1 MET 1 N 0.0048 0.0069 0.0118 2 MET 1 CA 0.0036 0.0066 0.0105 3 MET 1 C 0.0051 0.0061 0.0096 4 MET 1 O 0.0062 0.0063 0.0107 5 MET 1 CB 0.0020 0.0071 0.0115 6 MET 1 CG 0.0007 0.0068 0.0103 7 MET 1 SD -0.0004 0.0063 0.0083 8 MET 1 CE -0.0028 0.0069 0.0091 9 ARG 2 N 0.0052 0.0055 0.0078 10 ARG 2 CA 0.0066 0.0050 0.0068 11 ARG 2 C 0.0054 0.0047 0.0054 12 ARG 2 O 0.0044 0.0044 0.0041 13 ARG 2 CB 0.0081 0.0045 0.0057 14 ARG 2 CG 0.0098 0.0047 0.0069 15 ARG 2 CD 0.0108 0.0043 0.0060 16 ARG 2 NE 0.0125 0.0044 0.0071 17 ARG 2 CZ 0.0142 0.0040 0.0064 18 ARG 2 NH1 0.0144 0.0034 0.0046 19 ARG 2 NH2 0.0157 0.0042 0.0076 20 ILE 3 N 0.0054 0.0048 0.0057 21 ILE 3 CA 0.0042 0.0046 0.0046 22 ILE 3 C 0.0055 0.0042 0.0038 23 ILE 3 O 0.0069 0.0044 0.0048 24 ILE 3 CB 0.0026 0.0052 0.0059 25 ILE 3 CG1 0.0012 0.0055 0.0065 26 ILE 3 CG2 0.0015 0.0050 0.0049 27 ILE 3 CD1 0.0001 0.0062 0.0082 28 ILE 4 N 0.0053 0.0042 0.0027 29 ILE 4 CA 0.0063 0.0038 0.0015 30 ILE 4 C 0.0051 0.0033 0.0012 31 ILE 4 O 0.0036 0.0029 0.0010 32 ILE 4 CB 0.0067 0.0031 0.0001 33 ILE 4 CG1 0.0081 0.0036 0.0004 34 ILE 4 CG2 0.0074 0.0025 -0.0013 35 ILE 4 CD1 0.0085 0.0030 -0.0009 36 LEU 5 N 0.0056 0.0035 0.0013 37 LEU 5 CA 0.0046 0.0031 0.0010 38 LEU 5 C 0.0053 0.0025 -0.0005 39 LEU 5 O 0.0067 0.0027 -0.0007 40 LEU 5 CB 0.0047 0.0039 0.0023 41 LEU 5 CG 0.0034 0.0037 0.0025 42 LEU 5 CD1 0.0016 0.0033 0.0026 43 LEU 5 CD2 0.0037 0.0045 0.0039 44 LEU 6 N 0.0043 0.0016 -0.0016 45 LEU 6 CA 0.0048 0.0009 -0.0031 46 LEU 6 C 0.0038 0.0006 -0.0033 47 LEU 6 O 0.0024 0.0006 -0.0027 48 LEU 6 CB 0.0044 0.0001 -0.0044 49 LEU 6 CG 0.0051 0.0002 -0.0045 50 LEU 6 CD1 0.0044 -0.0007 -0.0059 51 LEU 6 CD2 0.0069 0.0006 -0.0047 52 GLY 7 N 0.0057 -0.0011 -0.0046 53 GLY 7 CA 0.0056 -0.0015 -0.0049 54 GLY 7 C 0.0074 -0.0021 -0.0058 55 GLY 7 O 0.0090 -0.0016 -0.0058 56 ALA 8 N 0.0072 -0.0033 -0.0066 57 ALA 8 CA 0.0087 -0.0040 -0.0076 58 ALA 8 C 0.0101 -0.0028 -0.0070 59 ALA 8 O 0.0095 -0.0016 -0.0059 60 ALA 8 CB 0.0080 -0.0054 -0.0084 61 PRO 9 N 0.0119 -0.0030 -0.0076 62 PRO 9 CA 0.0132 -0.0019 -0.0071 63 PRO 9 C 0.0126 -0.0020 -0.0071 64 PRO 9 O 0.0124 -0.0034 -0.0080 65 PRO 9 CB 0.0152 -0.0024 -0.0080 66 PRO 9 CG 0.0147 -0.0041 -0.0092 67 PRO 9 CD 0.0130 -0.0040 -0.0086 68 GLY 10 N 0.0133 -0.0013 -0.0062 69 GLY 10 CA 0.0121 -0.0013 -0.0059 70 GLY 10 C 0.0090 -0.0011 -0.0051 71 GLY 10 O 0.0079 -0.0006 -0.0044 72 ALA 11 N 0.0077 -0.0014 -0.0052 73 ALA 11 CA 0.0047 -0.0013 -0.0045 74 ALA 11 C 0.0040 0.0008 -0.0022 75 ALA 11 O 0.0016 0.0011 -0.0015 76 ALA 11 CB 0.0036 -0.0024 -0.0053 77 GLY 12 N 0.0060 0.0023 -0.0012 78 GLY 12 CA 0.0054 0.0044 0.0009 79 GLY 12 C 0.0038 0.0051 0.0019 80 GLY 12 O 0.0018 0.0060 0.0032 81 LYS 13 N 0.0032 0.0045 0.0025 82 LYS 13 CA 0.0025 0.0049 0.0031 83 LYS 13 C 0.0033 0.0062 0.0052 84 LYS 13 O 0.0024 0.0068 0.0063 85 LYS 13 CB 0.0037 0.0040 0.0016 86 LYS 13 CG 0.0063 0.0038 0.0013 87 LYS 13 CD 0.0074 0.0031 0.0001 88 LYS 13 CE 0.0100 0.0033 0.0004 89 LYS 13 NZ 0.0116 0.0026 -0.0007 90 GLY 14 N 0.0051 0.0066 0.0059 91 GLY 14 CA 0.0060 0.0078 0.0080 92 GLY 14 C 0.0041 0.0088 0.0096 93 GLY 14 O 0.0042 0.0097 0.0113 94 THR 15 N 0.0022 0.0084 0.0091 95 THR 15 CA 0.0003 0.0093 0.0105 96 THR 15 C -0.0009 0.0099 0.0115 97 THR 15 O -0.0018 0.0109 0.0132 98 THR 15 CB -0.0017 0.0087 0.0095 99 THR 15 OG1 -0.0030 0.0078 0.0080 100 THR 15 CG2 -0.0006 0.0081 0.0085 101 GLN 16 N -0.0022 0.0092 0.0113 102 GLN 16 CA -0.0032 0.0095 0.0116 103 GLN 16 C -0.0017 0.0097 0.0123 104 GLN 16 O -0.0024 0.0101 0.0127 105 GLN 16 CB -0.0045 0.0088 0.0099 106 GLN 16 CG -0.0067 0.0093 0.0102 107 GLN 16 CD -0.0080 0.0100 0.0110 108 GLN 16 OE1 -0.0084 0.0095 0.0101 109 GLN 16 NE2 -0.0086 0.0110 0.0126 110 ALA 17 N 0.0003 0.0095 0.0125 111 ALA 17 CA 0.0018 0.0096 0.0131 112 ALA 17 C 0.0016 0.0107 0.0149 113 ALA 17 O 0.0017 0.0109 0.0152 114 ALA 17 CB 0.0039 0.0092 0.0129 115 GLN 18 N 0.0015 0.0115 0.0163 116 GLN 18 CA 0.0013 0.0126 0.0181 117 GLN 18 C -0.0005 0.0130 0.0181 118 GLN 18 O -0.0004 0.0135 0.0191 119 GLN 18 CB 0.0010 0.0135 0.0194 120 GLN 18 CG 0.0029 0.0138 0.0205 121 GLN 18 CD 0.0023 0.0148 0.0220 122 GLN 18 OE1 0.0009 0.0156 0.0229 123 GLN 18 NE2 0.0034 0.0148 0.0223 124 PHE 19 N -0.0033 0.0124 0.0182 125 PHE 19 CA -0.0050 0.0127 0.0180 126 PHE 19 C -0.0044 0.0122 0.0173 127 PHE 19 O -0.0046 0.0126 0.0181 128 PHE 19 CB -0.0067 0.0125 0.0168 129 PHE 19 CG -0.0083 0.0125 0.0160 130 PHE 19 CD1 -0.0094 0.0134 0.0172 131 PHE 19 CD2 -0.0085 0.0116 0.0142 132 PHE 19 CE1 -0.0107 0.0133 0.0165 133 PHE 19 CE2 -0.0098 0.0116 0.0135 134 PHE 19 CZ -0.0109 0.0124 0.0146 135 ILE 20 N -0.0034 0.0112 0.0158 136 ILE 20 CA -0.0028 0.0106 0.0150 137 ILE 20 C -0.0013 0.0109 0.0163 138 ILE 20 O -0.0016 0.0111 0.0165 139 ILE 20 CB -0.0018 0.0095 0.0133 140 ILE 20 CG1 -0.0035 0.0093 0.0119 141 ILE 20 CG2 -0.0010 0.0089 0.0124 142 ILE 20 CD1 -0.0027 0.0083 0.0104 143 MET 21 N 0.0001 0.0110 0.0172 144 MET 21 CA 0.0015 0.0113 0.0186 145 MET 21 C 0.0004 0.0124 0.0200 146 MET 21 O 0.0006 0.0125 0.0204 147 MET 21 CB 0.0031 0.0114 0.0195 148 MET 21 CG 0.0045 0.0105 0.0182 149 MET 21 SD 0.0058 0.0106 0.0192 150 MET 21 CE 0.0078 0.0107 0.0204 151 GLU 22 N -0.0004 0.0132 0.0219 152 GLU 22 CA -0.0016 0.0143 0.0234 153 GLU 22 C -0.0032 0.0144 0.0228 154 GLU 22 O -0.0037 0.0151 0.0239 155 GLU 22 CB -0.0027 0.0150 0.0242 156 GLU 22 CG -0.0040 0.0162 0.0259 157 GLU 22 CD -0.0037 0.0170 0.0276 158 GLU 22 OE1 -0.0031 0.0167 0.0273 159 GLU 22 OE2 -0.0041 0.0180 0.0292 160 LYS 23 N -0.0040 0.0136 0.0209 161 LYS 23 CA -0.0055 0.0137 0.0202 162 LYS 23 C -0.0045 0.0131 0.0197 163 LYS 23 O -0.0054 0.0135 0.0200 164 LYS 23 CB -0.0070 0.0131 0.0184 165 LYS 23 CG -0.0092 0.0136 0.0182 166 LYS 23 CD -0.0103 0.0148 0.0200 167 LYS 23 CE -0.0126 0.0153 0.0198 168 LYS 23 NZ -0.0125 0.0153 0.0197 169 TYR 24 N -0.0027 0.0123 0.0190 170 TYR 24 CA -0.0016 0.0117 0.0184 171 TYR 24 C 0.0004 0.0118 0.0197 172 TYR 24 O 0.0013 0.0115 0.0195 173 TYR 24 CB -0.0012 0.0104 0.0162 174 TYR 24 CG -0.0033 0.0103 0.0149 175 TYR 24 CD1 -0.0047 0.0104 0.0143 176 TYR 24 CD2 -0.0038 0.0103 0.0146 177 TYR 24 CE1 -0.0068 0.0105 0.0134 178 TYR 24 CE2 -0.0059 0.0104 0.0138 179 TYR 24 CZ -0.0073 0.0105 0.0132 180 TYR 24 OH -0.0094 0.0107 0.0125 181 GLY 25 N 0.0013 0.0090 0.0195 182 GLY 25 CA 0.0031 0.0090 0.0207 183 GLY 25 C 0.0049 0.0084 0.0195 184 GLY 25 O 0.0063 0.0083 0.0197 185 ILE 26 N 0.0049 0.0081 0.0182 186 ILE 26 CA 0.0065 0.0075 0.0169 187 ILE 26 C 0.0070 0.0074 0.0170 188 ILE 26 O 0.0058 0.0077 0.0175 189 ILE 26 CB 0.0059 0.0070 0.0147 190 ILE 26 CG1 0.0043 0.0070 0.0139 191 ILE 26 CG2 0.0050 0.0071 0.0146 192 ILE 26 CD1 0.0033 0.0066 0.0121 193 PRO 27 N 0.0088 0.0070 0.0166 194 PRO 27 CA 0.0095 0.0069 0.0166 195 PRO 27 C 0.0093 0.0064 0.0146 196 PRO 27 O 0.0092 0.0060 0.0131 197 PRO 27 CB 0.0116 0.0067 0.0172 198 PRO 27 CG 0.0123 0.0064 0.0162 199 PRO 27 CD 0.0106 0.0067 0.0165 200 GLN 28 N 0.0092 0.0053 0.0103 201 GLN 28 CA 0.0092 0.0047 0.0087 202 GLN 28 C 0.0110 0.0047 0.0081 203 GLN 28 O 0.0121 0.0051 0.0088 204 GLN 28 CB 0.0084 0.0045 0.0086 205 GLN 28 CG 0.0085 0.0039 0.0069 206 GLN 28 CD 0.0079 0.0038 0.0069 207 GLN 28 OE1 0.0068 0.0041 0.0079 208 GLN 28 NE2 0.0085 0.0034 0.0057 209 ILE 29 N 0.0114 0.0042 0.0068 210 ILE 29 CA 0.0132 0.0042 0.0061 211 ILE 29 C 0.0130 0.0035 0.0045 212 ILE 29 O 0.0118 0.0030 0.0036 213 ILE 29 CB 0.0138 0.0041 0.0057 214 ILE 29 CG1 0.0138 0.0047 0.0073 215 ILE 29 CG2 0.0155 0.0040 0.0049 216 ILE 29 CD1 0.0139 0.0046 0.0069 217 SER 30 N 0.0142 0.0035 0.0041 218 SER 30 CA 0.0142 0.0029 0.0026 219 SER 30 C 0.0161 0.0030 0.0021 220 SER 30 O 0.0172 0.0035 0.0031 221 SER 30 CB 0.0135 0.0029 0.0027 222 SER 30 OG 0.0148 0.0031 0.0029 223 THR 31 N 0.0144 0.0050 -0.0010 224 THR 31 CA 0.0139 0.0053 -0.0009 225 THR 31 C 0.0129 0.0050 -0.0011 226 THR 31 O 0.0125 0.0049 -0.0011 227 THR 31 CB 0.0139 0.0063 -0.0005 228 THR 31 OG1 0.0136 0.0067 -0.0004 229 THR 31 CG2 0.0148 0.0065 -0.0004 230 GLY 32 N 0.0126 0.0049 -0.0011 231 GLY 32 CA 0.0117 0.0046 -0.0013 232 GLY 32 C 0.0117 0.0038 -0.0016 233 GLY 32 O 0.0110 0.0036 -0.0017 234 ASP 33 N 0.0123 0.0033 -0.0018 235 ASP 33 CA 0.0123 0.0024 -0.0021 236 ASP 33 C 0.0124 0.0024 -0.0021 237 ASP 33 O 0.0119 0.0019 -0.0023 238 ASP 33 CB 0.0131 0.0019 -0.0022 239 ASP 33 CG 0.0130 0.0017 -0.0023 240 ASP 33 OD1 0.0122 0.0017 -0.0024 241 ASP 33 OD2 0.0136 0.0016 -0.0023 242 MET 34 N 0.0118 0.0013 -0.0028 243 MET 34 CA 0.0118 0.0018 -0.0025 244 MET 34 C 0.0102 0.0026 -0.0025 245 MET 34 O 0.0097 0.0023 -0.0029 246 MET 34 CB 0.0130 0.0027 -0.0014 247 MET 34 CG 0.0135 0.0028 -0.0012 248 MET 34 SD 0.0150 0.0037 0.0000 249 MET 34 CE 0.0139 0.0054 0.0007 250 LEU 35 N 0.0095 0.0035 -0.0021 251 LEU 35 CA 0.0079 0.0044 -0.0021 252 LEU 35 C 0.0068 0.0034 -0.0032 253 LEU 35 O 0.0061 0.0033 -0.0035 254 LEU 35 CB 0.0074 0.0053 -0.0017 255 LEU 35 CG 0.0076 0.0068 -0.0006 256 LEU 35 CD1 0.0071 0.0076 -0.0003 257 LEU 35 CD2 0.0067 0.0075 -0.0005 258 ARG 36 N 0.0067 0.0026 -0.0038 259 ARG 36 CA 0.0056 0.0016 -0.0048 260 ARG 36 C 0.0059 0.0005 -0.0054 261 ARG 36 O 0.0049 -0.0001 -0.0063 262 ARG 36 CB 0.0058 0.0008 -0.0053 263 ARG 36 CG 0.0052 0.0018 -0.0048 264 ARG 36 CD 0.0051 0.0010 -0.0054 265 ARG 36 NE 0.0066 0.0006 -0.0052 266 ARG 36 CZ 0.0072 0.0014 -0.0044 267 ARG 36 NH1 0.0065 0.0027 -0.0038 268 ARG 36 NH2 0.0086 0.0009 -0.0042 269 ALA 37 N 0.0059 0.0001 -0.0076 270 ALA 37 CA 0.0062 -0.0014 -0.0089 271 ALA 37 C 0.0055 -0.0013 -0.0087 272 ALA 37 O 0.0052 -0.0026 -0.0097 273 ALA 37 CB 0.0086 -0.0018 -0.0094 274 ALA 38 N 0.0052 0.0002 -0.0074 275 ALA 38 CA 0.0045 0.0004 -0.0072 276 ALA 38 C 0.0020 0.0000 -0.0072 277 ALA 38 O 0.0012 -0.0008 -0.0078 278 ALA 38 CB 0.0051 0.0022 -0.0058 279 VAL 39 N 0.0010 0.0006 -0.0066 280 VAL 39 CA -0.0014 0.0004 -0.0066 281 VAL 39 C -0.0020 -0.0014 -0.0081 282 VAL 39 O -0.0031 -0.0020 -0.0084 283 VAL 39 CB -0.0020 0.0012 -0.0059 284 VAL 39 CG1 -0.0042 0.0005 -0.0063 285 VAL 39 CG2 -0.0019 0.0030 -0.0044 286 LYS 40 N -0.0014 -0.0020 -0.0095 287 LYS 40 CA -0.0018 -0.0037 -0.0111 288 LYS 40 C -0.0017 -0.0045 -0.0119 289 LYS 40 O -0.0034 -0.0053 -0.0124 290 LYS 40 CB -0.0001 -0.0044 -0.0119 291 LYS 40 CG 0.0002 -0.0062 -0.0136 292 LYS 40 CD 0.0023 -0.0066 -0.0142 293 LYS 40 CE 0.0044 -0.0058 -0.0138 294 LYS 40 NZ 0.0065 -0.0061 -0.0142 295 SER 41 N 0.0002 -0.0044 -0.0120 296 SER 41 CA 0.0004 -0.0051 -0.0127 297 SER 41 C -0.0005 -0.0041 -0.0116 298 SER 41 O 0.0007 -0.0032 -0.0109 299 SER 41 CB 0.0028 -0.0053 -0.0131 300 SER 41 OG 0.0035 -0.0068 -0.0145 301 GLY 42 N -0.0027 -0.0041 -0.0114 302 GLY 42 CA -0.0039 -0.0032 -0.0104 303 GLY 42 C -0.0030 -0.0030 -0.0103 304 GLY 42 O -0.0038 -0.0039 -0.0110 305 SER 43 N -0.0011 -0.0022 -0.0129 306 SER 43 CA -0.0007 -0.0024 -0.0135 307 SER 43 C -0.0021 -0.0016 -0.0104 308 SER 43 O -0.0027 -0.0007 -0.0080 309 SER 43 CB 0.0027 -0.0011 -0.0146 310 SER 43 OG 0.0045 0.0007 -0.0128 311 GLU 44 N -0.0027 -0.0018 -0.0103 312 GLU 44 CA -0.0040 -0.0011 -0.0074 313 GLU 44 C -0.0023 0.0010 -0.0047 314 GLU 44 O -0.0038 0.0015 -0.0022 315 GLU 44 CB -0.0041 -0.0014 -0.0079 316 GLU 44 CG -0.0047 -0.0003 -0.0049 317 GLU 44 CD -0.0080 -0.0011 -0.0030 318 GLU 44 OE1 -0.0100 -0.0027 -0.0041 319 GLU 44 OE2 -0.0086 -0.0001 -0.0003 320 LEU 45 N 0.0007 0.0024 -0.0052 321 LEU 45 CA 0.0025 0.0045 -0.0027 322 LEU 45 C 0.0025 0.0048 -0.0020 323 LEU 45 O 0.0023 0.0060 0.0008 324 LEU 45 CB 0.0058 0.0057 -0.0037 325 LEU 45 CG 0.0063 0.0061 -0.0035 326 LEU 45 CD1 0.0059 0.0075 -0.0001 327 LEU 45 CD2 0.0040 0.0041 -0.0051 328 GLY 46 N 0.0002 0.0025 -0.0072 329 GLY 46 CA -0.0002 0.0025 -0.0070 330 GLY 46 C -0.0018 0.0024 -0.0061 331 GLY 46 O -0.0021 0.0029 -0.0054 332 LYS 47 N -0.0027 0.0017 -0.0062 333 LYS 47 CA -0.0042 0.0016 -0.0054 334 LYS 47 C -0.0042 0.0028 -0.0042 335 LYS 47 O -0.0050 0.0032 -0.0033 336 LYS 47 CB -0.0050 0.0006 -0.0059 337 LYS 47 CG -0.0048 -0.0005 -0.0073 338 LYS 47 CD -0.0058 -0.0014 -0.0075 339 LYS 47 CE -0.0056 -0.0011 -0.0073 340 LYS 47 NZ -0.0067 -0.0019 -0.0074 341 GLN 48 N -0.0034 0.0033 -0.0041 342 GLN 48 CA -0.0033 0.0045 -0.0030 343 GLN 48 C -0.0029 0.0053 -0.0023 344 GLN 48 O -0.0035 0.0060 -0.0012 345 GLN 48 CB -0.0022 0.0049 -0.0032 346 GLN 48 CG -0.0028 0.0044 -0.0034 347 GLN 48 CD -0.0017 0.0047 -0.0038 348 GLN 48 OE1 -0.0012 0.0056 -0.0031 349 GLN 48 NE2 -0.0012 0.0039 -0.0050 350 ALA 49 N -0.0011 0.0051 -0.0032 351 ALA 49 CA -0.0008 0.0053 -0.0031 352 ALA 49 C -0.0024 0.0047 -0.0036 353 ALA 49 O -0.0027 0.0053 -0.0033 354 ALA 49 CB 0.0009 0.0045 -0.0034 355 LYS 50 N -0.0033 0.0036 -0.0043 356 LYS 50 CA -0.0048 0.0030 -0.0049 357 LYS 50 C -0.0063 0.0042 -0.0042 358 LYS 50 O -0.0071 0.0044 -0.0042 359 LYS 50 CB -0.0054 0.0015 -0.0058 360 LYS 50 CG -0.0071 0.0010 -0.0063 361 LYS 50 CD -0.0076 -0.0005 -0.0072 362 LYS 50 CE -0.0096 -0.0009 -0.0076 363 LYS 50 NZ -0.0109 0.0000 -0.0072 364 ASP 51 N -0.0067 0.0050 -0.0038 365 ASP 51 CA -0.0081 0.0062 -0.0032 366 ASP 51 C -0.0077 0.0075 -0.0023 367 ASP 51 O -0.0089 0.0080 -0.0021 368 ASP 51 CB -0.0083 0.0068 -0.0028 369 ASP 51 CG -0.0093 0.0057 -0.0035 370 ASP 51 OD1 -0.0109 0.0054 -0.0038 371 ASP 51 OD2 -0.0084 0.0052 -0.0038 372 ILE 52 N -0.0064 0.0068 -0.0040 373 ILE 52 CA -0.0062 0.0081 -0.0036 374 ILE 52 C -0.0068 0.0082 -0.0034 375 ILE 52 O -0.0075 0.0090 -0.0030 376 ILE 52 CB -0.0047 0.0086 -0.0038 377 ILE 52 CG1 -0.0044 0.0090 -0.0037 378 ILE 52 CG2 -0.0044 0.0097 -0.0035 379 ILE 52 CD1 -0.0030 0.0094 -0.0040 380 MET 53 N -0.0064 0.0073 -0.0038 381 MET 53 CA -0.0068 0.0073 -0.0037 382 MET 53 C -0.0083 0.0070 -0.0034 383 MET 53 O -0.0090 0.0077 -0.0030 384 MET 53 CB -0.0063 0.0061 -0.0042 385 MET 53 CG -0.0049 0.0062 -0.0046 386 MET 53 SD -0.0048 0.0047 -0.0051 387 MET 53 CE -0.0059 0.0049 -0.0048 388 ASP 54 N -0.0088 0.0061 -0.0036 389 ASP 54 CA -0.0102 0.0057 -0.0034 390 ASP 54 C -0.0110 0.0068 -0.0028 391 ASP 54 O -0.0121 0.0069 -0.0025 392 ASP 54 CB -0.0105 0.0046 -0.0037 393 ASP 54 CG -0.0102 0.0033 -0.0042 394 ASP 54 OD1 -0.0094 0.0033 -0.0044 395 ASP 54 OD2 -0.0106 0.0023 -0.0045 396 ALA 55 N -0.0115 0.0070 -0.0059 397 ALA 55 CA -0.0119 0.0074 -0.0051 398 ALA 55 C -0.0115 0.0085 -0.0046 399 ALA 55 O -0.0118 0.0090 -0.0040 400 ALA 55 CB -0.0118 0.0072 -0.0053 401 GLY 56 N -0.0109 0.0089 -0.0050 402 GLY 56 CA -0.0105 0.0099 -0.0046 403 GLY 56 C -0.0100 0.0105 -0.0047 404 GLY 56 O -0.0099 0.0113 -0.0042 405 LYS 57 N -0.0097 0.0100 -0.0054 406 LYS 57 CA -0.0092 0.0105 -0.0056 407 LYS 57 C -0.0083 0.0108 -0.0063 408 LYS 57 O -0.0081 0.0104 -0.0068 409 LYS 57 CB -0.0094 0.0098 -0.0059 410 LYS 57 CG -0.0102 0.0096 -0.0051 411 LYS 57 CD -0.0105 0.0089 -0.0055 412 LYS 57 CE -0.0106 0.0079 -0.0061 413 LYS 57 NZ -0.0108 0.0071 -0.0065 414 LEU 58 N -0.0015 0.0137 -0.0023 415 LEU 58 CA 0.0001 0.0135 -0.0025 416 LEU 58 C 0.0019 0.0129 -0.0028 417 LEU 58 O 0.0023 0.0135 -0.0028 418 LEU 58 CB 0.0003 0.0155 -0.0024 419 LEU 58 CG 0.0014 0.0156 -0.0025 420 LEU 58 CD1 0.0008 0.0139 -0.0026 421 LEU 58 CD2 0.0008 0.0176 -0.0023 422 VAL 59 N 0.0030 0.0115 -0.0030 423 VAL 59 CA 0.0048 0.0108 -0.0033 424 VAL 59 C 0.0064 0.0123 -0.0034 425 VAL 59 O 0.0069 0.0131 -0.0034 426 VAL 59 CB 0.0055 0.0089 -0.0036 427 VAL 59 CG1 0.0074 0.0081 -0.0039 428 VAL 59 CG2 0.0039 0.0074 -0.0035 429 THR 60 N 0.0074 0.0127 -0.0035 430 THR 60 CA 0.0089 0.0141 -0.0036 431 THR 60 C 0.0109 0.0134 -0.0039 432 THR 60 O 0.0113 0.0116 -0.0041 433 THR 60 CB 0.0092 0.0148 -0.0036 434 THR 60 OG1 0.0094 0.0131 -0.0038 435 THR 60 CG2 0.0075 0.0159 -0.0033 436 ASP 61 N 0.0106 0.0124 -0.0058 437 ASP 61 CA 0.0115 0.0115 -0.0047 438 ASP 61 C 0.0131 