1 MET 1 N 0.0019 -0.0049 -0.0009 2 MET 1 CA 0.0021 -0.0044 -0.0005 3 MET 1 C 0.0018 -0.0045 0.0000 4 MET 1 O 0.0015 -0.0048 0.0002 5 MET 1 CB 0.0024 -0.0041 -0.0005 6 MET 1 CG 0.0026 -0.0036 -0.0002 7 MET 1 SD 0.0028 -0.0033 -0.0002 8 MET 1 CE 0.0033 -0.0029 -0.0006 9 ARG 2 N 0.0018 -0.0044 0.0003 10 ARG 2 CA 0.0015 -0.0045 0.0009 11 ARG 2 C 0.0017 -0.0040 0.0013 12 ARG 2 O 0.0019 -0.0038 0.0012 13 ARG 2 CB 0.0012 -0.0048 0.0009 14 ARG 2 CG 0.0010 -0.0053 0.0006 15 ARG 2 CD 0.0008 -0.0056 0.0005 16 ARG 2 NE 0.0005 -0.0061 0.0003 17 ARG 2 CZ 0.0002 -0.0064 0.0004 18 ARG 2 NH1 0.0002 -0.0063 0.0006 19 ARG 2 NH2 -0.0000 -0.0069 0.0002 20 ILE 3 N 0.0016 -0.0039 0.0016 21 ILE 3 CA 0.0017 -0.0035 0.0020 22 ILE 3 C 0.0015 -0.0035 0.0026 23 ILE 3 O 0.0012 -0.0038 0.0027 24 ILE 3 CB 0.0020 -0.0032 0.0019 25 ILE 3 CG1 0.0023 -0.0031 0.0014 26 ILE 3 CG2 0.0022 -0.0027 0.0023 27 ILE 3 CD1 0.0025 -0.0029 0.0011 28 ILE 4 N 0.0006 -0.0052 0.0094 29 ILE 4 CA 0.0008 -0.0051 0.0087 30 ILE 4 C 0.0003 -0.0056 0.0085 31 ILE 4 O -0.0001 -0.0059 0.0086 32 ILE 4 CB 0.0010 -0.0050 0.0083 33 ILE 4 CG1 0.0015 -0.0045 0.0085 34 ILE 4 CG2 0.0010 -0.0050 0.0076 35 ILE 4 CD1 0.0017 -0.0043 0.0082 36 LEU 5 N 0.0002 -0.0057 0.0082 37 LEU 5 CA -0.0002 -0.0061 0.0079 38 LEU 5 C -0.0002 -0.0061 0.0072 39 LEU 5 O 0.0001 -0.0059 0.0069 40 LEU 5 CB -0.0003 -0.0062 0.0082 41 LEU 5 CG -0.0008 -0.0066 0.0081 42 LEU 5 CD1 -0.0012 -0.0069 0.0084 43 LEU 5 CD2 -0.0008 -0.0066 0.0085 44 LEU 6 N -0.0005 -0.0064 0.0069 45 LEU 6 CA -0.0005 -0.0065 0.0061 46 LEU 6 C -0.0009 -0.0069 0.0059 47 LEU 6 O -0.0013 -0.0072 0.0062 48 LEU 6 CB -0.0005 -0.0065 0.0059 49 LEU 6 CG -0.0001 -0.0061 0.0061 50 LEU 6 CD1 -0.0002 -0.0063 0.0058 51 LEU 6 CD2 0.0004 -0.0057 0.0059 52 GLY 7 N -0.0044 -0.0091 0.0107 53 GLY 7 CA -0.0055 -0.0083 0.0112 54 GLY 7 C -0.0068 -0.0079 0.0120 55 GLY 7 O -0.0071 -0.0088 0.0124 56 ALA 8 N -0.0075 -0.0065 0.0121 57 ALA 8 CA -0.0088 -0.0059 0.0128 58 ALA 8 C -0.0098 -0.0069 0.0138 59 ALA 8 O -0.0097 -0.0078 0.0140 60 ALA 8 CB -0.0093 -0.0041 0.0128 61 PRO 9 N -0.0108 -0.0070 0.0145 62 PRO 9 CA -0.0119 -0.0080 0.0155 63 PRO 9 C -0.0128 -0.0073 0.0159 64 PRO 9 O -0.0133 -0.0058 0.0159 65 PRO 9 CB -0.0127 -0.0079 0.0160 66 PRO 9 CG -0.0123 -0.0064 0.0153 67 PRO 9 CD -0.0108 -0.0065 0.0144 68 GLY 10 N -0.0094 -0.0060 0.0137 69 GLY 10 CA -0.0086 -0.0066 0.0133 70 GLY 10 C -0.0069 -0.0071 0.0133 71 GLY 10 O -0.0061 -0.0078 0.0127 72 ALA 11 N -0.0062 -0.0068 0.0139 73 ALA 11 CA -0.0046 -0.0072 0.0139 74 ALA 11 C -0.0042 -0.0083 0.0127 75 ALA 11 O -0.0028 -0.0088 0.0126 76 ALA 11 CB -0.0041 -0.0064 0.0150 77 GLY 12 N -0.0054 -0.0087 0.0118 78 GLY 12 CA -0.0051 -0.0098 0.0107 79 GLY 12 C -0.0043 -0.0100 0.0107 80 GLY 12 O -0.0032 -0.0107 0.0102 81 LYS 13 N 0.0017 -0.0043 0.0099 82 LYS 13 CA -0.0009 -0.0040 0.0087 83 LYS 13 C -0.0014 -0.0020 0.0074 84 LYS 13 O -0.0030 -0.0010 0.0062 85 LYS 13 CB -0.0027 -0.0062 0.0093 86 LYS 13 CG -0.0024 -0.0072 0.0100 87 LYS 13 CD -0.0044 -0.0092 0.0103 88 LYS 13 CE -0.0046 -0.0096 0.0105 89 LYS 13 NZ -0.0028 -0.0110 0.0120 90 GLY 14 N 0.0001 -0.0016 0.0077 91 GLY 14 CA -0.0002 0.0002 0.0066 92 GLY 14 C 0.0002 0.0026 0.0054 93 GLY 14 O -0.0008 0.0041 0.0041 94 THR 15 N 0.0016 0.0028 0.0058 95 THR 15 CA 0.0021 0.0050 0.0047 96 THR 15 C -0.0002 0.0059 0.0033 97 THR 15 O -0.0002 0.0080 0.0021 98 THR 15 CB 0.0038 0.0048 0.0055 99 THR 15 OG1 0.0023 0.0033 0.0058 100 THR 15 CG2 0.0061 0.0038 0.0069 101 GLN 16 N 0.0054 0.0044 0.0001 102 GLN 16 CA 0.0038 0.0049 -0.0017 103 GLN 16 C 0.0033 0.0037 -0.0023 104 GLN 16 O 0.0020 0.0041 -0.0038 105 GLN 16 CB 0.0026 0.0042 -0.0031 106 GLN 16 CG 0.0013 0.0062 -0.0045 107 GLN 16 CD 0.0021 0.0086 -0.0035 108 GLN 16 OE1 0.0028 0.0087 -0.0027 109 GLN 16 NE2 0.0018 0.0107 -0.0038 110 ALA 17 N 0.0045 0.0024 -0.0010 111 ALA 17 CA 0.0043 0.0011 -0.0013 112 ALA 17 C 0.0038 0.0028 -0.0018 113 ALA 17 O 0.0026 0.0023 -0.0032 114 ALA 17 CB 0.0057 -0.0006 0.0003 115 GLN 18 N 0.0048 0.0047 -0.0006 116 GLN 18 CA 0.0044 0.0064 -0.0009 117 GLN 18 C 0.0027 0.0075 -0.0029 118 GLN 18 O 0.0018 0.0078 -0.0038 119 GLN 18 CB 0.0056 0.0086 0.0005 120 GLN 18 CG 0.0070 0.0083 0.0021 121 GLN 18 CD 0.0078 0.0108 0.0032 122 GLN 18 OE1 0.0070 0.0128 0.0023 123 GLN 18 NE2 0.0095 0.0107 0.0051 124 PHE 19 N 0.0077 0.0076 -0.0060 125 PHE 19 CA 0.0070 0.0083 -0.0075 126 PHE 19 C 0.0058 0.0071 -0.0085 127 PHE 19 O 0.0051 0.0074 -0.0097 128 PHE 19 CB 0.0074 0.0090 -0.0073 129 PHE 19 CG 0.0065 0.0093 -0.0087 130 PHE 19 CD1 0.0061 0.0105 -0.0099 131 PHE 19 CD2 0.0061 0.0083 -0.0088 132 PHE 19 CE1 0.0053 0.0107 -0.0112 133 PHE 19 CE2 0.0052 0.0084 -0.0101 134 PHE 19 CZ 0.0048 0.0096 -0.0113 135 ILE 20 N 0.0056 0.0056 -0.0079 136 ILE 20 CA 0.0046 0.0042 -0.0087 137 ILE 20 C 0.0041 0.0038 -0.0092 138 ILE 20 O 0.0031 0.0038 -0.0105 139 ILE 20 CB 0.0046 0.0027 -0.0078 140 ILE 20 CG1 0.0050 0.0032 -0.0076 141 ILE 20 CG2 0.0035 0.0012 -0.0086 142 ILE 20 CD1 0.0053 0.0019 -0.0065 143 MET 21 N 0.0047 0.0036 -0.0082 144 MET 21 CA 0.0042 0.0032 -0.0087 145 MET 21 C 0.0039 0.0046 -0.0099 146 MET 21 O 0.0030 0.0044 -0.0111 147 MET 21 CB 0.0050 0.0029 -0.0074 148 MET 21 CG 0.0053 0.0014 -0.0062 149 MET 21 SD 0.0065 0.0015 -0.0044 150 MET 21 CE 0.0061 0.0006 -0.0046 151 GLU 22 N 0.0059 0.0061 -0.0128 152 GLU 22 CA 0.0062 0.0070 -0.0142 153 GLU 22 C 0.0059 0.0072 -0.0150 154 GLU 22 O 0.0056 0.0076 -0.0162 155 GLU 22 CB 0.0076 0.0079 -0.0140 156 GLU 22 CG 0.0080 0.0088 -0.0153 157 GLU 22 CD 0.0088 0.0094 -0.0153 158 GLU 22 OE1 0.0094 0.0093 -0.0142 159 GLU 22 OE2 0.0088 0.0101 -0.0165 160 LYS 23 N 0.0059 0.0068 -0.0143 161 LYS 23 CA 0.0057 0.0070 -0.0150 162 LYS 23 C 0.0043 0.0062 -0.0155 163 LYS 23 O 0.0038 0.0065 -0.0166 164 LYS 23 CB 0.0064 0.0071 -0.0141 165 LYS 23 CG 0.0067 0.0077 -0.0149 166 LYS 23 CD 0.0076 0.0088 -0.0158 167 LYS 23 CE 0.0079 0.0094 -0.0167 168 LYS 23 NZ 0.0068 0.0091 -0.0177 169 TYR 24 N 0.0036 0.0053 -0.0147 170 TYR 24 CA 0.0022 0.0045 -0.0150 171 TYR 24 C 0.0014 0.0041 -0.0154 172 TYR 24 O 0.0003 0.0036 -0.0159 173 TYR 24 CB 0.0019 0.0037 -0.0138 174 TYR 24 CG 0.0028 0.0041 -0.0134 175 TYR 24 CD1 0.0025 0.0043 -0.0141 176 TYR 24 CD2 0.0039 0.0045 -0.0124 177 TYR 24 CE1 0.0034 0.0048 -0.0139 178 TYR 24 CE2 0.0048 0.0050 -0.0122 179 TYR 24 CZ 0.0046 0.0052 -0.0130 180 TYR 24 OH 0.0055 0.0058 -0.0128 181 GLY 25 N 0.0062 0.0037 -0.0175 182 GLY 25 CA 0.0052 0.0031 -0.0180 183 GLY 25 C 0.0040 0.0015 -0.0167 184 GLY 25 O 0.0025 0.0007 -0.0175 185 ILE 26 N 0.0047 0.0011 -0.0149 186 ILE 26 CA 0.0038 -0.0003 -0.0134 187 ILE 26 C 0.0048 -0.0004 -0.0119 188 ILE 26 O 0.0063 0.0007 -0.0116 189 ILE 26 CB 0.0037 -0.0009 -0.0125 190 ILE 26 CG1 0.0054 -0.0002 -0.0113 191 ILE 26 CG2 0.0030 -0.0007 -0.0140 192 ILE 26 CD1 0.0054 -0.0004 -0.0108 193 PRO 27 N 0.0039 -0.0016 -0.0109 194 PRO 27 CA 0.0047 -0.0018 -0.0094 195 PRO 27 C 0.0052 -0.0024 -0.0074 196 PRO 27 O 0.0046 -0.0030 -0.0071 197 PRO 27 CB 0.0033 -0.0028 -0.0095 198 PRO 27 CG 0.0018 -0.0038 -0.0100 199 PRO 27 CD 0.0020 -0.0028 -0.0115 200 GLN 28 N 0.0033 -0.0016 -0.0014 201 GLN 28 CA 0.0033 -0.0011 0.0001 202 GLN 28 C 0.0019 -0.0017 0.0009 203 GLN 28 O 0.0011 -0.0022 0.0008 204 GLN 28 CB 0.0040 -0.0005 0.0007 205 GLN 28 CG 0.0040 0.0000 0.0023 206 GLN 28 CD 0.0045 0.0005 0.0028 207 GLN 28 OE1 0.0053 0.0008 0.0021 208 GLN 28 NE2 0.0040 0.0007 0.0042 209 ILE 29 N 0.0016 -0.0016 0.0017 210 ILE 29 CA 0.0003 -0.0022 0.0025 211 ILE 29 C 0.0004 -0.0016 0.0041 212 ILE 29 O 0.0013 -0.0009 0.0045 213 ILE 29 CB -0.0003 -0.0026 0.0023 214 ILE 29 CG1 -0.0003 -0.0031 0.0007 215 ILE 29 CG2 -0.0016 -0.0031 0.0032 216 ILE 29 CD1 -0.0005 -0.0033 0.0004 217 SER 30 N -0.0004 -0.0018 0.0049 218 SER 30 CA -0.0004 -0.0013 0.0065 219 SER 30 C -0.0018 -0.0020 0.0071 220 SER 30 O -0.0027 -0.0027 0.0064 221 SER 30 CB 0.0002 -0.0008 0.0068 222 SER 30 OG -0.0008 -0.0012 0.0073 223 THR 31 N -0.0011 0.0009 0.0060 224 THR 31 CA -0.0014 0.0009 0.0061 225 THR 31 C -0.0018 0.0007 0.0062 226 THR 31 O -0.0021 0.0004 0.0062 227 THR 31 CB -0.0013 0.0013 0.0062 228 THR 31 OG1 -0.0015 0.0016 0.0064 229 THR 31 CG2 -0.0009 0.0015 0.0061 230 GLY 32 N -0.0020 0.0007 0.0062 231 GLY 32 CA -0.0024 0.0006 0.0063 232 GLY 32 C -0.0025 0.0001 0.0061 233 GLY 32 O -0.0028 -0.0002 0.0062 234 ASP 33 N -0.0021 -0.0001 0.0059 235 ASP 33 CA -0.0021 -0.0006 0.0057 236 ASP 33 C -0.0021 -0.0008 0.0057 237 ASP 33 O -0.0024 -0.0011 0.0056 238 ASP 33 CB -0.0017 -0.0007 0.0056 239 ASP 33 CG -0.0018 -0.0006 0.0056 240 ASP 33 OD1 -0.0022 -0.0006 0.0057 241 ASP 33 OD2 -0.0014 -0.0006 0.0055 242 MET 34 N -0.0046 -0.0001 0.0056 243 MET 34 CA -0.0054 0.0001 0.0057 244 MET 34 C -0.0055 0.0001 0.0057 245 MET 34 O -0.0059 0.0004 0.0055 246 MET 34 CB -0.0057 -0.0003 0.0062 247 MET 34 CG -0.0065 -0.0001 0.0063 248 MET 34 SD -0.0067 -0.0006 0.0068 249 MET 34 CE -0.0065 -0.0011 0.0072 250 LEU 35 N -0.0052 -0.0003 0.0060 251 LEU 35 CA -0.0052 -0.0004 0.0061 252 LEU 35 C -0.0050 0.0001 0.0056 253 LEU 35 O -0.0054 0.0004 0.0054 254 LEU 35 CB -0.0047 -0.0008 0.0064 255 LEU 35 CG -0.0050 -0.0013 0.0069 256 LEU 35 CD1 -0.0045 -0.0018 0.0072 257 LEU 35 CD2 -0.0056 -0.0012 0.0070 258 ARG 36 N -0.0044 0.0002 0.0053 259 ARG 36 CA -0.0041 0.0006 0.0048 260 ARG 36 C -0.0045 0.0011 0.0044 261 ARG 36 O -0.0045 0.0015 0.0040 262 ARG 36 CB -0.0034 0.0005 0.0046 263 ARG 36 CG -0.0029 0.0000 0.0049 264 ARG 36 CD -0.0021 0.0000 0.0047 265 ARG 36 NE -0.0019 -0.0001 0.0048 266 ARG 36 CZ -0.0017 -0.0006 0.0052 267 ARG 36 NH1 -0.0017 -0.0010 0.0055 268 ARG 36 NH2 -0.0015 -0.0007 0.0052 269 ALA 37 N -0.0062 0.0014 0.0096 270 ALA 37 CA -0.0061 0.0024 0.0113 271 ALA 37 C -0.0049 0.0032 0.0114 272 ALA 37 O -0.0044 0.0042 0.0126 273 ALA 37 CB -0.0078 0.0020 0.0124 274 ALA 38 N -0.0045 0.0027 0.0101 275 ALA 38 CA -0.0034 0.0033 0.0101 276 ALA 38 C -0.0016 0.0041 0.0096 277 ALA 38 O -0.0006 0.0051 0.0103 278 ALA 38 CB -0.0037 0.0024 0.0089 279 VAL 39 N -0.0013 0.0036 0.0084 280 VAL 39 CA 0.0003 0.0041 0.0078 281 VAL 39 C 0.0008 0.0053 0.0092 282 VAL 39 O 0.0020 0.0062 0.0097 283 VAL 39 CB 0.0002 0.0033 0.0065 284 VAL 39 CG1 0.0016 0.0040 0.0062 285 VAL 39 CG2 0.0001 0.0024 0.0049 286 LYS 40 N 0.0024 0.0076 0.0140 287 LYS 40 CA 0.0029 0.0099 0.0164 288 LYS 40 C 0.0030 0.0110 0.0175 289 LYS 40 O 0.0054 0.0121 0.0183 290 LYS 40 CB 0.0004 0.0107 0.0176 291 LYS 40 CG -0.0000 0.0131 0.0202 292 LYS 40 CD -0.0031 0.0136 0.0211 293 LYS 40 CE -0.0060 0.0126 0.0204 294 LYS 40 NZ -0.0090 0.0128 0.0211 295 SER 41 N 0.0004 0.0109 0.0177 296 SER 41 CA 0.0002 0.0119 0.0188 297 SER 41 C 0.0017 0.0105 0.0171 298 SER 41 O 0.0001 0.0093 0.0161 299 SER 41 CB -0.0031 0.0121 0.0195 300 SER 41 OG -0.0041 0.0140 0.0216 301 GLY 42 N 0.0048 0.0106 0.0168 302 GLY 42 CA 0.0067 0.0094 0.0153 303 GLY 42 C 0.0056 0.0092 0.0153 304 GLY 42 O 0.0068 0.0104 0.0163 305 SER 43 N 0.0025 0.0055 0.0113 306 SER 43 CA 0.0020 0.0048 0.0096 307 SER 43 C 0.0028 0.0032 0.0082 308 SER 43 O 0.0033 0.0030 0.0085 309 SER 43 CB -0.0001 0.0059 0.0086 310 SER 43 OG -0.0010 0.0067 0.0087 311 GLU 44 N 0.0030 0.0021 0.0066 312 GLU 44 CA 0.0037 0.0006 0.0052 313 GLU 44 C 0.0029 0.0008 0.0045 314 GLU 44 O 0.0039 0.0001 0.0047 315 GLU 44 CB 0.0035 -0.0004 0.0034 316 GLU 44 CG 0.0039 -0.0019 0.0016 317 GLU 44 CD 0.0059 -0.0033 0.0020 318 GLU 44 OE1 0.0071 -0.0032 0.0037 319 GLU 44 OE2 0.0063 -0.0044 0.0007 320 LEU 45 N 0.0011 0.0017 0.0036 321 LEU 45 CA 0.0002 0.0020 0.0028 322 LEU 45 C 0.0004 0.0029 0.0045 323 LEU 45 O 0.0007 0.0025 0.0042 324 LEU 45 CB -0.0019 0.0030 0.0017 325 LEU 45 CG -0.0024 0.0020 -0.0005 326 LEU 45 CD1 -0.0021 0.0009 -0.0019 327 LEU 45 CD2 -0.0012 0.0011 -0.0004 328 GLY 46 N 0.0013 0.0044 0.0085 329 GLY 46 CA 0.0011 0.0047 0.0092 330 GLY 46 C 0.0023 0.0044 0.0091 331 GLY 46 O 0.0021 0.0044 0.0090 332 LYS 47 N 0.0036 0.0041 0.0091 333 LYS 47 CA 0.0048 0.0038 0.0090 334 LYS 47 C 0.0048 0.0033 0.0075 335 LYS 47 O 0.0051 0.0031 0.0073 336 LYS 47 CB 0.0061 0.0037 0.0092 337 LYS 47 CG 0.0061 0.0041 0.0105 338 LYS 47 CD 0.0068 0.0044 0.0118 339 LYS 47 CE 0.0060 0.0048 0.0122 340 LYS 47 NZ 0.0068 0.0050 0.0133 341 GLN 48 N 0.0044 0.0030 0.0065 342 GLN 48 CA 0.0043 0.0025 0.0051 343 GLN 48 C 0.0033 0.0026 0.0049 344 GLN 48 O 0.0036 0.0023 0.0042 345 GLN 48 CB 0.0037 0.0023 0.0043 346 GLN 48 CG 0.0048 0.0020 0.0040 347 GLN 48 CD 0.0042 0.0019 0.0033 348 GLN 48 OE1 0.0039 0.0015 0.0021 349 GLN 48 NE2 0.0041 0.0022 0.0041 350 ALA 49 N -0.0010 0.0058 0.0046 351 ALA 49 CA -0.0015 0.0050 0.0042 352 ALA 49 C -0.0017 0.0049 0.0034 353 ALA 49 O -0.0021 0.0044 0.0028 354 ALA 49 CB -0.0016 0.0042 0.0049 355 LYS 50 N -0.0016 0.0051 0.0035 356 LYS 50 CA -0.0018 0.0050 0.0027 357 LYS 50 C -0.0018 0.0056 0.0018 358 LYS 50 O -0.0022 0.0052 0.0011 359 LYS 50 CB -0.0017 0.0053 0.0030 360 LYS 50 CG -0.0019 0.0053 0.0023 361 LYS 50 CD -0.0017 0.0055 0.0026 362 LYS 50 CE -0.0018 0.0057 0.0018 363 LYS 50 NZ -0.0015 0.0067 0.0014 364 ASP 51 N -0.0015 0.0064 0.0019 365 ASP 51 CA -0.0014 0.0070 0.0011 366 ASP 51 C -0.0017 0.0066 0.0006 367 ASP 51 O -0.0019 0.0066 -0.0002 368 ASP 51 CB -0.0010 0.0079 0.0014 369 ASP 51 CG -0.0007 0.0084 0.0015 370 ASP 51 OD1 -0.0008 0.0086 0.0009 371 ASP 51 OD2 -0.0004 0.0086 0.0023 372 ILE 52 N -0.0020 0.0074 0.0000 373 ILE 52 CA -0.0024 0.0068 -0.0006 374 ILE 52 C -0.0030 0.0060 -0.0011 375 ILE 52 O -0.0031 