0.0112 -0.0037 439 ASP 61 O 0.0136 0.0098 -0.0027 440 ASP 61 CB 0.0122 0.0126 -0.0050 441 ASP 61 CG 0.0108 0.0128 -0.0059 442 ASP 61 OD1 0.0093 0.0119 -0.0062 443 ASP 61 OD2 0.0112 0.0139 -0.0062 444 GLU 62 N 0.0139 0.0125 -0.0040 445 GLU 62 CA 0.0154 0.0125 -0.0031 446 GLU 62 C 0.0152 0.0109 -0.0024 447 GLU 62 O 0.0163 0.0101 -0.0013 448 GLU 62 CB 0.0160 0.0142 -0.0037 449 GLU 62 CG 0.0164 0.0158 -0.0043 450 GLU 62 CD 0.0149 0.0163 -0.0055 451 GLU 62 OE1 0.0136 0.0164 -0.0063 452 GLU 62 OE2 0.0149 0.0167 -0.0057 453 LEU 63 N 0.0138 0.0106 -0.0030 454 LEU 63 CA 0.0134 0.0092 -0.0025 455 LEU 63 C 0.0129 0.0075 -0.0018 456 LEU 63 O 0.0133 0.0062 -0.0009 457 LEU 63 CB 0.0119 0.0094 -0.0034 458 LEU 63 CG 0.0119 0.0087 -0.0030 459 LEU 63 CD1 0.0107 0.0094 -0.0041 460 LEU 63 CD2 0.0114 0.0067 -0.0022 461 VAL 64 N 0.0146 0.0087 -0.0033 462 VAL 64 CA 0.0142 0.0077 -0.0030 463 VAL 64 C 0.0153 0.0073 -0.0022 464 VAL 64 O 0.0153 0.0063 -0.0016 465 VAL 64 CB 0.0135 0.0079 -0.0034 466 VAL 64 CG1 0.0130 0.0067 -0.0030 467 VAL 64 CG2 0.0125 0.0084 -0.0042 468 ILE 65 N 0.0161 0.0081 -0.0023 469 ILE 65 CA 0.0172 0.0078 -0.0016 470 ILE 65 C 0.0179 0.0073 -0.0009 471 ILE 65 O 0.0184 0.0066 -0.0003 472 ILE 65 CB 0.0180 0.0088 -0.0017 473 ILE 65 CG1 0.0177 0.0087 -0.0018 474 ILE 65 CG2 0.0192 0.0088 -0.0010 475 ILE 65 CD1 0.0165 0.0088 -0.0025 476 ALA 66 N 0.0178 0.0078 -0.0012 477 ALA 66 CA 0.0184 0.0074 -0.0007 478 ALA 66 C 0.0179 0.0061 -0.0003 479 ALA 66 O 0.0185 0.0054 0.0004 480 ALA 66 CB 0.0184 0.0081 -0.0011 481 LEU 67 N 0.0162 0.0071 -0.0003 482 LEU 67 CA 0.0155 0.0056 0.0000 483 LEU 67 C 0.0159 0.0047 0.0007 484 LEU 67 O 0.0159 0.0034 0.0013 485 LEU 67 CB 0.0138 0.0055 -0.0007 486 LEU 67 CG 0.0131 0.0064 -0.0014 487 LEU 67 CD1 0.0115 0.0058 -0.0019 488 LEU 67 CD2 0.0135 0.0061 -0.0011 489 VAL 68 N 0.0162 0.0053 0.0005 490 VAL 68 CA 0.0165 0.0044 0.0011 491 VAL 68 C 0.0181 0.0041 0.0019 492 VAL 68 O 0.0184 0.0030 0.0026 493 VAL 68 CB 0.0164 0.0052 0.0007 494 VAL 68 CG1 0.0170 0.0043 0.0013 495 VAL 68 CG2 0.0149 0.0055 -0.0002 496 LYS 69 N 0.0190 0.0052 0.0018 497 LYS 69 CA 0.0205 0.0050 0.0026 498 LYS 69 C 0.0206 0.0039 0.0032 499 LYS 69 O 0.0214 0.0029 0.0039 500 LYS 69 CB 0.0215 0.0064 0.0024 501 LYS 69 CG 0.0231 0.0066 0.0030 502 LYS 69 CD 0.0238 0.0081 0.0026 503 LYS 69 CE 0.0236 0.0090 0.0021 504 LYS 69 NZ 0.0241 0.0106 0.0016 505 GLU 70 N 0.0199 0.0037 0.0038 506 GLU 70 CA 0.0200 0.0030 0.0047 507 GLU 70 C 0.0192 0.0024 0.0054 508 GLU 70 O 0.0196 0.0018 0.0062 509 GLU 70 CB 0.0197 0.0031 0.0046 510 GLU 70 CG 0.0197 0.0024 0.0054 511 GLU 70 CD 0.0193 0.0026 0.0052 512 GLU 70 OE1 0.0199 0.0031 0.0047 513 GLU 70 OE2 0.0184 0.0022 0.0056 514 ARG 71 N 0.0180 0.0025 0.0052 515 ARG 71 CA 0.0171 0.0020 0.0058 516 ARG 71 C 0.0173 0.0017 0.0061 517 ARG 71 O 0.0173 0.0010 0.0070 518 ARG 71 CB 0.0159 0.0024 0.0052 519 ARG 71 CG 0.0148 0.0018 0.0058 520 ARG 71 CD 0.0146 0.0012 0.0066 521 ARG 71 NE 0.0137 0.0006 0.0072 522 ARG 71 CZ 0.0139 0.0001 0.0079 523 ARG 71 NH1 0.0150 0.0001 0.0080 524 ARG 71 NH2 0.0130 -0.0004 0.0084 525 ILE 72 N 0.0175 0.0022 0.0055 526 ILE 72 CA 0.0176 0.0020 0.0058 527 ILE 72 C 0.0188 0.0016 0.0064 528 ILE 72 O 0.0191 0.0014 0.0066 529 ILE 72 CB 0.0175 0.0026 0.0050 530 ILE 72 CG1 0.0185 0.0032 0.0044 531 ILE 72 CG2 0.0163 0.0030 0.0045 532 ILE 72 CD1 0.0184 0.0039 0.0036 533 ALA 73 N 0.0205 0.0021 0.0081 534 ALA 73 CA 0.0223 0.0019 0.0094 535 ALA 73 C 0.0220 0.0013 0.0117 536 ALA 73 O 0.0232 0.0011 0.0132 537 ALA 73 CB 0.0245 0.0024 0.0086 538 GLN 74 N 0.0206 0.0011 0.0120 539 GLN 74 CA 0.0201 0.0005 0.0140 540 GLN 74 C 0.0190 0.0001 0.0153 541 GLN 74 O 0.0179 0.0002 0.0143 542 GLN 74 CB 0.0187 0.0004 0.0139 543 GLN 74 CG 0.0200 0.0008 0.0128 544 GLN 74 CD 0.0187 0.0007 0.0126 545 GLN 74 OE1 0.0194 0.0011 0.0115 546 GLN 74 NE2 0.0169 0.0002 0.0137 547 GLU 75 N 0.0194 -0.0004 0.0174 548 GLU 75 CA 0.0185 -0.0008 0.0188 549 GLU 75 C 0.0161 -0.0012 0.0189 550 GLU 75 O 0.0152 -0.0014 0.0196 551 GLU 75 CB 0.0197 -0.0013 0.0210 552 GLU 75 CG 0.0222 -0.0009 0.0209 553 GLU 75 CD 0.0233 -0.0010 0.0217 554 GLU 75 OE1 0.0229 -0.0008 0.0207 555 GLU 75 OE2 0.0246 -0.0012 0.0233 556 ASP 76 N 0.0159 0.0003 0.0189 557 ASP 76 CA 0.0135 0.0004 0.0191 558 ASP 76 C 0.0125 0.0012 0.0171 559 ASP 76 O 0.0106 0.0013 0.0171 560 ASP 76 CB 0.0123 0.0003 0.0196 561 ASP 76 CG 0.0125 0.0010 0.0177 562 ASP 76 OD1 0.0139 0.0013 0.0163 563 ASP 76 OD2 0.0112 0.0010 0.0178 564 CYS 77 N 0.0139 0.0016 0.0155 565 CYS 77 CA 0.0133 0.0023 0.0135 566 CYS 77 C 0.0144 0.0023 0.0135 567 CYS 77 O 0.0147 0.0028 0.0118 568 CYS 77 CB 0.0142 0.0029 0.0116 569 CYS 77 SG 0.0131 0.0031 0.0113 570 ARG 78 N 0.0149 0.0016 0.0154 571 ARG 78 CA 0.0159 0.0015 0.0155 572 ARG 78 C 0.0143 0.0018 0.0150 573 ARG 78 O 0.0150 0.0019 0.0144 574 ARG 78 CB 0.0168 0.0006 0.0177 575 ARG 78 CG 0.0180 0.0004 0.0182 576 ARG 78 CD 0.0191 -0.0004 0.0204 577 ARG 78 NE 0.0215 -0.0005 0.0202 578 ARG 78 CZ 0.0225 -0.0005 0.0198 579 ARG 78 NH1 0.0214 -0.0003 0.0195 580 ARG 78 NH2 0.0248 -0.0006 0.0197 581 ASN 79 N 0.0117 0.0050 0.0154 582 ASN 79 CA 0.0099 0.0052 0.0149 583 ASN 79 C 0.0093 0.0052 0.0131 584 ASN 79 O 0.0080 0.0053 0.0124 585 ASN 79 CB 0.0086 0.0054 0.0163 586 ASN 79 CG 0.0089 0.0055 0.0181 587 ASN 79 OD1 0.0088 0.0055 0.0184 588 ASN 79 ND2 0.0094 0.0055 0.0193 589 GLY 80 N 0.0103 0.0050 0.0123 590 GLY 80 CA 0.0099 0.0050 0.0106 591 GLY 80 C 0.0100 0.0050 0.0108 592 GLY 80 O 0.0109 0.0049 0.0120 593 PHE 81 N 0.0090 0.0051 0.0097 594 PHE 81 CA 0.0090 0.0051 0.0098 595 PHE 81 C 0.0077 0.0052 0.0085 596 PHE 81 O 0.0070 0.0052 0.0073 597 PHE 81 CB 0.0109 0.0048 0.0093 598 PHE 81 CG 0.0117 0.0046 0.0077 599 PHE 81 CD1 0.0111 0.0046 0.0060 600 PHE 81 CD2 0.0130 0.0044 0.0077 601 PHE 81 CE1 0.0119 0.0044 0.0045 602 PHE 81 CE2 0.0137 0.0042 0.0062 603 PHE 81 CZ 0.0132 0.0042 0.0046 604 LEU 82 N 0.0087 0.0058 0.0089 605 LEU 82 CA 0.0077 0.0052 0.0077 606 LEU 82 C 0.0091 0.0050 0.0065 607 LEU 82 O 0.0099 0.0054 0.0070 608 LEU 82 CB 0.0066 0.0053 0.0085 609 LEU 82 CG 0.0056 0.0047 0.0074 610 LEU 82 CD1 0.0043 0.0041 0.0064 611 LEU 82 CD2 0.0046 0.0049 0.0086 612 LEU 83 N 0.0093 0.0046 0.0051 613 LEU 83 CA 0.0105 0.0043 0.0038 614 LEU 83 C 0.0095 0.0038 0.0028 615 LEU 83 O 0.0082 0.0033 0.0021 616 LEU 83 CB 0.0111 0.0041 0.0029 617 LEU 83 CG 0.0127 0.0040 0.0017 618 LEU 83 CD1 0.0141 0.0045 0.0024 619 LEU 83 CD2 0.0131 0.0039 0.0011 620 ASP 84 N 0.0100 0.0039 0.0029 621 ASP 84 CA 0.0091 0.0035 0.0021 622 ASP 84 C 0.0099 0.0030 0.0004 623 ASP 84 O 0.0114 0.0033 0.0003 624 ASP 84 CB 0.0091 0.0039 0.0033 625 ASP 84 CG 0.0085 0.0035 0.0025 626 ASP 84 OD1 0.0070 0.0032 0.0024 627 ASP 84 OD2 0.0096 0.0036 0.0022 628 GLY 85 N 0.0094 0.0040 -0.0014 629 GLY 85 CA 0.0099 0.0039 -0.0026 630 GLY 85 C 0.0109 0.0042 -0.0030 631 GLY 85 O 0.0115 0.0042 -0.0038 632 PHE 86 N 0.0111 0.0044 -0.0025 633 PHE 86 CA 0.0120 0.0047 -0.0028 634 PHE 86 C 0.0117 0.0047 -0.0024 635 PHE 86 O 0.0113 0.0048 -0.0014 636 PHE 86 CB 0.0130 0.0053 -0.0023 637 PHE 86 CG 0.0140 0.0055 -0.0028 638 PHE 86 CD1 0.0146 0.0055 -0.0038 639 PHE 86 CD2 0.0143 0.0058 -0.0022 640 PHE 86 CE1 0.0154 0.0057 -0.0042 641 PHE 86 CE2 0.0151 0.0060 -0.0026 642 PHE 86 CZ 0.0157 0.0060 -0.0037 643 PRO 87 N 0.0119 0.0045 -0.0031 644 PRO 87 CA 0.0124 0.0044 -0.0043 645 PRO 87 C 0.0118 0.0039 -0.0052 646 PRO 87 O 0.0109 0.0036 -0.0051 647 PRO 87 CB 0.0125 0.0044 -0.0046 648 PRO 87 CG 0.0116 0.0042 -0.0039 649 PRO 87 CD 0.0117 0.0046 -0.0028 650 ARG 88 N 0.0120 0.0045 -0.0066 651 ARG 88 CA 0.0116 0.0039 -0.0077 652 ARG 88 C 0.0116 0.0033 -0.0090 653 ARG 88 O 0.0111 0.0026 -0.0100 654 ARG 88 CB 0.0126 0.0041 -0.0080 655 ARG 88 CG 0.0124 0.0045 -0.0069 656 ARG 88 CD 0.0136 0.0047 -0.0072 657 ARG 88 NE 0.0142 0.0055 -0.0060 658 ARG 88 CZ 0.0156 0.0060 -0.0059 659 ARG 88 NH1 0.0164 0.0058 -0.0069 660 ARG 88 NH2 0.0161 0.0067 -0.0047 661 THR 89 N 0.0121 0.0034 -0.0090 662 THR 89 CA 0.0121 0.0029 -0.0102 663 THR 89 C 0.0119 0.0030 -0.0098 664 THR 89 O 0.0122 0.0036 -0.0086 665 THR 89 CB 0.0136 0.0030 -0.0111 666 THR 89 OG1 0.0147 0.0037 -0.0103 667 THR 89 CG2 0.0140 0.0030 -0.0115 668 ILE 90 N 0.0116 0.0025 -0.0108 669 ILE 90 CA 0.0114 0.0025 -0.0105 670 ILE 90 C 0.0128 0.0031 -0.0102 671 ILE 90 O 0.0128 0.0035 -0.0093 672 ILE 90 CB 0.0109 0.0018 -0.0117 673 ILE 90 CG1 0.0093 0.0012 -0.0118 674 ILE 90 CG2 0.0111 0.0020 -0.0116 675 ILE 90 CD1 0.0088 0.0005 -0.0132 676 PRO 91 N 0.0142 0.0060 -0.0098 677 PRO 91 CA 0.0155 0.0063 -0.0095 678 PRO 91 C 0.0157 0.0063 -0.0082 679 PRO 91 O 0.0165 0.0065 -0.0077 680 PRO 91 CB 0.0159 0.0064 -0.0103 681 PRO 91 CG 0.0152 0.0062 -0.0114 682 PRO 91 CD 0.0140 0.0059 -0.0108 683 GLN 92 N 0.0151 0.0062 -0.0077 684 GLN 92 CA 0.0152 0.0062 -0.0064 685 GLN 92 C 0.0148 0.0061 -0.0056 686 GLN 92 O 0.0153 0.0062 -0.0047 687 GLN 92 CB 0.0145 0.0061 -0.0061 688 GLN 92 CG 0.0152 0.0062 -0.0065 689 GLN 92 CD 0.0144 0.0060 -0.0065 690 GLN 92 OE1 0.0148 0.0061 -0.0067 691 GLN 92 NE2 0.0133 0.0057 -0.0063 692 ALA 93 N 0.0138 0.0059 -0.0059 693 ALA 93 CA 0.0133 0.0058 -0.0052 694 ALA 93 C 0.0141 0.0059 -0.0052 695 ALA 93 O 0.0142 0.0060 -0.0044 696 ALA 93 CB 0.0121 0.0055 -0.0057 697 ASP 94 N 0.0148 0.0054 -0.0073 698 ASP 94 CA 0.0155 0.0057 -0.0073 699 ASP 94 C 0.0168 0.0063 -0.0064 700 ASP 94 O 0.0172 0.0065 -0.0057 701 ASP 94 CB 0.0159 0.0057 -0.0089 702 ASP 94 CG 0.0160 0.0057 -0.0090 703 ASP 94 OD1 0.0149 0.0053 -0.0090 704 ASP 94 OD2 0.0172 0.0062 -0.0091 705 ALA 95 N 0.0175 0.0065 -0.0066 706 ALA 95 CA 0.0187 0.0071 -0.0057 707 ALA 95 C 0.0184 0.0071 -0.0041 708 ALA 95 O 0.0192 0.0075 -0.0033 709 ALA 95 CB 0.0193 0.0073 -0.0063 710 MET 96 N 0.0172 0.0067 -0.0037 711 MET 96 CA 0.0169 0.0067 -0.0021 712 MET 96 C 0.0168 0.0067 -0.0016 713 MET 96 O 0.0172 0.0069 -0.0004 714 MET 96 CB 0.0155 0.0061 -0.0018 715 MET 96 CG 0.0156 0.0062 -0.0017 716 MET 96 SD 0.0139 0.0055 -0.0017 717 MET 96 CE 0.0135 0.0055 0.0002 718 LYS 97 N 0.0166 0.0058 -0.0033 719 LYS 97 CA 0.0163 0.0058 -0.0029 720 LYS 97 C 0.0179 0.0064 -0.0027 721 LYS 97 O 0.0181 0.0066 -0.0015 722 LYS 97 CB 0.0153 0.0053 -0.0041 723 LYS 97 CG 0.0149 0.0052 -0.0035 724 LYS 97 CD 0.0135 0.0046 -0.0044 725 LYS 97 CE 0.0140 0.0046 -0.0061 726 LYS 97 NZ 0.0128 0.0041 -0.0067 727 GLU 98 N 0.0190 0.0066 -0.0039 728 GLU 98 CA 0.0206 0.0071 -0.0040 729 GLU 98 C 0.0216 0.0076 -0.0025 730 GLU 98 O 0.0226 0.0081 -0.0020 731 GLU 98 CB 0.0215 0.0072 -0.0056 732 GLU 98 CG 0.0206 0.0067 -0.0072 733 GLU 98 CD 0.0209 0.0067 -0.0075 734 GLU 98 OE1 0.0223 0.0071 -0.0080 735 GLU 98 OE2 0.0197 0.0064 -0.0074 736 ALA 99 N 0.0213 0.0076 -0.0019 737 ALA 99 CA 0.0222 0.0081 -0.0004 738 ALA 99 C 0.0214 0.0081 0.0012 739 ALA 99 O 0.0219 0.0085 0.0026 740 ALA 99 CB 0.0223 0.0082 -0.0004 741 GLY 100 N 0.0206 0.0066 -0.0005 742 GLY 100 CA 0.0198 0.0066 0.0009 743 GLY 100 C 0.0185 0.0063 0.0017 744 GLY 100 O 0.0179 0.0063 0.0030 745 ILE 101 N 0.0181 0.0061 0.0011 746 ILE 101 CA 0.0169 0.0059 0.0018 747 ILE 101 C 0.0153 0.0054 0.0013 748 ILE 101 O 0.0147 0.0052 0.0001 749 ILE 101 CB 0.0172 0.0059 0.0013 750 ILE 101 CG1 0.0188 0.0064 0.0018 751 ILE 101 CG2 0.0160 0.0057 0.0020 752 ILE 101 CD1 0.0193 0.0065 0.0011 753 ASN 102 N 0.0145 0.0053 0.0022 754 ASN 102 CA 0.0130 0.0049 0.0018 755 ASN 102 C 0.0118 0.0047 0.0026 756 ASN 102 O 0.0122 0.0049 0.0036 757 ASN 102 CB 0.0127 0.0049 0.0024 758 ASN 102 CG 0.0127 0.0051 0.0042 759 ASN 102 OD1 0.0139 0.0055 0.0049 760 ASN 102 ND2 0.0114 0.0048 0.0050 761 VAL 103 N 0.0086 0.0035 0.0012 762 VAL 103 CA 0.0073 0.0038 0.0021 763 VAL 103 C 0.0053 0.0037 0.0020 764 VAL 103 O 0.0047 0.0032 0.0007 765 VAL 103 CB 0.0073 0.0035 0.0012 766 VAL 103 CG1 0.0093 0.0036 0.0014 767 VAL 103 CG2 0.0067 0.0028 -0.0007 768 ASP 104 N 0.0043 0.0041 0.0035 769 ASP 104 CA 0.0023 0.0040 0.0035 770 ASP 104 C 0.0010 0.0036 0.0025 771 ASP 104 O -0.0003 0.0033 0.0017 772 ASP 104 CB 0.0016 0.0047 0.0054 773 ASP 104 CG 0.0028 0.0051 0.0065 774 ASP 104 OD1 0.0027 0.0050 0.0062 775 ASP 104 OD2 0.0039 0.0056 0.0076 776 TYR 105 N 0.0013 0.0037 0.0026 777 TYR 105 CA 0.0001 0.0033 0.0018 778 TYR 105 C 0.0010 0.0031 0.0009 779 TYR 105 O 0.0024 0.0034 0.0015 780 TYR 105 CB -0.0013 0.0037 0.0031 781 TYR 105 CG -0.0026 0.0040 0.0040 782 TYR 105 CD1 -0.0021 0.0045 0.0055 783 TYR 105 CD2 -0.0044 0.0036 0.0032 784 TYR 105 CE1 -0.0033 0.0048 0.0064 785 TYR 105 CE2 -0.0056 0.0038 0.0040 786 TYR 105 CZ -0.0051 0.0044 0.0056 787 TYR 105 OH -0.0062 0.0047 0.0065 788 VAL 106 N 0.0000 0.0023 0.0005 789 VAL 106 CA 0.0010 0.0018 -0.0008 790 VAL 106 C -0.0005 0.0013 -0.0010 791 VAL 106 O -0.0020 0.0006 -0.0016 792 VAL 106 CB 0.0015 0.0009 -0.0024 793 VAL 106 CG1 0.0025 0.0004 -0.0037 794 VAL 106 CG2 0.0028 0.0014 -0.0022 795 LEU 107 N -0.0002 0.0017 -0.0004 796 LEU 107 CA -0.0015 0.0014 -0.0005 797 LEU 107 C -0.0007 0.0008 -0.0018 798 LEU 107 O 0.0009 0.0011 -0.0018 799 LEU 107 CB -0.0019 0.0023 0.0012 800 LEU 107 CG -0.0024 0.0032 0.0027 801 LEU 107 CD1 -0.0025 0.0041 0.0043 802 LEU 107 CD2 -0.0042 0.0027 0.0027 803 GLU 108 N -0.0018 -0.0002 -0.0029 804 GLU 108 CA -0.0012 -0.0008 -0.0041 805 GLU 108 C -0.0023 -0.0008 -0.0036 806 GLU 108 O -0.0041 -0.0011 -0.0036 807 GLU 108 CB -0.0016 -0.0020 -0.0058 808 GLU 108 CG -0.0007 -0.0026 -0.0072 809 GLU 108 CD -0.0015 -0.0038 -0.0088 810 GLU 108 OE1 -0.0026 -0.0042 -0.0090 811 GLU 108 OE2 -0.0010 -0.0044 -0.0099 812 PHE 109 N -0.0021 -0.0008 -0.0031 813 PHE 109 CA -0.0027 -0.0002 -0.0025 814 PHE 109 C -0.0025 -0.0019 -0.0041 815 PHE 109 O -0.0004 -0.0023 -0.0048 816 PHE 109 CB -0.0008 0.0014 -0.0012 817 PHE 109 CG -0.0017 0.0026 0.0000 818 PHE 109 CD1 -0.0032 0.0040 0.0016 819 PHE 109 CD2 -0.0009 0.0023 -0.0003 820 PHE 109 CE1 -0.0038 0.0052 0.0029 821 PHE 109 CE2 -0.0015 0.0035 0.0010 822 PHE 109 CZ -0.0030 0.0050 0.0025 823 ASP 110 N -0.0046 -0.0027 -0.0047 824 ASP 110 CA -0.0047 -0.0044 -0.0063 825 ASP 110 C -0.0048 -0.0043 -0.0061 826 ASP 110 O -0.0066 -0.0036 -0.0053 827 ASP 110 CB -0.0070 -0.0057 -0.0072 828 ASP 110 CG -0.0070 -0.0076 -0.0090 829 ASP 110 OD1 -0.0050 -0.0084 -0.0101 830 ASP 110 OD2 -0.0090 -0.0083 -0.0094 831 VAL 111 N -0.0029 -0.0049 -0.0070 832 VAL 111 CA -0.0028 -0.0050 -0.0071 833 VAL 111 C -0.0018 -0.0068 -0.0089 834 VAL 111 O 0.0004 -0.0071 -0.0095 835 VAL 111 CB -0.0011 -0.0034 -0.0058 836 VAL 111 CG1 -0.0010 -0.0037 -0.0060 837 VAL 111 CG2 -0.0020 -0.0015 -0.0039 838 PRO 112 N -0.0007 -0.0084 -0.0087 839 PRO 112 CA 0.0000 -0.0103 -0.0099 840 PRO 112 C 0.0024 -0.0103 -0.0102 841 PRO 112 O 0.0033 -0.0092 -0.0097 842 PRO 112 CB -0.0013 -0.0108 -0.0100 843 PRO 112 CG -0.0034 -0.0099 -0.0092 844 PRO 112 CD -0.0026 -0.0079 -0.0083 845 ASP 113 N 0.0034 -0.0116 -0.0110 846 ASP 113 CA 0.0057 -0.0118 -0.0114 847 ASP 113 C 0.0065 -0.0116 -0.0114 848 ASP 113 O 0.0081 -0.0106 -0.0111 849 ASP 113 CB 0.0064 -0.0137 -0.0125 850 ASP 113 CG 0.0065 -0.0137 -0.0125 851 ASP 113 OD1 0.0060 -0.0122 -0.0117 852 ASP 113 OD2 0.0070 -0.0152 -0.0134 853 GLU 114 N 0.0054 -0.0126 -0.0118 854 GLU 114 CA 0.0061 -0.0126 -0.0119 855 GLU 114 C 0.0061 -0.0106 -0.0108 856 GLU 114 O 0.0076 -0.0100 -0.0107 857 GLU 114 CB 0.0047 -0.0139 -0.0124 858 GLU 114 CG 0.0051 -0.0160 -0.0136 859 GLU 114 CD 0.0075 -0.0163 -0.0141 860 GLU 114 OE1 0.0085 -0.0158 -0.0139 861 GLU 114 OE2 0.0084 -0.0172 -0.0146 862 LEU 115 N 0.0050 -0.0099 -0.0099 863 LEU 115 CA 0.0049 -0.0083 -0.0089 864 LEU 115 C 0.0065 -0.0072 -0.0085 865 LEU 115 O 0.0074 -0.0062 -0.0081 866 LEU 115 CB 0.0030 -0.0076 -0.0083 867 LEU 115 CG 0.0014 -0.0082 -0.0084 868 LEU 115 CD1 0.0008 -0.0100 -0.0093 869 LEU 115 CD2 -0.0002 -0.0071 -0.0076 870 ILE 116 N 0.0070 -0.0074 -0.0087 871 ILE 116 CA 0.0086 -0.0064 -0.0084 872 ILE 116 C 0.0105 -0.0069 -0.0089 873 ILE 116 O 0.0117 -0.0058 -0.0085 874 ILE 116 CB 0.0089 -0.0068 -0.0086 875 ILE 116 CG1 0.0073 -0.0061 -0.0080 876 ILE 116 CG2 0.0108 -0.0060 -0.0085 877 ILE 116 CD1 0.0073 -0.0066 -0.0083 878 VAL 117 N 0.0107 -0.0085 -0.0099 879 VAL 117 CA 0.0123 -0.0091 -0.0105 880 VAL 117 C 0.0126 -0.0083 -0.0100 881 VAL 117 O 0.0141 -0.0076 -0.0099 882 VAL 117 CB 0.0121 -0.0110 -0.0115 883 VAL 117 CG1 0.0139 -0.0115 -0.0121 884 VAL 117 CG2 0.0118 -0.0119 -0.0120 885 ASP 118 N 0.0117 -0.0086 -0.0092 886 ASP 118 CA 0.0119 -0.0074 -0.0087 887 ASP 118 C 0.0123 -0.0056 -0.0078 888 ASP 118 O 0.0133 -0.0047 -0.0073 889 ASP 118 CB 0.0100 -0.0074 -0.0088 890 ASP 118 CG 0.0095 -0.0091 -0.0097 891 ASP 118 OD1 0.0108 -0.0103 -0.0101 892 ASP 118 OD2 0.0079 -0.0093 -0.0099 893 ARG 119 N 0.0115 -0.0050 -0.0076 894 ARG 119 CA 0.0118 -0.0033 -0.0068 895 ARG 119 C 0.0138 -0.0031 -0.0065 896 ARG 119 O 0.0145 -0.0017 -0.0058 897 ARG 119 CB 0.0104 -0.0028 -0.0067 898 ARG 119 CG 0.0084 -0.0026 -0.0068 899 ARG 119 CD 0.0070 -0.0023 -0.0068 900 ARG 119 NE 0.0051 -0.0021 -0.0069 901 ARG 119 CZ 0.0036 -0.0017 -0.0069 902 ARG 119 NH1 0.0038 -0.0014 -0.0067 903 ARG 119 NH2 0.0019 -0.0015 -0.0070 904 ILE 120 N 0.0148 -0.0046 -0.0071 905 ILE 120 CA 0.0166 -0.0045 -0.0068 906 ILE 120 C 0.0182 -0.0052 -0.0070 907 ILE 120 O 0.0196 -0.0042 -0.0064 908 ILE 120 CB 0.0168 -0.0053 -0.0072 909 ILE 120 CG1 0.0156 -0.0043 -0.0068 910 ILE 120 CG2 0.0188 -0.0055 -0.0071 911 ILE 120 CD1 0.0151 -0.0053 -0.0074 912 VAL 121 N 0.0169 -0.0066 -0.0074 913 VAL 121 CA 0.0169 -0.0064 -0.0065 914 VAL 121 C 0.0163 -0.0054 -0.0052 915 VAL 121 O 0.0165 -0.0056 -0.0039 916 VAL 121 CB 0.0166 -0.0062 -0.0076 917 VAL 121 CG1 0.0172 -0.0071 -0.0090 918 VAL 121 CG2 0.0156 -0.0049 -0.0081 919 GLY 122 N 0.0155 -0.0044 -0.0055 920 GLY 122 CA 0.0149 -0.0034 -0.0043 921 GLY 122 C 0.0151 -0.0036 -0.0030 922 GLY 122 O 0.0145 -0.0027 -0.0025 923 ARG 123 N 0.0160 -0.0047 -0.0025 924 ARG 123 CA 0.0163 -0.0050 -0.0012 925 ARG 123 C 0.0168 -0.0055 0.0002 926 ARG 123 O 0.0174 -0.0064 0.0000 927 ARG 123 CB 0.0168 -0.0057 -0.0018 928 ARG 123 CG 0.0178 -0.0071 -0.0021 929 ARG 123 CD 0.0182 -0.0077 -0.0025 930 ARG 123 NE 0.0191 -0.0090 -0.0029 931 ARG 123 CZ 0.0194 -0.0095 -0.0042 932 ARG 123 NH1 0.0188 -0.0089 -0.0052 933 ARG 123 NH2 0.0203 -0.0108 -0.0045 934 ARG 124 N 0.0150 -0.0072 0.0022 935 ARG 124 CA 0.0136 -0.0082 0.0043 936 ARG 124 C 0.0141 -0.0108 0.0049 937 ARG 124 O 0.0148 -0.0113 0.0044 938 ARG 124 CB 0.0118 -0.0067 0.0057 939 ARG 124 CG 0.0114 -0.0039 0.0049 940 ARG 124 CD 0.0108 -0.0028 0.0050 941 ARG 124 NE 0.0102 -0.0001 0.0045 942 ARG 124 CZ 0.0112 0.0013 0.0027 943 ARG 124 NH1 0.0127 0.0003 0.0014 944 ARG 124 NH2 0.0105 0.0038 0.0024 945 VAL 125 N 0.0137 -0.0125 0.0061 946 VAL 125 CA 0.0142 -0.0151 0.0068 947 VAL 125 C 0.0127 -0.0162 0.0090 948 VAL 125 O 0.0115 -0.0154 0.0100 949 VAL 125 CB 0.0157 -0.0167 0.0057 950 VAL 125 CG1 0.0173 -0.0156 0.0035 951 VAL 125 CG2 0.0151 -0.0168 0.0065 952 HIS 126 N 0.0126 -0.0178 0.0098 953 HIS 126 CA 0.0113 -0.0190 0.0120 954 HIS 126 C 0.0121 -0.0213 0.0121 955 HIS 126 O 0.0131 -0.0232 0.0117 956 HIS 126 CB 0.0108 -0.0199 0.0129 957 HIS 126 CG 0.0094 -0.0212 0.0151 958 HIS 126 ND1 0.0080 -0.0203 0.0164 959 HIS 126 CD2 0.0093 -0.0233 0.0162 960 HIS 126 CE1 0.0070 -0.0219 0.0181 961 HIS 126 NE2 0.0078 -0.0237 0.0181 962 ALA 127 N 0.0102 -0.0189 0.0106 963 ALA 127 CA 0.0113 -0.0212 0.0107 964 ALA 127 C 0.0118 -0.0248 0.0122 965 ALA 127 O 0.0142 -0.0267 0.0110 966 ALA 127 CB 0.0097 -0.0202 0.0116 967 PRO 128 N 0.0097 -0.0259 0.0147 968 PRO 128 CA 0.0101 -0.0293 0.0162 969 PRO 128 C 0.0109 -0.0305 0.0160 970 PRO 128 O 0.0095 -0.0317 0.0179 971 PRO 128 CB 0.0073 -0.0297 0.0189 972 PRO 128 CG 0.0060 -0.0268 0.0186 973 PRO 128 CD 0.0068 -0.0242 0.0164 974 SER 129 N 0.0132 -0.0302 0.0137 975 SER 129 CA 0.0143 -0.0312 0.0133 976 SER 129 C 0.0169 -0.0304 0.0105 977 SER 129 O 0.0187 -0.0321 0.0096 978 SER 129 CB 0.0123 -0.0294 0.0141 979 SER 129 OG 0.0121 -0.0260 0.0126 980 GLY 130 N 0.0153 -0.0283 0.0097 981 GLY 130 CA 0.0169 -0.0276 0.0073 982 GLY 130 C 0.0172 -0.0255 0.0062 983 GLY 130 O 0.0185 -0.0246 0.0042 984 ARG 131 N 0.0159 -0.0246 0.0074 985 ARG 131 CA 0.0160 -0.0226 0.0065 986 ARG 131 C 0.0162 -0.0201 0.0053 987 ARG 131 O 0.0152 -0.0192 0.0061 988 ARG 131 CB 0.0144 -0.0219 0.0082 989 ARG 131 CG 0.0147 -0.0234 0.0083 990 ARG 131 CD 0.0138 -0.0256 0.0103 991 ARG 131 NE 0.0119 -0.0247 0.0123 992 ARG 131 CZ 0.0108 -0.0263 0.0143 993 ARG 131 NH1 0.0115 -0.0289 0.0145 994 ARG 131 NH2 0.0090 -0.0252 0.0160 995 VAL 132 N 0.0173 -0.0189 0.0034 996 VAL 132 CA 0.0176 -0.0165 0.0020 997 VAL 132 C 0.0174 -0.0141 0.0014 998 VAL 132 O 0.0180 -0.0144 0.0008 999 VAL 132 CB 0.0196 -0.0172 -0.0000 1000 VAL 132 CG1 0.0211 -0.0178 -0.0016 1001 VAL 132 CG2 0.0197 -0.0150 -0.0011 1002 TYR 133 N 0.0156 -0.0119 0.0019 1003 TYR 133 CA 0.0153 -0.0094 0.0014 1004 TYR 133 C 0.0158 -0.0080 -0.0001 1005 TYR 133 O 0.0162 -0.0089 -0.0005 1006 TYR 133 CB 0.0139 -0.0081 0.0036 1007 TYR 133 CG 0.0133 -0.0096 0.0053 1008 TYR 133 CD1 0.0132 -0.0092 0.0054 1009 TYR 133 CD2 0.0130 -0.0114 0.0069 1010 TYR 133 CE1 0.0128 -0.0106 0.0069 1011 TYR 133 CE2 0.0125 -0.0129 0.0084 1012 TYR 133 CZ 0.0124 -0.0125 0.0084 1013 TYR 133 OH 0.0120 -0.0140 0.0098 1014 HIS 134 N 0.0158 -0.0058 -0.0011 1015 HIS 134 CA 0.0161 -0.0041 -0.0025 1016 HIS 134 C 0.0153 -0.0014 -0.0020 1017 HIS 134 O 0.0154 -0.0004 -0.0027 1018 HIS 134 CB 0.0175 -0.0043 -0.0051 1019 HIS 134 CG 0.0179 -0.0029 -0.0065 1020 HIS 134 ND1 0.0176 -0.0003 -0.0071 1021 HIS 134 CD2 0.0184 -0.0035 -0.0073 1022 HIS 134 CE1 0.0180 0.0005 -0.0082 1023 HIS 134 NE2 0.0185 -0.0014 -0.0083 1024 VAL 135 N 0.0145 -0.0004 -0.0008 1025 VAL 135 CA 0.0136 0.0022 -0.0002 1026 VAL 135 C 0.0140 0.0039 -0.0018 1027 VAL 135 O 0.0133 0.0056 -0.0010 1028 VAL 135 CB 0.0131 0.0033 0.0002 1029 VAL 135 CG1 0.0124 0.0019 0.0022 1030 VAL 135 CG2 0.0142 0.0033 -0.0019 1031 LYS 136 N 0.0159 0.0027 -0.0031 1032 LYS 136 CA 0.0163 0.0044 -0.0049 1033 LYS 136 C 0.0166 0.0035 -0.0060 1034 LYS 136 O 0.0165 0.0047 -0.0058 1035 LYS 136 CB 0.0168 0.0048 -0.0068 1036 LYS 136 CG 0.0165 0.0063 -0.0061 1037 LYS 136 CD 0.0164 0.0046 -0.0052 1038 LYS 136 CE 0.0161 0.0061 -0.0044 1039 LYS 136 NZ 0.0159 0.0044 -0.0035 1040 PHE 137 N 0.0170 0.0014 -0.0071 1041 PHE 137 CA 0.0174 0.0004 -0.0084 1042 PHE 137 C 0.0171 -0.0003 -0.0071 1043 PHE 137 O 0.0173 0.0002 -0.0081 1044 PHE 137 CB 0.0179 -0.0018 -0.0100 1045 PHE 137 CG 0.0182 -0.0013 -0.0112 1046 PHE 137 CD1 0.0183 0.0011 -0.0121 1047 PHE 137 CD2 0.0183 -0.0031 -0.0115 1048 PHE 137 CE1 0.0185 0.0016 -0.0131 1049 PHE 137 CE2 0.0186 -0.0025 -0.0125 1050 PHE 137 CZ 0.0186 -0.0002 -0.0133 1051 ASN 138 N 0.0166 -0.0015 -0.0051 1052 ASN 138 CA 0.0163 -0.0021 -0.0037 1053 ASN 138 C 0.0156 -0.0020 -0.0010 1054 ASN 138 O 0.0154 -0.0039 0.0002 1055 ASN 138 CB 0.0166 -0.0046 -0.0044 1056 ASN 138 CG 0.0165 -0.0068 -0.0034 1057 ASN 138 OD1 0.0166 -0.0071 -0.0038 1058 ASN 138 ND2 0.0162 -0.0084 -0.0022 1059 PRO 139 N 0.0154 -0.0003 -0.0002 1060 PRO 139 CA 0.0137 0.0002 0.0021 1061 PRO 139 C 0.0127 -0.0015 0.0041 1062 PRO 139 O 0.0132 -0.0024 0.0037 1063 PRO 139 CB 0.0130 0.0034 0.0020 1064 PRO 139 CG 0.0140 0.0039 0.0004 1065 PRO 139 CD 0.0157 0.0022 -0.0015 1066 PRO 140 N 0.0114 -0.0021 0.0062 1067 PRO 140 CA 0.0105 -0.0037 0.0081 1068 PRO 140 C 0.0093 -0.0016 0.0091 1069 PRO 140 O 0.0089 0.0009 0.0087 1070 PRO 140 CB 0.0095 -0.0048 0.0099 1071 PRO 140 CG 0.0092 -0.0026 0.0095 1072 PRO 140 CD 0.0109 -0.0019 0.0069 1073 LYS 141 N 0.0088 -0.0027 0.0102 1074 LYS 141 CA 0.0077 -0.0009 0.0112 1075 LYS 141 C 0.0061 0.0008 0.0128 1076 LYS 141 O 0.0056 0.0033 0.0126 1077 LYS 141 CB 0.0071 -0.0028 0.0126 1078 LYS 141 CG 0.0086 -0.0044 0.0111 1079 LYS 141 CD 0.0080 -0.0064 0.0126 1080 LYS 141 CE 0.0094 -0.0087 0.0113 1081 LYS 141 NZ 0.0089 -0.0112 0.0129 1082 VAL 142 N 0.0053 -0.0009 0.0146 1083 VAL 142 CA 0.0039 0.0005 0.0161 1084 VAL 142 C 0.0047 0.0005 0.0150 1085 VAL 142 O 0.0052 -0.0015 0.0151 1086 VAL 142 CB 0.0026 -0.0011 0.0185 1087 VAL 142 CG1 0.0010 0.0006 0.0201 1088 VAL 142 CG2 0.0022 -0.0021 0.0194 1089 GLU 143 N 0.0051 0.0028 0.0137 1090 GLU 143 CA 0.0059 0.0032 0.0124 1091 GLU 143 C 0.0050 0.0023 0.0139 1092 GLU 143 O 0.0035 0.0032 0.0157 1093 GLU 143 CB 0.0061 0.0061 0.0112 1094 GLU 143 CG 0.0070 0.0066 0.0097 1095 GLU 143 CD 0.0089 0.0056 0.0074 1096 GLU 143 OE1 0.0097 0.0064 0.0061 1097 GLU 143 OE2 0.0097 0.0041 0.0069 1098 GLY 144 N 0.0060 0.0006 0.0131 1099 GLY 144 CA 0.0054 -0.0005 0.0144 1100 GLY 144 C 0.0048 -0.0030 0.0161 1101 GLY 144 O 0.0043 -0.0042 0.0171 1102 LYS 145 N 0.0043 -0.0035 0.0160 1103 LYS 145 CA 0.0037 -0.0060 0.0176 1104 LYS 145 C 0.0052 -0.0082 0.0164 1105 LYS 145 O 0.0062 -0.0074 0.0148 1106 LYS 145 CB 0.0021 -0.0051 0.0194 1107 LYS 145 CG 0.0005 -0.0028 0.0208 1108 LYS 145 CD -0.0009 -0.0042 0.0229 1109 LYS 145 CE -0.0027 -0.0020 0.0246 1110 LYS 145 NZ -0.0041 -0.0034 0.0269 1111 ASP 146 N 0.0053 -0.0109 0.0171 1112 ASP 146 CA 0.0067 -0.0132 0.0160 1113 ASP 146 C 0.0061 -0.0135 0.0169 1114 ASP 146 O 0.0046 -0.0141 0.0190 1115 ASP 146 CB 0.0069 -0.0161 0.0166 1116 ASP 146 CG 0.0081 -0.0186 0.0160 1117 ASP 146 OD1 0.0096 -0.0185 0.0140 1118 ASP 146 OD2 0.0074 -0.0207 0.0176 1119 ASP 147 N 0.0074 -0.0133 0.0152 1120 ASP 147 CA 0.0070 -0.0135 0.0157 1121 ASP 147 C 0.0066 -0.0162 0.0172 1122 ASP 147 O 0.0056 -0.0160 0.0183 1123 ASP 147 CB 0.0087 -0.0130 0.0134 1124 ASP 147 CG 0.0090 -0.0100 0.0120 1125 ASP 147 OD1 0.0077 -0.0082 0.0131 1126 ASP 147 OD2 0.0105 -0.0096 0.0099 1127 VAL 148 N 0.0071 -0.0191 0.0173 1128 VAL 148 CA 0.0068 -0.0218 0.0187 1129 VAL 148 C 0.0050 -0.0225 0.0212 1130 VAL 148 O 0.0041 -0.0240 0.0228 1131 VAL 148 CB 0.0086 -0.0243 0.0173 1132 VAL 148 CG1 0.0081 -0.0272 0.0189 1133 VAL 148 CG2 0.0099 -0.0246 0.0158 1134 THR 149 N 0.0044 -0.0214 0.0216 1135 THR 149 CA 0.0027 -0.0221 0.0239 1136 THR 149 C 0.0010 -0.0194 0.0250 1137 THR 149 O -0.0007 -0.0196 0.0272 1138 THR 149 CB 0.0032 -0.0236 0.0237 1139 THR 149 OG1 0.0039 -0.0216 0.0223 1140 THR 149 CG2 0.0048 -0.0263 0.0227 1141 GLY 150 N 0.0014 -0.0168 0.0237 1142 GLY 150 CA -0.0001 -0.0142 0.0246 1143 GLY 150 C -0.0005 -0.0143 0.0252 1144 GLY 150 O -0.0022 -0.0135 0.0270 1145 GLU 151 N 0.0014 -0.0151 0.0231 1146 GLU 151 CA 0.0013 -0.0154 0.0233 1147 GLU 151 C 0.0023 -0.0134 0.0214 1148 GLU 151 O 0.0038 -0.0131 0.0195 1149 GLU 151 CB 0.0022 -0.0184 0.0233 1150 GLU 151 CG 0.0016 -0.0192 0.0242 1151 GLU 151 CD 0.0024 -0.0223 0.0243 1152 GLU 151 OE1 0.0028 -0.0240 0.0245 1153 GLU 151 OE2 0.0027 -0.0231 0.0242 1154 GLU 152 N 0.0016 -0.0121 0.0218 1155 GLU 152 CA 0.0024 -0.0101 0.0201 1156 GLU 152 C 0.0044 -0.0114 0.0180 1157 GLU 152 O 0.0050 -0.0138 0.0182 1158 GLU 152 CB 0.0012 -0.0087 0.0211 1159 GLU 152 CG -0.0006 -0.0066 0.0226 1160 GLU 152 CD -0.0006 -0.0036 0.0214 1161 GLU 152 OE1 0.0008 -0.0029 0.0195 1162 GLU 152 OE2 -0.0019 -0.0019 0.0225 1163 LEU 153 N 0.0055 -0.0096 0.0161 1164 LEU 153 CA 0.0075 -0.0104 0.0140 1165 LEU 153 C 0.0076 -0.0095 0.0135 1166 LEU 153 O 0.0063 -0.0077 0.0145 1167 LEU 153 CB 0.0086 -0.0090 0.0121 1168 LEU 153 CG 0.0085 -0.0096 0.0124 1169 LEU 153 CD1 0.0096 -0.0079 0.0105 1170 LEU 153 CD2 0.0092 -0.0127 0.0126 1171 THR 154 N 0.0106 -0.0098 0.0091 1172 THR 154 CA 0.0111 -0.0095 0.0082 1173 THR 154 C 0.0122 -0.0091 0.0065 1174 THR 154 O 0.0126 -0.0091 0.0060 1175 THR 154 CB 0.0116 -0.0109 0.0088 1176 THR 154 OG1 0.0123 -0.0124 0.0092 1177 THR 154 CG2 0.0104 -0.0109 0.0103 1178 THR 155 N 0.0128 -0.0088 0.0056 1179 THR 155 CA 0.0139 -0.0085 0.0039 1180 THR 155 C 0.0150 -0.0099 0.0037 1181 THR 155 O 0.0147 -0.0103 0.0044 1182 THR 155 CB 0.0136 -0.0068 0.0029 1183 THR 155 OG1 0.0125 -0.0063 0.0038 1184 THR 155 CG2 0.0131 -0.0056 0.0024 1185 ARG 156 N 0.0163 -0.0106 0.0028 1186 ARG 156 CA 0.0174 -0.0119 0.0025 1187 ARG 156 C 0.0177 -0.0110 0.0014 1188 ARG 156 O 0.0174 -0.0096 0.0005 1189 ARG 156 CB 0.0187 -0.0128 0.0018 1190 ARG 156 CG 0.0195 -0.0147 0.0023 1191 ARG 156 CD 0.0209 -0.0155 0.0013 1192 ARG 156 NE 0.0208 -0.0152 0.0012 1193 ARG 156 CZ 0.0206 -0.0161 0.0022 1194 ARG 156 NH1 0.0204 -0.0174 0.0035 1195 ARG 156 NH2 0.0205 -0.0158 0.0020 1196 LYS 157 N 0.0216 -0.0092 -0.0021 1197 LYS 157 CA 0.0218 -0.0097 -0.0028 1198 LYS 157 C 0.0212 -0.0099 -0.0033 1199 LYS 157 O 0.0208 -0.0102 -0.0039 1200 LYS 157 CB 0.0227 -0.0100 -0.0029 1201 LYS 157 CG 0.0229 -0.0106 -0.0036 1202 LYS 157 CD 0.0227 -0.0109 -0.0042 1203 LYS 157 CE 0.0234 -0.0110 -0.0040 1204 LYS 157 NZ 0.0243 -0.0113 -0.0043 1205 ASP 158 N 0.0211 -0.0096 -0.0029 1206 ASP 158 CA 0.0206 -0.0097 -0.0032 1207 ASP 158 C 0.0196 -0.0096 -0.0034 1208 ASP 158 O 0.0192 -0.0099 -0.0040 1209 ASP 158 CB 0.0206 -0.0094 -0.0027 1210 ASP 158 CG 0.0215 -0.0094 -0.0024 1211 ASP 158 OD1 0.0220 -0.0098 -0.0028 1212 ASP 158 OD2 0.0216 -0.0090 -0.0018 1213 ASP 159 N 0.0193 -0.0092 -0.0030 1214 ASP 159 CA 0.0185 -0.0091 -0.0031 1215 ASP 159 C 0.0183 -0.0095 -0.0038 1216 ASP 159 O 0.0175 -0.0095 -0.0040 1217 ASP 159 CB 0.0183 -0.0086 -0.0024 1218 ASP 159 CG 0.0185 -0.0082 -0.0017 1219 ASP 159 OD1 0.0186 -0.0083 -0.0018 1220 ASP 159 OD2 0.0184 -0.0078 -0.0011 1221 GLN 160 N 0.0193 -0.0098 -0.0066 1222 GLN 160 CA 0.0190 -0.0099 -0.0078 1223 GLN 160 C 0.0185 -0.0100 -0.0089 1224 GLN 160 O 0.0191 -0.0103 -0.0093 1225 GLN 160 CB 0.0202 -0.0103 -0.0082 1226 GLN 160 CG 0.0202 -0.0102 -0.0078 1227 GLN 160 CD 0.0200 -0.0104 -0.0089 1228 GLN 160 OE1 0.0195 -0.0105 -0.0100 1229 GLN 160 NE2 0.0204 -0.0104 -0.0087 1230 GLU 161 N 0.0173 -0.0099 -0.0095 1231 GLU 161 CA 0.0167 -0.0100 -0.0106 1232 GLU 161 C 0.0176 -0.0104 -0.0117 1233 GLU 161 O 0.0176 -0.0105 -0.0122 1234 GLU 161 CB 0.0155 -0.0098 -0.0111 1235 GLU 161 CG 0.0145 -0.0097 -0.0118 1236 GLU 161 CD 0.0131 -0.0095 -0.0121 1237 GLU 161 OE1 0.0125 -0.0091 -0.0111 1238 GLU 161 OE2 0.0127 -0.0096 -0.0133 1239 GLU 162 N 0.0184 -0.0107 -0.0121 1240 GLU 162 CA 0.0193 -0.0111 -0.0132 1241 GLU 162 C 0.0204 -0.0113 -0.0128 1242 GLU 162 O 0.0207 -0.0115 -0.0136 1243 GLU 162 CB 0.0200 -0.0113 -0.0135 1244 GLU 162 CG 0.0212 -0.0118 -0.0144 1245 GLU 162 CD 0.0224 -0.0120 -0.0139 1246 GLU 162 OE1 0.0232 -0.0120 -0.0131 1247 GLU 162 OE2 0.0226 -0.0121 -0.0143 1248 THR 163 N 0.0210 -0.0112 -0.0128 1249 THR 163 CA 0.0217 -0.0109 -0.0122 1250 THR 163 C 0.0205 -0.0106 -0.0119 1251 THR 163 O 0.0206 -0.0108 -0.0122 1252 THR 163 CB 0.0226 -0.0101 -0.0111 1253 THR 163 OG1 0.0236 -0.0104 -0.0114 1254 THR 163 CG2 0.0233 -0.0097 -0.0105 1255 VAL 164 N 0.0193 -0.0102 -0.0114 1256 VAL 164 CA 0.0180 -0.0099 -0.0110 1257 VAL 164 C 0.0173 -0.0106 -0.0121 1258 VAL 164 O 0.0172 -0.0106 -0.0121 1259 VAL 164 CB 0.0168 -0.0093 -0.0103 1260 VAL 164 CG1 0.0155 -0.0090 -0.0099 1261 VAL 164 CG2 0.0175 -0.0086 -0.0092 1262 ARG 165 N 0.0168 -0.0112 -0.0130 1263 ARG 165 CA 0.0162 -0.0119 -0.0141 1264 ARG 165 C 0.0171 -0.0124 -0.0147 1265 ARG 165 O 0.0166 -0.0127 -0.0152 1266 ARG 165 CB 0.0156 -0.0125 -0.0150 1267 ARG 165 CG 0.0143 -0.0122 -0.0146 1268 ARG 165 CD 0.0132 -0.0129 -0.0156 1269 ARG 165 NE 0.0117 -0.0125 -0.0152 1270 ARG 165 CZ 0.0112 -0.0124 -0.0150 1271 ARG 165 NH1 0.0120 -0.0125 -0.0152 1272 ARG 165 NH2 0.0098 -0.0121 -0.0147 1273 LYS 166 N 0.0174 -0.0114 -0.0149 1274 LYS 166 CA 0.0187 -0.0119 -0.0156 1275 LYS 166 C 0.0189 -0.0114 -0.0147 1276 LYS 166 O 0.0189 -0.0118 -0.0154 1277 LYS 166 CB 0.0204 -0.0120 -0.0155 1278 LYS 166 CG 0.0211 -0.0131 -0.0170 1279 LYS 166 CD 0.0226 -0.0131 -0.0168 