0.0058 -0.0021 376 ILE 52 CB -0.0027 0.0064 0.0002 377 ILE 52 CG1 -0.0021 0.0071 0.0004 378 ILE 52 CG2 -0.0033 0.0055 -0.0003 379 ILE 52 CD1 -0.0023 0.0069 0.0012 380 MET 53 N -0.0033 0.0055 -0.0005 381 MET 53 CA -0.0039 0.0047 -0.0009 382 MET 53 C -0.0037 0.0051 -0.0018 383 MET 53 O -0.0040 0.0046 -0.0027 384 MET 53 CB -0.0042 0.0044 0.0000 385 MET 53 CG -0.0046 0.0038 0.0009 386 MET 53 SD -0.0048 0.0035 0.0018 387 MET 53 CE -0.0053 0.0028 0.0008 388 ASP 54 N -0.0031 0.0058 -0.0016 389 ASP 54 CA -0.0028 0.0062 -0.0023 390 ASP 54 C -0.0026 0.0065 -0.0035 391 ASP 54 O -0.0026 0.0065 -0.0043 392 ASP 54 CB -0.0022 0.0071 -0.0018 393 ASP 54 CG -0.0024 0.0068 -0.0009 394 ASP 54 OD1 -0.0030 0.0060 -0.0005 395 ASP 54 OD2 -0.0020 0.0074 -0.0006 396 ALA 55 N -0.0061 0.0102 -0.0048 397 ALA 55 CA -0.0058 0.0089 -0.0039 398 ALA 55 C -0.0052 0.0090 -0.0034 399 ALA 55 O -0.0050 0.0080 -0.0027 400 ALA 55 CB -0.0069 0.0079 -0.0042 401 GLY 56 N -0.0049 0.0101 -0.0039 402 GLY 56 CA -0.0043 0.0103 -0.0035 403 GLY 56 C -0.0050 0.0095 -0.0036 404 GLY 56 O -0.0046 0.0091 -0.0030 405 LYS 57 N -0.0062 0.0092 -0.0043 406 LYS 57 CA -0.0070 0.0084 -0.0046 407 LYS 57 C -0.0073 0.0094 -0.0054 408 LYS 57 O -0.0073 0.0105 -0.0060 409 LYS 57 CB -0.0080 0.0075 -0.0049 410 LYS 57 CG -0.0078 0.0063 -0.0041 411 LYS 57 CD -0.0089 0.0055 -0.0045 412 LYS 57 CE -0.0092 0.0062 -0.0052 413 LYS 57 NZ -0.0103 0.0055 -0.0056 414 LEU 58 N -0.0065 0.0108 0.0004 415 LEU 58 CA -0.0058 0.0109 0.0001 416 LEU 58 C -0.0055 0.0106 -0.0003 417 LEU 58 O -0.0057 0.0106 -0.0003 418 LEU 58 CB -0.0056 0.0116 0.0004 419 LEU 58 CG -0.0050 0.0118 0.0002 420 LEU 58 CD1 -0.0050 0.0116 -0.0000 421 LEU 58 CD2 -0.0050 0.0125 0.0006 422 VAL 59 N -0.0051 0.0104 -0.0007 423 VAL 59 CA -0.0048 0.0101 -0.0011 424 VAL 59 C -0.0043 0.0105 -0.0011 425 VAL 59 O -0.0040 0.0110 -0.0011 426 VAL 59 CB -0.0045 0.0098 -0.0016 427 VAL 59 CG1 -0.0041 0.0095 -0.0020 428 VAL 59 CG2 -0.0049 0.0093 -0.0016 429 THR 60 N -0.0043 0.0104 -0.0012 430 THR 60 CA -0.0039 0.0108 -0.0012 431 THR 60 C -0.0033 0.0108 -0.0016 432 THR 60 O -0.0032 0.0103 -0.0020 433 THR 60 CB -0.0041 0.0107 -0.0011 434 THR 60 OG1 -0.0043 0.0101 -0.0014 435 THR 60 CG2 -0.0047 0.0109 -0.0006 436 ASP 61 N -0.0040 0.0118 -0.0024 437 ASP 61 CA -0.0027 0.0112 -0.0019 438 ASP 61 C -0.0014 0.0104 -0.0015 439 ASP 61 O -0.0008 0.0092 -0.0010 440 ASP 61 CB -0.0019 0.0125 -0.0022 441 ASP 61 CG -0.0030 0.0132 -0.0026 442 ASP 61 OD1 -0.0044 0.0125 -0.0026 443 ASP 61 OD2 -0.0025 0.0145 -0.0028 444 GLU 62 N -0.0010 0.0113 -0.0016 445 GLU 62 CA 0.0003 0.0108 -0.0013 446 GLU 62 C 0.0000 0.0091 -0.0009 447 GLU 62 O 0.0011 0.0082 -0.0004 448 GLU 62 CB 0.0005 0.0121 -0.0016 449 GLU 62 CG 0.0010 0.0138 -0.0020 450 GLU 62 CD -0.0004 0.0147 -0.0025 451 GLU 62 OE1 -0.0017 0.0147 -0.0027 452 GLU 62 OE2 -0.0001 0.0154 -0.0026 453 LEU 63 N -0.0015 0.0088 -0.0010 454 LEU 63 CA -0.0020 0.0072 -0.0007 455 LEU 63 C -0.0021 0.0060 -0.0004 456 LEU 63 O -0.0017 0.0046 0.0001 457 LEU 63 CB -0.0036 0.0073 -0.0010 458 LEU 63 CG -0.0039 0.0061 -0.0008 459 LEU 63 CD1 -0.0053 0.0067 -0.0012 460 LEU 63 CD2 -0.0042 0.0044 -0.0004 461 VAL 64 N -0.0052 0.0054 0.0021 462 VAL 64 CA -0.0042 0.0045 0.0018 463 VAL 64 C -0.0024 0.0041 0.0016 464 VAL 64 O -0.0019 0.0028 0.0010 465 VAL 64 CB -0.0039 0.0054 0.0022 466 VAL 64 CG1 -0.0030 0.0043 0.0017 467 VAL 64 CG2 -0.0055 0.0060 0.0024 468 ILE 65 N -0.0016 0.0051 0.0022 469 ILE 65 CA 0.0001 0.0047 0.0021 470 ILE 65 C 0.0000 0.0035 0.0015 471 ILE 65 O 0.0012 0.0025 0.0011 472 ILE 65 CB 0.0011 0.0061 0.0029 473 ILE 65 CG1 0.0024 0.0066 0.0032 474 ILE 65 CG2 0.0022 0.0057 0.0027 475 ILE 65 CD1 0.0015 0.0072 0.0034 476 ALA 66 N -0.0014 0.0035 0.0014 477 ALA 66 CA -0.0018 0.0024 0.0009 478 ALA 66 C -0.0020 0.0008 0.0000 479 ALA 66 O -0.0014 -0.0003 -0.0005 480 ALA 66 CB -0.0033 0.0029 0.0010 481 LEU 67 N -0.0052 -0.0010 0.0032 482 LEU 67 CA -0.0054 -0.0015 0.0031 483 LEU 67 C -0.0047 -0.0013 0.0027 484 LEU 67 O -0.0046 -0.0018 0.0024 485 LEU 67 CB -0.0059 -0.0012 0.0036 486 LEU 67 CG -0.0067 -0.0013 0.0042 487 LEU 67 CD1 -0.0071 -0.0011 0.0046 488 LEU 67 CD2 -0.0070 -0.0021 0.0040 489 VAL 68 N -0.0042 -0.0006 0.0027 490 VAL 68 CA -0.0036 -0.0004 0.0023 491 VAL 68 C -0.0030 -0.0008 0.0017 492 VAL 68 O -0.0026 -0.0011 0.0013 493 VAL 68 CB -0.0032 0.0006 0.0024 494 VAL 68 CG1 -0.0025 0.0008 0.0020 495 VAL 68 CG2 -0.0037 0.0011 0.0030 496 LYS 69 N -0.0031 -0.0010 0.0017 497 LYS 69 CA -0.0026 -0.0014 0.0011 498 LYS 69 C -0.0028 -0.0023 0.0009 499 LYS 69 O -0.0024 -0.0027 0.0004 500 LYS 69 CB -0.0025 -0.0013 0.0011 501 LYS 69 CG -0.0019 -0.0014 0.0006 502 LYS 69 CD -0.0018 -0.0009 0.0007 503 LYS 69 CE -0.0024 -0.0013 0.0011 504 LYS 69 NZ -0.0024 -0.0008 0.0013 505 GLU 70 N -0.0083 -0.0037 0.0003 506 GLU 70 CA -0.0089 -0.0039 -0.0008 507 GLU 70 C -0.0080 -0.0043 -0.0016 508 GLU 70 O -0.0078 -0.0045 -0.0024 509 GLU 70 CB -0.0098 -0.0038 -0.0007 510 GLU 70 CG -0.0103 -0.0041 -0.0019 511 GLU 70 CD -0.0112 -0.0040 -0.0018 512 GLU 70 OE1 -0.0120 -0.0037 -0.0011 513 GLU 70 OE2 -0.0110 -0.0042 -0.0024 514 ARG 71 N -0.0074 -0.0043 -0.0014 515 ARG 71 CA -0.0064 -0.0046 -0.0021 516 ARG 71 C -0.0056 -0.0047 -0.0024 517 ARG 71 O -0.0054 -0.0050 -0.0034 518 ARG 71 CB -0.0058 -0.0045 -0.0016 519 ARG 71 CG -0.0048 -0.0048 -0.0024 520 ARG 71 CD -0.0053 -0.0050 -0.0034 521 ARG 71 NE -0.0044 -0.0053 -0.0042 522 ARG 71 CZ -0.0038 -0.0056 -0.0048 523 ARG 71 NH1 -0.0041 -0.0055 -0.0048 524 ARG 71 NH2 -0.0030 -0.0058 -0.0055 525 ILE 72 N -0.0050 -0.0045 -0.0016 526 ILE 72 CA -0.0041 -0.0047 -0.0018 527 ILE 72 C -0.0045 -0.0048 -0.0024 528 ILE 72 O -0.0039 -0.0049 -0.0025 529 ILE 72 CB -0.0033 -0.0045 -0.0008 530 ILE 72 CG1 -0.0040 -0.0042 0.0001 531 ILE 72 CG2 -0.0028 -0.0044 -0.0003 532 ILE 72 CD1 -0.0033 -0.0039 0.0011 533 ALA 73 N -0.0101 -0.0086 -0.0090 534 ALA 73 CA -0.0121 -0.0107 -0.0125 535 ALA 73 C -0.0122 -0.0114 -0.0159 536 ALA 73 O -0.0133 -0.0129 -0.0195 537 ALA 73 CB -0.0161 -0.0128 -0.0108 538 GLN 74 N -0.0111 -0.0104 -0.0148 539 GLN 74 CA -0.0108 -0.0109 -0.0177 540 GLN 74 C -0.0076 -0.0096 -0.0213 541 GLN 74 O -0.0050 -0.0078 -0.0205 542 GLN 74 CB -0.0103 -0.0101 -0.0154 543 GLN 74 CG -0.0136 -0.0115 -0.0122 544 GLN 74 CD -0.0133 -0.0108 -0.0098 545 GLN 74 OE1 -0.0156 -0.0116 -0.0066 546 GLN 74 NE2 -0.0105 -0.0093 -0.0112 547 GLU 75 N -0.0080 -0.0107 -0.0252 548 GLU 75 CA -0.0054 -0.0099 -0.0290 549 GLU 75 C -0.0014 -0.0073 -0.0289 550 GLU 75 O 0.0012 -0.0061 -0.0313 551 GLU 75 CB -0.0071 -0.0118 -0.0330 552 GLU 75 CG -0.0110 -0.0144 -0.0335 553 GLU 75 CD -0.0142 -0.0164 -0.0334 554 GLU 75 OE1 -0.0150 -0.0162 -0.0301 555 GLU 75 OE2 -0.0160 -0.0182 -0.0366 556 ASP 76 N -0.0093 -0.0060 -0.0269 557 ASP 76 CA -0.0026 -0.0031 -0.0265 558 ASP 76 C 0.0000 -0.0033 -0.0222 559 ASP 76 O 0.0054 -0.0008 -0.0224 560 ASP 76 CB 0.0004 -0.0024 -0.0243 561 ASP 76 CG -0.0001 -0.0049 -0.0174 562 ASP 76 OD1 -0.0040 -0.0076 -0.0145 563 ASP 76 OD2 0.0036 -0.0041 -0.0148 564 CYS 77 N -0.0039 -0.0062 -0.0187 565 CYS 77 CA -0.0021 -0.0067 -0.0146 566 CYS 77 C -0.0049 -0.0069 -0.0180 567 CYS 77 O -0.0059 -0.0083 -0.0150 568 CYS 77 CB -0.0046 -0.0100 -0.0082 569 CYS 77 SG -0.0017 -0.0102 -0.0035 570 ARG 78 N -0.0063 -0.0054 -0.0244 571 ARG 78 CA -0.0091 -0.0054 -0.0281 572 ARG 78 C -0.0045 -0.0033 -0.0283 573 ARG 78 O -0.0064 -0.0038 -0.0295 574 ARG 78 CB -0.0116 -0.0044 -0.0349 575 ARG 78 CG -0.0148 -0.0044 -0.0394 576 ARG 78 CD -0.0179 -0.0036 -0.0457 577 ARG 78 NE -0.0246 -0.0066 -0.0461 578 ARG 78 CZ -0.0275 -0.0089 -0.0429 579 ARG 78 NH1 -0.0243 -0.0087 -0.0392 580 ARG 78 NH2 -0.0337 -0.0115 -0.0436 581 ASN 79 N -0.0023 -0.0057 -0.0212 582 ASN 79 CA 0.0007 -0.0040 -0.0214 583 ASN 79 C 0.0018 -0.0034 -0.0178 584 ASN 79 O 0.0041 -0.0021 -0.0175 585 ASN 79 CB 0.0031 -0.0026 -0.0230 586 ASN 79 CG 0.0024 -0.0029 -0.0267 587 ASN 79 OD1 0.0025 -0.0028 -0.0291 588 ASN 79 ND2 0.0018 -0.0032 -0.0274 589 GLY 80 N 0.0002 -0.0044 -0.0151 590 GLY 80 CA 0.0010 -0.0040 -0.0115 591 GLY 80 C 0.0010 -0.0040 -0.0094 592 GLY 80 O -0.0004 -0.0048 -0.0104 593 PHE 81 N 0.0028 -0.0031 -0.0066 594 PHE 81 CA 0.0030 -0.0030 -0.0044 595 PHE 81 C 0.0054 -0.0017 -0.0015 596 PHE 81 O 0.0065 -0.0011 -0.0007 597 PHE 81 CB -0.0002 -0.0048 -0.0028 598 PHE 81 CG -0.0017 -0.0057 -0.0009 599 PHE 81 CD1 -0.0007 -0.0052 0.0024 600 PHE 81 CD2 -0.0041 -0.0071 -0.0026 601 PHE 81 CE1 -0.0021 -0.0061 0.0041 602 PHE 81 CE2 -0.0056 -0.0079 -0.0009 603 PHE 81 CZ -0.0046 -0.0074 0.0025 604 LEU 82 N 0.0020 -0.0034 0.0006 605 LEU 82 CA 0.0026 -0.0027 0.0016 606 LEU 82 C 0.0019 -0.0029 0.0027 607 LEU 82 O 0.0014 -0.0032 0.0028 608 LEU 82 CB 0.0034 -0.0023 0.0013 609 LEU 82 CG 0.0040 -0.0016 0.0022 610 LEU 82 CD1 0.0048 -0.0010 0.0025 611 LEU 82 CD2 0.0047 -0.0013 0.0017 612 LEU 83 N 0.0017 -0.0027 0.0035 613 LEU 83 CA 0.0010 -0.0029 0.0046 614 LEU 83 C 0.0017 -0.0022 0.0055 615 LEU 83 O 0.0024 -0.0016 0.0058 616 LEU 83 CB 0.0005 -0.0031 0.0049 617 LEU 83 CG -0.0004 -0.0034 0.0059 618 LEU 83 CD1 -0.0013 -0.0040 0.0058 619 LEU 83 CD2 -0.0007 -0.0036 0.0058 620 ASP 84 N 0.0014 -0.0022 0.0059 621 ASP 84 CA 0.0020 -0.0016 0.0067 622 ASP 84 C 0.0015 -0.0015 0.0080 623 ASP 84 O 0.0006 -0.0020 0.0084 624 ASP 84 CB 0.0020 -0.0017 0.0063 625 ASP 84 CG 0.0024 -0.0012 0.0072 626 ASP 84 OD1 0.0033 -0.0005 0.0072 627 ASP 84 OD2 0.0018 -0.0014 0.0078 628 GLY 85 N -0.0021 -0.0023 0.0059 629 GLY 85 CA -0.0024 -0.0013 0.0051 630 GLY 85 C -0.0016 -0.0006 0.0048 631 GLY 85 O -0.0020 -0.0001 0.0044 632 PHE 86 N -0.0004 -0.0007 0.0051 633 PHE 86 CA 0.0005 -0.0001 0.0049 634 PHE 86 C 0.0016 0.0000 0.0051 635 PHE 86 O 0.0020 -0.0008 0.0057 636 PHE 86 CB 0.0007 -0.0005 0.0052 637 PHE 86 CG 0.0016 0.0002 0.0049 638 PHE 86 CD1 0.0012 0.0010 0.0043 639 PHE 86 CD2 0.0029 0.0001 0.0052 640 PHE 86 CE1 0.0021 0.0017 0.0040 641 PHE 86 CE2 0.0037 0.0009 0.0049 642 PHE 86 CZ 0.0033 0.0016 0.0043 643 PRO 87 N 0.0022 0.0009 0.0046 644 PRO 87 CA 0.0020 0.0019 0.0038 645 PRO 87 C 0.0009 0.0024 0.0033 646 PRO 87 O 0.0003 0.0021 0.0034 647 PRO 87 CB 0.0031 0.0026 0.0036 648 PRO 87 CG 0.0035 0.0021 0.0040 649 PRO 87 CD 0.0034 0.0011 0.0047 650 ARG 88 N 0.0004 0.0037 0.0023 651 ARG 88 CA -0.0017 0.0042 0.0006 652 ARG 88 C -0.0011 0.0054 -0.0019 653 ARG 88 O -0.0028 0.0059 -0.0035 654 ARG 88 CB -0.0022 0.0042 0.0004 655 ARG 88 CG -0.0035 0.0030 0.0024 656 ARG 88 CD -0.0037 0.0030 0.0023 657 ARG 88 NE -0.0026 0.0021 0.0045 658 ARG 88 CZ -0.0004 0.0024 0.0048 659 ARG 88 NH1 0.0009 0.0035 0.0029 660 ARG 88 NH2 0.0005 0.0015 0.0069 661 THR 89 N 0.0012 0.0060 -0.0021 662 THR 89 CA 0.0020 0.0072 -0.0044 663 THR 89 C 0.0039 0.0074 -0.0040 664 THR 89 O 0.0051 0.0067 -0.0021 665 THR 89 CB 0.0032 0.0080 -0.0057 666 THR 89 OG1 0.0055 0.0078 -0.0044 667 THR 89 CG2 0.0015 0.0078 -0.0059 668 ILE 90 N 0.0043 0.0083 -0.0059 669 ILE 90 CA 0.0062 0.0086 -0.0058 670 ILE 90 C 0.0089 0.0088 -0.0053 671 ILE 90 O 0.0105 0.0085 -0.0041 672 ILE 90 CB 0.0061 0.0097 -0.0081 673 ILE 90 CG1 0.0038 0.0094 -0.0084 674 ILE 90 CG2 0.0086 0.0102 -0.0082 675 ILE 90 CD1 0.0032 0.0104 -0.0108 676 PRO 91 N 0.0090 0.0167 -0.0070 677 PRO 91 CA 0.0111 0.0164 -0.0066 678 PRO 91 C 0.0116 0.0139 -0.0045 679 PRO 91 O 0.0140 0.0133 -0.0039 680 PRO 91 CB 0.0095 0.0175 -0.0076 681 PRO 91 CG 0.0081 0.0194 -0.0093 682 PRO 91 CD 0.0068 0.0183 -0.0085 683 GLN 92 N 0.0092 0.0125 -0.0035 684 GLN 92 CA 0.0095 0.0100 -0.0014 685 GLN 92 C 0.0110 0.0089 -0.0004 686 GLN 92 O 0.0128 0.0074 0.0009 687 GLN 92 CB 0.0064 0.0089 -0.0007 688 GLN 92 CG 0.0053 0.0092 -0.0010 689 GLN 92 CD 0.0020 0.0086 -0.0007 690 GLN 92 OE1 0.0008 0.0086 -0.0008 691 GLN 92 NE2 0.0005 0.0082 -0.0005 692 ALA 93 N 0.0104 0.0097 -0.0011 693 ALA 93 CA 0.0117 0.0088 -0.0003 694 ALA 93 C 0.0149 0.0094 -0.0006 695 ALA 93 O 0.0167 0.0081 0.0007 696 ALA 93 CB 0.0101 0.0097 -0.0011 697 ASP 94 N 0.0124 0.0136 -0.0041 698 ASP 94 CA 0.0151 0.0153 -0.0033 699 ASP 94 C 0.0169 0.0156 -0.0021 700 ASP 94 O 0.0191 0.0157 -0.0003 701 ASP 94 CB 0.0153 0.0178 -0.0055 702 ASP 94 CG 0.0175 0.0190 -0.0047 703 ASP 94 OD1 0.0172 0.0181 -0.0042 704 ASP 94 OD2 0.0196 0.0209 -0.0046 705 ALA 95 N 0.0160 0.0158 -0.0030 706 ALA 95 CA 0.0175 0.0161 -0.0020 707 ALA 95 C 0.0179 0.0137 0.0005 708 ALA 95 O 0.0200 0.0140 0.0021 709 ALA 95 CB 0.0161 0.0166 -0.0037 710 MET 96 N 0.0159 0.0115 0.0009 711 MET 96 CA 0.0162 0.0092 0.0033 712 MET 96 C 0.0185 0.0093 0.0051 713 MET 96 O 0.0200 0.0086 0.0072 714 MET 96 CB 0.0138 0.0068 0.0034 715 MET 96 CG 0.0118 0.0059 0.0026 716 MET 96 SD 0.0089 0.0034 0.0023 717 MET 96 CE 0.0095 0.0007 0.0053 718 LYS 97 N 0.0185 0.0103 0.0008 719 LYS 97 CA 0.0216 0.0105 0.0039 720 LYS 97 C 0.0247 0.0137 0.0051 721 LYS 97 O 0.0273 0.0130 0.0082 722 LYS 97 CB 0.0216 0.0114 0.0034 723 LYS 97 CG 0.0247 0.0110 0.0068 724 LYS 97 CD 0.0243 0.0106 0.0066 725 LYS 97 CE 0.0249 0.0146 0.0047 726 LYS 97 NZ 0.0256 0.0143 0.0057 727 GLU 98 N 0.0243 0.0173 0.0026 728 GLU 98 CA 0.0270 0.0209 0.0032 729 GLU 98 C 0.0279 0.0200 0.0046 730 GLU 98 O 0.0308 0.0218 0.0065 731 GLU 98 CB 0.0260 0.0247 -0.0002 732 GLU 98 CG 0.0253 0.0261 -0.0017 733 GLU 98 CD 0.0286 0.0287 0.0001 734 GLU 98 OE1 0.0303 0.0322 -0.0003 735 GLU 98 OE2 0.0294 0.0271 0.0019 736 ALA 99 N 0.0254 0.0173 0.0037 737 ALA 99 CA 0.0260 0.0161 0.0050 738 ALA 99 C 0.0275 0.0126 0.0086 739 ALA 99 O 0.0281 0.0112 