1280 LYS 166 CE 0.0238 -0.0123 -0.0154 1281 LYS 166 NZ 0.0247 -0.0121 -0.0148 1282 ARG 167 N 0.0189 -0.0105 -0.0133 1283 ARG 167 CA 0.0190 -0.0099 -0.0124 1284 ARG 167 C 0.0175 -0.0100 -0.0128 1285 ARG 167 O 0.0177 -0.0101 -0.0129 1286 ARG 167 CB 0.0190 -0.0089 -0.0108 1287 ARG 167 CG 0.0207 -0.0086 -0.0101 1288 ARG 167 CD 0.0208 -0.0076 -0.0085 1289 ARG 167 NE 0.0196 -0.0069 -0.0076 1290 ARG 167 CZ 0.0201 -0.0065 -0.0068 1291 ARG 167 NH1 0.0217 -0.0066 -0.0068 1292 ARG 167 NH2 0.0189 -0.0059 -0.0061 1293 LEU 168 N 0.0160 -0.0100 -0.0130 1294 LEU 168 CA 0.0144 -0.0100 -0.0133 1295 LEU 168 C 0.0144 -0.0110 -0.0148 1296 LEU 168 O 0.0138 -0.0110 -0.0150 1297 LEU 168 CB 0.0128 -0.0097 -0.0131 1298 LEU 168 CG 0.0124 -0.0087 -0.0116 1299 LEU 168 CD1 0.0109 -0.0086 -0.0116 1300 LEU 168 CD2 0.0119 -0.0081 -0.0107 1301 VAL 169 N 0.0147 -0.0109 -0.0147 1302 VAL 169 CA 0.0142 -0.0121 -0.0150 1303 VAL 169 C 0.0144 -0.0114 -0.0148 1304 VAL 169 O 0.0134 -0.0115 -0.0145 1305 VAL 169 CB 0.0151 -0.0133 -0.0160 1306 VAL 169 CG1 0.0167 -0.0128 -0.0164 1307 VAL 169 CG2 0.0147 -0.0144 -0.0162 1308 GLU 170 N 0.0156 -0.0105 -0.0149 1309 GLU 170 CA 0.0160 -0.0097 -0.0147 1310 GLU 170 C 0.0148 -0.0088 -0.0139 1311 GLU 170 O 0.0143 -0.0087 -0.0137 1312 GLU 170 CB 0.0174 -0.0087 -0.0149 1313 GLU 170 CG 0.0184 -0.0085 -0.0152 1314 GLU 170 CD 0.0184 -0.0070 -0.0146 1315 GLU 170 OE1 0.0185 -0.0059 -0.0142 1316 GLU 170 OE2 0.0184 -0.0068 -0.0145 1317 TYR 171 N 0.0143 -0.0081 -0.0134 1318 TYR 171 CA 0.0131 -0.0072 -0.0125 1319 TYR 171 C 0.0117 -0.0081 -0.0123 1320 TYR 171 O 0.0109 -0.0077 -0.0119 1321 TYR 171 CB 0.0129 -0.0065 -0.0121 1322 TYR 171 CG 0.0116 -0.0057 -0.0113 1323 TYR 171 CD1 0.0116 -0.0044 -0.0107 1324 TYR 171 CD2 0.0103 -0.0064 -0.0110 1325 TYR 171 CE1 0.0103 -0.0038 -0.0099 1326 TYR 171 CE2 0.0091 -0.0058 -0.0102 1327 TYR 171 CZ 0.0091 -0.0044 -0.0097 1328 TYR 171 OH 0.0078 -0.0038 -0.0089 1329 HIS 172 N 0.0118 -0.0084 -0.0139 1330 HIS 172 CA 0.0102 -0.0095 -0.0136 1331 HIS 172 C 0.0102 -0.0102 -0.0140 1332 HIS 172 O 0.0089 -0.0103 -0.0133 1333 HIS 172 CB 0.0096 -0.0110 -0.0141 1334 HIS 172 CG 0.0089 -0.0105 -0.0134 1335 HIS 172 ND1 0.0073 -0.0101 -0.0122 1336 HIS 172 CD2 0.0095 -0.0104 -0.0136 1337 HIS 172 CE1 0.0070 -0.0096 -0.0118 1338 HIS 172 NE2 0.0083 -0.0098 -0.0126 1339 GLN 173 N 0.0116 -0.0106 -0.0150 1340 GLN 173 CA 0.0117 -0.0113 -0.0154 1341 GLN 173 C 0.0116 -0.0098 -0.0145 1342 GLN 173 O 0.0108 -0.0100 -0.0142 1343 GLN 173 CB 0.0133 -0.0119 -0.0167 1344 GLN 173 CG 0.0150 -0.0105 -0.0169 1345 GLN 173 CD 0.0166 -0.0112 -0.0183 1346 GLN 173 OE1 0.0178 -0.0103 -0.0185 1347 GLN 173 NE2 0.0166 -0.0127 -0.0191 1348 MET 174 N 0.0123 -0.0082 -0.0141 1349 MET 174 CA 0.0124 -0.0066 -0.0133 1350 MET 174 C 0.0108 -0.0059 -0.0120 1351 MET 174 O 0.0103 -0.0053 -0.0113 1352 MET 174 CB 0.0140 -0.0052 -0.0135 1353 MET 174 CG 0.0144 -0.0034 -0.0127 1354 MET 174 SD 0.0165 -0.0022 -0.0132 1355 MET 174 CE 0.0159 -0.0005 -0.0120 1356 THR 175 N 0.0102 -0.0055 -0.0128 1357 THR 175 CA 0.0090 -0.0051 -0.0116 1358 THR 175 C 0.0075 -0.0058 -0.0120 1359 THR 175 O 0.0066 -0.0055 -0.0111 1360 THR 175 CB 0.0085 -0.0044 -0.0105 1361 THR 175 OG1 0.0100 -0.0038 -0.0104 1362 THR 175 CG2 0.0078 -0.0036 -0.0091 1363 ALA 176 N 0.0071 -0.0069 -0.0133 1364 ALA 176 CA 0.0057 -0.0076 -0.0137 1365 ALA 176 C 0.0056 -0.0075 -0.0135 1366 ALA 176 O 0.0043 -0.0075 -0.0128 1367 ALA 176 CB 0.0056 -0.0088 -0.0152 1368 PRO 177 N 0.0069 -0.0075 -0.0141 1369 PRO 177 CA 0.0069 -0.0074 -0.0139 1370 PRO 177 C 0.0069 -0.0063 -0.0124 1371 PRO 177 O 0.0063 -0.0062 -0.0119 1372 PRO 177 CB 0.0083 -0.0077 -0.0150 1373 PRO 177 CG 0.0095 -0.0074 -0.0152 1374 PRO 177 CD 0.0085 -0.0077 -0.0151 1375 LEU 178 N 0.0065 -0.0033 -0.0127 1376 LEU 178 CA 0.0067 -0.0023 -0.0111 1377 LEU 178 C 0.0049 -0.0024 -0.0101 1378 LEU 178 O 0.0045 -0.0019 -0.0091 1379 LEU 178 CB 0.0077 -0.0016 -0.0104 1380 LEU 178 CG 0.0079 -0.0005 -0.0087 1381 LEU 178 CD1 0.0088 -0.0001 -0.0085 1382 LEU 178 CD2 0.0090 0.0001 -0.0082 1383 ILE 179 N 0.0038 -0.0029 -0.0104 1384 ILE 179 CA 0.0020 -0.0030 -0.0096 1385 ILE 179 C 0.0012 -0.0036 -0.0100 1386 ILE 179 O 0.0002 -0.0033 -0.0090 1387 ILE 179 CB 0.0010 -0.0037 -0.0102 1388 ILE 179 CG1 0.0019 -0.0033 -0.0100 1389 ILE 179 CG2 -0.0009 -0.0039 -0.0094 1390 ILE 179 CD1 0.0021 -0.0022 -0.0083 1391 GLY 180 N 0.0015 -0.0043 -0.0116 1392 GLY 180 CA 0.0008 -0.0049 -0.0122 1393 GLY 180 C 0.0015 -0.0043 -0.0114 1394 GLY 180 O 0.0006 -0.0044 -0.0111 1395 TYR 181 N 0.0034 -0.0025 -0.0118 1396 TYR 181 CA 0.0044 -0.0018 -0.0110 1397 TYR 181 C 0.0035 -0.0013 -0.0093 1398 TYR 181 O 0.0031 -0.0012 -0.0087 1399 TYR 181 CB 0.0062 -0.0011 -0.0110 1400 TYR 181 CG 0.0072 -0.0002 -0.0100 1401 TYR 181 CD1 0.0072 0.0005 -0.0083 1402 TYR 181 CD2 0.0082 -0.0002 -0.0107 1403 TYR 181 CE1 0.0081 0.0013 -0.0073 1404 TYR 181 CE2 0.0092 0.0006 -0.0098 1405 TYR 181 CZ 0.0092 0.0013 -0.0081 1406 TYR 181 OH 0.0102 0.0021 -0.0072 1407 TYR 182 N 0.0031 -0.0011 -0.0084 1408 TYR 182 CA 0.0023 -0.0006 -0.0067 1409 TYR 182 C 0.0005 -0.0012 -0.0064 1410 TYR 182 O -0.0001 -0.0008 -0.0051 1411 TYR 182 CB 0.0024 -0.0002 -0.0058 1412 TYR 182 CG 0.0041 0.0007 -0.0052 1413 TYR 182 CD1 0.0047 0.0014 -0.0042 1414 TYR 182 CD2 0.0051 0.0009 -0.0056 1415 TYR 182 CE1 0.0064 0.0023 -0.0037 1416 TYR 182 CE2 0.0067 0.0018 -0.0051 1417 TYR 182 CZ 0.0073 0.0024 -0.0042 1418 TYR 182 OH 0.0089 0.0032 -0.0037 1419 SER 183 N -0.0004 -0.0021 -0.0077 1420 SER 183 CA -0.0021 -0.0027 -0.0075 1421 SER 183 C -0.0019 -0.0027 -0.0077 1422 SER 183 O -0.0029 -0.0026 -0.0068 1423 SER 183 CB -0.0032 -0.0036 -0.0088 1424 SER 183 OG -0.0034 -0.0037 -0.0086 1425 LYS 184 N -0.0004 -0.0028 -0.0100 1426 LYS 184 CA -0.0002 -0.0029 -0.0103 1427 LYS 184 C 0.0003 -0.0021 -0.0089 1428 LYS 184 O -0.0003 -0.0021 -0.0085 1429 LYS 184 CB 0.0011 -0.0032 -0.0117 1430 LYS 184 CG 0.0003 -0.0042 -0.0132 1431 LYS 184 CD 0.0016 -0.0045 -0.0144 1432 LYS 184 CE 0.0008 -0.0054 -0.0159 1433 LYS 184 NZ 0.0021 -0.0057 -0.0173 1434 GLU 185 N 0.0013 -0.0014 -0.0080 1435 GLU 185 CA 0.0018 -0.0006 -0.0066 1436 GLU 185 C 0.0003 -0.0004 -0.0054 1437 GLU 185 O 0.0000 -0.0001 -0.0046 1438 GLU 185 CB 0.0031 0.0000 -0.0060 1439 GLU 185 CG 0.0048 0.0001 -0.0069 1440 GLU 185 CD 0.0054 0.0004 -0.0067 1441 GLU 185 OE1 0.0055 0.0010 -0.0053 1442 GLU 185 OE2 0.0059 -0.0001 -0.0078 1443 ALA 186 N -0.0007 -0.0006 -0.0053 1444 ALA 186 CA -0.0022 -0.0005 -0.0042 1445 ALA 186 C -0.0034 -0.0010 -0.0045 1446 ALA 186 O -0.0040 -0.0006 -0.0034 1447 ALA 186 CB -0.0031 -0.0008 -0.0043 1448 GLU 187 N -0.0038 -0.0016 -0.0065 1449 GLU 187 CA -0.0048 -0.0021 -0.0072 1450 GLU 187 C -0.0039 -0.0019 -0.0070 1451 GLU 187 O -0.0048 -0.0019 -0.0068 1452 GLU 187 CB -0.0051 -0.0029 -0.0090 1453 GLU 187 CG -0.0065 -0.0033 -0.0093 1454 GLU 187 CD -0.0065 -0.0040 -0.0111 1455 GLU 187 OE1 -0.0062 -0.0045 -0.0122 1456 GLU 187 OE2 -0.0068 -0.0042 -0.0113 1457 ALA 188 N -0.0022 -0.0016 -0.0070 1458 ALA 188 CA -0.0012 -0.0013 -0.0067 1459 ALA 188 C -0.0014 -0.0006 -0.0050 1460 ALA 188 O -0.0008 -0.0003 -0.0045 1461 ALA 188 CB 0.0006 -0.0013 -0.0073 1462 GLY 189 N -0.0021 -0.0003 -0.0039 1463 GLY 189 CA -0.0023 0.0004 -0.0022 1464 GLY 189 C -0.0007 0.0011 -0.0013 1465 GLY 189 O -0.0007 0.0017 0.0001 1466 ASN 190 N 0.0006 0.0011 -0.0027 1467 ASN 190 CA 0.0022 0.0019 -0.0021 1468 ASN 190 C 0.0021 0.0022 -0.0013 1469 ASN 190 O 0.0032 0.0029 -0.0005 1470 ASN 190 CB 0.0036 0.0017 -0.0034 1471 ASN 190 CG 0.0041 0.0017 -0.0039 1472 ASN 190 OD1 0.0045 0.0022 -0.0029 1473 ASN 190 ND2 0.0043 0.0010 -0.0054 1474 THR 191 N 0.0009 0.0018 -0.0015 1475 THR 191 CA 0.0008 0.0020 -0.0008 1476 THR 191 C -0.0009 0.0014 -0.0010 1477 THR 191 O -0.0018 0.0008 -0.0017 1478 THR 191 CB 0.0021 0.0021 -0.0016 1479 THR 191 OG1 0.0020 0.0024 -0.0008 1480 THR 191 CG2 0.0018 0.0012 -0.0033 1481 LYS 192 N -0.0014 0.0016 -0.0003 1482 LYS 192 CA -0.0030 0.0010 -0.0005 1483 LYS 192 C -0.0027 0.0007 -0.0013 1484 LYS 192 O -0.0017 0.0012 -0.0009 1485 LYS 192 CB -0.0040 0.0014 0.0010 1486 LYS 192 CG -0.0046 0.0016 0.0019 1487 LYS 192 CD -0.0035 0.0025 0.0030 1488 LYS 192 CE -0.0040 0.0031 0.0047 1489 LYS 192 NZ -0.0029 0.0039 0.0058 1490 TYR 193 N -0.0042 -0.0001 -0.0016 1491 TYR 193 CA -0.0039 -0.0004 -0.0025 1492 TYR 193 C -0.0057 -0.0008 -0.0022 1493 TYR 193 O -0.0073 -0.0012 -0.0022 1494 TYR 193 CB -0.0033 -0.0012 -0.0045 1495 TYR 193 CG -0.0034 -0.0018 -0.0057 1496 TYR 193 CD1 -0.0021 -0.0015 -0.0058 1497 TYR 193 CD2 -0.0050 -0.0027 -0.0066 1498 TYR 193 CE1 -0.0023 -0.0021 -0.0068 1499 TYR 193 CE2 -0.0052 -0.0033 -0.0076 1500 TYR 193 CZ -0.0039 -0.0030 -0.0077 1501 TYR 193 OH -0.0043 -0.0036 -0.0087 1502 ALA 194 N -0.0056 -0.0007 -0.0020 1503 ALA 194 CA -0.0074 -0.0011 -0.0018 1504 ALA 194 C -0.0071 -0.0014 -0.0026 1505 ALA 194 O -0.0055 -0.0009 -0.0024 1506 ALA 194 CB -0.0082 -0.0004 0.0002 1507 LYS 195 N -0.0084 -0.0022 -0.0034 1508 LYS 195 CA -0.0083 -0.0025 -0.0042 1509 LYS 195 C -0.0094 -0.0022 -0.0029 1510 LYS 195 O -0.0111 -0.0024 -0.0024 1511 LYS 195 CB -0.0089 -0.0036 -0.0060 1512 LYS 195 CG -0.0089 -0.0040 -0.0069 1513 LYS 195 CD -0.0078 -0.0046 -0.0088 1514 LYS 195 CE -0.0086 -0.0055 -0.0101 1515 LYS 195 NZ -0.0079 -0.0053 -0.0101 1516 VAL 196 N -0.0102 -0.0018 -0.0031 1517 VAL 196 CA -0.0111 -0.0005 -0.0015 1518 VAL 196 C -0.0110 -0.0012 -0.0023 1519 VAL 196 O -0.0089 -0.0017 -0.0032 1520 VAL 196 CB -0.0093 0.0012 0.0005 1521 VAL 196 CG1 -0.0094 0.0023 0.0018 1522 VAL 196 CG2 -0.0102 0.0022 0.0018 1523 ASP 197 N -0.0132 -0.0013 -0.0021 1524 ASP 197 CA -0.0133 -0.0019 -0.0028 1525 ASP 197 C -0.0118 -0.0004 -0.0012 1526 ASP 197 O -0.0129 0.0009 0.0005 1527 ASP 197 CB -0.0162 -0.0024 -0.0030 1528 ASP 197 CG -0.0163 -0.0033 -0.0042 1529 ASP 197 OD1 -0.0145 -0.0041 -0.0055 1530 ASP 197 OD2 -0.0184 -0.0032 -0.0037 1531 GLY 198 N -0.0094 -0.0006 -0.0018 1532 GLY 198 CA -0.0078 0.0007 -0.0004 1533 GLY 198 C -0.0086 0.0006 -0.0004 1534 GLY 198 O -0.0073 0.0016 0.0006 1535 THR 199 N -0.0101 -0.0007 -0.0015 1536 THR 199 CA -0.0111 -0.0005 -0.0014 1537 THR 199 C -0.0138 0.0011 0.0003 1538 THR 199 O -0.0152 0.0012 0.0003 1539 THR 199 CB -0.0122 -0.0026 -0.0038 1540 THR 199 OG1 -0.0150 -0.0030 -0.0045 1541 THR 199 CG2 -0.0097 -0.0043 -0.0056 1542 LYS 200 N -0.0145 0.0023 0.0016 1543 LYS 200 CA -0.0170 0.0039 0.0033 1544 LYS 200 C -0.0157 0.0059 0.0058 1545 LYS 200 O -0.0129 0.0062 0.0063 1546 LYS 200 CB -0.0188 0.0041 0.0035 1547 LYS 200 CG -0.0210 0.0025 0.0015 1548 LYS 200 CD -0.0226 0.0031 0.0021 1549 LYS 200 CE -0.0249 0.0016 0.0002 1550 LYS 200 NZ -0.0266 0.0025 0.0011 1551 PRO 201 N -0.0177 0.0074 0.0074 1552 PRO 201 CA -0.0166 0.0095 0.0098 1553 PRO 201 C -0.0152 0.0102 0.0108 1554 PRO 201 O -0.0165 0.0099 0.0104 1555 PRO 201 CB -0.0197 0.0107 0.0111 1556 PRO 201 CG -0.0223 0.0094 0.0094 1557 PRO 201 CD -0.0210 0.0073 0.0070 1558 VAL 202 N -0.0144 0.0105 0.0110 1559 VAL 202 CA -0.0128 0.0112 0.0120 1560 VAL 202 C -0.0147 0.0121 0.0131 1561 VAL 202 O -0.0142 0.0120 0.0130 1562 VAL 202 CB -0.0107 0.0123 0.0136 1563 VAL 202 CG1 -0.0094 0.0134 0.0151 1564 VAL 202 CG2 -0.0084 0.0113 0.0123 1565 ALA 203 N -0.0168 0.0129 0.0141 1566 ALA 203 CA -0.0188 0.0138 0.0153 1567 ALA 203 C -0.0205 0.0126 0.0136 1568 ALA 203 O -0.0215 0.0131 0.0142 1569 ALA 203 CB -0.0206 0.0149 0.0167 1570 GLU 204 N -0.0209 0.0112 0.0116 1571 GLU 204 CA -0.0225 0.0100 0.0100 1572 GLU 204 C -0.0206 0.0093 0.0090 1573 GLU 204 O -0.0214 0.0092 0.0089 1574 GLU 204 CB -0.0238 0.0088 0.0083 1575 GLU 204 CG -0.0263 0.0081 0.0072 1576 GLU 204 CD -0.0280 0.0071 0.0058 1577 GLU 204 OE1 -0.0280 0.0074 0.0063 1578 GLU 204 OE2 -0.0295 0.0061 0.0043 1579 VAL 205 N -0.0177 0.0084 0.0086 1580 VAL 205 CA -0.0159 0.0077 0.0077 1581 VAL 205 C -0.0155 0.0087 0.0091 1582 VAL 205 O -0.0156 0.0082 0.0085 1583 VAL 205 CB -0.0135 0.0074 0.0074 1584 VAL 205 CG1 -0.0118 0.0067 0.0066 1585 VAL 205 CG2 -0.0137 0.0064 0.0061 1586 ARG 206 N -0.0152 0.0100 0.0110 1587 ARG 206 CA -0.0148 0.0111 0.0126 1588 ARG 206 C -0.0170 0.0112 0.0125 1589 ARG 206 O -0.0168 0.0112 0.0126 1590 ARG 206 CB -0.0146 0.0125 0.0145 1591 ARG 206 CG -0.0138 0.0137 0.0162 1592 ARG 206 CD -0.0159 0.0149 0.0177 1593 ARG 206 NE -0.0152 0.0162 0.0196 1594 ARG 206 CZ -0.0150 0.0174 0.0213 1595 ARG 206 NH1 -0.0155 0.0174 0.0212 1596 ARG 206 NH2 -0.0144 0.0186 0.0230 1597 ALA 207 N -0.0192 0.0111 0.0123 1598 ALA 207 CA -0.0214 0.0111 0.0122 1599 ALA 207 C -0.0213 0.0098 0.0105 1600 ALA 207 O -0.0218 0.0100 0.0106 1601 ALA 207 CB -0.0236 0.0110 0.0120 1602 ASP 208 N -0.0203 0.0086 0.0088 1603 ASP 208 CA -0.0200 0.0075 0.0069 1604 ASP 208 C -0.0180 0.0075 0.0072 1605 ASP 208 O -0.0184 0.0071 0.0065 1606 ASP 208 CB -0.0193 0.0064 0.0051 1607 ASP 208 CG -0.0215 0.0060 0.0042 1608 ASP 208 OD1 -0.0235 0.0063 0.0045 1609 ASP 208 OD2 -0.0211 0.0053 0.0031 1610 LEU 209 N -0.0160 0.0080 0.0082 1611 LEU 209 CA -0.0140 0.0081 0.0085 1612 LEU 209 C -0.0147 0.0088 0.0097 1613 LEU 209 O -0.0138 0.0085 0.0093 1614 LEU 209 CB -0.0119 0.0086 0.0096 1615 LEU 209 CG -0.0107 0.0076 0.0080 1616 LEU 209 CD1 -0.0084 0.0080 0.0089 1617 LEU 209 CD2 -0.0103 0.0064 0.0061 1618 GLU 210 N -0.0162 0.0098 0.0112 1619 GLU 210 CA -0.0169 0.0105 0.0124 1620 GLU 210 C -0.0185 0.0098 0.0110 1621 GLU 210 O -0.0184 0.0099 0.0113 1622 GLU 210 CB -0.0183 0.0117 0.0143 1623 GLU 210 CG -0.0167 0.0125 0.0159 1624 GLU 210 CD -0.0178 0.0138 0.0180 1625 GLU 210 OE1 -0.0178 0.0145 0.0191 1626 GLU 210 OE2 -0.0186 0.0142 0.0186 1627 LYS 211 N -0.0195 0.0090 0.0102 1628 LYS 211 CA -0.0211 0.0084 0.0087 1629 LYS 211 C -0.0195 0.0073 0.0068 1630 LYS 211 O -0.0204 0.0067 0.0054 1631 LYS 211 CB -0.0233 0.0081 0.0077 1632 LYS 211 CG -0.0255 0.0090 0.0093 1633 LYS 211 CD -0.0265 0.0092 0.0094 1634 LYS 211 CE -0.0273 0.0081 0.0071 1635 LYS 211 NZ -0.0280 0.0082 0.0072 1636 ILE 212 N -0.0172 0.0070 0.0067 1637 ILE 212 CA -0.0155 0.0060 0.0049 1638 ILE 212 C -0.0136 0.0064 0.0059 1639 ILE 212 O -0.0131 0.0058 0.0049 1640 ILE 212 CB -0.0140 0.0054 0.0039 1641 ILE 212 CG1 -0.0156 0.0047 0.0023 1642 ILE 212 CG2 -0.0116 0.0046 0.0028 1643 ILE 212 CD1 -0.0143 0.0041 0.0014 1644 LEU 213 N -0.0127 0.0073 0.0080 1645 LEU 213 CA -0.0108 0.0077 0.0092 1646 LEU 213 C -0.0117 0.0086 0.0107 1647 LEU 213 O -0.0106 0.0085 0.0108 1648 LEU 213 CB -0.0090 0.0083 0.0105 1649 LEU 213 CG -0.0079 0.0074 0.0090 1650 LEU 213 CD1 -0.0066 0.0080 0.0104 1651 LEU 213 CD2 -0.0062 0.0065 0.0074 1652 GLY 214 N -0.0134 0.0094 0.0115 1653 GLY 214 CA -0.0140 0.0100 0.0128 1654 GLY 214 C -0.0126 0.0106 0.0143 1655 GLY 214 O -0.0127 0.0111 0.0154 1656 GLY 214 OXT -0.0113 0.0105 0.0143 1657 MET 1 N -0.0041 0.0086 0.0107 1658 MET 1 CA -0.0032 0.0080 0.0093 1659 MET 1 C -0.0048 0.0075 0.0085 1660 MET 1 O -0.0059 0.0079 0.0095 1661 MET 1 CB -0.0016 0.0085 0.0102 1662 MET 1 CG -0.0004 0.0081 0.0088 1663 MET 1 SD 0.0011 0.0074 0.0072 1664 MET 1 CE 0.0030 0.0082 0.0085 1665 ARG 2 N -0.0051 0.0067 0.0067 1666 ARG 2 CA -0.0066 0.0062 0.0059 1667 ARG 2 C -0.0054 0.0057 0.0045 1668 ARG 2 O -0.0044 0.0052 0.0033 1669 ARG 2 CB -0.0081 0.0056 0.0049 1670 ARG 2 CG -0.0092 0.0062 0.0063 1671 ARG 2 CD -0.0100 0.0057 0.0053 1672 ARG 2 NE -0.0120 0.0058 0.0060 1673 ARG 2 CZ -0.0134 0.0052 0.0050 1674 ARG 2 NH1 -0.0130 0.0045 0.0033 1675 ARG 2 NH2 -0.0152 0.0054 0.0058 1676 ILE 3 N -0.0056 0.0058 0.0047 1677 ILE 3 CA -0.0044 0.0053 0.0036 1678 ILE 3 C -0.0057 0.0048 0.0027 1679 ILE 3 O -0.0071 0.0051 0.0036 1680 ILE 3 CB -0.0029 0.0060 0.0048 1681 ILE 3 CG1 -0.0013 0.0064 0.0054 1682 ILE 3 CG2 -0.0021 0.0057 0.0039 1683 ILE 3 CD1 -0.0005 0.0073 0.0072 1684 ILE 4 N -0.0054 