0.0101 740 ALA 99 CB 0.0228 0.0147 0.0025 741 GLY 100 N 0.0248 0.0138 0.0027 742 GLY 100 CA 0.0258 0.0115 0.0054 743 GLY 100 C 0.0221 0.0088 0.0070 744 GLY 100 O 0.0228 0.0065 0.0095 745 ILE 101 N 0.0184 0.0091 0.0057 746 ILE 101 CA 0.0146 0.0066 0.0070 747 ILE 101 C 0.0126 0.0070 0.0061 748 ILE 101 O 0.0100 0.0086 0.0037 749 ILE 101 CB 0.0114 0.0068 0.0059 750 ILE 101 CG1 0.0134 0.0065 0.0068 751 ILE 101 CG2 0.0075 0.0043 0.0073 752 ILE 101 CD1 0.0107 0.0071 0.0055 753 ASN 102 N 0.0138 0.0055 0.0080 754 ASN 102 CA 0.0120 0.0057 0.0072 755 ASN 102 C 0.0080 0.0032 0.0086 756 ASN 102 O 0.0074 0.0010 0.0106 757 ASN 102 CB 0.0151 0.0054 0.0085 758 ASN 102 CG 0.0163 0.0022 0.0120 759 ASN 102 OD1 0.0180 0.0014 0.0133 760 ASN 102 ND2 0.0153 0.0004 0.0135 761 VAL 103 N 0.0018 -0.0034 0.0064 762 VAL 103 CA 0.0014 -0.0038 0.0064 763 VAL 103 C 0.0009 -0.0042 0.0067 764 VAL 103 O 0.0008 -0.0043 0.0065 765 VAL 103 CB 0.0013 -0.0040 0.0057 766 VAL 103 CG1 0.0018 -0.0036 0.0054 767 VAL 103 CG2 0.0011 -0.0042 0.0052 768 ASP 104 N 0.0006 -0.0044 0.0072 769 ASP 104 CA 0.0001 -0.0048 0.0075 770 ASP 104 C -0.0003 -0.0053 0.0070 771 ASP 104 O -0.0006 -0.0056 0.0071 772 ASP 104 CB -0.0001 -0.0049 0.0082 773 ASP 104 CG 0.0003 -0.0044 0.0087 774 ASP 104 OD1 0.0004 -0.0043 0.0090 775 ASP 104 OD2 0.0006 -0.0042 0.0088 776 TYR 105 N -0.0003 -0.0053 0.0066 777 TYR 105 CA -0.0007 -0.0058 0.0062 778 TYR 105 C -0.0006 -0.0057 0.0054 779 TYR 105 O -0.0002 -0.0055 0.0053 780 TYR 105 CB -0.0011 -0.0061 0.0065 781 TYR 105 CG -0.0014 -0.0063 0.0071 782 TYR 105 CD1 -0.0012 -0.0060 0.0078 783 TYR 105 CD2 -0.0019 -0.0067 0.0071 784 TYR 105 CE1 -0.0015 -0.0062 0.0084 785 TYR 105 CE2 -0.0021 -0.0069 0.0078 786 TYR 105 CZ -0.0019 -0.0066 0.0084 787 TYR 105 OH -0.0022 -0.0067 0.0091 788 VAL 106 N -0.0017 -0.0067 0.0079 789 VAL 106 CA -0.0017 -0.0067 0.0074 790 VAL 106 C -0.0020 -0.0071 0.0073 791 VAL 106 O -0.0021 -0.0073 0.0074 792 VAL 106 CB -0.0016 -0.0065 0.0072 793 VAL 106 CG1 -0.0016 -0.0064 0.0067 794 VAL 106 CG2 -0.0013 -0.0061 0.0074 795 LEU 107 N -0.0021 -0.0072 0.0072 796 LEU 107 CA -0.0024 -0.0076 0.0071 797 LEU 107 C -0.0025 -0.0076 0.0066 798 LEU 107 O -0.0023 -0.0074 0.0064 799 LEU 107 CB -0.0025 -0.0077 0.0073 800 LEU 107 CG -0.0024 -0.0077 0.0078 801 LEU 107 CD1 -0.0025 -0.0078 0.0080 802 LEU 107 CD2 -0.0025 -0.0079 0.0081 803 GLU 108 N -0.0027 -0.0078 0.0064 804 GLU 108 CA -0.0028 -0.0079 0.0059 805 GLU 108 C -0.0030 -0.0082 0.0058 806 GLU 108 O -0.0032 -0.0085 0.0060 807 GLU 108 CB -0.0028 -0.0079 0.0057 808 GLU 108 CG -0.0028 -0.0079 0.0051 809 GLU 108 CD -0.0029 -0.0080 0.0049 810 GLU 108 OE1 -0.0029 -0.0080 0.0051 811 GLU 108 OE2 -0.0030 -0.0080 0.0045 812 PHE 109 N -0.0058 -0.0111 0.0112 813 PHE 109 CA -0.0052 -0.0107 0.0112 814 PHE 109 C -0.0048 -0.0106 0.0119 815 PHE 109 O -0.0048 -0.0109 0.0124 816 PHE 109 CB -0.0053 -0.0106 0.0110 817 PHE 109 CG -0.0048 -0.0101 0.0107 818 PHE 109 CD1 -0.0048 -0.0099 0.0100 819 PHE 109 CD2 -0.0043 -0.0099 0.0112 820 PHE 109 CE1 -0.0044 -0.0094 0.0097 821 PHE 109 CE2 -0.0039 -0.0095 0.0109 822 PHE 109 CZ -0.0039 -0.0092 0.0102 823 ASP 110 N -0.0044 -0.0103 0.0119 824 ASP 110 CA -0.0040 -0.0103 0.0126 825 ASP 110 C -0.0034 -0.0099 0.0128 826 ASP 110 O -0.0031 -0.0095 0.0125 827 ASP 110 CB -0.0040 -0.0103 0.0126 828 ASP 110 CG -0.0037 -0.0103 0.0133 829 ASP 110 OD1 -0.0039 -0.0107 0.0138 830 ASP 110 OD2 -0.0033 -0.0100 0.0133 831 VAL 111 N -0.0033 -0.0100 0.0134 832 VAL 111 CA -0.0027 -0.0097 0.0137 833 VAL 111 C -0.0026 -0.0099 0.0145 834 VAL 111 O -0.0029 -0.0103 0.0149 835 VAL 111 CB -0.0026 -0.0096 0.0136 836 VAL 111 CG1 -0.0020 -0.0093 0.0140 837 VAL 111 CG2 -0.0027 -0.0094 0.0128 838 PRO 112 N -0.0099 -0.0170 0.0154 839 PRO 112 CA -0.0102 -0.0167 0.0145 840 PRO 112 C -0.0109 -0.0161 0.0127 841 PRO 112 O -0.0113 -0.0169 0.0117 842 PRO 112 CB -0.0103 -0.0185 0.0146 843 PRO 112 CG -0.0097 -0.0192 0.0163 844 PRO 112 CD -0.0097 -0.0188 0.0163 845 ASP 113 N -0.0110 -0.0146 0.0122 846 ASP 113 CA -0.0116 -0.0139 0.0105 847 ASP 113 C -0.0122 -0.0153 0.0092 848 ASP 113 O -0.0126 -0.0152 0.0080 849 ASP 113 CB -0.0116 -0.0125 0.0102 850 ASP 113 CG -0.0112 -0.0107 0.0111 851 ASP 113 OD1 -0.0109 -0.0105 0.0119 852 ASP 113 OD2 -0.0112 -0.0095 0.0109 853 GLU 114 N -0.0122 -0.0165 0.0093 854 GLU 114 CA -0.0127 -0.0179 0.0081 855 GLU 114 C -0.0129 -0.0190 0.0079 856 GLU 114 O -0.0134 -0.0194 0.0065 857 GLU 114 CB -0.0127 -0.0191 0.0084 858 GLU 114 CG -0.0128 -0.0183 0.0080 859 GLU 114 CD -0.0134 -0.0174 0.0062 860 GLU 114 OE1 -0.0139 -0.0184 0.0050 861 GLU 114 OE2 -0.0134 -0.0158 0.0061 862 LEU 115 N -0.0141 -0.0170 0.0107 863 LEU 115 CA -0.0140 -0.0166 0.0108 864 LEU 115 C -0.0136 -0.0155 0.0103 865 LEU 115 O -0.0133 -0.0153 0.0097 866 LEU 115 CB -0.0147 -0.0167 0.0119 867 LEU 115 CG -0.0150 -0.0179 0.0122 868 LEU 115 CD1 -0.0152 -0.0187 0.0124 869 LEU 115 CD2 -0.0156 -0.0178 0.0132 870 ILE 116 N -0.0136 -0.0146 0.0105 871 ILE 116 CA -0.0132 -0.0134 0.0101 872 ILE 116 C -0.0125 -0.0136 0.0088 873 ILE 116 O -0.0121 -0.0130 0.0083 874 ILE 116 CB -0.0133 -0.0126 0.0105 875 ILE 116 CG1 -0.0139 -0.0122 0.0117 876 ILE 116 CG2 -0.0127 -0.0115 0.0098 877 ILE 116 CD1 -0.0140 -0.0115 0.0121 878 VAL 117 N -0.0124 -0.0144 0.0085 879 VAL 117 CA -0.0118 -0.0146 0.0073 880 VAL 117 C -0.0116 -0.0151 0.0068 881 VAL 117 O -0.0111 -0.0146 0.0060 882 VAL 117 CB -0.0118 -0.0156 0.0071 883 VAL 117 CG1 -0.0112 -0.0158 0.0059 884 VAL 117 CG2 -0.0121 -0.0153 0.0076 885 ASP 118 N -0.0117 -0.0151 0.0067 886 ASP 118 CA -0.0114 -0.0159 0.0061 887 ASP 118 C -0.0112 -0.0141 0.0061 888 ASP 118 O -0.0104 -0.0141 0.0049 889 ASP 118 CB -0.0125 -0.0178 0.0073 890 ASP 118 CG -0.0127 -0.0198 0.0071 891 ASP 118 OD1 -0.0119 -0.0200 0.0058 892 ASP 118 OD2 -0.0137 -0.0212 0.0083 893 ARG 119 N -0.0119 -0.0126 0.0076 894 ARG 119 CA -0.0117 -0.0107 0.0079 895 ARG 119 C -0.0105 -0.0091 0.0064 896 ARG 119 O -0.0101 -0.0079 0.0060 897 ARG 119 CB -0.0128 -0.0095 0.0098 898 ARG 119 CG -0.0140 -0.0109 0.0114 899 ARG 119 CD -0.0151 -0.0098 0.0134 900 ARG 119 NE -0.0163 -0.0112 0.0149 901 ARG 119 CZ -0.0173 -0.0105 0.0167 902 ARG 119 NH1 -0.0174 -0.0085 0.0173 903 ARG 119 NH2 -0.0183 -0.0119 0.0180 904 ILE 120 N -0.0100 -0.0092 0.0055 905 ILE 120 CA -0.0088 -0.0076 0.0041 906 ILE 120 C -0.0077 -0.0085 0.0020 907 ILE 120 O -0.0068 -0.0077 0.0008 908 ILE 120 CB -0.0090 -0.0061 0.0047 909 ILE 120 CG1 -0.0099 -0.0046 0.0065 910 ILE 120 CG2 -0.0078 -0.0047 0.0031 911 ILE 120 CD1 -0.0105 -0.0039 0.0076 912 VAL 121 N -0.0047 -0.0091 0.0001 913 VAL 121 CA -0.0018 -0.0105 -0.0014 914 VAL 121 C -0.0004 -0.0097 -0.0018 915 VAL 121 O 0.0024 -0.0090 -0.0028 916 VAL 121 CB -0.0020 -0.0143 -0.0022 917 VAL 121 CG1 -0.0036 -0.0151 -0.0017 918 VAL 121 CG2 -0.0036 -0.0161 -0.0019 919 GLY 122 N -0.0024 -0.0094 -0.0009 920 GLY 122 CA -0.0014 -0.0086 -0.0012 921 GLY 122 C -0.0006 -0.0051 -0.0007 922 GLY 122 O -0.0013 -0.0040 -0.0002 923 ARG 123 N 0.0009 -0.0032 -0.0009 924 ARG 123 CA 0.0017 0.0002 -0.0005 925 ARG 123 C 0.0051 0.0011 -0.0017 926 ARG 123 O 0.0065 0.0002 -0.0025 927 ARG 123 CB -0.0004 0.0024 0.0009 928 ARG 123 CG 0.0003 0.0031 0.0008 929 ARG 123 CD -0.0017 0.0057 0.0022 930 ARG 123 NE -0.0014 0.0061 0.0021 931 ARG 123 CZ -0.0037 0.0058 0.0031 932 ARG 123 NH1 -0.0066 0.0052 0.0041 933 ARG 123 NH2 -0.0032 0.0062 0.0029 934 ARG 124 N 0.0043 0.0040 -0.0014 935 ARG 124 CA 0.0036 0.0041 -0.0023 936 ARG 124 C 0.0042 0.0038 -0.0012 937 ARG 124 O 0.0044 0.0028 0.0000 938 ARG 124 CB 0.0022 0.0029 -0.0029 939 ARG 124 CG 0.0015 0.0027 -0.0035 940 ARG 124 CD 0.0013 0.0040 -0.0050 941 ARG 124 NE 0.0006 0.0037 -0.0056 942 ARG 124 CZ 0.0011 0.0043 -0.0056 943 ARG 124 NH1 0.0023 0.0053 -0.0050 944 ARG 124 NH2 0.0003 0.0039 -0.0062 945 VAL 125 N 0.0044 0.0046 -0.0018 946 VAL 125 CA 0.0050 0.0044 -0.0009 947 VAL 125 C 0.0042 0.0042 -0.0017 948 VAL 125 O 0.0035 0.0047 -0.0030 949 VAL 125 CB 0.0063 0.0058 -0.0006 950 VAL 125 CG1 0.0072 0.0062 0.0000 951 VAL 125 CG2 0.0063 0.0071 -0.0020 952 HIS 126 N 0.0042 0.0033 -0.0008 953 HIS 126 CA 0.0035 0.0031 -0.0014 954 HIS 126 C 0.0045 0.0044 -0.0014 955 HIS 126 O 0.0054 0.0042 -0.0003 956 HIS 126 CB 0.0030 0.0017 -0.0006 957 HIS 126 CG 0.0024 0.0015 -0.0012 958 HIS 126 ND1 0.0015 0.0020 -0.0027 959 HIS 126 CD2 0.0025 0.0010 -0.0006 960 HIS 126 CE1 0.0012 0.0018 -0.0030 961 HIS 126 NE2 0.0017 0.0012 -0.0017 962 ALA 127 N 0.0063 0.0060 -0.0033 963 ALA 127 CA 0.0080 0.0068 -0.0034 964 ALA 127 C 0.0088 0.0056 -0.0018 965 ALA 127 O 0.0108 0.0056 -0.0009 966 ALA 127 CB 0.0072 0.0082 -0.0052 967 PRO 128 N 0.0072 0.0046 -0.0014 968 PRO 128 CA 0.0079 0.0034 0.0001 969 PRO 128 C 0.0081 0.0017 0.0020 970 PRO 128 O 0.0069 0.0003 0.0030 971 PRO 128 CB 0.0060 0.0031 -0.0004 972 PRO 128 CG 0.0050 0.0046 -0.0024 973 PRO 128 CD 0.0049 0.0047 -0.0026 974 SER 129 N 0.0096 0.0018 0.0026 975 SER 129 CA 0.0100 0.0003 0.0043 976 SER 129 C 0.0118 0.0009 0.0044 977 SER 129 O 0.0131 0.0001 0.0059 978 SER 129 CB 0.0078 -0.0008 0.0045 979 SER 129 OG 0.0071 0.0000 0.0034 980 GLY 130 N 0.0089 0.0021 0.0018 981 GLY 130 CA 0.0103 0.0028 0.0013 982 GLY 130 C 0.0093 0.0024 0.0015 983 GLY 130 O 0.0103 0.0030 0.0011 984 ARG 131 N 0.0074 0.0015 0.0020 985 ARG 131 CA 0.0063 0.0011 0.0022 986 ARG 131 C 0.0060 0.0024 0.0005 987 ARG 131 O 0.0054 0.0034 -0.0009 988 ARG 131 CB 0.0042 0.0001 0.0029 989 ARG 131 CG 0.0042 -0.0014 0.0048 990 ARG 131 CD 0.0041 -0.0022 0.0058 991 ARG 131 NE 0.0021 -0.0021 0.0051 992 ARG 131 CZ 0.0017 -0.0027 0.0057 993 ARG 131 NH1 0.0030 -0.0033 0.0069 994 ARG 131 NH2 -0.0001 -0.0025 0.0050 995 VAL 132 N 0.0064 0.0024 0.0006 996 VAL 132 CA 0.0063 0.0036 -0.0010 997 VAL 132 C 0.0048 0.0032 -0.0009 998 VAL 132 O 0.0048 0.0022 0.0004 999 VAL 132 CB 0.0086 0.0044 -0.0013 1000 VAL 132 CG1 0.0095 0.0036 0.0001 1001 VAL 132 CG2 0.0085 0.0058 -0.0031 1002 TYR 133 N 0.0023 0.0035 -0.0010 1003 TYR 133 CA 0.0023 0.0034 -0.0010 1004 TYR 133 C 0.0018 0.0023 -0.0008 1005 TYR 133 O 0.0016 0.0016 -0.0007 1006 TYR 133 CB 0.0036 0.0035 -0.0009 1007 TYR 133 CG 0.0042 0.0045 -0.0011 1008 TYR 133 CD1 0.0041 0.0055 -0.0013 1009 TYR 133 CD2 0.0047 0.0045 -0.0010 1010 TYR 133 CE1 0.0046 0.0065 -0.0014 1011 TYR 133 CE2 0.0052 0.0055 -0.0012 1012 TYR 133 CZ 0.0051 0.0065 -0.0014 1013 TYR 133 OH 0.0056 0.0074 -0.0015 1014 HIS 134 N 0.0016 0.0022 -0.0008 1015 HIS 134 CA 0.0012 0.0012 -0.0006 1016 HIS 134 C 0.0018 0.0010 -0.0005 1017 HIS 134 O 0.0015 0.0016 -0.0007 1018 HIS 134 CB -0.0001 0.0011 -0.0007 1019 HIS 134 CG -0.0005 -0.0000 -0.0005 1020 HIS 134 ND1 -0.0005 -0.0004 -0.0005 1021 HIS 134 CD2 -0.0009 -0.0009 -0.0004 1022 HIS 134 CE1 -0.0008 -0.0014 -0.0003 1023 HIS 134 NE2 -0.0011 -0.0018 -0.0002 1024 VAL 135 N 0.0026 0.0002 -0.0003 1025 VAL 135 CA 0.0032 -0.0000 -0.0002 1026 VAL 135 C 0.0026 0.0002 -0.0003 1027 VAL 135 O 0.0031 0.0005 -0.0003 1028 VAL 135 CB 0.0036 -0.0012 0.0001 1029 VAL 135 CG1 0.0045 -0.0013 0.0002 1030 VAL 135 CG2 0.0027 -0.0020 0.0002 1031 LYS 136 N 0.0026 -0.0033 0.0011 1032 LYS 136 CA 0.0013 -0.0033 0.0013 1033 LYS 136 C -0.0002 -0.0006 0.0006 1034 LYS 136 O 0.0007 0.0008 -0.0001 1035 LYS 136 CB -0.0008 -0.0056 0.0025 1036 LYS 136 CG 0.0005 -0.0084 0.0034 1037 LYS 136 CD 0.0007 -0.0097 0.0038 1038 LYS 136 CE 0.0021 -0.0126 0.0047 1039 LYS 136 NZ 0.0023 -0.0138 0.0051 1040 PHE 137 N -0.0023 0.0002 0.0007 1041 PHE 137 CA -0.0041 0.0027 0.0000 1042 PHE 137 C -0.0028 0.0054 -0.0012 1043 PHE 137 O -0.0035 0.0071 -0.0017 1044 PHE 137 CB -0.0067 0.0027 0.0005 1045 PHE 137 CG -0.0081 0.0000 0.0017 1046 PHE 137 CD1 -0.0081 -0.0016 0.0024 1047 PHE 137 CD2 -0.0092 -0.0009 0.0023 1048 PHE 137 CE1 -0.0091 -0.0042 0.0035 1049 PHE 137 CE2 -0.0102 -0.0035 0.0034 1050 PHE 137 CZ -0.0102 -0.0051 0.0040 1051 ASN 138 N -0.0010 0.0059 -0.0017 1052 ASN 138 CA 0.0004 0.0084 -0.0029 1053 ASN 138 C 0.0034 0.0079 -0.0033 1054 ASN 138 O 0.0040 0.0087 -0.0037 1055 ASN 138 CB -0.0013 0.0106 -0.0035 1056 ASN 138 CG -0.0012 0.0103 -0.0034 1057 ASN 138 OD1 -0.0018 0.0082 -0.0024 1058 ASN 138 ND2 -0.0004 0.0124 -0.0043 1059 PRO 139 N 0.0080 0.0090 -0.0027 1060 PRO 139 CA 0.0075 0.0092 -0.0016 1061 PRO 139 C 0.0070 0.0086 -0.0027 1062 PRO 139 O 0.0075 0.0083 -0.0044 1063 PRO 139 CB 0.0092 0.0103 -0.0007 1064 PRO 139 CG 0.0107 0.0104 -0.0022 1065 PRO 139 CD 0.0099 0.0098 -0.0028 1066 PRO 140 N 0.0059 0.0084 -0.0018 1067 PRO 140 CA 0.0055 0.0079 -0.0028 1068 PRO 140 C 0.0071 0.0086 -0.0030 1069 PRO 140 O 0.0082 0.0094 -0.0018 1070 PRO 140 CB 0.0038 0.0075 -0.0016 1071 PRO 140 CG 0.0041 0.0083 0.0003 1072 PRO 140 CD 0.0048 0.0085 0.0001 1073 LYS 141 N 0.0072 0.0082 -0.0044 1074 LYS 141 CA 0.0087 0.0087 -0.0047 1075 LYS 141 C 0.0087 0.0093 -0.0029 1076 LYS 141 O 0.0101 0.0102 -0.0021 1077 LYS 141 CB 0.0084 0.0081 -0.0063 1078 LYS 141 CG 0.0086 0.0075 -0.0082 1079 LYS 141 CD 0.0081 0.0068 -0.0096 1080 LYS 141 CE 0.0077 0.0061 -0.0114 1081 LYS 141 NZ 0.0065 0.0052 -0.0125 1082 VAL 142 N 0.0031 0.0078 -0.0011 1083 VAL 142 CA 0.0022 0.0086 -0.0001 1084 VAL 142 C 0.0018 0.0097 0.0010 1085 VAL 142 O 0.0006 0.0095 0.0009 1086 VAL 142 CB 0.0004 0.0080 -0.0006 1087 VAL 142 CG1 -0.0003 0.0088 0.0003 1088 VAL 142 CG2 0.0007 0.0066 -0.0019 1089 GLU 143 N 0.0030 0.0107 0.0019 1090 GLU 143 CA 0.0028 0.0118 0.0029 1091 GLU 143 C 0.0009 0.0123 0.0036 1092 GLU 143 O 0.0001 0.0125 0.0039 1093 GLU 143 CB 0.0042 0.0129 0.0039 1094 GLU 143 CG 0.0042 0.0141 0.0050 1095 GLU 143 CD 0.0051 0.0139 0.0048 1096 GLU 143 OE1 0.0067 0.0136 0.0043 1097 GLU 143 OE2 0.0042 0.0142 0.0051 1098 GLY 144 N 0.0001 0.0124 0.0038 1099 GLY 144 CA -0.0017 0.0128 0.0044 1100 GLY 144 C -0.0031 0.0117 0.0034 1101 GLY 144 O -0.0047 0.0119 0.0037 1102 LYS 145 N -0.0065 0.0129 -0.0002 1103 LYS 145 CA -0.0082 0.0094 0.0004 1104 LYS 145 C -0.0056 0.0063 -0.0003 1105 LYS 145 O -0.0030 0.0061 -0.0010 1106 LYS 145 CB -0.0106 0.0086 0.0011 1107 LYS 145 CG -0.0133 0.0114 0.0019 1108 LYS 145 CD -0.0166 0.0108 0.0029 1109 LYS 145 CE -0.0197 0.0130 0.0037 1110 LYS 145 NZ -0.0231 0.0120 0.0048 1111 ASP 146 N -0.0062 0.0039 -0.0001 1112 ASP 146 CA -0.0039 0.0007 -0.0007 1113 ASP 146 C -0.0044 -0.0020 -0.0004 1114 ASP 146 O -0.0073 -0.0033 0.0004 1115 ASP 146 CB -0.0046 -0.0011 -0.0004 1116 ASP 146 CG -0.0028 -0.0047 -0.0009 1117 ASP 146 OD1 0.0005 -0.0050 -0.0018 1118 ASP 146 OD2 -0.0046 -0.0074 -0.0003 1119 ASP 147 N -0.0015 -0.0030 -0.0013 1120 ASP 147 CA -0.0015 -0.0055 -0.0012 1121 ASP 147 C -0.0029 -0.0093 -0.0007 1122 ASP 147 O -0.0042 -0.0110 -0.0003 1123 ASP 147 CB 0.0022 -0.0057 -0.0023 1124 ASP 147 CG 0.0035 -0.0021 -0.0028 1125 ASP 147 OD1 0.0012 0.0004 -0.0022 1126 ASP 147 OD2 0.0067 -0.0017 -0.0038 1127 VAL 148 N -0.0026 -0.0144 0.0014 1128 VAL 148 CA -0.0040 -0.0185 0.0019 1129 VAL 148 C -0.0086 -0.0186 0.0023 1130 VAL 148 O -0.0107 -0.0220 0.0027 1131 VAL 148 CB -0.0005 -0.0200 0.0019 1132 VAL 148 CG1 -0.0026 -0.0227 0.0023 1133 VAL 148 CG2 0.0030 -0.0227 0.0019 1134 THR 149 N -0.0103 -0.0148 0.0020 1135 THR 149 CA -0.0147 -0.0146 0.0022 1136 THR 149 C -0.0180 -0.0118 0.0022 1137 THR 149 O -0.0220 -0.0121 0.0024 1138 THR 149 CB -0.0145 -0.0129 0.0020 1139 THR 149 OG1 -0.0129 -0.0085 0.0015 1140 THR 149 CG2 -0.0115 -0.0157 0.0021 1141 GLY 150 N -0.0163 -0.0091 0.0018 1142 GLY 150 CA -0.0192 -0.0062 0.0017 1143 GLY 150 C -0.0210 -0.0030 0.0015 1144 GLY 150 O -0.0248 -0.0017 0.0016 1145 GLU 151 N -0.0137 -0.0028 0.0001 1146 GLU 151 CA -0.0147 -0.0005 0.0002 1147 GLU 151 C -0.0126 0.0026 0.0000 1148 GLU 151 O -0.0097 0.0024 -0.0001 1149 GLU 151 CB -0.0142 -0.0020 0.0002 1150 GLU 151 CG -0.0161 -0.0004 0.0002 1151 GLU 151 CD -0.0158 -0.0023 0.0002 1152 GLU 151 OE1 -0.0152 -0.0053 0.0003 1153 GLU 151 OE2 -0.0161 -0.0007 0.0002 1154 GLU 152 N -0.0141 0.0055 0.0000 1155 GLU 152 CA -0.0124 0.0086 -0.0001 1156 GLU 152 C -0.0094 0.0090 -0.0003 1157 GLU 152 O -0.0093 0.0078 -0.0002 1158 GLU 152 CB -0.0147 0.0115 -0.0000 1159 GLU 152 CG -0.0172 0.0119 0.0001 1160 GLU 152 CD -0.0162 0.0146 -0.0000 1161 GLU 152 OE1 -0.0133 0.0147 -0.0002 1162 GLU 152 OE2 -0.0184 0.0166 0.0001 1163 LEU 153 N -0.0069 0.0107 -0.0004 1164 LEU 153 CA -0.0039 0.0113 -0.0006 1165 LEU 153 C -0.0041 0.0147 -0.0006 1166 LEU 153 O -0.0062 0.0167 -0.0005 1167 LEU 153 CB -0.0010 0.0111 -0.0007 1168 LEU 153 CG -0.0006 0.0080 -0.0007 1169 LEU 153 CD1 0.0023 0.0084 -0.0008 1170 LEU 153 CD2 -0.0000 0.0051 -0.0006 1171 THR 154 N 0.0062 0.0052 -0.0079 1172 THR 154 CA 0.0069 0.0050 -0.0093 1173 THR 154 C 0.0060 0.0047 -0.0082 1174 THR 154 O 0.0046 0.0045 -0.0064 1175 THR 154 CB 0.0090 0.0068 -0.0099 1176 THR 154 OG1 0.0093 0.0085 -0.0079 1177 THR 154 CG2 0.0101 0.0068 -0.0117 1178 THR 155 N 0.0066 0.0046 -0.0094 1179 THR 155 CA 0.0058 0.0043 -0.0085 1180 THR 155 C 0.0074 0.0061 -0.0084 1181 THR 155 O 0.0089 0.0067 -0.0100 1182 THR 155 CB 0.0049 0.0025 -0.0099 1183 THR 155 OG1 0.0058 0.0019 -0.0122 1184 THR 155 CG2 0.0029 0.0009 -0.0090 1185 ARG 156 N 0.0071 0.0069 -0.0066 1186 ARG 156 CA 0.0085 0.0086 -0.0065 1187 ARG 156 C 0.0088 0.0078 -0.0081 1188 ARG 156 O 0.0075 0.0061 -0.0086 1189 ARG 156 CB 0.0080 0.0096 -0.0041 1190 ARG 156 CG 0.0095 0.0118 -0.0033 1191 ARG 156 CD 0.0090 0.0127 -0.0010 1192 ARG 156 NE 0.0074 0.0122 0.0008 1193 ARG 156 CZ 0.0073 0.0131 0.0021 1194 ARG 156 NH1 0.0089 0.0145 0.0018 1195 ARG 156 NH2 0.0058 0.0125 0.0037 1196 LYS 157 N 0.0135 0.0080 -0.0123 1197 LYS 157 CA 0.0137 0.0057 -0.0134 1198 LYS 157 C 0.0102 0.0044 -0.0103 1199 LYS 157 O 0.0091 0.0007 -0.0106 1200 LYS 157 CB 0.0162 0.0088 -0.0147 1201 LYS 157 CG 0.0160 0.0070 -0.0153 1202 LYS 157 CD 0.0168 0.0025 -0.0179 1203 LYS 157 CE 0.0205 0.0029 -0.0216 1204 LYS 157 NZ 0.0225 0.0049 -0.0228 1205 ASP 158 N 0.0085 0.0074 -0.0073 1206 ASP 158 CA 0.0052 0.0067 -0.0041 1207 ASP 158 C 0.0028 0.0027 -0.0032 1208 ASP 158 O 0.0006 0.0001 -0.0021 1209 ASP 158 CB 0.0039 0.0108 -0.0012 1210 ASP 158 CG 0.0062 0.0151 -0.0019 1211 ASP 158 OD1 0.0079 0.0149 -0.0037 1212 ASP 158 OD2 0.0063 0.0187 -0.0005 1213 ASP 159 N 0.0032 0.0021 -0.0039 1214 ASP 159 CA 0.0010 -0.0016 -0.0031 1215 ASP 159 C 0.0013 -0.0061 -0.0052 1216 ASP 159 O -0.0009 -0.0095 -0.0043 1217 ASP 159 CB 0.0018 -0.0009 -0.0037 1218 ASP 159 CG 0.0017 0.0036 -0.0018 1219 ASP 159 OD1 0.0006 0.0061 0.0004 1220 ASP 159 OD2 0.0027 0.0047 -0.0024 1221 GLN 160 N 0.0045 -0.0062 -0.0095 1222 GLN 160 CA 0.0055 -0.0106 -0.0109 1223 GLN 160 C 0.0024 -0.0136 -0.0084 1224 GLN 160 O 0.0004 -0.0122 -0.0065 1225 GLN 160 CB 0.0081 -0.0099 -0.0131 1226 GLN 160 CG 0.0118 -0.0102 -0.0165 1227 GLN 160 CD 0.0133 -0.0144 -0.0183 1228 GLN 160 OE1 0.0114 -0.0178 -0.0170 1229 GLN 160 NE2 0.0167 -0.0143 -0.0214 1230 GLU 161 N 0.0020 -0.0179 -0.0086 1231 GLU 161 CA -0.0009 -0.0211 -0.0064 1232 GLU 161 C -0.0016 -0.0215 -0.0058 1233 GLU 161 O -0.0045 -0.0215 -0.0031 1234 GLU 161 CB -0.0005 -0.0258 -0.0073 1235 GLU 161 CG -0.0039 -0.0286 -0.0045 1236 GLU 161 CD -0.0035 -0.0329 -0.0053 1237 GLU 161 OE1 -0.0027 -0.0325 -0.0061 1238 GLU 161 OE2 -0.0042 -0.0368 -0.0052 1239 GLU 162 N 0.0012 -0.0218 -0.0083 1240 GLU 162 CA 0.0009 -0.0221 -0.0081 1241 GLU 162 C -0.0007 -0.0179 -0.0062 1242 GLU 162 O -0.0028 -0.0183 -0.0043 1243 GLU 162 CB 0.0044 -0.0227 -0.0113 1244 GLU 162 CG 0.0045 -0.0223 -0.0114 1245 GLU 162 CD 0.0076 -0.0192 -0.0138 1246 GLU 162 OE1 0.0073 -0.0150 -0.0130 1247 GLU 162 OE2 0.0103 -0.0211 -0.0164 1248 THR 163 N -0.0009 -0.0124 -0.0045 1249 THR 163 CA -0.0021 -0.0090 -0.0035 1250 THR 163 C -0.0047 -0.0089 -0.0008 1251 THR 163 O -0.0065 -0.0079 0.0010 1252 THR 163 CB -0.0006 -0.0060 -0.0052 1253 THR 163 OG1 0.0018 -0.0063 -0.0077 1254 THR 163 CG2 -0.0018 -0.0024 -0.0043 1255 VAL 164 N -0.0049 -0.0100 -0.0005 1256 VAL 164 CA -0.0073 -0.0100 0.0019 1257 VAL 164 C -0.0091 -0.0123 0.0040 1258 VAL 164 O -0.0111 -0.0110 0.0060 1259 VAL 164 CB -0.0070 -0.0112 0.0017 1260 VAL 164 CG1 -0.0095 -0.0112 0.0043 1261 VAL 164 CG2 -0.0053 -0.0088 -0.0002 1262 ARG 165 N -0.0084 -0.0156 0.0035 1263 ARG 165 CA -0.0100 -0.0179 0.0053 1264 ARG 165 C -0.0108 -0.0166 0.0061 1265 ARG 165 O -0.0129 -0.0173 0.0082 1266 ARG 165 CB -0.0088 -0.0217 0.0043 1267 ARG 165 CG -0.0088 -0.0234 0.0044 1268 ARG 165 CD -0.0092 -0.0273 0.0051 1269 ARG 165 NE -0.0100 -0.0289 0.0061 1270 ARG 165 CZ -0.0085 -0.0307 0.0047 1271 ARG 165 NH1 -0.0062 -0.0311 0.0022 1272 ARG 165 NH2 -0.0094 -0.0321 0.0057 1273 LYS 166 N -0.0091 -0.0118 0.0046 1274 LYS 166 CA -0.0096 -0.0107 0.0050 1275 LYS 166 C -0.0109 -0.0087 0.0062 1276 LYS 166 O -0.0120 -0.0085 0.0075 1277 LYS 166 CB -0.0082 -0.0098 0.0033 1278 LYS 166 CG -0.0077 -0.0110 0.0029 1279 LYS 166 CD -0.0061 -0.0105 0.0009 1280 LYS 166 CE -0.0058 -0.0079 0.0003 1281 LYS 166 NZ -0.0041 -0.0075 -0.0017 1282 ARG 167 N -0.0106 -0.0073 0.0058 1283 ARG 167 CA -0.0118 -0.0053 0.0069 1284 ARG 167 C -0.0134 -0.0062 0.0088 1285 ARG 167 O -0.0146 -0.0052 0.0100 1286 ARG 167 CB -0.0113 -0.0040 0.0061 1287 ARG 167 CG -0.0102 -0.0022 0.0046 1288 ARG 167 CD -0.0104 -0.0002 0.0046 1289 ARG 167 NE -0.0100 -0.0009 0.0043 1290 ARG 167 CZ -0.0086 -0.0006 0.0027 1291 ARG 167 NH1 -0.0075 0.0004 0.0013 1292 ARG 167 NH2 -0.0084 -0.0014 0.0024 1293 LEU 168 N -0.0134 -0.0081 0.0090 1294 LEU 168 CA -0.0148 -0.0091 0.0108 1295 LEU 168 C -0.0157 -0.0101 0.0118 1296 LEU 168 O -0.0171 -0.0098 0.0135 1297 LEU 168 CB -0.0146 -0.0109 0.0107 1298 LEU 168 CG -0.0142 -0.0099 0.0102 1299 LEU 168 CD1 -0.0137 -0.0121 0.0099 1300 LEU 168 CD2 -0.0157 -0.0085 0.0116 1301 VAL 169 N -0.0116 -0.0060 0.0080 1302 VAL 169 CA -0.0113 -0.0057 0.0074 1303 VAL 169 C -0.0104 -0.0056 0.0075 1304 VAL 169 O -0.0100 -0.0055 0.0074 1305 VAL 169 CB -0.0115 -0.0055 0.0066 1306 VAL 169 CG1 -0.0114 -0.0054 0.0066 1307 VAL 169 CG2 -0.0111 -0.0052 0.0060 1308 GLU 170 N -0.0102 -0.0056 0.0077 1309 GLU 170 CA -0.0094 -0.0055 0.0078 1310 GLU 170 C -0.0090 -0.0057 0.0084 1311 GLU 170 O -0.0083 -0.0055 0.0083 1312 GLU 170 CB -0.0093 -0.0056 0.0081 1313 GLU 170 CG -0.0087 -0.0054 0.0079 1314 GLU 170 CD -0.0081 -0.0055 0.0085 1315 GLU 170 OE1 -0.0083 -0.0058 0.0091 1316 GLU 170 OE2 -0.0074 -0.0053 0.0084 1317 TYR 171 N -0.0094 -0.0060 0.0089 1318 TYR 171 CA -0.0092 -0.0061 0.0095 1319 TYR 171 C -0.0091 -0.0060 0.0093 1320 TYR 171 O -0.0085 -0.0060 0.0095 1321 TYR 171 CB -0.0097 -0.0065 0.0101 1322 TYR 171 CG -0.0096 -0.0067 0.0107 1323 TYR 171 CD1 -0.0090 -0.0068 0.0112 1324 TYR 171 CD2 -0.0100 -0.0068 0.0107 1325 TYR 171 CE1 -0.0088 -0.0069 0.0117 1326 TYR 171 CE2 -0.0098 -0.0069 0.0112 1327 TYR 171 CZ -0.0093 -0.0070 0.0117 1328 TYR 171 OH -0.0091 -0.0072 0.0122 1329 HIS 172 N -0.0076 -0.0041 0.0055 1330 HIS 172 CA -0.0079 -0.0040 0.0048 1331 HIS 172 C -0.0068 -0.0037 0.0036 1332 HIS 172 O -0.0064 -0.0036 0.0035 1333 HIS 172 CB -0.0096 -0.0041 0.0041 1334 HIS 172 CG -0.0108 -0.0045 0.0054 1335 HIS 172 ND1 -0.0109 -0.0046 0.0063 1336 HIS 172 CD2 -0.0118 -0.0047 0.0059 1337 HIS 172 CE1 -0.0120 -0.0049 0.0073 1338 HIS 172 NE2 -0.0126 -0.0050 0.0071 1339 GLN 173 N -0.0062 -0.0034 0.0026 1340 GLN 173 CA -0.0051 -0.0031 0.0014 1341 GLN 173 C -0.0036 -0.0030 0.0022 1342 GLN 173 O -0.0028 -0.0029 0.0017 1343 GLN 173 CB -0.0048 -0.0029 0.0002 1344 GLN 173 CG -0.0040 -0.0029 0.0009 1345 GLN 173 CD -0.0036 -0.0026 -0.0003 1346 GLN 173 OE1 -0.0024 -0.0025 -0.0002 1347 GLN 173 NE2 -0.0047 -0.0026 -0.0014 1348 MET 174 N -0.0032 -0.0032 0.0035 1349 MET 174 CA -0.0018 -0.0032 0.0045 1350 MET 174 C -0.0019 -0.0033 0.0056 1351 MET 174 O -0.0008 -0.0032 0.0057 1352 MET 174 CB -0.0014 -0.0033 0.0054 1353 MET 174 CG -0.0000 -0.0032 0.0065 1354 MET 174 SD 0.0003 -0.0033 0.0071 1355 MET 174 CE -0.0002 -0.0037 0.0092 1356 THR 175 N -0.0020 -0.0041 0.0005 1357 THR 175 CA -0.0021 -0.0041 0.0008 1358 THR 175 C -0.0029 -0.0031 -0.0015 1359 THR 175 O -0.0024 -0.0033 -0.0016 1360 THR 175 CB -0.0037 -0.0040 0.0035 1361 THR 175 OG1 -0.0032 -0.0048 0.0055 1362 THR 175 CG2 -0.0031 -0.0046 0.0044 1363 ALA 176 N -0.0040 -0.0020 -0.0034 1364 ALA 176 CA -0.0048 -0.0010 -0.0057 1365 ALA 176 C -0.0026 -0.0017 -0.0073 1366 ALA 176 O -0.0029 -0.0014 -0.0077 1367 ALA 176 CB -0.0060 0.0001 -0.0076 1368 PRO 177 N -0.0004 -0.0026 -0.0082 1369 PRO 177 CA 0.0017 -0.0032 -0.0097 1370 PRO 177 C 0.0030 -0.0043 -0.0080 1371 PRO 177 O 0.0041 -0.0046 -0.0091 1372 PRO 177 CB 0.0035 -0.0037 -0.0110 1373 PRO 177 CG 0.0031 -0.0041 -0.0091 1374 PRO 177 CD 0.0002 -0.0029 -0.0082 1375 LEU 178 N 0.0010 -0.0022 -0.0063 1376 LEU 178 CA 0.0016 -0.0023 -0.0046 1377 LEU 178 C 0.0002 -0.0022 -0.0040 1378 LEU 178 O 0.0007 -0.0023 -0.0034 1379 LEU 178 CB 0.0019 -0.0025 -0.0031 1380 LEU 178 CG 0.0026 -0.0026 -0.0013 1381 LEU 178 CD1 0.0044 -0.0028 -0.0016 1382 LEU 178 CD2 0.0028 -0.0028 -0.0000 1383 ILE 179 N -0.0015 -0.0021 -0.0041 1384 ILE 179 CA -0.0030 -0.0019 -0.0036 1385 ILE 179 C -0.0029 -0.0019 -0.0049 1386 ILE 179 O -0.0030 -0.0019 -0.0043 1387 ILE 179 CB -0.0049 -0.0017 -0.0039 1388 ILE 179 CG1 -0.0051 -0.0018 -0.0028 1389 ILE 179 CG2 -0.0065 -0.0016 -0.0034 1390 ILE 179 CD1 -0.0047 -0.0020 -0.0008 1391 GLY 180 N -0.0026 -0.0018 -0.0067 1392 GLY 180 CA -0.0024 -0.0017 -0.0081 1393 GLY 180 C -0.0007 -0.0019 -0.0077 1394 GLY 180 O -0.0007 -0.0019 -0.0081 1395 TYR 181 N 0.0005 -0.0008 -0.0119 1396 TYR 181 CA 0.0037 -0.0004 -0.0105 1397 TYR 181 C 0.0030 -0.0010 -0.0071 1398 TYR 181 O 0.0040 -0.0009 -0.0065 1399 TYR 181 CB 0.0061 -0.0000 -0.0100 1400 TYR 181 CG 0.0094 0.0003 -0.0081 1401 TYR 181 CD1 0.0096 -0.0002 -0.0045 1402 TYR 181 CD2 0.0122 0.0010 -0.0098 1403 TYR 181 CE1 0.0126 0.0001 -0.0028 1404 TYR 181 CE2 0.0152 0.0014 -0.0081 1405 TYR 181 CZ 0.0154 0.0009 -0.0046 1406 TYR 181 OH 0.0184 0.0012 -0.0029 1407 TYR 182 N 0.0013 -0.0017 -0.0049 1408 TYR 182 CA 0.0006 -0.0023 -0.0015 1409 TYR 182 C -0.0018 -0.0027 -0.0015 1410 TYR 182 O -0.0017 -0.0030 0.0009 1411 TYR 182 CB -0.0007 -0.0028 0.0009 1412 TYR 182 CG 0.0022 -0.0025 0.0024 1413 TYR 182 CD1 0.0050 -0.0022 0.0041 1414 TYR 182 CD2 0.0024 -0.0024 0.0022 1415 TYR 182 CE1 0.0078 -0.0019 0.0054 1416 TYR 182 CE2 0.0052 -0.0021 0.0035 1417 TYR 182 CZ 0.0079 -0.0018 0.0051 1418 TYR 182 OH 0.0107 -0.0015 0.0063 1419 SER 183 N -0.0039 -0.0027 -0.0042 1420 SER 183 CA -0.0061 -0.0031 -0.0043 1421 SER 183 C -0.0039 -0.0026 -0.0052 1422 SER 183 O -0.0043 -0.0028 -0.0038 1423 SER 183 CB -0.0090 -0.0033 -0.0069 1424 SER 183 OG -0.0111 -0.0038 -0.0060 1425 LYS 184 N -0.0081 -0.0050 -0.0250 1426 LYS 184 CA -0.0034 -0.0053 -0.0293 1427 LYS 184 C 0.0018 -0.0048 -0.0217 1428 LYS 184 O 0.0019 -0.0048 -0.0218 1429 LYS 184 CB 0.0035 -0.0057 -0.0374 1430 LYS 184 CG -0.0007 -0.0063 -0.0475 1431 LYS 184 CD 0.0070 -0.0068 -0.0554 1432 LYS 184 CE 0.0026 -0.0073 -0.0653 1433 LYS 184 NZ 0.0096 -0.0078 -0.0732 1434 GLU 185 N 0.0059 -0.0044 -0.0148 1435 GLU 185 CA 