0.0047 0.0018 1685 ILE 4 CA -0.0064 0.0043 0.0007 1686 ILE 4 C -0.0054 0.0037 0.0003 1687 ILE 4 O -0.0040 0.0031 0.0001 1688 ILE 4 CB -0.0069 0.0035 -0.0007 1689 ILE 4 CG1 -0.0082 0.0041 -0.0005 1690 ILE 4 CG2 -0.0074 0.0029 -0.0020 1691 ILE 4 CD1 -0.0084 0.0035 -0.0016 1692 LEU 5 N -0.0060 0.0039 0.0003 1693 LEU 5 CA -0.0052 0.0034 -0.0000 1694 LEU 5 C -0.0059 0.0028 -0.0015 1695 LEU 5 O -0.0072 0.0031 -0.0016 1696 LEU 5 CB -0.0053 0.0042 0.0011 1697 LEU 5 CG -0.0041 0.0038 0.0011 1698 LEU 5 CD1 -0.0024 0.0035 0.0014 1699 LEU 5 CD2 -0.0045 0.0046 0.0022 1700 LEU 6 N -0.0050 0.0018 -0.0025 1701 LEU 6 CA -0.0056 0.0011 -0.0040 1702 LEU 6 C -0.0046 0.0006 -0.0042 1703 LEU 6 O -0.0032 0.0006 -0.0036 1704 LEU 6 CB -0.0054 0.0003 -0.0051 1705 LEU 6 CG -0.0060 0.0006 -0.0049 1706 LEU 6 CD1 -0.0056 -0.0002 -0.0061 1707 LEU 6 CD2 -0.0078 0.0012 -0.0048 1708 GLY 7 N -0.0065 -0.0013 -0.0055 1709 GLY 7 CA -0.0062 -0.0018 -0.0058 1710 GLY 7 C -0.0077 -0.0023 -0.0067 1711 GLY 7 O -0.0091 -0.0018 -0.0067 1712 ALA 8 N -0.0075 -0.0033 -0.0074 1713 ALA 8 CA -0.0088 -0.0039 -0.0083 1714 ALA 8 C -0.0101 -0.0029 -0.0079 1715 ALA 8 O -0.0097 -0.0019 -0.0069 1716 ALA 8 CB -0.0081 -0.0051 -0.0090 1717 PRO 9 N -0.0116 -0.0032 -0.0086 1718 PRO 9 CA -0.0129 -0.0022 -0.0082 1719 PRO 9 C -0.0123 -0.0023 -0.0081 1720 PRO 9 O -0.0121 -0.0034 -0.0089 1721 PRO 9 CB -0.0145 -0.0028 -0.0091 1722 PRO 9 CG -0.0139 -0.0043 -0.0102 1723 PRO 9 CD -0.0125 -0.0042 -0.0096 1724 GLY 10 N -0.0133 -0.0017 -0.0069 1725 GLY 10 CA -0.0123 -0.0016 -0.0065 1726 GLY 10 C -0.0096 -0.0018 -0.0060 1727 GLY 10 O -0.0086 -0.0019 -0.0058 1728 ALA 11 N -0.0083 -0.0020 -0.0058 1729 ALA 11 CA -0.0057 -0.0022 -0.0053 1730 ALA 11 C -0.0048 -0.0003 -0.0034 1731 ALA 11 O -0.0028 -0.0003 -0.0029 1732 ALA 11 CB -0.0046 -0.0030 -0.0057 1733 GLY 12 N -0.0064 0.0013 -0.0024 1734 GLY 12 CA -0.0057 0.0032 -0.0006 1735 GLY 12 C -0.0043 0.0041 0.0005 1736 GLY 12 O -0.0029 0.0052 0.0018 1737 LYS 13 N -0.0040 0.0041 0.0010 1738 LYS 13 CA -0.0033 0.0046 0.0017 1739 LYS 13 C -0.0040 0.0062 0.0036 1740 LYS 13 O -0.0030 0.0068 0.0046 1741 LYS 13 CB -0.0042 0.0037 0.0005 1742 LYS 13 CG -0.0065 0.0032 -0.0004 1743 LYS 13 CD -0.0077 0.0028 -0.0011 1744 LYS 13 CE -0.0103 0.0028 -0.0015 1745 LYS 13 NZ -0.0118 0.0029 -0.0015 1746 GLY 14 N -0.0058 0.0067 0.0041 1747 GLY 14 CA -0.0067 0.0082 0.0059 1748 GLY 14 C -0.0051 0.0092 0.0074 1749 GLY 14 O -0.0052 0.0104 0.0090 1750 THR 15 N -0.0035 0.0087 0.0069 1751 THR 15 CA -0.0018 0.0095 0.0083 1752 THR 15 C -0.0005 0.0101 0.0091 1753 THR 15 O 0.0003 0.0113 0.0107 1754 THR 15 CB -0.0001 0.0087 0.0074 1755 THR 15 OG1 0.0012 0.0076 0.0061 1756 THR 15 CG2 -0.0015 0.0080 0.0063 1757 GLN 16 N 0.0004 0.0093 0.0088 1758 GLN 16 CA 0.0017 0.0096 0.0092 1759 GLN 16 C 0.0005 0.0100 0.0098 1760 GLN 16 O 0.0014 0.0104 0.0102 1761 GLN 16 CB 0.0030 0.0085 0.0076 1762 GLN 16 CG 0.0044 0.0083 0.0071 1763 GLN 16 CD 0.0059 0.0094 0.0084 1764 GLN 16 OE1 0.0065 0.0102 0.0094 1765 GLN 16 NE2 0.0067 0.0094 0.0084 1766 ALA 17 N -0.0016 0.0100 0.0100 1767 ALA 17 CA -0.0029 0.0104 0.0105 1768 ALA 17 C -0.0027 0.0118 0.0123 1769 ALA 17 O -0.0024 0.0121 0.0127 1770 ALA 17 CB -0.0051 0.0099 0.0102 1771 GLN 18 N -0.0028 0.0126 0.0134 1772 GLN 18 CA -0.0026 0.0140 0.0151 1773 GLN 18 C -0.0006 0.0144 0.0154 1774 GLN 18 O -0.0005 0.0152 0.0164 1775 GLN 18 CB -0.0027 0.0148 0.0161 1776 GLN 18 CG -0.0043 0.0158 0.0175 1777 GLN 18 CD -0.0042 0.0167 0.0186 1778 GLN 18 OE1 -0.0056 0.0166 0.0186 1779 GLN 18 NE2 -0.0026 0.0175 0.0195 1780 PHE 19 N 0.0019 0.0135 0.0155 1781 PHE 19 CA 0.0037 0.0138 0.0155 1782 PHE 19 C 0.0035 0.0134 0.0149 1783 PHE 19 O 0.0042 0.0140 0.0157 1784 PHE 19 CB 0.0053 0.0132 0.0143 1785 PHE 19 CG 0.0071 0.0132 0.0139 1786 PHE 19 CD1 0.0082 0.0142 0.0152 1787 PHE 19 CD2 0.0076 0.0122 0.0123 1788 PHE 19 CE1 0.0098 0.0142 0.0148 1789 PHE 19 CE2 0.0092 0.0122 0.0119 1790 PHE 19 CZ 0.0103 0.0132 0.0132 1791 ILE 20 N 0.0025 0.0124 0.0136 1792 ILE 20 CA 0.0021 0.0119 0.0130 1793 ILE 20 C 0.0008 0.0125 0.0141 1794 ILE 20 O 0.0011 0.0126 0.0143 1795 ILE 20 CB 0.0013 0.0107 0.0113 1796 ILE 20 CG1 0.0028 0.0101 0.0101 1797 ILE 20 CG2 0.0007 0.0102 0.0106 1798 ILE 20 CD1 0.0021 0.0089 0.0085 1799 MET 21 N -0.0007 0.0128 0.0149 1800 MET 21 CA -0.0021 0.0134 0.0161 1801 MET 21 C -0.0010 0.0145 0.0176 1802 MET 21 O -0.0012 0.0148 0.0181 1803 MET 21 CB -0.0037 0.0135 0.0167 1804 MET 21 CG -0.0051 0.0125 0.0155 1805 MET 21 SD -0.0073 0.0128 0.0164 1806 MET 21 CE -0.0070 0.0125 0.0159 1807 GLU 22 N -0.0003 0.0153 0.0193 1808 GLU 22 CA 0.0009 0.0165 0.0207 1809 GLU 22 C 0.0026 0.0165 0.0203 1810 GLU 22 O 0.0032 0.0173 0.0214 1811 GLU 22 CB 0.0016 0.0171 0.0215 1812 GLU 22 CG 0.0020 0.0184 0.0233 1813 GLU 22 CD 0.0024 0.0191 0.0241 1814 GLU 22 OE1 0.0013 0.0186 0.0238 1815 GLU 22 OE2 0.0038 0.0200 0.0251 1816 LYS 23 N 0.0034 0.0155 0.0187 1817 LYS 23 CA 0.0051 0.0155 0.0182 1818 LYS 23 C 0.0043 0.0152 0.0180 1819 LYS 23 O 0.0052 0.0157 0.0186 1820 LYS 23 CB 0.0064 0.0146 0.0166 1821 LYS 23 CG 0.0081 0.0144 0.0159 1822 LYS 23 CD 0.0101 0.0144 0.0154 1823 LYS 23 CE 0.0116 0.0138 0.0142 1824 LYS 23 NZ 0.0124 0.0144 0.0149 1825 TYR 24 N 0.0027 0.0143 0.0171 1826 TYR 24 CA 0.0018 0.0138 0.0167 1827 TYR 24 C -0.0001 0.0142 0.0177 1828 TYR 24 O -0.0007 0.0140 0.0175 1829 TYR 24 CB 0.0015 0.0125 0.0148 1830 TYR 24 CG 0.0034 0.0121 0.0137 1831 TYR 24 CD1 0.0049 0.0120 0.0133 1832 TYR 24 CD2 0.0039 0.0118 0.0132 1833 TYR 24 CE1 0.0067 0.0118 0.0124 1834 TYR 24 CE2 0.0058 0.0116 0.0124 1835 TYR 24 CZ 0.0072 0.0115 0.0120 1836 TYR 24 OH 0.0090 0.0113 0.0111 1837 GLY 25 N -0.0013 0.0119 0.0175 1838 GLY 25 CA -0.0031 0.0121 0.0185 1839 GLY 25 C -0.0048 0.0114 0.0174 1840 GLY 25 O -0.0060 0.0114 0.0176 1841 ILE 26 N -0.0049 0.0109 0.0162 1842 ILE 26 CA -0.0065 0.0101 0.0150 1843 ILE 26 C -0.0073 0.0100 0.0150 1844 ILE 26 O -0.0064 0.0104 0.0155 1845 ILE 26 CB -0.0056 0.0094 0.0131 1846 ILE 26 CG1 -0.0042 0.0093 0.0125 1847 ILE 26 CG2 -0.0047 0.0095 0.0132 1848 ILE 26 CD1 -0.0033 0.0086 0.0107 1849 PRO 27 N -0.0092 0.0096 0.0147 1850 PRO 27 CA -0.0100 0.0096 0.0147 1851 PRO 27 C -0.0099 0.0087 0.0129 1852 PRO 27 O -0.0097 0.0082 0.0115 1853 PRO 27 CB -0.0120 0.0096 0.0154 1854 PRO 27 CG -0.0124 0.0092 0.0146 1855 PRO 27 CD -0.0107 0.0096 0.0149 1856 GLN 28 N -0.0095 0.0074 0.0090 1857 GLN 28 CA -0.0095 0.0065 0.0074 1858 GLN 28 C -0.0114 0.0063 0.0067 1859 GLN 28 O -0.0126 0.0068 0.0074 1860 GLN 28 CB -0.0088 0.0065 0.0074 1861 GLN 28 CG -0.0089 0.0056 0.0059 1862 GLN 28 CD -0.0082 0.0056 0.0060 1863 GLN 28 OE1 -0.0082 0.0063 0.0073 1864 GLN 28 NE2 -0.0076 0.0049 0.0048 1865 ILE 29 N -0.0116 0.0056 0.0053 1866 ILE 29 CA -0.0134 0.0054 0.0046 1867 ILE 29 C -0.0135 0.0046 0.0030 1868 ILE 29 O -0.0125 0.0039 0.0020 1869 ILE 29 CB -0.0137 0.0052 0.0042 1870 ILE 29 CG1 -0.0136 0.0060 0.0057 1871 ILE 29 CG2 -0.0155 0.0049 0.0034 1872 ILE 29 CD1 -0.0136 0.0058 0.0054 1873 SER 30 N -0.0149 0.0046 0.0028 1874 SER 30 CA -0.0152 0.0038 0.0013 1875 SER 30 C -0.0171 0.0038 0.0009 1876 SER 30 O -0.0182 0.0044 0.0019 1877 SER 30 CB -0.0149 0.0039 0.0015 1878 SER 30 OG -0.0158 0.0046 0.0027 1879 THR 31 N -0.0152 0.0054 -0.0021 1880 THR 31 CA -0.0144 0.0057 -0.0019 1881 THR 31 C -0.0132 0.0054 -0.0020 1882 THR 31 O -0.0125 0.0051 -0.0021 1883 THR 31 CB -0.0145 0.0067 -0.0013 1884 THR 31 OG1 -0.0143 0.0073 -0.0009 1885 THR 31 CG2 -0.0157 0.0069 -0.0013 1886 GLY 32 N -0.0130 0.0055 -0.0020 1887 GLY 32 CA -0.0119 0.0052 -0.0020 1888 GLY 32 C -0.0116 0.0042 -0.0026 1889 GLY 32 O -0.0107 0.0040 -0.0027 1890 ASP 33 N -0.0123 0.0035 -0.0031 1891 ASP 33 CA -0.0121 0.0025 -0.0037 1892 ASP 33 C -0.0119 0.0024 -0.0037 1893 ASP 33 O -0.0111 0.0020 -0.0039 1894 ASP 33 CB -0.0131 0.0019 -0.0041 1895 ASP 33 CG -0.0131 0.0017 -0.0042 1896 ASP 33 OD1 -0.0122 0.0018 -0.0041 1897 ASP 33 OD2 -0.0140 0.0014 -0.0045 1898 MET 34 N -0.0119 0.0010 -0.0040 1899 MET 34 CA -0.0120 0.0015 -0.0037 1900 MET 34 C -0.0103 0.0023 -0.0036 1901 MET 34 O -0.0098 0.0021 -0.0039 1902 MET 34 CB -0.0135 0.0025 -0.0027 1903 MET 34 CG -0.0144 0.0023 -0.0026 1904 MET 34 SD -0.0160 0.0036 -0.0014 1905 MET 34 CE -0.0146 0.0054 -0.0006 1906 LEU 35 N -0.0094 0.0033 -0.0032 1907 LEU 35 CA -0.0078 0.0042 -0.0031 1908 LEU 35 C -0.0063 0.0031 -0.0041 1909 LEU 35 O -0.0054 0.0030 -0.0044 1910 LEU 35 CB -0.0073 0.0056 -0.0024 1911 LEU 35 CG -0.0084 0.0069 -0.0013 1912 LEU 35 CD1 -0.0085 0.0078 -0.0007 1913 LEU 35 CD2 -0.0076 0.0079 -0.0009 1914 ARG 36 N -0.0063 0.0023 -0.0046 1915 ARG 36 CA -0.0050 0.0013 -0.0056 1916 ARG 36 C -0.0050 0.0001 -0.0063 1917 ARG 36 O -0.0037 -0.0002 -0.0068 1918 ARG 36 CB -0.0051 0.0004 -0.0061 1919 ARG 36 CG -0.0044 0.0015 -0.0056 1920 ARG 36 CD -0.0044 0.0007 -0.0061 1921 ARG 36 NE -0.0061 0.0005 -0.0058 1922 ARG 36 CZ -0.0068 0.0016 -0.0049 1923 ARG 36 NH1 -0.0060 0.0030 -0.0043 1924 ARG 36 NH2 -0.0084 0.0013 -0.0047 1925 ALA 37 N -0.0058 -0.0018 -0.0081 1926 ALA 37 CA -0.0058 -0.0035 -0.0095 1927 ALA 37 C -0.0048 -0.0036 -0.0094 1928 ALA 37 O -0.0035 -0.0050 -0.0103 1929 ALA 37 CB -0.0083 -0.0041 -0.0104 1930 ALA 38 N -0.0053 -0.0022 -0.0083 1931 ALA 38 CA -0.0044 -0.0021 -0.0081 1932 ALA 38 C -0.0017 -0.0023 -0.0077 1933 ALA 38 O -0.0007 -0.0030 -0.0081 1934 ALA 38 CB -0.0055 -0.0004 -0.0069 1935 VAL 39 N -0.0006 -0.0015 -0.0068 1936 VAL 39 CA 0.0020 -0.0015 -0.0063 1937 VAL 39 C 0.0030 -0.0035 -0.0077 1938 VAL 39 O 0.0047 -0.0042 -0.0080 1939 VAL 39 CB 0.0027 -0.0002 -0.0051 1940 VAL 39 CG1 0.0053 -0.0006 -0.0050 1941 VAL 39 CG2 0.0020 0.0018 -0.0036 1942 LYS 40 N 0.0022 -0.0041 -0.0091 1943 LYS 40 CA 0.0030 -0.0062 -0.0107 1944 LYS 40 C 0.0032 -0.0076 -0.0118 1945 LYS 40 O 0.0054 -0.0084 -0.0121 1946 LYS 40 CB 0.0010 -0.0069 -0.0116 1947 LYS 40 CG 0.0010 -0.0092 -0.0136 1948 LYS 40 CD -0.0014 -0.0100 -0.0147 1949 LYS 40 CE -0.0040 -0.0090 -0.0144 1950 LYS 40 NZ -0.0063 -0.0095 -0.0152 1951 SER 41 N 0.0010 -0.0078 -0.0124 1952 SER 41 CA 0.0011 -0.0090 -0.0134 1953 SER 41 C 0.0016 -0.0076 -0.0122 1954 SER 41 O -0.0001 -0.0067 -0.0117 1955 SER 41 CB -0.0014 -0.0100 -0.0147 1956 SER 41 OG -0.0037 -0.0087 -0.0140 1957 GLY 42 N 0.0042 -0.0074 -0.0115 1958 GLY 42 CA 0.0050 -0.0062 -0.0103 1959 GLY 42 C 0.0036 -0.0063 -0.0107 1960 GLY 42 O 0.0039 -0.0079 -0.0119 1961 SER 43 N 0.0019 -0.0052 -0.0115 1962 SER 43 CA 0.0015 -0.0055 -0.0126 1963 SER 43 C 0.0031 -0.0047 -0.0088 1964 SER 43 O 0.0040 -0.0038 -0.0059 1965 SER 43 CB -0.0026 -0.0041 -0.0139 1966 SER 43 OG -0.0050 -0.0020 -0.0117 1967 GLU 44 N 0.0038 -0.0049 -0.0087 1968 GLU 44 CA 0.0053 -0.0041 -0.0052 1969 GLU 44 C 0.0031 -0.0017 -0.0021 1970 GLU 44 O 0.0045 -0.0012 0.0005 1971 GLU 44 CB 0.0051 -0.0043 -0.0058 1972 GLU 44 CG 0.0064 -0.0033 -0.0023 1973 GLU 44 CD 0.0105 -0.0047 -0.0008 1974 GLU 44 OE1 0.0127 -0.0068 -0.0031 1975 GLU 44 OE2 0.0115 -0.0036 0.0027 1976 LEU 45 N -0.0005 -0.0002 -0.0027 1977 LEU 45 CA -0.0030 0.0022 -0.0001 1978 LEU 45 C -0.0030 0.0027 0.0010 1979 LEU 45 O -0.0025 0.0039 0.0043 1980 LEU 45 CB -0.0069 0.0034 -0.0018 1981 LEU 45 CG -0.0078 0.0039 -0.0016 1982 LEU 45 CD1 -0.0044 0.0028 -0.0004 1983 LEU 45 CD2 -0.0100 0.0032 -0.0054 1984 GLY 46 N 0.0009 0.0003 -0.0066 1985 GLY 46 CA 0.0013 0.0003 -0.0062 1986 GLY 46 C 0.0029 0.0001 -0.0052 1987 GLY 46 O 0.0032 0.0005 -0.0045 1988 LYS 47 N 0.0039 -0.0005 -0.0053 1989 LYS 47 CA 0.0056 -0.0007 -0.0044 1990 LYS 47 C 0.0056 0.0004 -0.0030 1991 LYS 47 O 0.0064 0.0007 -0.0019 1992 LYS 47 CB 0.0066 -0.0018 -0.0050 1993 LYS 47 CG 0.0070 -0.0030 -0.0064 1994 LYS 47 CD 0.0083 -0.0035 -0.0061 1995 LYS 47 CE 0.0078 -0.0031 -0.0059 1996 LYS 47 NZ 0.0090 -0.0037 -0.0058 1997 GLN 48 N 0.0046 0.0009 -0.0029 1998 GLN 48 CA 0.0045 0.0020 -0.0015 1999 GLN 48 C 0.0038 0.0029 -0.0008 2000 GLN 48 O 0.0043 0.0036 0.0004 2001 GLN 48 CB 0.0036 0.0024 -0.0017 2002 GLN 48 CG 0.0043 0.0015 -0.0024 2003 GLN 48 CD 0.0038 0.0019 -0.0022 2004 GLN 48 OE1 0.0030 0.0030 -0.0013 2005 GLN 48 NE2 0.0042 0.0012 -0.0029 2006 ALA 49 N 0.0022 0.0032 -0.0026 2007 ALA 49 CA 0.0019 0.0035 -0.0024 2008 ALA 49 C 0.0036 0.0032 -0.0025 2009 ALA 49 O 0.0040 0.0042 -0.0018 2010 ALA 49 CB 0.0004 0.0025 -0.0030 2011 LYS 50 N 0.0044 0.0019 -0.0033 2012 LYS 50 CA 0.0060 0.0015 -0.0036 2013 LYS 50 C 0.0075 0.0027 -0.0028 2014 LYS 50 O 0.0084 0.0030 -0.0026 2015 LYS 50 CB 0.0067 0.0001 -0.0046 2016 LYS 50 CG 0.0086 -0.0003 -0.0048 2017 LYS 50 CD 0.0092 -0.0018 -0.0058 2018 LYS 50 CE 0.0111 -0.0022 -0.0060 2019 LYS 50 NZ 0.0125 -0.0015 -0.0055 2020 ASP 51 N 0.0076 0.0034 -0.0023 2021 ASP 51 CA 0.0090 0.0045 -0.0015 2022 ASP 51 C 0.0086 0.0059 -0.0006 2023 ASP 51 O 0.0099 0.0065 -0.0001 2024 ASP 51 CB 0.0090 0.0049 -0.0012 2025 ASP 51 CG 0.0104 0.0041 -0.0017 2026 ASP 51 OD1 0.0118 0.0037 -0.0020 2027 ASP 51 OD2 0.0102 0.0039 -0.0019 2028 ILE 52 N 0.0075 0.0055 -0.0028 2029 ILE 52 CA 0.0073 0.0069 -0.0024 2030 ILE 52 C 0.0078 0.0071 -0.0021 2031 ILE 52 O 0.0085 0.0079 -0.0014 2032 ILE 52 CB 0.0058 0.0073 -0.0028 2033 ILE 52 CG1 0.0055 0.0076 -0.0028 2034 ILE 52 CG2 0.0054 0.0085 -0.0024 2035 ILE 52 CD1 0.0041 0.0080 -0.0032 2036 MET 53 N 0.0074 0.0064 -0.0025 2037 MET 53 CA 0.0078 0.0065 -0.0023 2038 MET 53 C 0.0093 0.0062 -0.0018 2039 MET 53 O 0.0099 0.0068 -0.0013 2040 MET 53 CB 0.0072 0.0055 -0.0030 2041 MET 53 CG 0.0057 0.0058 -0.0035 2042 MET 53 SD 0.0050 0.0049 -0.0041 2043 MET 53 CE 0.0063 0.0049 -0.0036 2044 ASP 54 N 0.0099 0.0052 -0.0020 2045 ASP 54 CA 0.0113 0.0049 -0.0015 2046 ASP 54 C 0.0119 0.0060 -0.0008 2047 ASP 54 O 0.0130 0.0061 -0.0003 2048 ASP 54 CB 0.0117 0.0036 -0.0019 2049 ASP 54 CG 0.0119 0.0025 -0.0023 2050 ASP 54 OD1 0.0127 0.0025 -0.0020 2051 ASP 54 OD2 0.0113 0.0016 -0.0030 2052 ALA 55 N 0.0125 0.0061 -0.0044 2053 ALA 55 CA 0.0128 0.0063 -0.0034 2054 ALA 55 C 0.0123 0.0076 -0.0028 2055 ALA 55 O 0.0124 0.0079 -0.0019 2056 ALA 55 CB 0.0130 0.0057 -0.0039 2057 GLY 56 N 0.0116 0.0085 -0.0032 2058 GLY 56 CA 0.0110 0.0098 -0.0027 2059 GLY 56 C 0.0105 0.0103 -0.0031 2060 GLY 56 O 0.0101 0.0113 -0.0025 2061 LYS 57 N 0.0104 0.0097 -0.0042 2062 LYS 57 CA 0.0100 0.0101 -0.0047 2063 LYS 57 C 0.0091 0.0107 -0.0059 2064 LYS 57 O 0.0090 0.0105 -0.0065 2065 LYS 57 CB 0.0104 0.0090 -0.0052 2066 LYS 57 CG 0.0113 0.0083 -0.0042 2067 LYS 57 CD 0.0118 0.0070 -0.0049 2068 LYS 57 CE 0.0127 0.0062 -0.0040 2069 LYS 57 NZ 0.0132 0.0049 -0.0047 2070 LEU 58 N 0.0026 0.0139 -0.0030 2071 LEU 58 CA 0.0011 0.0132 -0.0031 2072 LEU 58 C -0.0007 0.0123 -0.0031 2073 LEU 58 O -0.0012 0.0132 -0.0031 2074 LEU 58 CB 0.0004 0.0149 -0.0031 2075 LEU 58 CG -0.0011 0.0145 -0.0031 2076 LEU 58 CD1 -0.0005 0.0158 -0.0031 2077 LEU 58 CD2 -0.0033 0.0150 -0.0032 2078 VAL 59 N -0.0017 0.0107 -0.0032 2079 VAL 59 CA -0.0034 0.0098 -0.0033 2080 VAL 59 C -0.0053 0.0112 -0.0033 2081 VAL 59 O -0.0058 0.0120 -0.0033 2082 VAL 59 CB -0.0040 0.0077 -0.0033 2083 VAL 59 CG1 -0.0053 0.0066 -0.0034 2084 VAL 59 CG2 -0.0020 0.0064 -0.0033 2085 THR 60 N -0.0062 0.0116 -0.0033 2086 THR 60 CA -0.0080 0.0130 -0.0033 2087 THR 60 C -0.0098 0.0121 -0.0034 2088 THR 60 O -0.0102 0.0103 -0.0034 2089 THR 60 CB -0.0084 0.0134 -0.0033 2090 THR 60 OG1 -0.0101 0.0147 -0.0033 2091 THR 60 CG2 -0.0089 0.0114 -0.0034 2092 ASP 61 N -0.0103 0.0117 -0.0053 2093 ASP 61 CA -0.0112 0.0108 -0.0045 2094 ASP 61 C -0.0128 0.0105 -0.0037 2095 ASP 61 O -0.0136 0.0095 -0.0030 2096 ASP 61 CB -0.0118 0.0119 -0.0047 2097 ASP 61 CG -0.0105 0.0121 -0.0053 2098 ASP 61 OD1 -0.0091 0.0112 -0.0055 2099 ASP 61 OD2 -0.0109 0.0131 -0.0056 2100 GLU 62 N -0.0132 0.0114 -0.0040 2101 GLU 62 CA -0.0147 0.0113 -0.0033 2102 GLU 62 C -0.0144 0.0096 -0.0027 2103 GLU 62 O -0.0155 