0.0109 -0.0040 -0.0069 1436 GLU 185 C 0.0037 -0.0036 -0.0007 1437 GLU 185 O 0.0055 -0.0034 0.0024 1438 GLU 185 CB 0.0158 -0.0036 -0.0010 1439 GLU 185 CG 0.0249 -0.0039 -0.0054 1440 GLU 185 CD 0.0323 -0.0039 -0.0059 1441 GLU 185 OE1 0.0344 -0.0034 0.0015 1442 GLU 185 OE2 0.0358 -0.0043 -0.0138 1443 ALA 186 N -0.0045 -0.0035 0.0011 1444 ALA 186 CA -0.0120 -0.0032 0.0069 1445 ALA 186 C -0.0152 -0.0035 0.0024 1446 ALA 186 O -0.0162 -0.0032 0.0074 1447 ALA 186 CB -0.0203 -0.0032 0.0078 1448 GLU 187 N -0.0272 -0.0028 -0.0117 1449 GLU 187 CA -0.0316 -0.0033 -0.0196 1450 GLU 187 C -0.0207 -0.0035 -0.0197 1451 GLU 187 O -0.0235 -0.0035 -0.0205 1452 GLU 187 CB -0.0352 -0.0043 -0.0340 1453 GLU 187 CG -0.0489 -0.0042 -0.0356 1454 GLU 187 CD -0.0511 -0.0052 -0.0493 1455 GLU 187 OE1 -0.0467 -0.0061 -0.0596 1456 GLU 187 OE2 -0.0573 -0.0052 -0.0496 1457 ALA 188 N -0.0083 -0.0036 -0.0185 1458 ALA 188 CA 0.0028 -0.0037 -0.0182 1459 ALA 188 C 0.0038 -0.0027 -0.0045 1460 ALA 188 O 0.0116 -0.0027 -0.0024 1461 ALA 188 CB 0.0156 -0.0041 -0.0215 1462 GLY 189 N -0.0039 -0.0019 0.0049 1463 GLY 189 CA -0.0038 -0.0009 0.0184 1464 GLY 189 C 0.0073 -0.0004 0.0272 1465 GLY 189 O 0.0093 0.0004 0.0383 1466 ASN 190 N 0.0095 0.0025 0.0107 1467 ASN 190 CA 0.0114 0.0035 0.0114 1468 ASN 190 C 0.0096 0.0021 0.0124 1469 ASN 190 O 0.0110 0.0026 0.0137 1470 ASN 190 CB 0.0130 0.0056 0.0081 1471 ASN 190 CG 0.0159 0.0075 0.0079 1472 ASN 190 OD1 0.0181 0.0080 0.0105 1473 ASN 190 ND2 0.0160 0.0086 0.0047 1474 THR 191 N 0.0064 0.0003 0.0117 1475 THR 191 CA 0.0044 -0.0012 0.0124 1476 THR 191 C 0.0010 -0.0032 0.0120 1477 THR 191 O 0.0005 -0.0032 0.0111 1478 THR 191 CB 0.0046 -0.0002 0.0097 1479 THR 191 OG1 0.0029 -0.0016 0.0106 1480 THR 191 CG2 0.0032 0.0001 0.0059 1481 LYS 192 N -0.0012 -0.0049 0.0129 1482 LYS 192 CA -0.0046 -0.0069 0.0125 1483 LYS 192 C -0.0065 -0.0072 0.0097 1484 LYS 192 O -0.0061 -0.0070 0.0099 1485 LYS 192 CB -0.0059 -0.0089 0.0161 1486 LYS 192 CG -0.0045 -0.0089 0.0189 1487 LYS 192 CD -0.0016 -0.0079 0.0216 1488 LYS 192 CE -0.0026 -0.0096 0.0250 1489 LYS 192 NZ 0.0001 -0.0087 0.0276 1490 TYR 193 N -0.0072 -0.0070 0.0067 1491 TYR 193 CA -0.0067 -0.0073 0.0060 1492 TYR 193 C -0.0069 -0.0079 0.0060 1493 TYR 193 O -0.0074 -0.0083 0.0064 1494 TYR 193 CB -0.0065 -0.0078 0.0056 1495 TYR 193 CG -0.0061 -0.0083 0.0050 1496 TYR 193 CD1 -0.0055 -0.0080 0.0045 1497 TYR 193 CD2 -0.0064 -0.0092 0.0049 1498 TYR 193 CE1 -0.0052 -0.0085 0.0039 1499 TYR 193 CE2 -0.0061 -0.0097 0.0043 1500 TYR 193 CZ -0.0055 -0.0094 0.0038 1501 TYR 193 OH -0.0052 -0.0099 0.0033 1502 ALA 194 N -0.0065 -0.0079 0.0056 1503 ALA 194 CA -0.0067 -0.0084 0.0056 1504 ALA 194 C -0.0062 -0.0087 0.0049 1505 ALA 194 O -0.0057 -0.0082 0.0045 1506 ALA 194 CB -0.0070 -0.0080 0.0061 1507 LYS 195 N -0.0063 -0.0095 0.0047 1508 LYS 195 CA -0.0058 -0.0098 0.0040 1509 LYS 195 C -0.0059 -0.0099 0.0041 1510 LYS 195 O -0.0064 -0.0102 0.0045 1511 LYS 195 CB -0.0059 -0.0107 0.0037 1512 LYS 195 CG -0.0054 -0.0111 0.0030 1513 LYS 195 CD -0.0050 -0.0114 0.0025 1514 LYS 195 CE -0.0054 -0.0120 0.0026 1515 LYS 195 NZ -0.0057 -0.0117 0.0031 1516 VAL 196 N -0.0035 -0.0093 0.0069 1517 VAL 196 CA -0.0028 -0.0081 0.0067 1518 VAL 196 C -0.0015 -0.0081 0.0072 1519 VAL 196 O -0.0009 -0.0087 0.0078 1520 VAL 196 CB -0.0029 -0.0074 0.0063 1521 VAL 196 CG1 -0.0019 -0.0064 0.0063 1522 VAL 196 CG2 -0.0040 -0.0070 0.0056 1523 ASP 197 N -0.0012 -0.0075 0.0071 1524 ASP 197 CA 0.0001 -0.0075 0.0077 1525 ASP 197 C 0.0008 -0.0066 0.0076 1526 ASP 197 O 0.0008 -0.0056 0.0071 1527 ASP 197 CB 0.0002 -0.0071 0.0076 1528 ASP 197 CG 0.0014 -0.0072 0.0082 1529 ASP 197 OD1 0.0020 -0.0080 0.0088 1530 ASP 197 OD2 0.0018 -0.0066 0.0080 1531 GLY 198 N 0.0015 -0.0071 0.0081 1532 GLY 198 CA 0.0022 -0.0063 0.0081 1533 GLY 198 C 0.0034 -0.0058 0.0084 1534 GLY 198 O 0.0042 -0.0052 0.0084 1535 THR 199 N 0.0080 -0.0071 0.0082 1536 THR 199 CA 0.0116 -0.0046 0.0098 1537 THR 199 C 0.0119 -0.0003 0.0071 1538 THR 199 O 0.0146 0.0021 0.0080 1539 THR 199 CB 0.0127 -0.0064 0.0120 1540 THR 199 OG1 0.0105 -0.0062 0.0098 1541 THR 199 CG2 0.0121 -0.0108 0.0145 1542 LYS 200 N 0.0091 0.0007 0.0039 1543 LYS 200 CA 0.0091 0.0047 0.0012 1544 LYS 200 C 0.0101 0.0073 0.0003 1545 LYS 200 O 0.0101 0.0059 0.0013 1546 LYS 200 CB 0.0054 0.0045 -0.0021 1547 LYS 200 CG 0.0043 0.0032 -0.0022 1548 LYS 200 CD 0.0008 0.0036 -0.0057 1549 LYS 200 CE -0.0007 0.0022 -0.0061 1550 LYS 200 NZ -0.0040 0.0032 -0.0098 1551 PRO 201 N 0.0110 0.0113 -0.0016 1552 PRO 201 CA 0.0120 0.0140 -0.0026 1553 PRO 201 C 0.0088 0.0127 -0.0046 1554 PRO 201 O 0.0057 0.0117 -0.0067 1555 PRO 201 CB 0.0127 0.0182 -0.0048 1556 PRO 201 CG 0.0109 0.0173 -0.0057 1557 PRO 201 CD 0.0117 0.0136 -0.0025 1558 VAL 202 N 0.0129 0.0155 -0.0010 1559 VAL 202 CA 0.0121 0.0152 -0.0015 1560 VAL 202 C 0.0097 0.0167 -0.0030 1561 VAL 202 O 0.0081 0.0156 -0.0040 1562 VAL 202 CB 0.0140 0.0164 -0.0003 1563 VAL 202 CG1 0.0131 0.0167 -0.0009 1564 VAL 202 CG2 0.0161 0.0144 0.0010 1565 ALA 203 N 0.0094 0.0191 -0.0033 1566 ALA 203 CA 0.0072 0.0207 -0.0047 1567 ALA 203 C 0.0052 0.0191 -0.0059 1568 ALA 203 O 0.0031 0.0196 -0.0073 1569 ALA 203 CB 0.0076 0.0235 -0.0046 1570 GLU 204 N 0.0057 0.0175 -0.0056 1571 GLU 204 CA 0.0038 0.0160 -0.0067 1572 GLU 204 C 0.0031 0.0134 -0.0070 1573 GLU 204 O 0.0010 0.0129 -0.0083 1574 GLU 204 CB 0.0044 0.0152 -0.0063 1575 GLU 204 CG 0.0021 0.0147 -0.0077 1576 GLU 204 CD 0.0026 0.0146 -0.0073 1577 GLU 204 OE1 0.0045 0.0158 -0.0062 1578 GLU 204 OE2 0.0012 0.0133 -0.0082 1579 VAL 205 N 0.0057 0.0108 -0.0051 1580 VAL 205 CA 0.0047 0.0092 -0.0050 1581 VAL 205 C 0.0035 0.0093 -0.0062 1582 VAL 205 O 0.0023 0.0085 -0.0068 1583 VAL 205 CB 0.0054 0.0084 -0.0038 1584 VAL 205 CG1 0.0043 0.0069 -0.0037 1585 VAL 205 CG2 0.0065 0.0083 -0.0025 1586 ARG 206 N 0.0039 0.0104 -0.0067 1587 ARG 206 CA 0.0029 0.0107 -0.0078 1588 ARG 206 C 0.0020 0.0110 -0.0091 1589 ARG 206 O 0.0007 0.0104 -0.0099 1590 ARG 206 CB 0.0036 0.0120 -0.0081 1591 ARG 206 CG 0.0028 0.0123 -0.0091 1592 ARG 206 CD 0.0027 0.0138 -0.0103 1593 ARG 206 NE 0.0033 0.0149 -0.0105 1594 ARG 206 CZ 0.0026 0.0154 -0.0116 1595 ARG 206 NH1 0.0013 0.0150 -0.0126 1596 ARG 206 NH2 0.0032 0.0164 -0.0117 1597 ALA 207 N 0.0025 0.0120 -0.0092 1598 ALA 207 CA 0.0018 0.0124 -0.0103 1599 ALA 207 C 0.0008 0.0110 -0.0102 1600 ALA 207 O -0.0004 0.0107 -0.0112 1601 ALA 207 CB 0.0027 0.0135 -0.0102 1602 ASP 208 N 0.0026 0.0093 -0.0079 1603 ASP 208 CA 0.0022 0.0080 -0.0082 1604 ASP 208 C 0.0017 0.0068 -0.0086 1605 ASP 208 O 0.0010 0.0062 -0.0095 1606 ASP 208 CB 0.0027 0.0075 -0.0072 1607 ASP 208 CG 0.0030 0.0084 -0.0071 1608 ASP 208 OD1 0.0025 0.0092 -0.0080 1609 ASP 208 OD2 0.0036 0.0082 -0.0061 1610 LEU 209 N 0.0021 0.0065 -0.0079 1611 LEU 209 CA 0.0017 0.0053 -0.0081 1612 LEU 209 C 0.0009 0.0055 -0.0094 1613 LEU 209 O 0.0003 0.0045 -0.0100 1614 LEU 209 CB 0.0023 0.0051 -0.0071 1615 LEU 209 CG 0.0028 0.0043 -0.0060 1616 LEU 209 CD1 0.0033 0.0038 -0.0051 1617 LEU 209 CD2 0.0023 0.0030 -0.0064 1618 GLU 210 N 0.0009 0.0069 -0.0098 1619 GLU 210 CA 0.0002 0.0072 -0.0110 1620 GLU 210 C -0.0005 0.0069 -0.0121 1621 GLU 210 O -0.0012 0.0065 -0.0130 1622 GLU 210 CB 0.0004 0.0087 -0.0112 1623 GLU 210 CG 0.0009 0.0089 -0.0104 1624 GLU 210 CD 0.0009 0.0102 -0.0109 1625 GLU 210 OE1 0.0003 0.0102 -0.0118 1626 GLU 210 OE2 0.0015 0.0113 -0.0103 1627 LYS 211 N 0.0016 0.0071 -0.0060 1628 LYS 211 CA 0.0009 0.0069 -0.0072 1629 LYS 211 C 0.0006 0.0050 -0.0073 1630 LYS 211 O -0.0001 0.0046 -0.0083 1631 LYS 211 CB 0.0011 0.0080 -0.0070 1632 LYS 211 CG 0.0010 0.0099 -0.0074 1633 LYS 211 CD 0.0019 0.0111 -0.0063 1634 LYS 211 CE 0.0021 0.0108 -0.0059 1635 LYS 211 NZ 0.0030 0.0118 -0.0046 1636 ILE 212 N 0.0011 0.0039 -0.0063 1637 ILE 212 CA 0.0009 0.0021 -0.0063 1638 ILE 212 C 0.0005 0.0011 -0.0068 1639 ILE 212 O -0.0001 -0.0001 -0.0076 1640 ILE 212 CB 0.0019 0.0013 -0.0047 1641 ILE 212 CG1 0.0022 0.0019 -0.0043 1642 ILE 212 CG2 0.0017 -0.0006 -0.0046 1643 ILE 212 CD1 0.0031 0.0013 -0.0027 1644 LEU 213 N 0.0008 0.0016 -0.0064 1645 LEU 213 CA 0.0005 0.0007 -0.0067 1646 LEU 213 C -0.0002 0.0014 -0.0080 1647 LEU 213 O -0.0008 0.0004 -0.0088 1648 LEU 213 CB 0.0014 0.0008 -0.0054 1649 LEU 213 CG 0.0022 -0.0000 -0.0040 1650 LEU 213 CD1 0.0030 0.0003 -0.0027 1651 LEU 213 CD2 0.0018 -0.0019 -0.0042 1652 GLY 214 N 0.0025 0.0051 -0.0094 1653 GLY 214 CA 0.0022 0.0055 -0.0114 1654 GLY 214 C 0.0012 0.0053 -0.0126 1655 GLY 214 O 0.0021 0.0059 -0.0131 1656 GLY 214 OXT -0.0005 0.0046 -0.0129 1657 MET 1 N 0.0107 -0.0104 0.0012 1658 MET 1 CA 0.0110 -0.0098 0.0012 1659 MET 1 C 0.0115 -0.0095 0.0012 1660 MET 1 O 0.0120 -0.0098 0.0012 1661 MET 1 CB 0.0113 -0.0101 0.0012 1662 MET 1 CG 0.0115 -0.0096 0.0012 1663 MET 1 SD 0.0109 -0.0090 0.0010 1664 MET 1 CE 0.0105 -0.0095 0.0011 1665 ARG 2 N 0.0115 -0.0089 0.0011 1666 ARG 2 CA 0.0120 -0.0086 0.0011 1667 ARG 2 C 0.0122 -0.0080 0.0010 1668 ARG 2 O 0.0118 -0.0076 0.0009 1669 ARG 2 CB 0.0117 -0.0083 0.0010 1670 ARG 2 CG 0.0114 -0.0088 0.0011 1671 ARG 2 CD 0.0109 -0.0086 0.0010 1672 ARG 2 NE 0.0109 -0.0088 0.0010 1673 ARG 2 CZ 0.0108 -0.0085 0.0010 1674 ARG 2 NH1 0.0105 -0.0079 0.0009 1675 ARG 2 NH2 0.0108 -0.0088 0.0010 1676 ILE 3 N 0.0128 -0.0080 0.0010 1677 ILE 3 CA 0.0131 -0.0076 0.0010 1678 ILE 3 C 0.0137 -0.0072 0.0010 1679 ILE 3 O 0.0141 -0.0075 0.0011 1680 ILE 3 CB 0.0134 -0.0080 0.0011 1681 ILE 3 CG1 0.0128 -0.0082 0.0011 1682 ILE 3 CG2 0.0138 -0.0076 0.0011 1683 ILE 3 CD1 0.0129 -0.0088 0.0012 1684 ILE 4 N 0.0127 -0.0038 0.0013 1685 ILE 4 CA 0.0136 -0.0034 0.0023 1686 ILE 4 C 0.0127 -0.0030 0.0026 1687 ILE 4 O 0.0115 -0.0025 0.0028 1688 ILE 4 CB 0.0139 -0.0029 0.0034 1689 ILE 4 CG1 0.0151 -0.0034 0.0032 1690 ILE 4 CG2 0.0144 -0.0023 0.0046 1691 ILE 4 CD1 0.0153 -0.0029 0.0042 1692 LEU 5 N 0.0132 -0.0031 0.0026 1693 LEU 5 CA 0.0125 -0.0027 0.0029 1694 LEU 5 C 0.0130 -0.0022 0.0041 1695 LEU 5 O 0.0142 -0.0024 0.0043 1696 LEU 5 CB 0.0125 -0.0033 0.0019 1697 LEU 5 CG 0.0116 -0.0030 0.0020 1698 LEU 5 CD1 0.0101 -0.0027 0.0017 1699 LEU 5 CD2 0.0118 -0.0036 0.0011 1700 LEU 6 N 0.0123 -0.0014 0.0050 1701 LEU 6 CA 0.0128 -0.0008 0.0063 1702 LEU 6 C 0.0120 -0.0004 0.0065 1703 LEU 6 O 0.0108 -0.0003 0.0060 1704 LEU 6 CB 0.0126 -0.0001 0.0072 1705 LEU 6 CG 0.0132 -0.0004 0.0070 1706 LEU 6 CD1 0.0129 0.0003 0.0081 1707 LEU 6 CD2 0.0147 -0.0009 0.0070 1708 GLY 7 N 0.0040 -0.0025 0.0104 1709 GLY 7 CA 0.0031 -0.0040 0.0096 1710 GLY 7 C -0.0005 -0.0053 0.0078 1711 GLY 7 O -0.0025 -0.0038 0.0073 1712 ALA 8 N -0.0012 -0.0081 0.0068 1713 ALA 8 CA -0.0045 -0.0097 0.0050 1714 ALA 8 C -0.0075 -0.0071 0.0044 1715 ALA 8 O -0.0071 -0.0045 0.0052 1716 ALA 8 CB -0.0044 -0.0131 0.0042 1717 PRO 9 N -0.0105 -0.0076 0.0030 1718 PRO 9 CA -0.0134 -0.0051 0.0025 1719 PRO 9 C -0.0138 -0.0057 0.0021 1720 PRO 9 O -0.0144 -0.0087 0.0012 1721 PRO 9 CB -0.0164 -0.0062 0.0009 1722 PRO 9 CG -0.0153 -0.0102 0.0004 1723 PRO 9 CD -0.0115 -0.0099 0.0020 1724 GLY 10 N -0.0080 -0.0070 0.0057 1725 GLY 10 CA -0.0084 -0.0062 0.0058 1726 GLY 10 C -0.0067 -0.0058 0.0057 1727 GLY 10 O -0.0068 -0.0053 0.0058 1728 ALA 11 N -0.0050 -0.0062 0.0054 1729 ALA 11 CA -0.0033 -0.0059 0.0053 1730 ALA 11 C -0.0028 -0.0038 0.0055 1731 ALA 11 O -0.0017 -0.0033 0.0054 1732 ALA 11 CB -0.0018 -0.0069 0.0049 1733 GLY 12 N -0.0035 -0.0026 0.0058 1734 GLY 12 CA -0.0031 -0.0006 0.0060 1735 GLY 12 C -0.0013 0.0000 0.0059 1736 GLY 12 O -0.0005 0.0014 0.0060 1737 LYS 13 N 0.0057 0.0019 0.0059 1738 LYS 13 CA 0.0048 0.0011 0.0048 1739 LYS 13 C 0.0049 -0.0004 0.0046 1740 LYS 13 O 0.0041 -0.0009 0.0037 1741 LYS 13 CB 0.0046 0.0010 0.0046 1742 LYS 13 CG 0.0055 0.0008 0.0055 1743 LYS 13 CD 0.0054 0.0001 0.0052 1744 LYS 13 CE 0.0064 -0.0005 0.0062 1745 LYS 13 NZ 0.0063 -0.0015 0.0059 1746 GLY 14 N 0.0058 -0.0011 0.0054 1747 GLY 14 CA 0.0060 -0.0025 0.0053 1748 GLY 14 C 0.0057 -0.0026 0.0049 1749 GLY 14 O 0.0054 -0.0037 0.0045 1750 THR 15 N 0.0055 -0.0013 0.0051 1751 THR 15 CA 0.0052 -0.0012 0.0048 1752 THR 15 C 0.0041 -0.0017 0.0036 1753 THR 15 O 0.0039 -0.0023 0.0032 1754 THR 15 CB 0.0051 0.0004 0.0050 1755 THR 15 OG1 0.0043 0.0013 0.0044 1756 THR 15 CG2 0.0062 0.0009 0.0062 1757 GLN 16 N 0.0096 0.0006 0.0043 1758 GLN 16 CA 0.0069 -0.0003 0.0021 1759 GLN 16 C 0.0079 -0.0031 0.0007 1760 GLN 16 O 0.0058 -0.0041 -0.0013 1761 GLN 16 CB 0.0046 0.0026 0.0027 1762 GLN 16 CG 0.0033 0.0052 0.0037 1763 GLN 16 CD 0.0012 0.0044 0.0019 1764 GLN 16 OE1 -0.0001 0.0024 -0.0004 1765 GLN 16 NE2 0.0010 0.0059 0.0028 1766 ALA 17 N 0.0111 -0.0044 0.0017 1767 ALA 17 CA 0.0124 -0.0070 0.0007 1768 ALA 17 C 0.0118 -0.0100 -0.0018 1769 ALA 17 O 0.0106 -0.0115 -0.0036 1770 ALA 17 CB 0.0159 -0.0074 0.0026 1771 GLN 18 N 0.0128 -0.0110 -0.0019 1772 GLN 18 CA 0.0123 -0.0139 -0.0042 1773 GLN 18 C 0.0088 -0.0139 -0.0064 1774 GLN 18 O 0.0081 -0.0162 -0.0085 1775 GLN 18 CB 0.0133 -0.0145 -0.0040 1776 GLN 18 CG 0.0159 -0.0176 -0.0047 1777 GLN 18 CD 0.0166 -0.0182 -0.0046 1778 GLN 18 OE1 0.0193 -0.0183 -0.0030 1779 GLN 18 NE2 0.0142 -0.0187 -0.0065 1780 PHE 19 N 0.0110 -0.0086 0.0003 1781 PHE 19 CA 0.0087 -0.0079 -0.0018 1782 PHE 19 C 0.0082 -0.0089 -0.0032 1783 PHE 19 O 0.0070 -0.0100 -0.0053 1784 PHE 19 CB 0.0075 -0.0049 -0.0010 1785 PHE 19 CG 0.0053 -0.0040 -0.0029 1786 PHE 19 CD1 0.0040 -0.0047 -0.0049 1787 PHE 19 CD2 0.0044 -0.0024 -0.0027 1788 PHE 19 CE1 0.0019 -0.0039 -0.0067 1789 PHE 19 CE2 0.0024 -0.0016 -0.0045 1790 PHE 19 CZ 0.0011 -0.0024 -0.0065 1791 ILE 20 N 0.0090 -0.0086 -0.0020 1792 ILE 20 CA 0.0086 -0.0095 -0.0031 1793 ILE 20 C 0.0095 -0.0124 -0.0042 1794 ILE 20 O 0.0085 -0.0134 -0.0060 1795 ILE 20 CB 0.0094 -0.0084 -0.0014 1796 ILE 20 CG1 0.0081 -0.0055 -0.0007 1797 ILE 20 CG2 0.0092 -0.0095 -0.0024 1798 ILE 20 CD1 0.0091 -0.0041 0.0013 1799 MET 21 N 0.0114 -0.0137 -0.0030 1800 MET 21 CA 0.0124 -0.0165 -0.0038 1801 MET 21 C 0.0112 -0.0176 -0.0060 1802 MET 21 O 0.0107 -0.0193 -0.0078 1803 MET 21 CB 0.0146 -0.0175 -0.0020 1804 MET 21 CG 0.0162 -0.0169 0.0002 1805 MET 21 SD 0.0188 -0.0188 0.0019 1806 MET 21 CE 0.0195 -0.0166 0.0041 1807 GLU 22 N 0.0130 -0.0162 0.0002 1808 GLU 22 CA 0.0120 -0.0174 -0.0010 1809 GLU 22 C 0.0096 -0.0168 -0.0026 1810 GLU 22 O 0.0086 -0.0183 -0.0038 1811 GLU 22 CB 0.0127 -0.0167 -0.0003 1812 GLU 22 CG 0.0125 -0.0186 -0.0010 1813 GLU 22 CD 0.0135 -0.0181 -0.0000 1814 GLU 22 OE1 0.0153 -0.0175 0.0015 1815 GLU 22 OE2 0.0126 -0.0184 -0.0008 1816 LYS 23 N 0.0088 -0.0147 -0.0026 1817 LYS 23 CA 0.0066 -0.0141 -0.0041 1818 LYS 23 C 0.0058 -0.0154 -0.0051 1819 LYS 23 O 0.0043 -0.0164 -0.0065 1820 LYS 23 CB 0.0059 -0.0113 -0.0037 1821 LYS 23 CG 0.0036 -0.0105 -0.0052 1822 LYS 23 CD 0.0027 -0.0082 -0.0052 1823 LYS 23 CE 0.0006 -0.0068 -0.0064 1824 LYS 23 NZ -0.0011 -0.0082 -0.0081 1825 TYR 24 N 0.0070 -0.0155 -0.0042 1826 TYR 24 CA 0.0064 -0.0165 -0.0050 1827 TYR 24 C 0.0075 -0.0190 -0.0049 1828 TYR 24 O 0.0068 -0.0200 -0.0057 1829 TYR 24 CB 0.0065 -0.0146 -0.0043 1830 TYR 24 CG 0.0051 -0.0122 -0.0046 1831 TYR 24 CD1 0.0030 -0.0118 -0.0061 1832 TYR 24 CD2 0.0059 -0.0103 -0.0034 1833 TYR 24 CE1 0.0017 -0.0097 -0.0064 1834 TYR 24 CE2 0.0046 -0.0082 -0.0037 1835 TYR 24 CZ 0.0026 -0.0079 -0.0052 1836 TYR 24 OH 0.0013 -0.0058 -0.0055 1837 GLY 25 N 0.0123 -0.0157 0.0058 1838 GLY 25 CA 0.0125 -0.0158 0.0057 1839 GLY 25 C 0.0127 -0.0146 0.0055 1840 GLY 25 O 0.0122 -0.0143 0.0057 1841 ILE 26 N 0.0133 -0.0139 0.0051 1842 ILE 26 CA 0.0135 -0.0128 0.0048 1843 ILE 26 C 0.0147 -0.0127 0.0042 1844 ILE 26 O 0.0152 -0.0133 0.0039 1845 ILE 26 CB 0.0130 -0.0119 0.0050 1846 ILE 26 CG1 0.0135 -0.0121 0.0048 1847 ILE 26 CG2 0.0119 -0.0121 0.0057 1848 ILE 26 CD1 0.0131 -0.0112 0.0050 1849 PRO 27 N 0.0151 -0.0119 0.0039 1850 PRO 27 CA 0.0162 -0.0118 0.0033 1851 PRO 27 C 0.0165 -0.0108 0.0030 1852 PRO 27 O 0.0159 -0.0100 0.0032 1853 PRO 27 CB 0.0164 -0.0115 0.0031 1854 PRO 27 CG 0.0154 -0.0108 0.0036 1855 PRO 27 CD 0.0146 -0.0115 0.0041 1856 GLN 28 N 0.0151 -0.0085 0.0079 1857 GLN 28 CA 0.0160 -0.0078 0.0055 1858 GLN 28 C 0.0148 -0.0062 0.0041 1859 GLN 28 O 0.0147 -0.0062 0.0042 1860 GLN 28 CB 0.0183 -0.0090 0.0047 1861 GLN 28 CG 0.0194 -0.0084 0.0022 1862 GLN 28 CD 0.0217 -0.0096 0.0016 1863 GLN 28 OE1 0.0224 -0.0108 0.0027 1864 GLN 28 NE2 0.0229 -0.0095 -0.0002 1865 ILE 29 N 0.0141 -0.0049 0.0027 1866 ILE 29 CA 0.0128 -0.0033 0.0013 1867 ILE 29 C 0.0138 -0.0026 -0.0011 1868 ILE 29 O 0.0143 -0.0026 -0.0019 1869 ILE 29 CB 0.0107 -0.0021 0.0019 1870 ILE 29 CG1 0.0096 -0.0027 0.0044 1871 ILE 29 CG2 0.0094 -0.0004 0.0004 1872 ILE 29 CD1 0.0076 -0.0017 0.0050 1873 SER 30 N 0.0140 -0.0020 -0.0024 1874 SER 30 CA 0.0148 -0.0012 -0.0048 1875 SER 30 C 0.0131 0.0004 -0.0056 1876 SER 30 O 0.0121 0.0005 -0.0046 1877 SER 30 CB 0.0169 -0.0023 -0.0056 1878 SER 30 OG 0.0168 -0.0027 -0.0047 1879 THR 31 N 0.0045 0.0029 -0.0064 1880 THR 31 CA 0.0033 0.0031 -0.0068 1881 THR 31 C 0.0023 0.0034 -0.0071 1882 THR 31 O 0.0013 0.0040 -0.0069 1883 THR 31 CB 0.0033 0.0025 -0.0078 1884 THR 31 OG1 0.0036 0.0018 -0.0087 1885 THR 31 CG2 0.0043 0.0022 -0.0075 1886 GLY 32 N 0.0027 0.0031 -0.0074 1887 GLY 32 CA 0.0018 0.0033 -0.0076 1888 GLY 32 C 0.0013 0.0042 -0.0066 1889 GLY 32 O 0.0002 0.0047 -0.0066 1890 ASP 33 N 0.0021 0.0045 -0.0056 1891 ASP 33 CA 0.0018 0.0053 -0.0046 1892 ASP 33 C 0.0010 0.0058 -0.0043 1893 ASP 33 O -0.0000 0.0064 -0.0041 1894 ASP 33 CB 0.0029 0.0055 -0.0036 1895 ASP 33 CG 0.0035 0.0052 -0.0035 1896 ASP 33 OD1 0.0029 0.0051 -0.0041 1897 ASP 33 OD2 0.0045 0.0051 -0.0029 1898 MET 34 N -0.0047 0.0028 -0.0032 1899 MET 34 CA -0.0055 0.0024 -0.0035 1900 MET 34 C -0.0058 0.0022 -0.0034 1901 MET 34 O -0.0063 0.0017 -0.0033 1902 MET 34 CB -0.0059 0.0029 -0.0042 1903 MET 34 CG -0.0066 0.0025 -0.0044 1904 MET 34 SD -0.0069 0.0031 -0.0053 1905 MET 34 CE -0.0068 0.0035 -0.0057 1906 LEU 35 N -0.0053 0.0027 -0.0036 1907 LEU 35 CA -0.0055 0.0025 -0.0035 1908 LEU 35 C -0.0052 0.0021 -0.0027 1909 LEU 35 O -0.0056 0.0016 -0.0025 1910 LEU 35 CB -0.0051 0.0032 -0.0039 1911 LEU 35 CG -0.0054 0.0036 -0.0047 1912 LEU 35 CD1 -0.0048 0.0043 -0.0050 1913 LEU 35 CD2 -0.0061 0.0034 -0.0050 1914 ARG 36 N -0.0045 0.0022 -0.0023 1915 ARG 36 CA -0.0042 0.0018 -0.0016 1916 ARG 36 C -0.0047 0.0011 -0.0012 1917 ARG 36 O -0.0049 0.0006 -0.0009 1918 ARG 36 CB -0.0034 0.0020 -0.0012 1919 ARG 36 CG -0.0028 0.0025 -0.0014 1920 ARG 36 CD -0.0020 0.0028 -0.0010 1921 ARG 36 NE -0.0018 0.0032 -0.0013 1922 ARG 36 CZ -0.0016 0.0038 -0.0019 1923 ARG 36 NH1 -0.0017 0.0041 -0.0022 1924 ARG 36 NH2 -0.0014 0.0041 -0.0021 1925 ALA 37 N -0.0074 -0.0058 -0.0053 1926 ALA 37 CA -0.0087 -0.0100 -0.0067 1927 ALA 37 C -0.0089 -0.0106 -0.0069 1928 ALA 37 O -0.0075 -0.0141 -0.0074 1929 ALA 37 CB -0.0131 -0.0111 -0.0082 1930 ALA 38 N -0.0107 -0.0072 -0.0065 1931 ALA 38 CA -0.0110 -0.0074 -0.0067 1932 ALA 38 C -0.0066 -0.0080 -0.0057 1933 ALA 38 O -0.0064 -0.0100 -0.0061 1934 ALA 38 CB -0.0138 -0.0034 -0.0064 1935 VAL 39 N -0.0032 -0.0060 -0.0043 1936 VAL 39 CA 0.0012 -0.0062 -0.0032 1937 VAL 39 C 0.0031 -0.0110 -0.0039 1938 VAL 39 O 0.0049 -0.0130 -0.0039 1939 VAL 39 CB 0.0043 -0.0031 -0.0016 1940 VAL 39 CG1 0.0090 -0.0042 -0.0006 1941 VAL 39 CG2 0.0029 0.0018 -0.0007 1942 LYS 40 N 0.0079 -0.0197 -0.0079 1943 LYS 40 CA 0.0109 -0.0283 -0.0110 1944 LYS 40 C 0.0087 -0.0329 -0.0127 1945 LYS 40 O 0.0146 -0.0353 -0.0134 1946 LYS 40 CB 0.0066 -0.0323 -0.0126 1947 LYS 40 CG 0.0065 -0.0418 -0.0161 1948 LYS 40 CD -0.0026 -0.0455 -0.0178 1949 LYS 40 CE -0.0100 -0.0428 -0.0170 1950 LYS 40 NZ -0.0191 -0.0448 -0.0180 1951 SER 41 N 0.0002 -0.0340 -0.0134 1952 SER 41 CA -0.0024 -0.0381 -0.0150 1953 SER 41 C -0.0030 -0.0315 -0.0126 1954 SER 41 O -0.0099 -0.0276 -0.0114 1955 SER 41 CB -0.0111 -0.0428 -0.0171 1956 SER 41 OG -0.0177 -0.0382 -0.0156 1957 GLY 42 N 0.0047 -0.0298 -0.0117 1958 GLY 42 CA 0.0055 -0.0237 -0.0094 1959 GLY 42 C -0.0018 -0.0237 -0.0096 1960 GLY 42 O -0.0028 -0.0293 -0.0118 1961 SER 43 N -0.0038 -0.0134 -0.0074 1962 SER 43 CA -0.0068 -0.0126 -0.0065 1963 SER 43 C -0.0056 -0.0085 -0.0045 1964 SER 43 O -0.0029 -0.0069 -0.0041 1965 SER 43 CB -0.0112 -0.0132 -0.0061 1966 SER 43 OG -0.0114 -0.0121 -0.0055 1967 GLU 44 N -0.0073 -0.0068 -0.0034 1968 GLU 44 CA -0.0063 -0.0029 -0.0015 1969 GLU 44 C -0.0065 -0.0007 -0.0003 1970 GLU 44 O -0.0034 0.0006 -0.0000 1971 GLU 44 CB -0.0092 -0.0016 -0.0003 1972 GLU 44 CG -0.0087 0.0026 0.0018 1973 GLU 44 CD -0.0048 0.0037 0.0018 1974 GLU 44 OE1 -0.0036 0.0017 0.0006 1975 GLU 44 OE2 -0.0028 0.0066 0.0031 1976 LEU 45 N -0.0102 -0.0007 0.0003 1977 LEU 45 CA -0.0110 0.0012 0.0015 1978 LEU 45 C -0.0082 0.0003 0.0005 1979 LEU 45 O -0.0062 0.0028 0.0016 1980 LEU 45 CB -0.0155 0.0004 0.0017 1981 LEU 45 CG -0.0188 0.0024 0.0033 1982 LEU 45 CD1 -0.0171 0.0045 0.0042 1983 LEU 45 CD2 -0.0224 -0.0002 0.0025 1984 GLY 46 N -0.0063 -0.0025 -0.0056 1985 GLY 46 CA -0.0042 -0.0031 -0.0056 1986 GLY 46 C -0.0007 -0.0025 -0.0048 1987 GLY 46 O 0.0011 -0.0020 -0.0042 1988 LYS 47 N 0.0003 -0.0028 -0.0048 1989 LYS 47 CA 0.0035 -0.0023 -0.0040 1990 LYS 47 C 0.0036 0.0009 -0.0022 1991 LYS 47 O 0.0061 0.0021 -0.0013 1992 LYS 47 CB 0.0043 -0.0036 -0.0046 1993 LYS 47 CG 0.0049 -0.0069 -0.0063 1994 LYS 47 CD 0.0083 -0.0080 -0.0064 1995 LYS 47 CE 0.0088 -0.0083 -0.0065 1996 LYS 47 NZ 0.0120 -0.0097 -0.0068 1997 GLN 48 N 0.0010 0.0024 -0.0018 1998 GLN 48 CA 0.0010 0.0055 -0.0001 1999 GLN 48 C 0.0009 0.0067 0.0005 2000 GLN 48 O 0.0026 0.0087 0.0018 2001 GLN 48 CB -0.0019 0.0068 0.0001 2002 GLN 48 CG -0.0019 0.0057 -0.0005 2003 GLN 48 CD -0.0041 0.0075 0.0002 2004 GLN 48 OE1 -0.0053 0.0099 0.0013 2005 GLN 48 NE2 -0.0046 0.0064 -0.0005 2006 ALA 49 N -0.0030 0.0028 0.0003 2007 ALA 49 CA -0.0034 0.0040 0.0009 2008 ALA 49 C -0.0014 0.0037 0.0017 2009 ALA 49 O -0.0008 0.0051 0.0029 2010 ALA 49 CB -0.0051 0.0035 -0.0003 2011 LYS 50 N -0.0004 0.0019 0.0009 2012 LYS 50 CA 0.0015 0.0013 0.0016 2013 LYS 50 C 0.0032 0.0023 0.0030 2014 LYS 50 O 0.0044 0.0028 0.0040 2015 LYS 50 CB 0.0023 -0.0009 0.0005 2016 LYS 50 CG 0.0045 -0.0016 0.0011 2017 LYS 50 CD 0.0052 -0.0039 0.0000 2018 LYS 50 CE 0.0075 -0.0046 0.0007 2019 LYS 50 NZ 0.0092 -0.0046 0.0015 2020 ASP 51 N 0.0034 0.0024 0.0032 2021 ASP 51 CA 0.0050 0.0033 0.0046 2022 ASP 51 C 0.0046 0.0054 0.0058 2023 ASP 51 O 0.0060 0.0062 0.0071 2024 ASP 51 CB 0.0049 0.0030 0.0044 2025 ASP 51 CG 0.0067 0.0012 0.0041 2026 ASP 51 OD1 0.0083 0.0007 0.0045 2027 ASP 51 OD2 0.0064 0.0004 0.0034 2028 ILE 52 N -0.0016 0.0036 0.0057 2029 ILE 52 CA -0.0018 0.0051 0.0061 2030 ILE 52 C -0.0014 0.0057 0.0068 2031 ILE 52 O -0.0008 0.0064 0.0076 2032 ILE 52 CB -0.0030 0.0057 0.0053 2033 ILE 52 CG1 -0.0033 0.0055 0.0050 2034 ILE 52 CG2 -0.0034 0.0071 0.0056 2035 ILE 52 CD1 -0.0045 0.0060 0.0041 2036 MET 53 N -0.0017 0.0053 0.0064 2037 MET 53 CA -0.0013 0.0058 0.0069 2038 MET 53 C -0.0001 0.0053 0.0078 2039 MET 53 O 0.0004 0.0061 0.0085 2040 MET 53 CB -0.0019 0.0052 0.0062 2041 MET 53 CG -0.0031 0.0056 0.0052 2042 MET 53 SD -0.0037 0.0053 0.0046 2043 MET 53 CE -0.0026 0.0055 0.0056 2044 ASP 54 N 0.0004 0.0041 0.0077 2045 ASP 54 CA 0.0016 0.0036 0.0086 2046 ASP 54 C 0.0021 0.0044 0.0094 2047 ASP 54 O 0.0030 0.0045 0.0102 2048 ASP 54 CB 0.0019 0.0021 0.0083 2049 ASP 54 CG 0.0021 0.0013 0.0081 2050 ASP 54 OD1 0.0028 0.0015 0.0087 2051 ASP 54 OD2 0.0015 0.0005 0.0072 2052 ALA 55 N 0.0007 0.0041 0.0087 2053 ALA 55 CA 0.0010 0.0047 0.0092 2054 ALA 55 C 0.0011 0.0067 0.0094 2055 ALA 55 O 0.0013 0.0075 0.0097 2056 ALA 55 CB 0.0003 0.0042 0.0081 2057 GLY 56 N 0.0009 0.0076 0.0092 2058 GLY 56 CA 0.0009 0.0094 0.0093 2059 GLY 56 C 0.0000 0.0105 0.0083 2060 GLY 56 O 0.0001 0.0120 0.0085 2061 LYS 57 N -0.0008 0.0096 0.0070 2062 LYS 57 CA -0.0017 0.0104 0.0059 2063 LYS 57 C -0.0025 0.0110 0.0048 2064 LYS 57 O -0.0025 0.0103 0.0047 2065 LYS 57 CB -0.0022 0.0091 0.0051 2066 LYS 57 CG -0.0015 0.0085 0.0060 2067 LYS 57 CD -0.0019 0.0068 0.0053 2068 LYS 57 CE -0.0012 0.0059 0.0063 2069 LYS 57 NZ -0.0015 0.0041 0.0057 2070 LEU 58 N -0.0002 0.0170 -0.0012 2071 LEU 58 CA -0.0006 0.0173 -0.0017 2072 LEU 58 C -0.0018 0.0163 -0.0024 2073 LEU 58 O -0.0025 0.0160 -0.0029 2074 LEU 58 CB -0.0005 0.0188 -0.0025 2075 LEU 58 CG -0.0008 0.0194 -0.0031 2076 LEU 58 CD1 -0.0000 0.0209 -0.0031 2077 LEU 58 CD2 -0.0021 0.0194 -0.0042 2078 VAL 59 N -0.0021 0.0159 -0.0024 2079 VAL 59 CA -0.0032 0.0149 -0.0030 2080 VAL 59 C -0.0041 0.0157 -0.0042 2081 VAL 59 O -0.0039 0.0169 -0.0047 2082 VAL 59 CB -0.0033 0.0142 -0.0027 2083 VAL 59 CG1 -0.0044 0.0129 -0.0031 2084 VAL 59 CG2 -0.0023 0.0137 -0.0015 2085 THR 60 N -0.0050 0.0151 -0.0048 2086 THR 60 CA -0.0059 0.0158 -0.0060 2087 THR 60 C -0.0065 0.0159 -0.0066 2088 THR 60 O -0.0068 0.0149 -0.0063 2089 THR 60 CB -0.0068 0.0149 -0.0063 2090 THR 60 OG1 -0.0077 0.0155 -0.0075 2091 THR 60 CG2 -0.0073 0.0134 -0.0061 2092 ASP 61 N -0.0032 0.0191 -0.0112 2093 ASP 61 CA -0.0039 0.0181 -0.0100 2094 ASP 61 C -0.0074 0.0172 -0.0083 2095 ASP 61 O -0.0083 0.0157 -0.0066 2096 ASP 61 CB -0.0042 0.0201 -0.0120 2097 ASP 61 CG -0.0007 0.0208 -0.0134 2098 ASP 61 OD1 0.0021 0.0196 -0.0127 2099 ASP 61 OD2 -0.0008 0.0225 -0.0152 2100 GLU 62 N -0.0096 0.0182 -0.0090 2101 GLU 62 CA -0.0130 0.0176 -0.0077 2102 GLU 62 C -0.0128 0.0149 -0.0049 2103 GLU 62 O -0.0147 0.0135 -0.0031 2104 GLU 62 CB -0.0151 0.0194 -0.0093 2105 GLU 62 CG -0.0164 0.0220 -0.0118 2106 GLU 62 CD -0.0135 0.0235 -0.0140 2107 GLU 62 OE1 -0.0115 0.0244 -0.0152 2108 GLU 62 OE2 -0.0133 0.0240 -0.0145 2109 LEU 63 N -0.0104 0.0142 -0.0046 2110 LEU 63 CA -0.0100 0.0117 -0.0021 2111 LEU 63 C -0.0084 0.0100 -0.0005 2112 LEU 63 O -0.0098 0.0082 0.0017 2113 LEU 63 CB -0.0077 0.0115 -0.0022 2114 LEU 63 CG -0.0096 0.0111 -0.0015 2115 LEU 63 CD1 -0.0069 0.0102 -0.0010 2116 LEU 63 CD2 -0.0122 0.0092 0.0010 2117 VAL 64 N -0.0073 0.0097 -0.0026 2118 VAL 64 CA -0.0055 0.0092 -0.0016 2119 VAL 64 C -0.0056 0.0091 -0.0007 2120 VAL 64 O -0.0051 0.0088 0.0011 2121 VAL 64 CB -0.0036 0.0091 -0.0029 2122 VAL 64 CG1 -0.0017 0.0086 -0.0019 2123 VAL 64 CG2 -0.0033 0.0091 -0.0033 2124 ILE 65 N -0.0063 0.0094 -0.0018 2125 ILE 65 CA -0.0064 0.0093 -0.0010 2126 ILE 65 C -0.0079 0.0094 0.0008 2127 ILE 65 O -0.0077 0.0091 0.0021 2128 ILE 65 CB -0.0069 0.0097 -0.0026 2129 ILE 65 CG1 -0.0051 0.0095 -0.0040 2130 ILE 65 CG2 -0.0073 0.0096 -0.0016 2131 ILE 65 CD1 -0.0033 0.0090 -0.0030 2132 ALA 66 N -0.0095 0.0097 0.0008 2133 ALA 66 CA -0.0111 0.0097 0.0024 2134 ALA 66 C -0.0103 0.0093 0.0043 2135 ALA 66 O -0.0107 0.0092 0.0060 2136 ALA 66 CB -0.0129 0.0102 0.0017 2137 LEU 67 N -0.0117 0.0063 -0.0021 2138 LEU 67 CA -0.0108 0.0057 -0.0008 2139 LEU 67 C -0.0093 0.0049 0.0004 2140 LEU 67 O -0.0090 0.0046 0.0021 2141 LEU 67 CB -0.0100 0.0054 -0.0021 2142 LEU 67 CG -0.0113 0.0062 -0.0028 2143 LEU 67 CD1 -0.0104 0.0058 -0.0043 2144 