0.0088 -0.0019 2104 GLU 62 CB -0.0150 0.0128 -0.0038 2105 GLU 62 CG -0.0158 0.0144 -0.0042 2106 GLU 62 CD -0.0148 0.0151 -0.0050 2107 GLU 62 OE1 -0.0135 0.0156 -0.0057 2108 GLU 62 OE2 -0.0153 0.0152 -0.0048 2109 LEU 63 N -0.0130 0.0092 -0.0031 2110 LEU 63 CA -0.0126 0.0077 -0.0026 2111 LEU 63 C -0.0124 0.0062 -0.0020 2112 LEU 63 O -0.0133 0.0051 -0.0012 2113 LEU 63 CB -0.0110 0.0075 -0.0032 2114 LEU 63 CG -0.0112 0.0077 -0.0031 2115 LEU 63 CD1 -0.0096 0.0071 -0.0035 2116 LEU 63 CD2 -0.0125 0.0066 -0.0022 2117 VAL 64 N -0.0144 0.0077 -0.0038 2118 VAL 64 CA -0.0141 0.0069 -0.0035 2119 VAL 64 C -0.0151 0.0066 -0.0029 2120 VAL 64 O -0.0152 0.0057 -0.0023 2121 VAL 64 CB -0.0132 0.0072 -0.0040 2122 VAL 64 CG1 -0.0130 0.0064 -0.0036 2123 VAL 64 CG2 -0.0120 0.0072 -0.0044 2124 ILE 65 N -0.0160 0.0074 -0.0031 2125 ILE 65 CA -0.0170 0.0072 -0.0025 2126 ILE 65 C -0.0178 0.0066 -0.0019 2127 ILE 65 O -0.0183 0.0060 -0.0013 2128 ILE 65 CB -0.0178 0.0082 -0.0028 2129 ILE 65 CG1 -0.0171 0.0085 -0.0033 2130 ILE 65 CG2 -0.0189 0.0079 -0.0023 2131 ILE 65 CD1 -0.0169 0.0077 -0.0029 2132 ALA 66 N -0.0178 0.0068 -0.0021 2133 ALA 66 CA -0.0184 0.0063 -0.0015 2134 ALA 66 C -0.0179 0.0052 -0.0011 2135 ALA 66 O -0.0185 0.0045 -0.0004 2136 ALA 66 CB -0.0186 0.0070 -0.0018 2137 LEU 67 N -0.0164 0.0066 -0.0011 2138 LEU 67 CA -0.0156 0.0053 -0.0009 2139 LEU 67 C -0.0159 0.0044 -0.0004 2140 LEU 67 O -0.0159 0.0033 0.0001 2141 LEU 67 CB -0.0142 0.0053 -0.0015 2142 LEU 67 CG -0.0137 0.0057 -0.0019 2143 LEU 67 CD1 -0.0123 0.0058 -0.0026 2144 LEU 67 CD2 -0.0139 0.0047 -0.0014 2145 VAL 68 N -0.0161 0.0049 -0.0005 2146 VAL 68 CA -0.0164 0.0042 -0.0000 2147 VAL 68 C -0.0177 0.0039 0.0007 2148 VAL 68 O -0.0179 0.0028 0.0013 2149 VAL 68 CB -0.0164 0.0049 -0.0004 2150 VAL 68 CG1 -0.0170 0.0042 0.0002 2151 VAL 68 CG2 -0.0151 0.0050 -0.0010 2152 LYS 69 N -0.0186 0.0049 0.0006 2153 LYS 69 CA -0.0199 0.0047 0.0013 2154 LYS 69 C -0.0200 0.0038 0.0017 2155 LYS 69 O -0.0207 0.0031 0.0024 2156 LYS 69 CB -0.0208 0.0060 0.0011 2157 LYS 69 CG -0.0221 0.0059 0.0018 2158 LYS 69 CD -0.0230 0.0072 0.0016 2159 LYS 69 CE -0.0238 0.0072 0.0020 2160 LYS 69 NZ -0.0232 0.0071 0.0017 2161 GLU 70 N -0.0194 0.0029 0.0032 2162 GLU 70 CA -0.0198 0.0025 0.0042 2163 GLU 70 C -0.0190 0.0026 0.0050 2164 GLU 70 O -0.0192 0.0023 0.0056 2165 GLU 70 CB -0.0200 0.0023 0.0044 2166 GLU 70 CG -0.0204 0.0019 0.0054 2167 GLU 70 CD -0.0204 0.0018 0.0058 2168 GLU 70 OE1 -0.0197 0.0020 0.0060 2169 GLU 70 OE2 -0.0212 0.0014 0.0058 2170 ARG 71 N -0.0181 0.0029 0.0050 2171 ARG 71 CA -0.0173 0.0031 0.0057 2172 ARG 71 C -0.0171 0.0032 0.0056 2173 ARG 71 O -0.0171 0.0030 0.0063 2174 ARG 71 CB -0.0164 0.0035 0.0055 2175 ARG 71 CG -0.0156 0.0037 0.0062 2176 ARG 71 CD -0.0158 0.0033 0.0073 2177 ARG 71 NE -0.0150 0.0034 0.0080 2178 ARG 71 CZ -0.0148 0.0034 0.0083 2179 ARG 71 NH1 -0.0154 0.0033 0.0079 2180 ARG 71 NH2 -0.0141 0.0036 0.0089 2181 ILE 72 N -0.0169 0.0035 0.0047 2182 ILE 72 CA -0.0167 0.0037 0.0046 2183 ILE 72 C -0.0175 0.0033 0.0048 2184 ILE 72 O -0.0174 0.0033 0.0047 2185 ILE 72 CB -0.0164 0.0041 0.0035 2186 ILE 72 CG1 -0.0172 0.0039 0.0028 2187 ILE 72 CG2 -0.0155 0.0045 0.0033 2188 ILE 72 CD1 -0.0173 0.0041 0.0020 2189 ALA 73 N -0.0190 0.0038 0.0071 2190 ALA 73 CA -0.0202 0.0038 0.0080 2191 ALA 73 C -0.0202 0.0041 0.0102 2192 ALA 73 O -0.0211 0.0042 0.0112 2193 ALA 73 CB -0.0223 0.0036 0.0074 2194 GLN 74 N -0.0190 0.0043 0.0110 2195 GLN 74 CA -0.0189 0.0046 0.0130 2196 GLN 74 C -0.0175 0.0048 0.0141 2197 GLN 74 O -0.0163 0.0048 0.0132 2198 GLN 74 CB -0.0189 0.0047 0.0135 2199 GLN 74 CG -0.0204 0.0044 0.0124 2200 GLN 74 CD -0.0208 0.0045 0.0132 2201 GLN 74 OE1 -0.0215 0.0043 0.0121 2202 GLN 74 NE2 -0.0205 0.0048 0.0150 2203 GLU 75 N -0.0178 0.0051 0.0159 2204 GLU 75 CA -0.0166 0.0054 0.0174 2205 GLU 75 C -0.0145 0.0055 0.0171 2206 GLU 75 O -0.0132 0.0056 0.0172 2207 GLU 75 CB -0.0173 0.0056 0.0194 2208 GLU 75 CG -0.0193 0.0055 0.0195 2209 GLU 75 CD -0.0194 0.0053 0.0186 2210 GLU 75 OE1 -0.0178 0.0054 0.0180 2211 GLU 75 OE2 -0.0210 0.0052 0.0184 2212 ASP 76 N -0.0149 0.0058 0.0172 2213 ASP 76 CA -0.0129 0.0059 0.0170 2214 ASP 76 C -0.0121 0.0061 0.0152 2215 ASP 76 O -0.0103 0.0062 0.0150 2216 ASP 76 CB -0.0126 0.0060 0.0172 2217 ASP 76 CG -0.0137 0.0059 0.0158 2218 ASP 76 OD1 -0.0147 0.0059 0.0146 2219 ASP 76 OD2 -0.0137 0.0059 0.0160 2220 CYS 77 N -0.0133 0.0060 0.0138 2221 CYS 77 CA -0.0126 0.0061 0.0120 2222 CYS 77 C -0.0128 0.0061 0.0120 2223 CYS 77 O -0.0127 0.0061 0.0105 2224 CYS 77 CB -0.0135 0.0061 0.0103 2225 CYS 77 SG -0.0131 0.0061 0.0101 2226 ARG 78 N -0.0131 0.0060 0.0137 2227 ARG 78 CA -0.0133 0.0060 0.0138 2228 ARG 78 C -0.0114 0.0062 0.0132 2229 ARG 78 O -0.0115 0.0062 0.0121 2230 ARG 78 CB -0.0137 0.0059 0.0159 2231 ARG 78 CG -0.0142 0.0059 0.0161 2232 ARG 78 CD -0.0154 0.0057 0.0179 2233 ARG 78 NE -0.0174 0.0056 0.0176 2234 ARG 78 CZ -0.0181 0.0055 0.0182 2235 ARG 78 NH1 -0.0170 0.0056 0.0190 2236 ARG 78 NH2 -0.0199 0.0054 0.0179 2237 ASN 79 N -0.0102 0.0085 0.0142 2238 ASN 79 CA -0.0083 0.0085 0.0137 2239 ASN 79 C -0.0080 0.0080 0.0120 2240 ASN 79 O -0.0066 0.0080 0.0113 2241 ASN 79 CB -0.0072 0.0090 0.0149 2242 ASN 79 CG -0.0071 0.0095 0.0165 2243 ASN 79 OD1 -0.0073 0.0095 0.0167 2244 ASN 79 ND2 -0.0068 0.0098 0.0178 2245 GLY 80 N -0.0092 0.0078 0.0113 2246 GLY 80 CA -0.0090 0.0073 0.0097 2247 GLY 80 C -0.0095 0.0073 0.0097 2248 GLY 80 O -0.0105 0.0075 0.0108 2249 PHE 81 N -0.0088 0.0070 0.0086 2250 PHE 81 CA -0.0093 0.0069 0.0085 2251 PHE 81 C -0.0080 0.0067 0.0073 2252 PHE 81 O -0.0071 0.0065 0.0064 2253 PHE 81 CB -0.0110 0.0066 0.0078 2254 PHE 81 CG -0.0113 0.0061 0.0062 2255 PHE 81 CD1 -0.0107 0.0057 0.0047 2256 PHE 81 CD2 -0.0120 0.0060 0.0062 2257 PHE 81 CE1 -0.0109 0.0052 0.0033 2258 PHE 81 CE2 -0.0122 0.0056 0.0047 2259 PHE 81 CZ -0.0117 0.0052 0.0032 2260 LEU 82 N -0.0088 0.0071 0.0073 2261 LEU 82 CA -0.0079 0.0064 0.0062 2262 LEU 82 C -0.0092 0.0061 0.0051 2263 LEU 82 O -0.0101 0.0065 0.0055 2264 LEU 82 CB -0.0068 0.0065 0.0070 2265 LEU 82 CG -0.0060 0.0059 0.0060 2266 LEU 82 CD1 -0.0046 0.0052 0.0052 2267 LEU 82 CD2 -0.0054 0.0062 0.0069 2268 LEU 83 N -0.0095 0.0056 0.0038 2269 LEU 83 CA -0.0107 0.0053 0.0025 2270 LEU 83 C -0.0099 0.0047 0.0015 2271 LEU 83 O -0.0087 0.0041 0.0007 2272 LEU 83 CB -0.0114 0.0050 0.0016 2273 LEU 83 CG -0.0129 0.0048 0.0004 2274 LEU 83 CD1 -0.0144 0.0054 0.0011 2275 LEU 83 CD2 -0.0134 0.0047 -0.0000 2276 ASP 84 N -0.0104 0.0048 0.0016 2277 ASP 84 CA -0.0098 0.0043 0.0008 2278 ASP 84 C -0.0106 0.0038 -0.0008 2279 ASP 84 O -0.0121 0.0040 -0.0010 2280 ASP 84 CB -0.0101 0.0048 0.0018 2281 ASP 84 CG -0.0095 0.0044 0.0011 2282 ASP 84 OD1 -0.0080 0.0041 0.0010 2283 ASP 84 OD2 -0.0106 0.0045 0.0008 2284 GLY 85 N -0.0099 0.0045 -0.0024 2285 GLY 85 CA -0.0103 0.0043 -0.0035 2286 GLY 85 C -0.0112 0.0046 -0.0039 2287 GLY 85 O -0.0119 0.0047 -0.0046 2288 PHE 86 N -0.0114 0.0048 -0.0035 2289 PHE 86 CA -0.0122 0.0051 -0.0038 2290 PHE 86 C -0.0118 0.0050 -0.0034 2291 PHE 86 O -0.0113 0.0051 -0.0026 2292 PHE 86 CB -0.0131 0.0056 -0.0033 2293 PHE 86 CG -0.0141 0.0059 -0.0038 2294 PHE 86 CD1 -0.0146 0.0058 -0.0047 2295 PHE 86 CD2 -0.0144 0.0061 -0.0034 2296 PHE 86 CE1 -0.0153 0.0060 -0.0052 2297 PHE 86 CE2 -0.0151 0.0063 -0.0039 2298 PHE 86 CZ -0.0156 0.0062 -0.0048 2299 PRO 87 N -0.0120 0.0049 -0.0041 2300 PRO 87 CA -0.0125 0.0048 -0.0051 2301 PRO 87 C -0.0120 0.0043 -0.0059 2302 PRO 87 O -0.0111 0.0039 -0.0058 2303 PRO 87 CB -0.0127 0.0048 -0.0054 2304 PRO 87 CG -0.0118 0.0046 -0.0049 2305 PRO 87 CD -0.0118 0.0049 -0.0038 2306 ARG 88 N -0.0118 0.0051 -0.0073 2307 ARG 88 CA -0.0115 0.0046 -0.0084 2308 ARG 88 C -0.0114 0.0040 -0.0096 2309 ARG 88 O -0.0110 0.0035 -0.0105 2310 ARG 88 CB -0.0124 0.0047 -0.0087 2311 ARG 88 CG -0.0125 0.0052 -0.0076 2312 ARG 88 CD -0.0137 0.0055 -0.0078 2313 ARG 88 NE -0.0143 0.0061 -0.0066 2314 ARG 88 CZ -0.0156 0.0065 -0.0066 2315 ARG 88 NH1 -0.0164 0.0064 -0.0076 2316 ARG 88 NH2 -0.0160 0.0071 -0.0055 2317 THR 89 N -0.0120 0.0042 -0.0096 2318 THR 89 CA -0.0120 0.0037 -0.0108 2319 THR 89 C -0.0119 0.0038 -0.0104 2320 THR 89 O -0.0120 0.0043 -0.0094 2321 THR 89 CB -0.0132 0.0037 -0.0116 2322 THR 89 OG1 -0.0143 0.0043 -0.0110 2323 THR 89 CG2 -0.0134 0.0035 -0.0122 2324 ILE 90 N -0.0116 0.0034 -0.0113 2325 ILE 90 CA -0.0115 0.0034 -0.0111 2326 ILE 90 C -0.0128 0.0040 -0.0108 2327 ILE 90 O -0.0128 0.0043 -0.0099 2328 ILE 90 CB -0.0110 0.0028 -0.0122 2329 ILE 90 CG1 -0.0096 0.0023 -0.0123 2330 ILE 90 CG2 -0.0110 0.0029 -0.0120 2331 ILE 90 CD1 -0.0090 0.0017 -0.0135 2332 PRO 91 N -0.0143 0.0067 -0.0103 2333 PRO 91 CA -0.0156 0.0069 -0.0100 2334 PRO 91 C -0.0158 0.0069 -0.0087 2335 PRO 91 O -0.0166 0.0070 -0.0082 2336 PRO 91 CB -0.0161 0.0070 -0.0107 2337 PRO 91 CG -0.0154 0.0070 -0.0118 2338 PRO 91 CD -0.0142 0.0067 -0.0113 2339 GLN 92 N -0.0150 0.0067 -0.0082 2340 GLN 92 CA -0.0151 0.0067 -0.0069 2341 GLN 92 C -0.0148 0.0066 -0.0062 2342 GLN 92 O -0.0153 0.0066 -0.0053 2343 GLN 92 CB -0.0144 0.0065 -0.0066 2344 GLN 92 CG -0.0149 0.0066 -0.0070 2345 GLN 92 CD -0.0141 0.0065 -0.0068 2346 GLN 92 OE1 -0.0131 0.0063 -0.0066 2347 GLN 92 NE2 -0.0145 0.0066 -0.0070 2348 ALA 93 N -0.0139 0.0065 -0.0066 2349 ALA 93 CA -0.0135 0.0064 -0.0060 2350 ALA 93 C -0.0143 0.0065 -0.0061 2351 ALA 93 O -0.0146 0.0065 -0.0052 2352 ALA 93 CB -0.0123 0.0062 -0.0065 2353 ASP 94 N -0.0149 0.0060 -0.0079 2354 ASP 94 CA -0.0158 0.0063 -0.0081 2355 ASP 94 C -0.0169 0.0067 -0.0073 2356 ASP 94 O -0.0174 0.0069 -0.0065 2357 ASP 94 CB -0.0162 0.0064 -0.0095 2358 ASP 94 CG -0.0161 0.0064 -0.0101 2359 ASP 94 OD1 -0.0163 0.0064 -0.0093 2360 ASP 94 OD2 -0.0158 0.0062 -0.0113 2361 ALA 95 N -0.0174 0.0069 -0.0074 2362 ALA 95 CA -0.0185 0.0072 -0.0067 2363 ALA 95 C -0.0183 0.0072 -0.0052 2364 ALA 95 O -0.0191 0.0075 -0.0044 2365 ALA 95 CB -0.0189 0.0073 -0.0071 2366 MET 96 N -0.0171 0.0068 -0.0048 2367 MET 96 CA -0.0168 0.0067 -0.0034 2368 MET 96 C -0.0169 0.0068 -0.0029 2369 MET 96 O -0.0175 0.0070 -0.0019 2370 MET 96 CB -0.0155 0.0063 -0.0031 2371 MET 96 CG -0.0154 0.0063 -0.0027 2372 MET 96 SD -0.0139 0.0058 -0.0026 2373 MET 96 CE -0.0133 0.0056 -0.0012 2374 LYS 97 N -0.0166 0.0061 -0.0044 2375 LYS 97 CA -0.0165 0.0061 -0.0040 2376 LYS 97 C -0.0180 0.0065 -0.0039 2377 LYS 97 O -0.0182 0.0067 -0.0029 2378 LYS 97 CB -0.0155 0.0057 -0.0051 2379 LYS 97 CG -0.0156 0.0057 -0.0049 2380 LYS 97 CD -0.0144 0.0053 -0.0057 2381 LYS 97 CE -0.0146 0.0052 -0.0074 2382 LYS 97 NZ -0.0135 0.0048 -0.0080 2383 GLU 98 N -0.0189 0.0067 -0.0049 2384 GLU 98 CA -0.0204 0.0071 -0.0050 2385 GLU 98 C -0.0212 0.0075 -0.0036 2386 GLU 98 O -0.0220 0.0078 -0.0030 2387 GLU 98 CB -0.0212 0.0072 -0.0065 2388 GLU 98 CG -0.0209 0.0070 -0.0077 2389 GLU 98 CD -0.0210 0.0069 -0.0093 2390 GLU 98 OE1 -0.0218 0.0071 -0.0095 2391 GLU 98 OE2 -0.0204 0.0066 -0.0102 2392 ALA 99 N -0.0211 0.0075 -0.0031 2393 ALA 99 CA -0.0218 0.0078 -0.0018 2394 ALA 99 C -0.0210 0.0077 -0.0003 2395 ALA 99 O -0.0213 0.0079 0.0009 2396 ALA 99 CB -0.0219 0.0079 -0.0017 2397 GLY 100 N -0.0202 0.0070 -0.0017 2398 GLY 100 CA -0.0194 0.0069 -0.0004 2399 GLY 100 C -0.0182 0.0067 0.0005 2400 GLY 100 O -0.0177 0.0067 0.0018 2401 ILE 101 N -0.0178 0.0065 -0.0001 2402 ILE 101 CA -0.0166 0.0063 0.0007 2403 ILE 101 C -0.0150 0.0058 0.0002 2404 ILE 101 O -0.0145 0.0056 -0.0011 2405 ILE 101 CB -0.0167 0.0063 0.0002 2406 ILE 101 CG1 -0.0183 0.0067 0.0005 2407 ILE 101 CG2 -0.0156 0.0061 0.0012 2408 ILE 101 CD1 -0.0187 0.0067 -0.0005 2409 ASN 102 N -0.0141 0.0057 0.0013 2410 ASN 102 CA -0.0126 0.0053 0.0009 2411 ASN 102 C -0.0114 0.0051 0.0017 2412 ASN 102 O -0.0116 0.0052 0.0030 2413 ASN 102 CB -0.0125 0.0053 0.0013 2414 ASN 102 CG -0.0134 0.0054 0.0002 2415 ASN 102 OD1 -0.0142 0.0057 0.0007 2416 ASN 102 ND2 -0.0132 0.0052 -0.0014 2417 VAL 103 N -0.0082 0.0041 0.0007 2418 VAL 103 CA -0.0069 0.0044 0.0015 2419 VAL 103 C -0.0049 0.0042 0.0014 2420 VAL 103 O -0.0045 0.0036 0.0002 2421 VAL 103 CB -0.0070 0.0041 0.0007 2422 VAL 103 CG1 -0.0090 0.0043 0.0008 2423 VAL 103 CG2 -0.0064 0.0032 -0.0011 2424 ASP 104 N -0.0037 0.0047 0.0026 2425 ASP 104 CA -0.0018 0.0046 0.0027 2426 ASP 104 C -0.0005 0.0040 0.0018 2427 ASP 104 O 0.0009 0.0036 0.0011 2428 ASP 104 CB -0.0012 0.0054 0.0046 2429 ASP 104 CG -0.0024 0.0060 0.0057 2430 ASP 104 OD1 -0.0025 0.0059 0.0054 2431 ASP 104 OD2 -0.0033 0.0066 0.0068 2432 TYR 105 N -0.0010 0.0041 0.0018 2433 TYR 105 CA 0.0002 0.0036 0.0009 2434 TYR 105 C -0.0009 0.0032 0.0000 2435 TYR 105 O -0.0024 0.0036 0.0006 2436 TYR 105 CB 0.0015 0.0041 0.0023 2437 TYR 105 CG 0.0030 0.0044 0.0031 2438 TYR 105 CD1 0.0025 0.0051 0.0046 2439 TYR 105 CD2 0.0048 0.0039 0.0025 2440 TYR 105 CE1 0.0039 0.0053 0.0054 2441 TYR 105 CE2 0.0061 0.0042 0.0033 2442 TYR 105 CZ 0.0057 0.0049 0.0047 2443 TYR 105 OH 0.0070 0.0051 0.0055 2444 VAL 106 N -0.0001 0.0024 -0.0002 2445 VAL 106 CA -0.0012 0.0020 -0.0014 2446 VAL 106 C 0.0001 0.0014 -0.0015 2447 VAL 106 O 0.0015 0.0006 -0.0019 2448 VAL 106 CB -0.0018 0.0010 -0.0029 2449 VAL 106 CG1 -0.0029 0.0005 -0.0041 2450 VAL 106 CG2 -0.0029 0.0016 -0.0026 2451 LEU 107 N -0.0004 0.0019 -0.0011 2452 LEU 107 CA 0.0008 0.0015 -0.0011 2453 LEU 107 C -0.0000 0.0008 -0.0025 2454 LEU 107 O -0.0015 0.0012 -0.0025 2455 LEU 107 CB 0.0010 0.0025 0.0004 2456 LEU 107 CG 0.0019 0.0033 0.0020 2457 LEU 107 CD1 0.0020 0.0043 0.0033 2458 LEU 107 CD2 0.0038 0.0027 0.0019 2459 GLU 108 N 0.0010 -0.0004 -0.0035 2460 GLU 108 CA 0.0004 -0.0011 -0.0048 2461 GLU 108 C 0.0014 -0.0011 -0.0044 2462 GLU 108 O 0.0031 -0.0016 -0.0043 2463 GLU 108 CB 0.0008 -0.0023 -0.0064 2464 GLU 108 CG 0.0000 -0.0030 -0.0076 2465 GLU 108 CD 0.0004 -0.0043 -0.0092 2466 GLU 108 OE1 0.0016 -0.0047 -0.0093 2467 GLU 108 OE2 -0.0005 -0.0048 -0.0104 2468 PHE 109 N 0.0011 -0.0014 -0.0040 2469 PHE 109 CA 0.0015 -0.0009 -0.0035 2470 PHE 109 C 0.0012 -0.0026 -0.0049 2471 PHE 109 O -0.0007 -0.0029 -0.0056 2472 PHE 109 CB -0.0002 0.0007 -0.0024 2473 PHE 109 CG 0.0005 0.0017 -0.0014 2474 PHE 109 CD1 0.0019 0.0031 0.0001 2475 PHE 109 CD2 -0.0003 0.0013 -0.0019 2476 PHE 109 CE1 0.0024 0.0041 0.0011 2477 PHE 109 CE2 0.0002 0.0023 -0.0009 2478 PHE 109 CZ 0.0016 0.0037 0.0006 2479 ASP 110 N 0.0032 -0.0035 -0.0054 2480 ASP 110 CA 0.0031 -0.0051 -0.0068 2481 ASP 110 C 0.0032 -0.0052 -0.0068 2482 ASP 110 O 0.0050 -0.0049 -0.0062 2483 ASP 110 CB 0.0050 -0.0065 -0.0077 2484 ASP 110 CG 0.0049 -0.0084 -0.0094 2485 ASP 110 OD1 0.0029 -0.0090 -0.0102 2486 ASP 110 OD2 0.0067 -0.0094 -0.0099 2487 VAL 111 N 0.0013 -0.0056 -0.0076 2488 VAL 111 CA 0.0011 -0.0058 -0.0078 2489 VAL 111 C 0.0002 -0.0076 -0.0096 2490 VAL 111 O -0.0016 -0.0079 -0.0102 2491 VAL 111 CB -0.0006 -0.0043 -0.0068 2492 VAL 111 CG1 -0.0007 -0.0046 -0.0071 2493 VAL 111 CG2 -0.0000 -0.0025 -0.0051 2494 PRO 112 N -0.0014 -0.0090 -0.0092 2495 PRO 112 CA -0.0019 -0.0104 -0.0104 2496 PRO 112 C -0.0038 -0.0103 -0.0108 2497 PRO 112 O -0.0044 -0.0093 -0.0103 2498 PRO 112 CB -0.0007 -0.0112 -0.0106 2499 PRO 112 CG 0.0008 -0.0105 -0.0096 2500 PRO 112 CD 0.0000 -0.0089 -0.0087 2501 ASP 113 N -0.0047 -0.0113 -0.0117 2502 ASP 113 CA -0.0065 -0.0112 -0.0122 2503 ASP 113 C -0.0068 -0.0113 -0.0124 2504 ASP 113 O -0.0082 -0.0107 -0.0124 2505 ASP 113 CB -0.0072 -0.0125 -0.0133 2506 ASP 113 CG -0.0072 -0.0123 -0.0132 2507 ASP 113 OD1 -0.0065 -0.0114 -0.0124 2508 ASP 113 OD2 -0.0080 -0.0132 -0.0140 2509 GLU 114 N -0.0056 -0.0120 -0.0125 2510 GLU 114 CA -0.0058 -0.0121 -0.0127 2511 GLU 114 C -0.0058 -0.0107 -0.0117 2512 GLU 114 O -0.0067 -0.0103 -0.0117 2513 GLU 114 CB -0.0044 -0.0133 -0.0131 2514 GLU 114 CG -0.0046 -0.0148 -0.0142 2515 GLU 114 CD -0.0063 -0.0152 -0.0150 2516 GLU 114 OE1 -0.0070 -0.0149 -0.0150 2517 GLU 114 OE2 -0.0071 -0.0157 -0.0156 2518 LEU 115 N -0.0050 -0.0101 -0.0107 2519 LEU 115 CA -0.0049 -0.0088 -0.0096 2520 LEU 115 C -0.0064 -0.0079 -0.0092 2521 LEU 115 O -0.0069 -0.0070 -0.0087 2522 LEU 115 CB -0.0034 -0.0083 -0.0089 2523 LEU 115 CG -0.0019 -0.0087 -0.0088 2524 LEU 115 CD1 -0.0016 -0.0102 -0.0099 2525 LEU 115 CD2 -0.0005 -0.0083 -0.0081 2526 ILE 116 N -0.0072 -0.0080 -0.0096 2527 ILE 116 CA -0.0086 -0.0071 -0.0092 2528 ILE 116 C -0.0099 -0.0075 -0.0098 2529 ILE 116 O -0.0108 -0.0066 -0.0093 2530 ILE 116 CB -0.0091 -0.0072 -0.0094 2531 ILE 116 CG1 -0.0079 -0.0067 -0.0087 2532 ILE 116 CG2 -0.0108 -0.0065 -0.0092 2533 ILE 116 CD1 -0.0079 -0.0072 -0.0091 2534 VAL 117 N -0.0100 -0.0087 -0.0108 2535 VAL 117 CA -0.0112 -0.0091 -0.0114 2536 VAL 117 C -0.0111 -0.0085 -0.0109 2537 VAL 117 O -0.0123 -0.0078 -0.0107 2538 VAL 117 CB -0.0110 -0.0106 -0.0126 2539 VAL 117 CG1 -0.0121 -0.0110 -0.0131 2540 VAL 117 CG2 -0.0113 -0.0112 -0.0132 2541 ASP 118 N -0.0100 -0.0089 -0.0100 2542 ASP 118 CA -0.0097 -0.0082 -0.0094 2543 ASP 118 C -0.0102 -0.0069 -0.0084 2544 ASP 118 O -0.0110 -0.0063 -0.0080 2545 ASP 118 CB -0.0079 -0.0082 -0.0093 2546 ASP 118 CG -0.0072 -0.0094 -0.0103 2547 ASP 118 OD1 -0.0081 -0.0103 -0.0110 2548 ASP 118 OD2 -0.0058 -0.0095 -0.0103 2549 ARG 119 N -0.0098 -0.0063 -0.0080 2550 ARG 119 CA -0.0102 -0.0050 -0.0070 2551 ARG 119 C -0.0119 -0.0048 -0.0069 2552 ARG 119 O -0.0125 -0.0038 -0.0061 2553 ARG 119 CB -0.0094 -0.0047 -0.0066 2554 ARG 119 CG -0.0077 -0.0047 -0.0066 2555 ARG 119 CD -0.0068 -0.0044 -0.0063 2556 ARG 119 NE -0.0051 -0.0044 -0.0062 2557 ARG 119 CZ -0.0041 -0.0044 -0.0061 2558 ARG 119 NH1 -0.0046 -0.0043 -0.0061 2559 ARG 119 NH2 -0.0026 -0.0043 -0.0060 2560 ILE 120 N -0.0128 -0.0058 -0.0077 2561 ILE 120 CA -0.0145 -0.0057 -0.0077 2562 ILE 120 C -0.0154 -0.0061 -0.0081 2563 ILE 120 O -0.0165 -0.0054 -0.0076 2564 ILE 120 CB -0.0150 -0.0063 -0.0082 2565 ILE 120 CG1 -0.0142 -0.0057 -0.0077 2566 ILE 120 CG2 -0.0167 -0.0062 -0.0082 2567 ILE 120 CD1 -0.0147 -0.0062 -0.0081 2568 VAL 121 N -0.0143 -0.0074 -0.0083 2569 VAL 121 CA -0.0141 -0.0073 -0.0083 2570 VAL 121 C -0.0134 -0.0069 -0.0074 2571 VAL 121 O -0.0134 -0.0069 -0.0069 2572 VAL 121 CB -0.0137 -0.0073 -0.0094 2573 VAL 121 CG1 -0.0144 -0.0076 -0.0103 2574 VAL 121 CG2 -0.0126 -0.0069 -0.0096 2575 GLY 122 N -0.0126 -0.0067 -0.0071 2576 GLY 122 CA -0.0119 -0.0063 -0.0063 2577 GLY 122 C -0.0124 -0.0064 -0.0052 2578 GLY 122 O -0.0119 -0.0061 -0.0046 2579 ARG 123 N -0.0133 -0.0067 -0.0050 2580 ARG 123 CA -0.0139 -0.0068 -0.0040 2581 ARG 123 C -0.0143 -0.0069 -0.0034 2582 ARG 123 O -0.0148 -0.0071 -0.0038 2583 ARG 123 CB -0.0147 -0.0071 -0.0042 2584 ARG 123 CG -0.0155 -0.0073 -0.0033 2585 ARG 123 CD -0.0160 -0.0075 -0.0034 2586 ARG 123 NE -0.0167 -0.0078 -0.0042 2587 ARG 123 CZ -0.0171 -0.0080 -0.0046 2588 ARG 123 NH1 -0.0167 -0.0078 -0.0043 2589 ARG 123 NH2 -0.0178 -0.0083 -0.0053 2590 ARG 124 N -0.0139 -0.0083 -0.0022 2591 ARG 124 CA -0.0138 -0.0086 -0.0009 2592 ARG 124 C -0.0147 -0.0096 0.0003 2593 ARG 124 O -0.0150 -0.0098 0.0004 2594 ARG 124 CB -0.0123 -0.0079 -0.0000 2595 ARG 124 CG -0.0112 -0.0068 -0.0010 2596 ARG 124 CD -0.0111 -0.0067 -0.0013 2597 ARG 124 NE -0.0102 -0.0057 -0.0024 2598 ARG 124 CZ -0.0104 -0.0054 -0.0039 2599 ARG 124 NH1 -0.0115 -0.0059 -0.0046 2600 ARG 124 NH2 -0.0095 -0.0045 -0.0048 2601 VAL 125 N -0.0151 -0.0101 0.0011 2602 VAL 125 CA -0.0160 -0.0111 0.0023 2603 VAL 125 C -0.0157 -0.0113 0.0037 2604 VAL 125 O -0.0152 -0.0110 0.0036 2605 VAL 125 CB -0.0175 -0.0119 0.0016 2606 VAL 125 CG1 -0.0181 -0.0120 0.0008 2607 VAL 125 CG2 -0.0176 -0.0116 0.0005 2608 HIS 126 N -0.0158 -0.0118 0.0050 2609 HIS 126 CA -0.0156 -0.0122 0.0065 2610 HIS 126 C -0.0170 -0.0131 0.0065 2611 HIS 126 O -0.0179 -0.0138 0.0070 2612 HIS 126 CB -0.0153 -0.0124 0.0079 2613 HIS 126 CG -0.0152 -0.0128 0.0094 2614 HIS 126 ND1 -0.0141 -0.0123 0.0099 2615 HIS 126 CD2 -0.0161 -0.0137 0.0105 2616 HIS 126 CE1 -0.0144 -0.0128 0.0112 2617 HIS 126 NE2 -0.0155 -0.0137 0.0116 2618 ALA 127 N -0.0169 -0.0122 0.0050 2619 ALA 127 CA -0.0185 -0.0130 0.0048 2620 ALA 127 C -0.0196 -0.0142 0.0064 2621 ALA 127 O -0.0212 -0.0149 0.0061 2622 ALA 127 CB -0.0180 -0.0125 0.0044 2623 PRO 128 N -0.0188 -0.0145 0.0082 2624 PRO 128 CA -0.0197 -0.0156 0.0099 2625 PRO 128 C -0.0207 -0.0163 0.0103 2626 PRO 128 O -0.0220 -0.0173 0.0113 2627 PRO 128 CB -0.0182 -0.0155 0.0115 2628 PRO 128 CG -0.0170 -0.0145 0.0106 2629 PRO 128 CD -0.0169 -0.0137 0.0088 2630 SER 129 N -0.0202 -0.0158 0.0097 2631 SER 129 CA -0.0211 -0.0164 0.0101 2632 SER 129 C -0.0219 -0.0161 0.0083 2633 SER 129 O -0.0228 -0.0166 0.0084 2634 SER 129 CB -0.0197 -0.0161 0.0113 2635 SER 129 OG -0.0182 -0.0150 0.0103 2636 GLY 130 N -0.0205 -0.0155 0.0070 2637 GLY 130 CA -0.0210 -0.0153 0.0054 2638 GLY 130 C -0.0201 -0.0147 0.0052 2639 GLY 130 O -0.0205 -0.0146 0.0041 2640 ARG 131 N -0.0188 -0.0144 0.0064 2641 ARG 131 CA -0.0178 -0.0139 0.0063 2642 ARG 131 C -0.0170 -0.0130 0.0048 2643 ARG 131 O -0.0162 -0.0124 0.0044 2644 ARG 131 CB -0.0166 -0.0138 0.0079 2645 ARG 131 CG -0.0173 -0.0146 0.0094 2646 ARG 131 CD -0.0161 -0.0144 0.0110 2647 ARG 131 NE -0.0154 -0.0143 0.0116 2648 ARG 131 CZ -0.0159 -0.0149 0.0129 2649 ARG 131 NH1 -0.0171 -0.0158 0.0137 2650 ARG 131 NH2 -0.0152 -0.0147 0.0134 2651 VAL 132 N -0.0172 -0.0128 0.0038 2652 VAL 132 CA -0.0166 -0.0120 0.0022 2653 VAL 132 C -0.0150 -0.0112 0.0023 2654 VAL 132 O -0.0146 -0.0113 0.0034 2655 VAL 132 CB -0.0177 -0.0122 0.0009 2656 VAL 132 CG1 -0.0171 -0.0113 -0.0007 2657 VAL 132 CG2 -0.0193 -0.0129 0.0006 2658 TYR 133 N -0.0144 -0.0105 0.0017 2659 TYR 133 CA -0.0131 -0.0094 0.0016 2660 TYR 133 C -0.0130 -0.0088 -0.0001 2661 TYR 133 O -0.0136 -0.0090 -0.0009 2662 TYR 133 CB -0.0120 -0.0090 0.0026 2663 TYR 133 CG -0.0119 -0.0095 0.0043 2664 TYR 133 CD1 -0.0116 -0.0094 0.0050 2665 TYR 133 CD2 -0.0123 -0.0100 0.0053 2666 TYR 133 CE1 -0.0116 -0.0099 0.0065 2667 TYR 133 CE2 -0.0123 -0.0106 0.0068 2668 TYR 133 CZ -0.0120 -0.0105 0.0075 2669 TYR 133 OH -0.0120 -0.0111 0.0090 2670 HIS 134 N -0.0122 -0.0080 -0.0008 2671 HIS 134 CA -0.0120 -0.0073 -0.0023 2672 HIS 134 C -0.0106 -0.0062 -0.0025 2673 HIS 134 O -0.0101 -0.0058 -0.0026 2674 HIS 134 CB -0.0128 -0.0076 -0.0035 2675 HIS 134 CG -0.0128 -0.0070 -0.0051 2676 HIS 134 ND1 -0.0117 -0.0060 -0.0058 2677 HIS 134 CD2 -0.0138 -0.0074 -0.0062 2678 HIS 134 CE1 -0.0120 -0.0057 -0.0072 2679 HIS 134 NE2 -0.0132 -0.0066 -0.0075 2680 VAL 135 N -0.0100 -0.0057 -0.0026 2681 VAL 135 CA -0.0087 -0.0046 -0.0028 2682 VAL 135 C -0.0080 -0.0038 -0.0035 2683 VAL 135 O -0.0069 -0.0031 -0.0029 2684 VAL 135 CB -0.0084 -0.0041 -0.0035 2685 VAL 135 CG1 -0.0087 -0.0047 -0.0025 2686 VAL 135 CG2 -0.0092 -0.0042 -0.0051 2687 LYS 136 N -0.0092 -0.0042 -0.0042 2688 LYS 136 CA -0.0086 -0.0033 -0.0052 2689 LYS 136 C -0.0088 -0.0036 -0.0050 2690 LYS 136 O -0.0081 -0.0028 -0.0050 2691 LYS 136 CB -0.0088 -0.0033 -0.0069 2692 LYS 136 CG -0.0085 -0.0030 -0.0073 2693 LYS 136 CD -0.0095 -0.0041 -0.0073 2694 LYS 136 CE -0.0093 -0.0038 -0.0077 2695 LYS 136 NZ -0.0103 -0.0049 -0.0079 2696 PHE 137 N -0.0098 -0.0047 -0.0048 2697 PHE 137 CA -0.0101 -0.0051 -0.0047 2698 PHE 137 C -0.0098 -0.0051 -0.0030 2699 PHE 137 O -0.0089 -0.0042 -0.0024 2700 PHE 137 CB -0.0112 -0.0064 -0.0052 2701 PHE 137 CG -0.0115 -0.0065 -0.0069 2702 PHE 137 CD1 -0.0110 -0.0058 -0.0077 2703 PHE 137 CD2 -0.0124 -0.0073 -0.0078 2704 PHE 137 CE1 -0.0113 -0.0059 -0.0093 2705 PHE 137 CE2 -0.0127 -0.0074 -0.0094 2706 PHE 137 CZ -0.0122 -0.0067 -0.0101 2707 ASN 138 N -0.0107 -0.0062 -0.0022 2708 ASN 138 CA -0.0106 -0.0064 -0.0005 2709 ASN 138 C -0.0103 -0.0063 0.0006 2710 ASN 138 O -0.0111 -0.0072 0.0012 2711 ASN 138 CB -0.0116 -0.0076 -0.0002 2712 ASN 138 CG -0.0126 -0.0086 -0.0008 2713 ASN 138 OD1 -0.0128 -0.0086 -0.0022 2714 ASN 138 ND2 -0.0132 -0.0095 0.0003 2715 PRO 139 N -0.0092 -0.0063 0.0009 2716 PRO 139 CA -0.0083 -0.0061 0.0014 2717 PRO 139 C -0.0082 -0.0069 0.0034 2718 PRO 139 O -0.0085 -0.0075 0.0045 2719 PRO 139 CB -0.0065 -0.0049 0.0009 2720 PRO 139 CG -0.0061 -0.0050 0.0016 2721 PRO 139 CD -0.0079 -0.0056 0.0008 2722 PRO 140 N -0.0079 -0.0070 0.0040 2723 PRO 140 CA -0.0078 -0.0078 0.0059 2724 PRO 140 C -0.0059 -0.0072 0.0068 2725 PRO 140 O -0.0047 -0.0062 0.0059 2726 PRO 140 CB -0.0079 -0.0079 0.0060 2727 PRO 140 CG -0.0071 -0.0068 0.0045 2728 PRO 140 CD -0.0078 -0.0065 0.0030 2729 LYS 141 N -0.0058 -0.0078 0.0084 2730 LYS 141 CA -0.0040 -0.0073 0.0093 2731 LYS 141 C -0.0026 -0.0066 0.0093 2732 LYS 141 O -0.0012 -0.0056 0.0088 2733 LYS 141 CB -0.0041 -0.0082 0.0112 2734 LYS 141 CG -0.0053 -0.0089 0.0114 2735 LYS 141 CD -0.0045 -0.0093 0.0132 2736 LYS 141 CE -0.0059 -0.0102 0.0137 2737 LYS 141 NZ -0.0073 -0.0113 0.0145 2738 VAL 142 N -0.0036 -0.0071 0.0096 2739 VAL 142 CA -0.0026 -0.0067 0.0097 2740 VAL 142 C -0.0032 -0.0064 0.0080 2741 VAL 142 O -0.0046 -0.0070 0.0076 2742 VAL 142 CB -0.0030 -0.0074 0.0112 2743 VAL 142 CG1 -0.0015 -0.0069 0.0121 2744 VAL 142 CG2 -0.0038 -0.0083 0.0125 2745 GLU 143 N -0.0021 -0.0054 0.0068 2746 GLU 143 CA -0.0025 -0.0050 0.0051 2747 GLU 143 C -0.0032 -0.0054 0.0050 2748 GLU 143 O -0.0024 -0.0052 0.0057 2749 GLU 143 CB -0.0009 -0.0039 0.0042 2750 GLU 143 CG 0.0006 -0.0035 0.0051 2751 GLU 143 CD 0.0019 -0.0024 0.0040 2752 GLU 143 OE1 0.0022 -0.0019 0.0030 2753 GLU 143 OE2 0.0026 -0.0021 0.0041 2754 GLY 144 N -0.0047 -0.0058 0.0041 2755 GLY 144 CA -0.0056 -0.0062 0.0039 2756 GLY 144 C -0.0064 -0.0071 0.0055 2757 GLY 144 O -0.0072 -0.0076 0.0055 2758 LYS 145 N -0.0061 -0.0075 0.0069 2759 LYS 145 CA -0.0067 -0.0083 0.0084 2760 LYS 145 C -0.0077 -0.0090 0.0090 2761 LYS 145 O -0.0076 -0.0089 0.0088 2762 LYS 145 CB -0.0052 -0.0081 0.0098 2763 LYS 145 CG -0.0039 -0.0072 0.0093 2764 LYS 145 CD -0.0040 -0.0074 0.0096 2765 LYS 145 CE -0.0025 -0.0066 0.0093 2766 LYS 145 NZ -0.0025 -0.0068 0.0099 2767 ASP 146 N -0.0087 -0.0099 0.0099 2768 ASP 146 CA -0.0098 -0.0107 0.0107 2769 ASP 146 C -0.0089 -0.0107 0.0122 2770 ASP 146 O -0.0084 -0.0109 0.0134 2771 ASP 146 CB -0.0111 -0.0115 0.0112 2772 ASP 146 CG -0.0125 -0.0123 0.0118 2773 ASP 146 OD1 -0.0130 -0.0123 0.0110 2774 ASP 146 OD2 -0.0131 -0.0131 0.0129 2775 ASP 147 N -0.0087 -0.0106 0.0120 2776 ASP 147 CA -0.0078 -0.0106 0.0133 2777 ASP 147 C -0.0082 -0.0114 0.0150 2778 ASP 147 O -0.0072 -0.0114 0.0162 2779 ASP 147 CB -0.0082 -0.0106 0.0129 2780 ASP 147 CG -0.0080 -0.0099 0.0111 2781 ASP 147 OD1 -0.0075 -0.0094 0.0102 2782 ASP 147 OD2 -0.0084 -0.0099 0.0106 2783 VAL 148 N -0.0097 -0.0122 0.0152 2784 VAL 148 CA -0.0102 -0.0130 0.0167 2785 VAL 148 C -0.0099 -0.0131 0.0173 2786 VAL 148 O -0.0088 -0.0128 0.0183 2787 VAL 148 CB -0.0120 -0.0139 0.0166 2788 VAL 148 CG1 -0.0129 -0.0138 0.0149 2789 VAL 148 CG2 -0.0128 -0.0147 0.0179 2790 THR 149 N -0.0109 -0.0133 0.0166 2791 THR 149 CA -0.0107 -0.0134 0.0171 2792 THR 149 C -0.0091 -0.0125 0.0168 2793 THR 149 O -0.0085 -0.0125 0.0178 2794 THR 149 CB -0.0120 -0.0138 0.0162 2795 THR 149 OG1 -0.0120 -0.0132 0.0145 2796 THR 149 CG2 -0.0136 -0.0147 0.0166 2797 GLY 150 N -0.0086 -0.0118 0.0154 2798 GLY 150 CA -0.0072 -0.0109 0.0150 2799 GLY 150 C -0.0077 -0.0107 0.0136 2800 GLY 150 O -0.0068 -0.0099 0.0126 2801 GLU 151 N -0.0091 -0.0112 0.0135 2802 GLU 151 CA -0.0097 -0.0111 0.0122 2803 GLU 151 C -0.0097 -0.0105 0.0103 2804 GLU 151 O -0.0102 -0.0105 0.0099 2805 GLU 151 CB -0.0114 -0.0119 0.0125 2806 GLU 151 CG -0.0115 -0.0126 0.0143 2807 GLU 151 CD -0.0132 -0.0134 0.0146 2808 GLU 151 OE1 -0.0135 -0.0135 0.0143 2809 GLU 151 OE2 -0.0142 -0.0141 0.0152 2810 GLU 152 N -0.0092 -0.0099 0.0093 2811 GLU 152 CA -0.0091 -0.0092 0.0075 2812 GLU 152 C -0.0107 -0.0096 0.0064 2813 GLU 152 O -0.0120 -0.0102 0.0065 2814 GLU 152 CB -0.0083 -0.0086 0.0067 2815 GLU 152 CG -0.0079 -0.0078 0.0049 2816 GLU 152 CD -0.0072 -0.0072 0.0040 2817 GLU 152 OE1 -0.0081 -0.0074 0.0033 2818 GLU 152 OE2 -0.0057 -0.0065 0.0041 2819 LEU 153 N -0.0105 -0.0092 0.0052 2820 LEU 153 CA -0.0119 -0.0094 0.0041 2821 LEU 153 C -0.0123 -0.0092 0.0026 2822 LEU 153 O -0.0113 -0.0085 0.0019 2823 LEU 153 CB -0.0114 -0.0090 0.0034 2824 LEU 153 CG -0.0108 -0.0091 0.0048 2825 LEU 153 CD1 -0.0102 -0.0086 0.0039 2826 LEU 153 CD2 -0.0120 -0.0101 0.0059 2827 THR 154 N -0.0140 -0.0090 0.0009 2828 THR 154 CA -0.0144 -0.0089 0.0002 2829 THR 154 C -0.0147 -0.0089 -0.0004 2830 THR 154 O -0.0147 -0.0089 -0.0001 2831 THR 154 CB -0.0150 -0.0092 0.0003 2832 THR 154 OG1 -0.0156 -0.0094 0.0007 2833 THR 154 CG2 -0.0147 -0.0092 0.0009 2834 THR 155 N -0.0150 -0.0088 -0.0010 2835 THR 155 CA -0.0153 -0.0087 -0.0016 2836 THR 155 C -0.0161 -0.0089 -0.0017 2837 THR 155 O -0.0163 -0.0090 -0.0017 2838 THR 155 CB -0.0149 -0.0084 -0.0023 2839 THR 155 OG1 -0.0152 -0.0083 -0.0029 2840 THR 155 CG2 -0.0148 -0.0083 -0.0027 2841 ARG 156 N -0.0166 -0.0090 -0.0019 2842 ARG 156 CA -0.0175 -0.0093 -0.0021 2843 ARG 156 C -0.0176 -0.0091 -0.0029 2844 ARG 156 O -0.0174 -0.0088 -0.0034 2845 ARG 156 CB -0.0179 -0.0095 -0.0019 2846 ARG 156 CG -0.0188 -0.0097 -0.0018 2847 ARG 156 CD -0.0193 -0.0099 -0.0018 2848 ARG 156 NE -0.0189 -0.0098 -0.0016 2849 ARG 156 CZ -0.0186 -0.0099 -0.0009 2850 ARG 156 NH1 -0.0187 -0.0101 -0.0003 2851 ARG 156 NH2 -0.0182 -0.0098 -0.0008 2852 LYS 157 N -0.0185 -0.0081 -0.0044 2853 LYS 157 CA -0.0185 -0.0086 -0.0045 2854 LYS 157 C -0.0180 -0.0088 -0.0046 2855 LYS 157 O -0.0178 -0.0092 -0.0047 2856 LYS 157 CB -0.0189 -0.0086 -0.0046 2857 LYS 157 CG -0.0191 -0.0091 -0.0047 2858 LYS 157 CD -0.0194 -0.0094 -0.0047 2859 LYS 157 CE -0.0196 -0.0099 -0.0049 2860 LYS 157 NZ -0.0199 -0.0099 -0.0049 2861 ASP 158 N -0.0177 -0.0084 -0.0045 2862 ASP 158 CA -0.0172 -0.0085 -0.0045 2863 ASP 158 C -0.0168 -0.0086 -0.0045 2864 ASP 158 O -0.0164 -0.0089 -0.0045 2865 ASP 158 CB -0.0170 -0.0081 -0.0044 2866 ASP 158 CG -0.0174 -0.0080 -0.0044 2867 ASP 158 OD1 -0.0179 -0.0079 -0.0044 2868 ASP 158 OD2 -0.0172 -0.0080 -0.0044 2869 ASP 159 N -0.0168 -0.0084 -0.0044 2870 ASP 159 CA -0.0164 -0.0085 -0.0044 2871 ASP 159 C -0.0165 -0.0090 -0.0046 2872 ASP 159 O -0.0163 -0.0091 -0.0046 2873 ASP 159 CB -0.0164 -0.0081 -0.0043 2874 ASP 159 CG -0.0163 -0.0076 -0.0042 2875 ASP 159 OD1 -0.0161 -0.0076 -0.0042 2876 ASP 159 OD2 -0.0165 -0.0072 -0.0041 2877 GLN 160 N -0.0171 -0.0093 -0.0084 2878 GLN 160 CA -0.0165 -0.0094 -0.0096 2879 GLN 160 C -0.0161 -0.0095 -0.0107 2880 GLN 160 O -0.0168 -0.0097 -0.0111 2881 GLN 160 CB -0.0175 -0.0096 -0.0102 2882 GLN 160 CG -0.0177 -0.0095 -0.0093 2883 GLN 160 CD -0.0186 -0.0097 -0.0100 2884 GLN 160 OE1 -0.0191 -0.0100 -0.0110 2885 GLN 160 NE2 -0.0188 -0.0097 -0.0093 2886 GLU 161 N -0.0148 -0.0094 -0.0111 2887 GLU 161 CA -0.0142 -0.0094 -0.0121 2888 GLU 161 C -0.0151 -0.0098 -0.0133 2889 GLU 161 O -0.0152 -0.0099 -0.0138 2890 GLU 161 CB -0.0129 -0.0093 -0.0126 2891 GLU 161 CG -0.0121 -0.0094 -0.0136 2892 GLU 161 CD -0.0106 -0.0092 -0.0137 2893 GLU 161 OE1 -0.0100 -0.0089 -0.0127 2894 GLU 161 OE2 -0.0101 -0.0093 -0.0149 2895 GLU 162 N -0.0159 -0.0100 -0.0136 2896 GLU 162 CA -0.0168 -0.0103 -0.0147 2897 GLU 162 C -0.0179 -0.0104 -0.0143 2898 GLU 162 O -0.0181 -0.0105 -0.0150 2899 GLU 162 CB -0.0174 -0.0105 -0.0151 2900 GLU 162 CG -0.0185 -0.0108 -0.0162 2901 GLU 162 CD -0.0192 -0.0110 -0.0166 2902 GLU 162 OE1 -0.0195 -0.0109 -0.0157 2903 GLU 162 OE2 -0.0194 -0.0112 -0.0178 2904 THR 163 N -0.0184 -0.0101 -0.0143 2905 THR 163 CA -0.0192 -0.0097 -0.0137 2906 THR 163 C -0.0183 -0.0095 -0.0132 2907 THR 163 O -0.0185 -0.0095 -0.0134 2908 THR 163 CB -0.0200 -0.0091 -0.0128 2909 THR 163 OG1 -0.0207 -0.0093 -0.0133 2910 THR 163 CG2 -0.0210 -0.0087 -0.0124 2911 VAL 164 N -0.0172 -0.0093 -0.0127 2912 VAL 164 CA -0.0162 -0.0091 -0.0121 2913 VAL 164 C -0.0156 -0.0096 -0.0130 2914 VAL 164 O -0.0155 -0.0096 -0.0129 2915 VAL 164 CB -0.0151 -0.0088 -0.0115 2916 VAL 164 CG1 -0.0139 -0.0087 -0.0111 2917 VAL 164 CG2 -0.0156 -0.0082 -0.0104 2918 ARG 165 N -0.0153 -0.0102 -0.0140 2919 ARG 165 CA -0.0147 -0.0107 -0.0149 2920 ARG 165 C -0.0157 -0.0110 -0.0154 2921 ARG 165 O -0.0153 -0.0112 -0.0159 2922 ARG 165 CB -0.0141 -0.0113 -0.0158 2923 ARG 165 CG -0.0129 -0.0111 -0.0153 2924 ARG 165 CD -0.0120 -0.0118 -0.0162 2925 ARG 165 NE -0.0106 -0.0117 -0.0159 2926 ARG 165 CZ -0.0099 -0.0116 -0.0155 2927 ARG 165 NH1 -0.0104 -0.0115 -0.0155 2928 ARG 165 NH2 -0.0086 -0.0115 -0.0152 2929 LYS 166 N -0.0159 -0.0099 -0.0155 2930 LYS 166 CA -0.0171 -0.0103 -0.0162 2931 LYS 166 C -0.0173 -0.0098 -0.0153 2932 LYS 166 O -0.0173 -0.0101 -0.0159 2933 LYS 166 CB -0.0186 -0.0104 -0.0163 2934 LYS 166 CG -0.0187 -0.0111 -0.0176 2935 LYS 166 CD -0.0202 -0.0111 -0.0176 2936 LYS 166 CE -0.0201 -0.0104 -0.0164 2937 LYS 166 NZ -0.0214 -0.0104 -0.0165 2938 ARG 167 N -0.0174 -0.0090 -0.0140 2939 ARG 167 CA -0.0175 -0.0085 -0.0131 2940 ARG 167 C -0.0162 -0.0087 -0.0134 2941 ARG 167 O -0.0164 -0.0088 -0.0135 2942 ARG 167 CB -0.0173 -0.0077 -0.0117 2943 ARG 167 CG -0.0188 -0.0073 -0.0110 2944 ARG 167 CD -0.0186 -0.0064 -0.0095 2945 ARG 167 NE -0.0174 -0.0061 -0.0089 2946 ARG 167 CZ -0.0177 -0.0058 -0.0084 2947 ARG 167 NH1 -0.0191 -0.0057 -0.0084 2948 ARG 167 NH2 -0.0166 -0.0055 -0.0079 2949 LEU 168 N -0.0148 -0.0088 -0.0135 2950 LEU 168 CA -0.0134 -0.0089 -0.0138 2951 LEU 168 C -0.0135 -0.0097 -0.0151 2952 LEU 168 O -0.0133 -0.0097 -0.0151 2953 LEU 168 CB -0.0120 -0.0089 -0.0137 2954 LEU 168 CG -0.0115 -0.0081 -0.0123 2955 LEU 168 CD1 -0.0101 -0.0082 -0.0125 2956 LEU 168 CD2 -0.0112 -0.0075 -0.0113 2957 VAL 169 N -0.0138 -0.0098 -0.0153 2958 VAL 169 CA -0.0135 -0.0105 -0.0154 2959 VAL 169 C -0.0135 -0.0098 -0.0151 2960 VAL 169 O -0.0127 -0.0099 -0.0147 2961 VAL 169 CB -0.0142 -0.0115 -0.0161 2962 VAL 169 CG1 -0.0141 -0.0123 -0.0164 2963 VAL 169 CG2 -0.0153 -0.0110 -0.0167 2964 GLU 170 N -0.0144 -0.0090 -0.0154 2965 GLU 170 CA -0.0145 -0.0082 -0.0152 2966 GLU 170 C -0.0136 -0.0075 -0.0144 2967 GLU 170 O -0.0131 -0.0075 -0.0140 2968 GLU 170 CB -0.0156 -0.0073 -0.0155 2969 GLU 170 CG -0.0157 -0.0064 -0.0153 2970 GLU 170 CD -0.0168 -0.0060 -0.0158 2971 GLU 170 OE1 -0.0176 -0.0060 -0.0163 2972 GLU 170 OE2 -0.0170 -0.0056 -0.0158 2973 TYR 171 N -0.0134 -0.0070 -0.0140 2974 TYR 171 CA -0.0125 -0.0063 -0.0133 2975 TYR 171 C -0.0115 -0.0071 -0.0129 2976 TYR 171 O -0.0109 -0.0067 -0.0124 2977 TYR 171 CB -0.0124 -0.0058 -0.0131 2978 TYR 171 CG -0.0114 -0.0053 -0.0123 2979 TYR 171 CD1 -0.0114 -0.0041 -0.0118 2980 TYR 171 CD2 -0.0105 -0.0060 -0.0119 2981 TYR 171 CE1 -0.0104 -0.0037 -0.0111 2982 TYR 171 CE2 -0.0095 -0.0056 -0.0112 2983 TYR 171 CZ -0.0095 -0.0044 -0.0108 2984 TYR 171 OH -0.0086 -0.0040 -0.0100 2985 HIS 172 N -0.0114 -0.0073 -0.0143 2986 HIS 172 CA -0.0100 -0.0082 -0.0138 2987 HIS 172 C -0.0100 -0.0087 -0.0140 2988 HIS 172 O -0.0089 -0.0087 -0.0133 2989 HIS 172 CB -0.0095 -0.0097 -0.0143 2990 HIS 172 CG -0.0089 -0.0094 -0.0137 2991 HIS 172 ND1 -0.0078 -0.0089 -0.0125 2992 HIS 172 CD2 -0.0093 -0.0097 -0.0141 2993 HIS 172 CE1 -0.0075 -0.0088 -0.0122 2994 HIS 172 NE2 -0.0084 -0.0093 -0.0132 2995 GLN 173 N -0.0111 -0.0090 -0.0150 2996 GLN 173 CA -0.0111 -0.0094 -0.0153 2997 GLN 173 C -0.0111 -0.0080 -0.0146 2998 GLN 173 O -0.0105 -0.0082 -0.0142 2999 GLN 173 CB -0.0123 -0.0101 -0.0165 3000 GLN 173 CG -0.0138 -0.0091 -0.0171 3001 GLN 173 CD -0.0149 -0.0100 -0.0184 3002 GLN 173 OE1 -0.0145 -0.0114 -0.0189 3003 GLN 173 NE2 -0.0162 -0.0093 -0.0190 3004 MET 174 N -0.0118 -0.0066 -0.0143 3005 MET 174 CA -0.0119 -0.0051 -0.0136 3006 MET 174 C -0.0105 -0.0047 -0.0123 3007 MET 174 O -0.0100 -0.0041 -0.0117 3008 MET 174 CB -0.0130 -0.0038 -0.0137 3009 MET 174 CG -0.0145 -0.0033 -0.0146 3010 MET 174 SD -0.0152 -0.0012 -0.0140 3011 MET 174 CE -0.0143 -0.0007 -0.0130 3012 THR 175 N -0.0101 -0.0047 -0.0132 3013 THR 175 CA -0.0090 -0.0043 -0.0121 3014 THR 175 C -0.0076 -0.0050 -0.0124 3015 THR 175 O -0.0069 -0.0047 -0.0116 3016 THR 175 CB -0.0085 -0.0039 -0.0112 3017 THR 175 OG1 -0.0098 -0.0032 -0.0109 3018 THR 175 CG2 -0.0075 -0.0033 -0.0099 3019 ALA 176 N -0.0073 -0.0059 -0.0136 3020 ALA 176 CA -0.0060 -0.0066 -0.0140 3021 ALA 176 C -0.0060 -0.0065 -0.0138 3022 ALA 176 O -0.0049 -0.0065 -0.0131 3023 ALA 176 CB -0.0058 -0.0077 -0.0154 3024 PRO 177 N -0.0072 -0.0065 -0.0144 3025 PRO 177 CA -0.0072 -0.0064 -0.0142 3026 PRO 177 C -0.0072 -0.0054 -0.0128 3027 PRO 177 O -0.0064 -0.0054 -0.0124 3028 PRO 177 CB -0.0086 -0.0066 -0.0152 3029 PRO 177 CG -0.0096 -0.0064 -0.0154 3030 PRO 177 CD -0.0086 -0.0067 -0.0154 3031 LEU 178 N -0.0069 -0.0028 -0.0132 3032 LEU 178 CA -0.0070 -0.0018 -0.0116 3033 LEU 178 C -0.0052 -0.0019 -0.0106 3034 LEU 178 O -0.0048 -0.0015 -0.0097 3035 LEU 178 CB -0.0080 -0.0010 -0.0110 3036 LEU 178 CG -0.0084 0.0001 -0.0094 3037 LEU 178 CD1 -0.0096 0.0006 -0.0095 3038 LEU 178 CD2 -0.0091 0.0008 -0.0088 3039 ILE 179 N -0.0042 -0.0025 -0.0110 3040 ILE 179 CA -0.0025 -0.0028 -0.0102 3041 ILE 179 C -0.0017 -0.0033 -0.0105 3042 ILE 179 O -0.0007 -0.0030 -0.0095 3043 ILE 179 CB -0.0016 -0.0035 -0.0108 3044 ILE 179 CG1 -0.0023 -0.0031 -0.0106 3045 ILE 179 CG2 0.0003 -0.0038 -0.0100 3046 ILE 179 CD1 -0.0025 -0.0020 -0.0090 3047 GLY 180 N -0.0020 -0.0040 -0.0119 3048 GLY 180 CA -0.0013 -0.0045 -0.0123 3049 GLY 180 C -0.0020 -0.0038 -0.0116 3050 GLY 180 O -0.0011 -0.0038 -0.0111 3051 TYR 181 N -0.0036 -0.0022 -0.0124 3052 TYR 181 CA -0.0046 -0.0014 -0.0115 3053 TYR 181 C -0.0037 -0.0010 -0.0097 3054 TYR 181 O -0.0035 -0.0008 -0.0091 3055 TYR 181 CB -0.0064 -0.0007 -0.0116 3056 TYR 181 CG -0.0074 0.0003 -0.0105 3057 TYR 181 CD1 -0.0074 0.0010 -0.0088 3058 TYR 181 CD2 -0.0085 0.0005 -0.0110 3059 TYR 181 CE1 -0.0083 0.0019 -0.0078 3060 TYR 181 CE2 -0.0094 0.0014 -0.0100 3061 TYR 181 CZ -0.0093 0.0021 -0.0084 3062 TYR 181 OH -0.0103 0.0029 -0.0074 3063 TYR 182 N -0.0033 -0.0008 -0.0089 3064 TYR 182 CA -0.0025 -0.0003 -0.0072 3065 TYR 182 C -0.0008 -0.0009 -0.0069 3066 TYR 182 O -0.0004 -0.0006 -0.0057 3067 TYR 182 CB -0.0025 0.0001 -0.0063 3068 TYR 182 CG -0.0042 0.0010 -0.0058 3069 TYR 182 CD1 -0.0050 0.0017 -0.0050 3070 TYR 182 CD2 -0.0051 0.0012 -0.0062 3071 TYR 182 CE1 -0.0066 0.0026 -0.0046 3072 TYR 182 CE2 -0.0067 0.0021 -0.0058 3073 TYR 182 CZ -0.0074 0.0028 -0.0050 3074 TYR 182 OH -0.0090 0.0036 -0.0046 3075 SER 183 N 0.0002 -0.0018 -0.0079 3076 SER 183 CA 0.0019 -0.0025 -0.0077 3077 SER 183 C 0.0018 -0.0024 -0.0077 3078 SER 183 O 0.0029 -0.0025 -0.0068 3079 SER 183 CB 0.0028 -0.0035 -0.0091 3080 SER 183 OG 0.0027 -0.0035 -0.0093 3081 LYS 184 N 0.0005 -0.0026 -0.0101 3082 LYS 184 CA 0.0004 -0.0026 -0.0103 3083 LYS 184 C -0.0003 -0.0017 -0.0090 3084 LYS 184 O 0.0002 -0.0017 -0.0086 3085 LYS 184 CB -0.0007 -0.0031 -0.0119 3086 LYS 184 CG 0.0002 -0.0041 -0.0133 3087 LYS 184 CD -0.0009 -0.0045 -0.0147 3088 LYS 184 CE -0.0000 -0.0055 -0.0162 3089 LYS 184 NZ -0.0012 -0.0059 -0.0176 3090 GLU 185 N -0.0014 -0.0010 -0.0083 3091 GLU 185 CA -0.0021 -0.0001 -0.0070 3092 GLU 185 C -0.0006 0.0000 -0.0057 3093 GLU 185 O -0.0005 0.0004 -0.0049 3094 GLU 185 CB -0.0033 0.0006 -0.0063 3095 GLU 185 CG -0.0050 0.0006 -0.0073 3096 GLU 185 CD -0.0058 0.0010 -0.0072 3097 GLU 185 OE1 -0.0063 0.0018 -0.0059 3098 GLU 185 OE2 -0.0061 0.0004 -0.0084 3099 ALA 186 N 0.0005 -0.0003 -0.0056 3100 ALA 186 CA 0.0020 -0.0002 -0.0045 3101 ALA 186 C 0.0032 -0.0008 -0.0049 3102 ALA 186 O 0.0039 -0.0005 -0.0038 3103 ALA 186 CB 0.0029 -0.0005 -0.0046 3104 GLU 187 N 0.0036 -0.0015 -0.0070 3105 GLU 187 CA 0.0047 -0.0020 -0.0078 3106 GLU 187 C 0.0038 -0.0017 -0.0075 3107 GLU 187 O 0.0047 -0.0018 -0.0073 3108 GLU 187 CB 0.0047 -0.0028 -0.0096 3109 GLU 187 CG 0.0061 -0.0033 -0.0102 3110 GLU 187 CD 0.0060 -0.0042 -0.0121 3111 GLU 187 OE1 0.0054 -0.0044 -0.0129 3112 GLU 187 OE2 0.0065 -0.0045 -0.0127 3113 ALA 188 N 0.0021 -0.0014 -0.0076 3114 ALA 188 CA 0.0010 -0.0011 -0.0073 3115 ALA 188 C 0.0013 -0.0003 -0.0055 3116 ALA 188 O 0.0011 -0.0001 -0.0051 3117 ALA 188 CB -0.0009 -0.0009 -0.0078 3118 GLY 189 N 0.0017 0.0000 -0.0045 3119 GLY 189 CA 0.0020 0.0008 -0.0028 3120 GLY 189 C 0.0004 0.0015 -0.0018 3121 GLY 189 O 0.0005 0.0021 -0.0003 3122 ASN 190 N -0.0009 0.0015 -0.0032 3123 ASN 190 CA -0.0024 0.0022 -0.0025 3124 ASN 190 C -0.0023 0.0026 -0.0016 3125 ASN 190 O -0.0033 0.0033 -0.0007 3126 ASN 190 CB -0.0039 0.0022 -0.0037 3127 ASN 190 CG -0.0041 0.0019 -0.0045 3128 ASN 190 OD1 -0.0036 0.0021 -0.0038 3129 ASN 190 ND2 -0.0048 0.0015 -0.0060 3130 THR 191 N -0.0011 0.0021 -0.0019 3131 THR 191 CA -0.0009 0.0023 -0.0011 3132 THR 191 C 0.0009 0.0017 -0.0013 3133 THR 191 O 0.0018 0.0011 -0.0020 3134 THR 191 CB -0.0022 0.0024 -0.0019 3135 THR 191 OG1 -0.0022 0.0028 -0.0010 3136 THR 191 CG2 -0.0018 0.0015 -0.0036 3137 LYS 192 N 0.0014 0.0018 -0.0007 3138 LYS 192 CA 0.0031 0.0012 -0.0009 3139 LYS 192 C 0.0027 0.0009 -0.0017 3140 LYS 192 O 0.0017 0.0014 -0.0013 3141 LYS 192 CB 0.0042 0.0015 0.0007 3142 LYS 192 CG 0.0050 0.0016 0.0014 3143 LYS 192 CD 0.0038 0.0024 0.0023 3144 LYS 192 CE 0.0036 0.0032 0.0039 3145 LYS 192 NZ 0.0023 0.0040 0.0047 3146 TYR 193 N 0.0040 -0.0000 -0.0016 3147 TYR 193 CA 0.0035 -0.0004 -0.0026 3148 TYR 193 C 0.0052 -0.0009 -0.0024 3149 TYR 193 O 0.0067 -0.0015 -0.0023 3150 TYR 193 CB 0.0029 -0.0012 -0.0045 3151 TYR 193 CG 0.0028 -0.0019 -0.0057 3152 TYR 193 CD1 0.0014 -0.0016 -0.0061 3153 TYR 193 CD2 0.0043 -0.0030 -0.0065 3154 TYR 193 CE1 0.0014 -0.0022 -0.0071 3155 TYR 193 CE2 0.0044 -0.0036 -0.0075 3156 TYR 193 CZ 0.0030 -0.0032 -0.0078 3157 TYR 193 OH 0.0031 -0.0038 -0.0088 3158 ALA 194 N 0.0049 -0.0008 -0.0023 3159 ALA 194 CA 0.0064 -0.0013 -0.0021 3160 ALA 194 C 0.0060 -0.0016 -0.0030 3161 ALA 194 O 0.0046 -0.0010 -0.0029 3162 ALA 194 CB 0.0072 -0.0005 -0.0002 3163 LYS 195 N 0.0072 -0.0026 -0.0038 3164 LYS 195 CA 0.0070 -0.0030 -0.0047 3165 LYS 195 C 0.0080 -0.0027 -0.0035 3166 LYS 195 O 0.0095 -0.0027 -0.0026 3167 LYS 195 CB 0.0078 -0.0042 -0.0063 3168 LYS 195 CG 0.0074 -0.0047 -0.0074 3169 LYS 195 CD 0.0060 -0.0051 -0.0090 3170 LYS 195 CE 0.0067 -0.0059 -0.0099 3171 LYS 195 NZ 0.0053 -0.0062 -0.0114 3172 VAL 196 N 0.0087 -0.0025 -0.0035 3173 VAL 196 CA 0.0096 -0.0013 -0.0020 3174 VAL 196 C 0.0094 -0.0021 -0.0029 3175 VAL 196 O 0.0072 -0.0024 -0.0037 3176 VAL 196 CB 0.0079 0.0007 -0.0002 3177 VAL 196 CG1 0.0086 0.0019 0.0013 3178 VAL 196 CG2 0.0083 0.0015 0.0008 3179 ASP 197 N 0.0116 -0.0025 -0.0029 3180 ASP 197 CA 0.0116 -0.0032 -0.0037 3181 ASP 197 C 0.0105 -0.0017 -0.0022 3182 ASP 197 O 0.0117 -0.0004 -0.0006 3183 ASP 197 CB 0.0145 -0.0039 -0.0038 3184 ASP 197 CG 0.0148 -0.0046 -0.0045 3185 ASP 197 OD1 0.0128 -0.0048 -0.0051 3186 ASP 197 OD2 0.0171 -0.0050 -0.0045 3187 GLY 198 N 0.0080 -0.0017 -0.0028 3188 GLY 198 CA 0.0067 -0.0003 -0.0015 3189 GLY 198 C 0.0070 -0.0006 -0.0017 3190 GLY 198 O 0.0054 0.0002 -0.0013 3191 THR 199 N 0.0087 -0.0019 -0.0025 3192 THR 199 CA 0.0091 -0.0020 -0.0026 3193 THR 199 C 0.0112 -0.0002 -0.0008 3194 THR 199 O 0.0112 0.0006 0.0000 3195 THR 199 CB 0.0104 -0.0041 -0.0047 3196 THR 199 OG1 0.0132 -0.0044 -0.0049 3197 THR 199 CG2 0.0084 -0.0058 -0.0065 3198 LYS 200 N 0.0128 0.0005 -0.0000 3199 LYS 200 CA 0.0149 0.0021 0.0018 3200 LYS 200 C 0.0134 0.0042 0.0038 3201 LYS 200 O 0.0107 0.0044 0.0039 3202 LYS 200 CB 0.0166 0.0025 0.0022 3203 LYS 200 CG 0.0185 0.0007 0.0004 3204 LYS 200 CD 0.0200 0.0011 0.0010 3205 LYS 200 CE 0.0218 -0.0007 -0.0008 3206 LYS 200 NZ 0.0236 -0.0002 -0.0002 3207 PRO 201 N 0.0151 0.0055 0.0052 3208 PRO 201 CA 0.0139 0.0076 0.0072 3209 PRO 201 C 0.0130 0.0087 0.0083 3210 PRO 201 O 0.0145 0.0084 0.0081 3211 PRO 201 CB 0.0165 0.0086 0.0084 3212 PRO 201 CG 0.0192 0.0074 0.0072 3213 PRO 201 CD 0.0181 0.0052 0.0050 3214 VAL 202 N 0.0120 0.0092 0.0084 3215 VAL 202 CA 0.0107 0.0102 0.0094 3216 VAL 202 C 0.0125 0.0112 0.0106 3217 VAL 202 O 0.0122 0.0112 0.0106 3218 VAL 202 CB 0.0085 0.0115 0.0107 3219 VAL 202 CG1 0.0073 0.0124 0.0116 3220 VAL 202 CG2 0.0065 0.0105 0.0094 3221 ALA 203 N 0.0145 0.0119 0.0116 3222 ALA 203 CA 0.0164 0.0129 0.0128 3223 ALA 203 C 0.0180 0.0117 0.0115 3224 ALA 203 O 0.0190 0.0122 0.0122 3225 ALA 203 CB 0.0181 0.0139 0.0140 3226 GLU 204 N 0.0184 0.0100 0.0097 3227 GLU 204 CA 0.0200 0.0088 0.0083 3228 GLU 204 C 0.0184 0.0079 0.0073 3229 GLU 204 O 0.0195 0.0075 0.0069 3230 GLU 204 CB 0.0213 0.0074 0.0068 3231 GLU 204 CG 0.0240 0.0067 0.0063 3232 GLU 204 CD 0.0252 0.0052 0.0046 3233 GLU 204 OE1 0.0249 0.0050 0.0044 3234 GLU 204 OE2 0.0265 0.0041 0.0034 3235 VAL 205 N 0.0154 0.0074 0.0070 3236 VAL 205 CA 0.0138 0.0068 0.0062 3237 VAL 205 C 0.0137 0.0080 0.0076 3238 VAL 205 O 0.0140 0.0077 0.0072 3239 VAL 205 CB 0.0113 0.0067 0.0059 3240 VAL 205 CG1 0.0097 0.0061 0.0050 3241 VAL 205 CG2 0.0113 0.0057 0.0047 3242 ARG 206 N 0.0133 0.0095 0.0092 3243 ARG 206 CA 0.0132 0.0108 0.0107 3244 ARG 206 C 0.0154 0.0108 0.0109 3245 ARG 206 O 0.0153 0.0109 0.0110 3246 ARG 206 CB 0.0128 0.0123 0.0124 3247 ARG 206 CG 0.0123 0.0137 0.0140 3248 ARG 206 CD 0.0117 0.0150 0.0154 3249 ARG 206 NE 0.0117 0.0166 0.0172 3250 ARG 206 CZ 0.0135 0.0172 0.0181 3251 ARG 206 NH1 0.0156 0.0164 0.0173 3252 ARG 206 NH2 0.0133 0.0187 0.0198 3253 ALA 207 N 0.0175 0.0106 0.0108 3254 ALA 207 CA 0.0197 0.0105 0.0109 3255 ALA 207 C 0.0197 0.0091 0.0093 3256 ALA 207 O 0.0206 0.0092 0.0094 3257 ALA 207 CB 0.0218 0.0104 0.0109 3258 ASP 208 N 0.0185 0.0079 0.0077 3259 ASP 208 CA 0.0183 0.0066 0.0060 3260 ASP 208 C 0.0166 0.0069 0.0062 3261 ASP 208 O 0.0171 0.0065 0.0057 3262 ASP 208 CB 0.0175 0.0054 0.0043 3263 ASP 208 CG 0.0195 0.0048 0.0035 3264 ASP 208 OD1 0.0216 0.0049 0.0037 3265 ASP 208 OD2 0.0189 0.0043 0.0027 3266 LEU 209 N 0.0146 0.0076 0.0071 3267 LEU 209 CA 0.0129 0.0078 0.0074 3268 LEU 209 C 0.0138 0.0088 0.0088 3269 LEU 209 O 0.0132 0.0086 0.0086 3270 LEU 209 CB 0.0108 0.0085 0.0083 3271 LEU 209 CG 0.0098 0.0076 0.0070 3272 LEU 209 CD1 0.0077 0.0084 0.0080 3273 LEU 209 CD2 0.0092 0.0062 0.0051 3274 GLU 210 N 0.0152 0.0098 0.0102 3275 GLU 210 CA 0.0161 0.0107 0.0115 3276 GLU 210 C 0.0177 0.0099 0.0105 3277 GLU 210 O 0.0177 0.0102 0.0108 3278 GLU 210 CB 0.0174 0.0119 0.0132 3279 GLU 210 CG 0.0158 0.0129 0.0145 3280 GLU 210 CD 0.0170 0.0142 0.0164 3281 GLU 210 OE1 0.0168 0.0152 0.0178 3282 GLU 210 OE2 0.0180 0.0143 0.0165 3283 LYS 211 N 0.0186 0.0089 0.0096 3284 LYS 211 CA 0.0202 0.0082 0.0084 3285 LYS 211 C 0.0187 0.0072 0.0069 3286 LYS 211 O 0.0192 0.0070 0.0065 3287 LYS 211 CB 0.0219 0.0074 0.0071 3288 LYS 211 CG 0.0238 0.0082 0.0084 3289 LYS 211 CD 0.0246 0.0074 0.0072 3290 LYS 211 CE 0.0252 0.0059 0.0049 3291 LYS 211 NZ 0.0254 0.0051 0.0036 3292 ILE 212 N 0.0168 0.0067 0.0061 3293 ILE 212 CA 0.0152 0.0057 0.0046 3294 ILE 212 C 0.0136 0.0063 0.0055 3295 ILE 212 O 0.0134 0.0058 0.0047 3296 ILE 212 CB 0.0136 0.0050 0.0035 3297 ILE 212 CG1 0.0151 0.0041 0.0021 3298 ILE 212 CG2 0.0116 0.0042 0.0023 3299 ILE 212 CD1 0.0140 0.0038 0.0016 3300 LEU 213 N 0.0126 0.0075 0.0073 3301 LEU 213 CA 0.0109 0.0081 0.0083 3302 LEU 213 C 0.0119 0.0091 0.0099 3303 LEU 213 O 0.0108 0.0095 0.0104 3304 LEU 213 CB 0.0090 0.0088 0.0094 3305 LEU 213 CG 0.0076 0.0079 0.0079 3306 LEU 213 CD1 0.0058 0.0086 0.0091 3307 LEU 213 CD2 0.0062 0.0069 0.0065 3308 GLY 214 N 0.0141 0.0095 0.0102 3309 GLY 214 CA 0.0152 0.0104 0.0117 3310 GLY 214 C 0.0152 0.0115 0.0134 3311 GLY 214 O 0.0167 0.0122 0.0146 3312 GLY 214 OXT 0.0138 0.0117 0.0134