LEU 67 CD2 -0.0120 0.0063 -0.0009 2145 VAL 68 N -0.0083 0.0045 -0.0004 2146 VAL 68 CA -0.0069 0.0037 0.0006 2147 VAL 68 C -0.0078 0.0039 0.0023 2148 VAL 68 O -0.0072 0.0035 0.0041 2149 VAL 68 CB -0.0057 0.0032 -0.0008 2150 VAL 68 CG1 -0.0045 0.0025 0.0005 2151 VAL 68 CG2 -0.0045 0.0028 -0.0023 2152 LYS 69 N -0.0091 0.0047 0.0017 2153 LYS 69 CA -0.0101 0.0050 0.0032 2154 LYS 69 C -0.0110 0.0053 0.0049 2155 LYS 69 O -0.0112 0.0052 0.0067 2156 LYS 69 CB -0.0116 0.0058 0.0022 2157 LYS 69 CG -0.0123 0.0061 0.0035 2158 LYS 69 CD -0.0136 0.0068 0.0024 2159 LYS 69 CE -0.0156 0.0077 0.0035 2160 LYS 69 NZ -0.0165 0.0081 0.0034 2161 GLU 70 N -0.0141 0.0006 0.0010 2162 GLU 70 CA -0.0154 0.0015 0.0032 2163 GLU 70 C -0.0136 0.0020 0.0051 2164 GLU 70 O -0.0136 0.0026 0.0070 2165 GLU 70 CB -0.0175 0.0015 0.0027 2166 GLU 70 CG -0.0189 0.0023 0.0048 2167 GLU 70 CD -0.0206 0.0023 0.0044 2168 GLU 70 OE1 -0.0196 0.0022 0.0042 2169 GLU 70 OE2 -0.0228 0.0025 0.0044 2170 ARG 71 N -0.0122 0.0016 0.0044 2171 ARG 71 CA -0.0104 0.0020 0.0060 2172 ARG 71 C -0.0085 0.0022 0.0070 2173 ARG 71 O -0.0082 0.0029 0.0091 2174 ARG 71 CB -0.0091 0.0015 0.0048 2175 ARG 71 CG -0.0072 0.0019 0.0063 2176 ARG 71 CD -0.0085 0.0027 0.0084 2177 ARG 71 NE -0.0067 0.0031 0.0100 2178 ARG 71 CZ -0.0053 0.0035 0.0116 2179 ARG 71 NH1 -0.0055 0.0036 0.0118 2180 ARG 71 NH2 -0.0038 0.0038 0.0129 2181 ILE 72 N -0.0072 0.0015 0.0054 2182 ILE 72 CA -0.0052 0.0016 0.0062 2183 ILE 72 C -0.0062 0.0022 0.0076 2184 ILE 72 O -0.0048 0.0023 0.0084 2185 ILE 72 CB -0.0038 0.0008 0.0041 2186 ILE 72 CG1 -0.0055 0.0004 0.0025 2187 ILE 72 CG2 -0.0027 0.0003 0.0028 2188 ILE 72 CD1 -0.0044 0.0000 0.0016 2189 ALA 73 N -0.0110 0.0038 0.0096 2190 ALA 73 CA -0.0125 0.0056 0.0122 2191 ALA 73 C -0.0125 0.0083 0.0166 2192 ALA 73 O -0.0137 0.0101 0.0192 2193 ALA 73 CB -0.0174 0.0057 0.0105 2194 GLN 74 N -0.0112 0.0086 0.0175 2195 GLN 74 CA -0.0114 0.0111 0.0216 2196 GLN 74 C -0.0070 0.0119 0.0246 2197 GLN 74 O -0.0034 0.0106 0.0236 2198 GLN 74 CB -0.0133 0.0114 0.0215 2199 GLN 74 CG -0.0176 0.0105 0.0184 2200 GLN 74 CD -0.0204 0.0113 0.0187 2201 GLN 74 OE1 -0.0230 0.0101 0.0158 2202 GLN 74 NE2 -0.0200 0.0134 0.0224 2203 GLU 75 N -0.0078 0.0144 0.0284 2204 GLU 75 CA -0.0044 0.0158 0.0320 2205 GLU 75 C -0.0001 0.0146 0.0314 2206 GLU 75 O 0.0039 0.0143 0.0323 2207 GLU 75 CB -0.0066 0.0186 0.0357 2208 GLU 75 CG -0.0120 0.0194 0.0352 2209 GLU 75 CD -0.0141 0.0180 0.0320 2210 GLU 75 OE1 -0.0114 0.0165 0.0305 2211 GLU 75 OE2 -0.0184 0.0183 0.0311 2212 ASP 76 N -0.0028 0.0119 0.0269 2213 ASP 76 CA 0.0019 0.0096 0.0258 2214 ASP 76 C 0.0051 0.0067 0.0220 2215 ASP 76 O 0.0096 0.0047 0.0216 2216 ASP 76 CB 0.0004 0.0093 0.0236 2217 ASP 76 CG -0.0037 0.0090 0.0188 2218 ASP 76 OD1 -0.0052 0.0087 0.0167 2219 ASP 76 OD2 -0.0056 0.0090 0.0170 2220 CYS 77 N 0.0026 0.0065 0.0191 2221 CYS 77 CA 0.0055 0.0039 0.0155 2222 CYS 77 C 0.0073 0.0043 0.0182 2223 CYS 77 O 0.0086 0.0026 0.0156 2224 CYS 77 CB 0.0021 0.0030 0.0101 2225 CYS 77 SG 0.0003 0.0023 0.0067 2226 ARG 78 N 0.0074 0.0064 0.0234 2227 ARG 78 CA 0.0092 0.0069 0.0263 2228 ARG 78 C 0.0150 0.0043 0.0258 2229 ARG 78 O 0.0165 0.0032 0.0247 2230 ARG 78 CB 0.0085 0.0096 0.0322 2231 ARG 78 CG 0.0097 0.0104 0.0354 2232 ARG 78 CD 0.0068 0.0136 0.0404 2233 ARG 78 NE 0.0011 0.0154 0.0391 2234 ARG 78 CZ -0.0026 0.0167 0.0385 2235 ARG 78 NH1 -0.0014 0.0163 0.0390 2236 ARG 78 NH2 -0.0077 0.0182 0.0373 2237 ASN 79 N 0.0131 0.0001 0.0189 2238 ASN 79 CA 0.0157 -0.0017 0.0189 2239 ASN 79 C 0.0161 -0.0034 0.0161 2240 ASN 79 O 0.0182 -0.0049 0.0158 2241 ASN 79 CB 0.0170 -0.0020 0.0198 2242 ASN 79 CG 0.0174 -0.0007 0.0227 2243 ASN 79 OD1 0.0176 0.0000 0.0243 2244 ASN 79 ND2 0.0175 -0.0004 0.0235 2245 GLY 80 N 0.0141 -0.0031 0.0141 2246 GLY 80 CA 0.0142 -0.0046 0.0114 2247 GLY 80 C 0.0129 -0.0047 0.0096 2248 GLY 80 O 0.0113 -0.0034 0.0102 2249 PHE 81 N 0.0137 -0.0064 0.0074 2250 PHE 81 CA 0.0125 -0.0066 0.0055 2251 PHE 81 C 0.0140 -0.0087 0.0035 2252 PHE 81 O 0.0157 -0.0099 0.0032 2253 PHE 81 CB 0.0099 -0.0057 0.0040 2254 PHE 81 CG 0.0099 -0.0064 0.0027 2255 PHE 81 CD1 0.0105 -0.0081 0.0003 2256 PHE 81 CD2 0.0092 -0.0053 0.0039 2257 PHE 81 CE1 0.0104 -0.0087 -0.0009 2258 PHE 81 CE2 0.0092 -0.0059 0.0028 2259 PHE 81 CZ 0.0098 -0.0076 0.0003 2260 LEU 82 N 0.0134 -0.0077 0.0034 2261 LEU 82 CA 0.0142 -0.0074 0.0029 2262 LEU 82 C 0.0147 -0.0067 0.0022 2263 LEU 82 O 0.0153 -0.0070 0.0022 2264 LEU 82 CB 0.0151 -0.0083 0.0031 2265 LEU 82 CG 0.0161 -0.0081 0.0025 2266 LEU 82 CD1 0.0159 -0.0077 0.0024 2267 LEU 82 CD2 0.0170 -0.0090 0.0028 2268 LEU 83 N 0.0143 -0.0057 0.0018 2269 LEU 83 CA 0.0147 -0.0049 0.0011 2270 LEU 83 C 0.0157 -0.0046 0.0006 2271 LEU 83 O 0.0156 -0.0043 0.0004 2272 LEU 83 CB 0.0138 -0.0039 0.0009 2273 LEU 83 CG 0.0138 -0.0030 0.0003 2274 LEU 83 CD1 0.0142 -0.0033 0.0004 2275 LEU 83 CD2 0.0127 -0.0023 0.0004 2276 ASP 84 N 0.0166 -0.0049 0.0004 2277 ASP 84 CA 0.0177 -0.0048 -0.0001 2278 ASP 84 C 0.0180 -0.0037 -0.0008 2279 ASP 84 O 0.0181 -0.0035 -0.0010 2280 ASP 84 CB 0.0186 -0.0056 0.0001 2281 ASP 84 CG 0.0197 -0.0056 -0.0004 2282 ASP 84 OD1 0.0201 -0.0058 -0.0004 2283 ASP 84 OD2 0.0204 -0.0055 -0.0007 2284 GLY 85 N 0.0159 -0.0007 0.0002 2285 GLY 85 CA 0.0157 -0.0002 -0.0016 2286 GLY 85 C 0.0146 0.0013 -0.0019 2287 GLY 85 O 0.0142 0.0020 -0.0034 2288 PHE 86 N 0.0140 0.0019 -0.0006 2289 PHE 86 CA 0.0129 0.0033 -0.0007 2290 PHE 86 C 0.0128 0.0033 0.0008 2291 PHE 86 O 0.0131 0.0027 0.0022 2292 PHE 86 CB 0.0120 0.0045 -0.0004 2293 PHE 86 CG 0.0109 0.0060 -0.0009 2294 PHE 86 CD1 0.0107 0.0065 -0.0027 2295 PHE 86 CD2 0.0101 0.0069 0.0004 2296 PHE 86 CE1 0.0097 0.0078 -0.0032 2297 PHE 86 CE2 0.0092 0.0082 -0.0001 2298 PHE 86 CZ 0.0090 0.0086 -0.0019 2299 PRO 87 N 0.0125 0.0038 0.0004 2300 PRO 87 CA 0.0121 0.0045 -0.0013 2301 PRO 87 C 0.0130 0.0035 -0.0029 2302 PRO 87 O 0.0140 0.0022 -0.0026 2303 PRO 87 CB 0.0115 0.0052 -0.0009 2304 PRO 87 CG 0.0121 0.0043 0.0006 2305 PRO 87 CD 0.0122 0.0040 0.0017 2306 ARG 88 N 0.0092 0.0067 -0.0010 2307 ARG 88 CA 0.0081 0.0056 -0.0010 2308 ARG 88 C 0.0084 0.0052 0.0009 2309 ARG 88 O 0.0075 0.0041 0.0012 2310 ARG 88 CB 0.0080 0.0061 -0.0027 2311 ARG 88 CG 0.0076 0.0064 -0.0047 2312 ARG 88 CD 0.0079 0.0073 -0.0062 2313 ARG 88 NE 0.0085 0.0085 -0.0076 2314 ARG 88 CZ 0.0097 0.0099 -0.0081 2315 ARG 88 NH1 0.0103 0.0103 -0.0074 2316 ARG 88 NH2 0.0102 0.0109 -0.0093 2317 THR 89 N 0.0097 0.0061 0.0021 2318 THR 89 CA 0.0101 0.0058 0.0040 2319 THR 89 C 0.0111 0.0062 0.0056 2320 THR 89 O 0.0117 0.0071 0.0052 2321 THR 89 CB 0.0108 0.0066 0.0038 2322 THR 89 OG1 0.0120 0.0082 0.0032 2323 THR 89 CG2 0.0098 0.0061 0.0024 2324 ILE 90 N 0.0113 0.0058 0.0074 2325 ILE 90 CA 0.0123 0.0062 0.0091 2326 ILE 90 C 0.0139 0.0079 0.0089 2327 ILE 90 O 0.0146 0.0086 0.0094 2328 ILE 90 CB 0.0122 0.0053 0.0111 2329 ILE 90 CG1 0.0107 0.0036 0.0114 2330 ILE 90 CG2 0.0133 0.0059 0.0127 2331 ILE 90 CD1 0.0104 0.0026 0.0132 2332 PRO 91 N 0.0127 0.0046 0.0057 2333 PRO 91 CA 0.0144 0.0061 0.0055 2334 PRO 91 C 0.0146 0.0069 0.0038 2335 PRO 91 O 0.0159 0.0080 0.0038 2336 PRO 91 CB 0.0147 0.0066 0.0052 2337 PRO 91 CG 0.0136 0.0053 0.0063 2338 PRO 91 CD 0.0121 0.0041 0.0057 2339 GLN 92 N 0.0134 0.0064 0.0022 2340 GLN 92 CA 0.0135 0.0071 0.0005 2341 GLN 92 C 0.0135 0.0069 0.0010 2342 GLN 92 O 0.0143 0.0078 0.0004 2343 GLN 92 CB 0.0121 0.0065 -0.0013 2344 GLN 92 CG 0.0124 0.0071 -0.0024 2345 GLN 92 CD 0.0109 0.0064 -0.0039 2346 GLN 92 OE1 0.0097 0.0053 -0.0040 2347 GLN 92 NE2 0.0111 0.0069 -0.0051 2348 ALA 93 N 0.0125 0.0056 0.0022 2349 ALA 93 CA 0.0123 0.0053 0.0029 2350 ALA 93 C 0.0138 0.0061 0.0043 2351 ALA 93 O 0.0145 0.0067 0.0042 2352 ALA 93 CB 0.0108 0.0037 0.0038 2353 ASP 94 N 0.0118 0.0037 0.0025 2354 ASP 94 CA 0.0120 0.0037 0.0025 2355 ASP 94 C 0.0127 0.0031 0.0020 2356 ASP 94 O 0.0127 0.0028 0.0016 2357 ASP 94 CB 0.0124 0.0041 0.0034 2358 ASP 94 CG 0.0119 0.0045 0.0037 2359 ASP 94 OD1 0.0116 0.0043 0.0032 2360 ASP 94 OD2 0.0118 0.0050 0.0044 2361 ALA 95 N 0.0135 0.0029 0.0022 2362 ALA 95 CA 0.0142 0.0024 0.0017 2363 ALA 95 C 0.0139 0.0019 0.0008 2364 ALA 95 O 0.0143 0.0015 0.0003 2365 ALA 95 CB 0.0150 0.0023 0.0020 2366 MET 96 N 0.0132 0.0020 0.0006 2367 MET 96 CA 0.0128 0.0016 -0.0003 2368 MET 96 C 0.0123 0.0015 -0.0006 2369 MET 96 O 0.0125 0.0011 -0.0012 2370 MET 96 CB 0.0122 0.0017 -0.0004 2371 MET 96 CG 0.0126 0.0014 -0.0007 2372 MET 96 SD 0.0118 0.0017 -0.0007 2373 MET 96 CE 0.0110 0.0014 -0.0016 2374 LYS 97 N 0.0113 0.0002 -0.0028 2375 LYS 97 CA 0.0113 0.0002 -0.0038 2376 LYS 97 C 0.0114 -0.0008 -0.0042 2377 LYS 97 O 0.0114 -0.0011 -0.0049 2378 LYS 97 CB 0.0112 0.0008 -0.0040 2379 LYS 97 CG 0.0112 0.0006 -0.0050 2380 LYS 97 CD 0.0111 0.0013 -0.0054 2381 LYS 97 CE 0.0111 0.0013 -0.0050 2382 LYS 97 NZ 0.0110 0.0019 -0.0054 2383 GLU 98 N 0.0115 -0.0014 -0.0036 2384 GLU 98 CA 0.0116 -0.0023 -0.0039 2385 GLU 98 C 0.0116 -0.0029 -0.0039 2386 GLU 98 O 0.0117 -0.0034 -0.0046 2387 GLU 98 CB 0.0116 -0.0028 -0.0033 2388 GLU 98 CG 0.0116 -0.0026 -0.0037 2389 GLU 98 CD 0.0116 -0.0026 -0.0031 2390 GLU 98 OE1 0.0117 -0.0030 -0.0023 2391 GLU 98 OE2 0.0116 -0.0022 -0.0033 2392 ALA 99 N 0.0116 -0.0028 -0.0033 2393 ALA 99 CA 0.0117 -0.0032 -0.0033 2394 ALA 99 C 0.0116 -0.0028 -0.0040 2395 ALA 99 O 0.0116 -0.0030 -0.0040 2396 ALA 99 CB 0.0117 -0.0032 -0.0023 2397 GLY 100 N 0.0077 -0.0048 -0.0047 2398 GLY 100 CA 0.0076 -0.0048 -0.0048 2399 GLY 100 C 0.0077 -0.0048 -0.0048 2400 GLY 100 O 0.0076 -0.0048 -0.0049 2401 ILE 101 N 0.0078 -0.0047 -0.0046 2402 ILE 101 CA 0.0079 -0.0046 -0.0045 2403 ILE 101 C 0.0078 -0.0044 -0.0046 2404 ILE 101 O 0.0078 -0.0042 -0.0045 2405 ILE 101 CB 0.0080 -0.0046 -0.0043 2406 ILE 101 CG1 0.0081 -0.0049 -0.0042 2407 ILE 101 CG2 0.0081 -0.0046 -0.0042 2408 ILE 101 CD1 0.0083 -0.0048 -0.0040 2409 ASN 102 N 0.0077 -0.0043 -0.0047 2410 ASN 102 CA 0.0076 -0.0041 -0.0048 2411 ASN 102 C 0.0077 -0.0040 -0.0047 2412 ASN 102 O 0.0077 -0.0042 -0.0047 2413 ASN 102 CB 0.0074 -0.0041 -0.0050 2414 ASN 102 CG 0.0074 -0.0041 -0.0051 2415 ASN 102 OD1 0.0072 -0.0042 -0.0052 2416 ASN 102 ND2 0.0074 -0.0039 -0.0050 2417 VAL 103 N 0.0083 -0.0107 -0.0032 2418 VAL 103 CA 0.0086 -0.0101 -0.0028 2419 VAL 103 C 0.0075 -0.0088 -0.0040 2420 VAL 103 O 0.0068 -0.0078 -0.0047 2421 VAL 103 CB 0.0099 -0.0090 -0.0014 2422 VAL 103 CG1 0.0110 -0.0103 -0.0002 2423 VAL 103 CG2 0.0097 -0.0071 -0.0015 2424 ASP 104 N 0.0073 -0.0088 -0.0042 2425 ASP 104 CA 0.0063 -0.0076 -0.0052 2426 ASP 104 C 0.0067 -0.0056 -0.0047 2427 ASP 104 O 0.0059 -0.0042 -0.0055 2428 ASP 104 CB 0.0060 -0.0087 -0.0057 2429 ASP 104 CG 0.0056 -0.0107 -0.0062 2430 ASP 104 OD1 0.0046 -0.0110 -0.0073 2431 ASP 104 OD2 0.0063 -0.0121 -0.0055 2432 TYR 105 N 0.0080 -0.0054 -0.0033 2433 TYR 105 CA 0.0084 -0.0035 -0.0027 2434 TYR 105 C 0.0098 -0.0032 -0.0012 2435 TYR 105 O 0.0106 -0.0046 -0.0003 2436 TYR 105 CB 0.0086 -0.0034 -0.0025 2437 TYR 105 CG 0.0073 -0.0033 -0.0039 2438 TYR 105 CD1 0.0067 -0.0051 -0.0046 2439 TYR 105 CD2 0.0067 -0.0016 -0.0045 2440 TYR 105 CE1 0.0055 -0.0051 -0.0059 2441 TYR 105 CE2 0.0055 -0.0015 -0.0058 2442 TYR 105 CZ 0.0049 -0.0033 -0.0065 2443 TYR 105 OH 0.0037 -0.0033 -0.0078 2444 VAL 106 N 0.0104 -0.0010 0.0030 2445 VAL 106 CA 0.0106 -0.0010 0.0042 2446 VAL 106 C 0.0091 -0.0004 0.0044 2447 VAL 106 O 0.0082 -0.0000 0.0047 2448 VAL 106 CB 0.0111 -0.0010 0.0056 2449 VAL 106 CG1 0.0113 -0.0010 0.0068 2450 VAL 106 CG2 0.0125 -0.0016 0.0053 2451 LEU 107 N 0.0089 -0.0004 0.0040 2452 LEU 107 CA 0.0075 0.0002 0.0041 2453 LEU 107 C 0.0075 0.0003 0.0054 2454 LEU 107 O 0.0082 0.0001 0.0055 2455 LEU 107 CB 0.0071 0.0001 0.0027 2456 LEU 107 CG 0.0070 0.0000 0.0012 2457 LEU 107 CD1 0.0066 0.0000 -0.0001 2458 LEU 107 CD2 0.0060 0.0004 0.0012 2459 GLU 108 N 0.0065 0.0008 0.0064 2460 GLU 108 CA 0.0064 0.0010 0.0077 2461 GLU 108 C 0.0051 0.0015 0.0073 2462 GLU 108 O 0.0039 0.0019 0.0071 2463 GLU 108 CB 0.0062 0.0012 0.0091 2464 GLU 108 CG 0.0060 0.0014 0.0103 2465 GLU 108 CD 0.0058 0.0017 0.0118 2466 GLU 108 OE1 0.0054 0.0018 0.0118 2467 GLU 108 OE2 0.0060 0.0018 0.0129 2468 PHE 109 N 0.0025 0.0015 0.0088 2469 PHE 109 CA 0.0010 0.0009 0.0077 2470 PHE 109 C -0.0002 -0.0002 0.0082 2471 PHE 109 O -0.0003 -0.0001 0.0076 2472 PHE 109 CB 0.0010 0.0019 0.0059 2473 PHE 109 CG -0.0003 0.0016 0.0046 2474 PHE 109 CD1 -0.0001 0.0020 0.0041 2475 PHE 109 CD2 -0.0017 0.0010 0.0038 2476 PHE 109 CE1 -0.0013 0.0018 0.0028 2477 PHE 109 CE2 -0.0029 0.0007 0.0025 2478 PHE 109 CZ -0.0027 0.0011 0.0020 2479 ASP 110 N -0.0011 -0.0014 0.0090 2480 ASP 110 CA -0.0021 -0.0025 0.0097 2481 ASP 110 C -0.0038 -0.0033 0.0087 2482 ASP 110 O -0.0047 -0.0039 0.0086 2483 ASP 110 CB -0.0019 -0.0034 0.0115 2484 ASP 110 CG -0.0026 -0.0045 0.0125 2485 ASP 110 OD1 -0.0025 -0.0043 0.0123 2486 ASP 110 OD2 -0.0033 -0.0055 0.0135 2487 VAL 111 N -0.0043 -0.0034 0.0081 2488 VAL 111 CA -0.0060 -0.0042 0.0072 2489 VAL 111 C -0.0063 -0.0049 0.0081 2490 VAL 111 O -0.0054 -0.0043 0.0082 2491 VAL 111 CB -0.0063 -0.0034 0.0053 2492 VAL 111 CG1 -0.0080 -0.0042 0.0044 2493 VAL 111 CG2 -0.0058 -0.0025 0.0044 2494 PRO 112 N -0.0068 -0.0126 -0.0017 2495 PRO 112 CA -0.0063 -0.0121 -0.0041 2496 PRO 112 C -0.0067 -0.0123 -0.0036 2497 PRO 112 O -0.0060 -0.0125 -0.0014 2498 PRO 112 CB -0.0033 -0.0114 -0.0048 2499 PRO 112 CG -0.0028 -0.0115 -0.0036 2500 PRO 112 CD -0.0042 -0.0122 -0.0009 2501 ASP 113 N -0.0077 -0.0121 -0.0057 2502 ASP 113 CA -0.0083 -0.0123 -0.0054 2503 ASP 113 C -0.0059 -0.0119 -0.0045 2504 ASP 113 O -0.0061 -0.0122 -0.0031 2505 ASP 113 CB -0.0095 -0.0120 -0.0081 2506 ASP 113 CG -0.0124 -0.0125 -0.0088 2507 ASP 113 OD1 -0.0133 -0.0129 -0.0075 2508 ASP 113 OD2 -0.0138 -0.0124 -0.0107 2509 GLU 114 N -0.0035 -0.0113 -0.0053 2510 GLU 114 CA -0.0010 -0.0110 -0.0045 2511 GLU 114 C -0.0004 -0.0114 -0.0015 2512 GLU 114 O 0.0005 -0.0114 -0.0002 2513 GLU 114 CB 0.0013 -0.0102 -0.0062 2514 GLU 114 CG 0.0010 -0.0097 -0.0092 2515 GLU 114 CD 0.0004 -0.0098 -0.0097 2516 GLU 114 OE1 0.0019 -0.0097 -0.0085 2517 GLU 114 OE2 -0.0016 -0.0099 -0.0113 2518 LEU 115 N -0.0018 -0.0086 -0.0019 2519 LEU 115 CA -0.0016 -0.0094 -0.0007 2520 LEU 115 C -0.0021 -0.0104 0.0002 2521 LEU 115 O -0.0015 -0.0109 0.0013 2522 LEU 115 CB -0.0022 -0.0097 -0.0008 2523 LEU 115 CG -0.0014 -0.0090 -0.0011 2524 LEU 115 CD1 -0.0009 -0.0079 -0.0022 2525 LEU 115 CD2 -0.0022 -0.0093 -0.0012 2526 ILE 116 N -0.0033 -0.0106 -0.0003 2527 ILE 116 CA -0.0038 -0.0115 0.0005 2528 ILE 116 C -0.0028 -0.0112 0.0009 2529 ILE 116 O -0.0024 -0.0118 0.0020 2530 ILE 116 CB -0.0053 -0.0117 -0.0001 2531 ILE 116 CG1 -0.0064 -0.0122 -0.0002 2532 ILE 116 CG2 -0.0057 -0.0126 0.0007 2533 ILE 116 CD1 -0.0077 -0.0121 -0.0013 2534 VAL 117 N -0.0024 -0.0103 -0.0000 2535 VAL 117 CA -0.0014 -0.0100 0.0002 2536 VAL 117 C -0.0001 -0.0102 0.0013 2537 VAL 117 O 0.0003 -0.0107 0.0022 2538 VAL 117 CB -0.0009 -0.0089 -0.0009 2539 VAL 117 CG1 0.0003 -0.0086 -0.0006 2540 VAL 117 CG2 -0.0021 -0.0087 -0.0019 2541 ASP 118 N 0.0012 -0.0062 0.0039 2542 ASP 118 CA 0.0017 -0.0056 0.0046 2543 ASP 118 C 0.0016 -0.0065 0.0052 2544 ASP 118 O 0.0021 -0.0065 0.0063 2545 ASP 118 CB 0.0017 -0.0046 0.0038 2546 ASP 118 CG 0.0019 -0.0035 0.0032 2547 ASP 118 OD1 0.0020 -0.0034 0.0035 2548 ASP 118 OD2 0.0018 -0.0028 0.0025 2549 ARG 119 N 0.0010 -0.0072 0.0045 2550 ARG 119 CA 0.0009 -0.0081 0.0050 2551 ARG 119 C 0.0010 -0.0090 0.0060 2552 ARG 119 O 0.0011 -0.0095 0.0068 2553 ARG 119 CB 0.0002 -0.0088 0.0040 2554 ARG 119 CG 0.0001 -0.0080 0.0031 2555 ARG 119 CD -0.0005 -0.0086 0.0020 2556 ARG 119 NE -0.0006 -0.0077 0.0011 2557 ARG 119 CZ -0.0011 -0.0079 0.0001 2558 ARG 119 NH1 -0.0016 -0.0089 -0.0004 2559 ARG 119 NH2 -0.0011 -0.0071 -0.0006 2560 ILE 120 N 0.0010 -0.0092 0.0061 2561 ILE 120 CA 0.0010 -0.0101 0.0070 2562 ILE 120 C 0.0016 -0.0095 0.0080 2563 ILE 120 O 0.0019 -0.0100 0.0091 2564 ILE 120 CB 0.0005 -0.0109 0.0064 2565 ILE 120 CG1 -0.0002 -0.0116 0.0055 2566 ILE 120 CG2 0.0005 -0.0117 0.0073 2567 ILE 120 CD1 -0.0007 -0.0124 0.0049 2568 VAL 121 N 0.0052 -0.0084 0.0097 2569 VAL 121 CA 0.0034 -0.0082 0.0123 2570 VAL 121 C 0.0020 -0.0053 0.0129 2571 VAL 121 O 0.0005 -0.0052 0.0150 2572 VAL 121 CB 0.0030 -0.0091 0.0133 2573 VAL 121 CG1 0.0044 -0.0119 0.0126 2574 VAL 121 CG2 0.0029 -0.0067 0.0123 2575 GLY 122 N 0.0024 -0.0031 0.0111 2576 GLY 122 CA 0.0012 -0.0003 0.0115 2577 GLY 122 C 0.0014 0.0002 0.0108 2578 GLY 122 O 0.0016 0.0024 0.0094 2579 ARG 123 N 0.0014 -0.0017 0.0118 2580 ARG 123 CA 0.0017 -0.0015 0.0113 2581 ARG 123 C 0.0003 -0.0018 0.0137 2582 ARG 123 O -0.0001 -0.0039 0.0153 2583 ARG 123 CB 0.0035 -0.0037 0.0097 2584 ARG 123 CG 0.0039 -0.0041 0.0094 2585 ARG 123 CD 0.0058 -0.0049 0.0070 2586 ARG 123 NE 0.0068 -0.0079 0.0069 2587 ARG 123 CZ 0.0086 -0.0089 0.0049 2588 ARG 123 NH1 0.0095 -0.0073 0.0027 2589 ARG 123 NH2 0.0094 -0.0117 0.0050 2590 ARG 124 N 0.0033 0.0038 0.0107 2591 ARG 124 CA 0.0033 0.0041 0.0092 2592 ARG 124 C 0.0052 0.0050 0.0068 2593 ARG 124 O 0.0056 0.0053 0.0057 2594 ARG 124 CB 0.0005 0.0036 0.0081 2595 ARG 124 CG -0.0017 0.0027 0.0102 2596 ARG 124 CD -0.0016 0.0025 0.0117 2597 ARG 124 NE -0.0035 0.0016 0.0139 2598 ARG 124 CZ -0.0033 0.0012 0.0162 2599 ARG 124 NH1 -0.0012 0.0016 0.0168 2600 ARG 124 NH2 -0.0051 0.0004 0.0181 2601 VAL 125 N 0.0063 0.0054 0.0060 2602 VAL 125 CA 0.0082 0.0063 0.0038 2603 VAL 125 C 0.0078 0.0065 0.0020 2604 VAL 125 O 0.0072 0.0062 0.0029 2605 VAL 125 CB 0.0111 0.0068 0.0048 2606 VAL 125 CG1 0.0121 0.0069 0.0052 2607 VAL 125 CG2 0.0115 0.0064 0.0074 2608 HIS 126 N 0.0083 0.0071 -0.0007 2609 HIS 126 CA 0.0081 0.0075 -0.0026 2610 HIS 126 C 0.0110 0.0081 -0.0024 2611 HIS 126 O 0.0128 0.0088 -0.0037 2612 HIS 126 CB 0.0075 0.0079 -0.0055 2613 HIS 126 CG 0.0076 0.0083 -0.0075 2614 HIS 126 ND1 0.0057 0.0078 -0.0077 2615 HIS 126 CD2 0.0094 0.0091 -0.0094 2616 HIS 126 CE1 0.0064 0.0083 -0.0095 2617 HIS 126 NE2 0.0086 0.0091 -0.0106 2618 ALA 127 N 0.0117 0.0084 -0.0020 2619 ALA 127 CA 0.0143 0.0104 -0.0019 2620 ALA 127 C 0.0160 0.0130 -0.0046 2621 ALA 127 O 0.0188 0.0148 -0.0037 2622 ALA 127 CB 0.0132 0.0095 -0.0019 2623 PRO 128 N 0.0145 0.0134 -0.0080 2624 PRO 128 CA 0.0161 0.0159 -0.0108 2625 PRO 128 C 0.0178 0.0173 -0.0109 2626 PRO 128 O 0.0198 0.0196 -0.0124 2627 PRO 128 CB 0.0135 0.0154 -0.0142 2628 PRO 128 CG 0.0114 0.0133 -0.0131 2629 PRO 128 CD 0.0113 0.0116 -0.0096 2630 SER 129 N 0.0171 0.0160 -0.0092 2631 SER 129 CA 0.0187 0.0172 -0.0092 2632 SER 129 C 0.0202 0.0167 -0.0056 2633 SER 129 O 0.0219 0.0179 -0.0051 2634 SER 129 CB 0.0164 0.0163 -0.0111 2635 SER 129 OG 0.0140 0.0137 -0.0095 2636 GLY 130 N 0.0159 0.0115 -0.0037 2637 GLY 130 CA 0.0159 0.0115 -0.0020 2638 GLY 130 C 0.0144 0.0109 -0.0020 2639 GLY 130 O 0.0145 0.0109 -0.0009 2640 ARG 131 N 0.0131 0.0104 -0.0033 2641 ARG 131 CA 0.0116 0.0098 -0.0034 2642 ARG 131 C 0.0105 0.0093 -0.0016 2643 ARG 131 O 0.0098 0.0091 -0.0010 2644 ARG 131 CB 0.0105 0.0094 -0.0052 2645 ARG 131 CG 0.0113 0.0097 -0.0070 2646 ARG 131 CD 0.0101 0.0093 -0.0087 2647 ARG 131 NE 0.0099 0.0092 -0.0092 2648 ARG 131 CZ 0.0108 0.0096 -0.0106 2649 ARG 131 NH1 0.0120 0.0101 -0.0115 2650 ARG 131 NH2 0.0105 0.0095 -0.0109 2651 VAL 132 N 0.0102 0.0092 -0.0007 2652 VAL 132 CA 0.0093 0.0088 0.0011 2653 VAL 132 C 0.0073 0.0080 0.0009 2654 VAL 132 O 0.0067 0.0078 -0.0003 2655 VAL 132 CB 0.0102 0.0092 0.0024 2656 VAL 132 CG1 0.0091 0.0087 0.0042 2657 VAL 132 CG2 0.0121 0.0099 0.0029 2658 TYR 133 N 0.0053 0.0033 0.0004 2659 TYR 133 CA 0.0023 0.0054 0.0003 2660 TYR 133 C 0.0016 0.0061 0.0022 2661 TYR 133 O 0.0032 0.0051 0.0045 2662 TYR 133 CB 0.0011 0.0064 0.0022 2663 TYR 133 CG 0.0015 0.0061 0.0005 2664 TYR 133 CD1 0.0003 0.0067 -0.0027 2665 TYR 133 CD2 0.0032 0.0049 0.0019 2666 TYR 133 CE1 0.0007 0.0063 -0.0045 2667 TYR 133 CE2 0.0037 0.0045 0.0002 2668 TYR 133 CZ 0.0025 0.0051 -0.0030 2669 TYR 133 OH 0.0030 0.0046 -0.0049 2670 HIS 134 N -0.0007 0.0077 0.0013 2671 HIS 134 CA -0.0016 0.0084 0.0030 2672 HIS 134 C -0.0047 0.0107 0.0037 2673 HIS 134 O -0.0065 0.0118 0.0015 2674 HIS 134 CB -0.0010 0.0079 0.0012 2675 HIS 134 CG -0.0013 0.0083 0.0033 2676 HIS 134 ND1 -0.0039 0.0101 0.0045 2677 HIS 134 CD2 0.0005 0.0070 0.0048 2678 HIS 134 CE1 -0.0036 0.0100 0.0067 2679 HIS 134 NE2 -0.0009 0.0082 0.0069 2680 VAL 135 N -0.0053 0.0113 0.0070 2681 VAL 135 CA -0.0081 0.0133 0.0083 2682 VAL 135 C -0.0104 0.0149 0.0066 2683 VAL 135 O -0.0127 0.0165 0.0061 2684 VAL 135 CB -0.0080 0.0136 0.0122 2685 VAL 135 CG1 -0.0063 0.0125 0.0139 2686 VAL 135 CG2 -0.0069 0.0128 0.0132 2687 LYS 136 N -0.0128 0.0162 0.0056 2688 LYS 136 CA -0.0147 0.0185 0.0031 2689 LYS 136 C -0.0145 0.0181 -0.0013 2690 LYS 136 O -0.0163 0.0204 -0.0035 2691 LYS 136 CB -0.0145 0.0182 0.0035 2692 LYS 136 CG -0.0147 0.0187 0.0077 2693 LYS 136 CD -0.0122 0.0155 0.0098 2694 LYS 136 CE -0.0125 0.0160 0.0141 2695 LYS 136 NZ -0.0100 0.0129 0.0160 2696 PHE 137 N -0.0121 0.0152 -0.0026 2697 PHE 137 CA -0.0116 0.0145 -0.0067 2698 PHE 137 C -0.0119 0.0148 -0.0070 2699 PHE 137 O -0.0140 0.0174 -0.0070 2700 PHE 137 CB -0.0090 0.0112 -0.0079 2701 PHE 137 CG -0.0085 0.0106 -0.0080 2702 PHE 137 CD1 -0.0097 0.0121 -0.0052 2703 PHE 137 CD2 -0.0069 0.0085 -0.0108 2704 PHE 137 CE1 -0.0092 0.0115 -0.0052 2705 PHE 137 CE2 -0.0064 0.0079 -0.0108 2706 PHE 137 CZ -0.0076 0.0094 -0.0080 2707 ASN 138 N -0.0098 0.0122 -0.0070 2708 ASN 138 CA -0.0097 0.0120 -0.0074 2709 ASN 138 C -0.0097 0.0122 -0.0033 2710 ASN 138 O -0.0078 0.0098 -0.0016 2711 ASN 138 CB -0.0072 0.0089 -0.0095 2712 ASN 138 CG -0.0049 0.0060 -0.0076 2713 ASN 138 OD1 -0.0046 0.0058 -0.0074 2714 ASN 138 ND2 -0.0031 0.0039 -0.0062 2715 PRO 139 N -0.0141 0.0110 -0.0032 2716 PRO 139 CA -0.0080 0.0122 -0.0046 2717 PRO 139 C -0.0052 0.0072 -0.0018 2718 PRO 139 O -0.0073 0.0026 0.0012 2719 PRO 139 CB -0.0038 0.0135 -0.0058 2720 PRO 139 CG -0.0058 0.0092 -0.0030 2721 PRO 139 CD -0.0130 0.0094 -0.0024 2722 PRO 140 N -0.0007 0.0082 -0.0029 2723 PRO 140 CA 0.0021 0.0034 -0.0002 2724 PRO 140 C 0.0067 0.0006 0.0010 2725 PRO 140 O 0.0097 0.0034 -0.0010 2726 PRO 140 CB 0.0056 0.0061 -0.0022 2727 PRO 140 CG 0.0076 0.0114 -0.0056 2728 PRO 140 CD 0.0019 0.0134 -0.0063 2729 LYS 141 N 0.0070 -0.0049 0.0044 2730 LYS 141 CA 0.0113 -0.0079 0.0058 2731 LYS 141 C 0.0180 -0.0055 0.0037 2732 LYS 141 O 0.0211 -0.0044 0.0027 2733 LYS 141 CB 0.0118 -0.0141 0.0096 2734 LYS 141 CG 0.0055 -0.0172 0.0121 2735 LYS 141 CD 0.0071 -0.0233 0.0156 2736 LYS 141 CE 0.0013 -0.0270 0.0184 2737 LYS 141 NZ -0.0004 -0.0284 0.0194 2738 VAL 142 N 0.0200 -0.0008 -0.0044 2739 VAL 142 CA 0.0245 0.0018 -0.0025 2740 VAL 142 C 0.0227 0.0040 -0.0079 2741 VAL 142 O 0.0183 0.0009 -0.0089 2742 VAL 142 CB 0.0246 -0.0023 0.0038 2743 VAL 142 CG1 0.0310 0.0002 0.0080 2744 VAL 142 CG2 0.0217 -0.0073 0.0073 2745 GLU 143 N 0.0260 0.0093 -0.0115 2746 GLU 143 CA 0.0248 0.0119 -0.0170 2747 GLU 143 C 0.0236 0.0103 -0.0160 2748 GLU 143 O 0.0275 0.0112 -0.0124 2749 GLU 143 CB 0.0294 0.0180 -0.0199 2750 GLU 143 CG 0.0357 0.0203 -0.0154 2751 GLU 143 CD 0.0400 0.0264 -0.0188 2752 GLU 143 OE1 0.0397 0.0291 -0.0233 2753 GLU 143 OE2 0.0436 0.0283 -0.0171 2754 GLY 144 N 0.0182 0.0080 -0.0195 2755 GLY 144 CA 0.0163 0.0062 -0.0191 2756 GLY 144 C 0.0149 0.0009 -0.0132 2757 GLY 144 O 0.0133 -0.0012 -0.0122 2758 LYS 145 N 0.0104 0.0038 -0.0058 2759 LYS 145 CA 0.0107 0.0040 -0.0064 2760 LYS 145 C 0.0100 0.0042 -0.0050 2761 LYS 145 O 0.0094 0.0033 -0.0035 2762 LYS 145 CB 0.0114 0.0022 -0.0075 2763 LYS 145 CG 0.0121 0.0015 -0.0088 2764 LYS 145 CD 0.0129 0.0025 -0.0106 2765 LYS 145 CE 0.0136 0.0015 -0.0118 2766 LYS 145 NZ 0.0144 0.0023 -0.0137 2767 ASP 146 N 0.0101 0.0053 -0.0056 2768 ASP 146 CA 0.0096 0.0056 -0.0045 2769 ASP 146 C 0.0098 0.0037 -0.0044 2770 ASP 146 O 0.0104 0.0032 -0.0058 2771 ASP 146 CB 0.0098 0.0073 -0.0053 2772 ASP 146 CG 0.0091 0.0080 -0.0041 2773 ASP 146 OD1 0.0083 0.0081 -0.0024 2774 ASP 146 OD2 0.0094 0.0085 -0.0048 2775 ASP 147 N 0.0091 0.0026 -0.0029 2776 ASP 147 CA 0.0092 0.0008 -0.0026 2777 ASP 147 C 0.0096 0.0008 -0.0034 2778 ASP 147 O 0.0101 -0.0007 -0.0041 2779 ASP 147 CB 0.0083 0.0003 -0.0006 2780 ASP 147 CG 0.0078 0.0005 0.0003 2781 ASP 147 OD1 0.0082 0.0008 -0.0006 2782 ASP 147 OD2 0.0070 0.0003 0.0020 2783 VAL 148 N 0.0098 0.0086 -0.0075 2784 VAL 148 CA 0.0097 0.0103 -0.0088 2785 VAL 148 C 0.0088 0.0104 -0.0106 2786 VAL 148 O 0.0079 0.0098 -0.0118 2787 VAL 148 CB 0.0110 0.0122 -0.0080 2788 VAL 148 CG1 0.0117 0.0121 -0.0065 2789 VAL 148 CG2 0.0109 0.0140 -0.0095 2790 THR 149 N 0.0091 0.0111 -0.0106 2791 THR 149 CA 0.0083 0.0113 -0.0122 2792 THR 149 C 0.0072 0.0094 -0.0128 2793 THR 149 O 0.0062 0.0093 -0.0144 2794 THR 149 CB 0.0088 0.0123 -0.0119 2795 THR 149 OG1 0.0091 0.0112 -0.0105 2796 THR 149 CG2 0.0099 0.0143 -0.0115 2797 GLY 150 N 0.0073 0.0079 -0.0115 2798 GLY 150 CA 0.0063 0.0061 -0.0119 2799 GLY 150 C 0.0063 0.0058 -0.0116 2800 GLY 150 O 0.0060 0.0041 -0.0110 2801 GLU 151 N 0.0027 0.0049 -0.0139 2802 GLU 151 CA 0.0031 0.0049 -0.0131 2803 GLU 151 C 0.0035 0.0038 -0.0108 2804 GLU 151 O 0.0043 0.0039 -0.0095 2805 GLU 151 CB 0.0045 0.0070 -0.0135 2806 GLU 151 CG 0.0042 0.0082 -0.0158 2807 GLU 151 CD 0.0054 0.0102 -0.0161 2808 GLU 151 OE1 0.0054 0.0105 -0.0167 2809 GLU 151 OE2 0.0065 0.0115 -0.0159 2810 GLU 152 N 0.0029 0.0027 -0.0105 2811 GLU 152 CA 0.0030 0.0014 -0.0084 2812 GLU 152 C 0.0047 0.0024 -0.0066 2813 GLU 152 O 0.0056 0.0039 -0.0070 2814 GLU 152 CB 0.0021 0.0002 -0.0085 2815 GLU 152 CG 0.0020 -0.0013 -0.0064 2816 GLU 152 CD 0.0011 -0.0025 -0.0066 2817 GLU 152 OE1 0.0017 -0.0018 -0.0063 2818 GLU 152 OE2 -0.0003 -0.0041 -0.0069 2819 LEU 153 N 0.0049 0.0015 -0.0048 2820 LEU 153 CA 0.0064 0.0022 -0.0029 2821 LEU 153 C 0.0067 0.0019 -0.0019 2822 LEU 153 O 0.0057 0.0005 -0.0020 2823 LEU 153 CB 0.0065 0.0012 -0.0013 2824 LEU 153 CG 0.0061 0.0012 -0.0021 2825 LEU 153 CD1 0.0062 0.0000 -0.0004 2826 LEU 153 CD2 0.0072 0.0032 -0.0029 2827 THR 154 N -0.0004 -0.0039 0.0115 2828 THR 154 CA 0.0002 -0.0050 0.0127 2829 THR 154 C 0.0008 -0.0053 0.0119 2830 THR 154 O 0.0010 -0.0049 0.0104 2831 THR 154 CB 0.0011 -0.0061 0.0132 2832 THR 154 OG1 0.0021 -0.0065 0.0118 2833 THR 154 CG2 0.0005 -0.0058 0.0140 2834 THR 155 N 0.0013 -0.0061 0.0129 2835 THR 155 CA 0.0019 -0.0065 0.0122 2836 THR 155 C 0.0032 -0.0079 0.0124 2837 THR 155 O 0.0034 -0.0085 0.0135 2838 THR 155 CB 0.0013 -0.0062 0.0131 2839 THR 155 OG1 0.0020 -0.0067 0.0126 2840 THR 155 CG2 0.0011 -0.0068 0.0150 2841 ARG 156 N 0.0041 -0.0084 0.0113 2842 ARG 156 CA 0.0054 -0.0097 0.0114 2843 ARG 156 C 0.0057 -0.0105 0.0125 2844 ARG 156 O 0.0054 -0.0102 0.0126 2845 ARG 156 CB 0.0063 -0.0100 0.0097 2846 ARG 156 CG 0.0076 -0.0112 0.0096 2847 ARG 156 CD 0.0085 -0.0116 0.0081 2848 ARG 156 NE 0.0079 -0.0105 0.0068 2849 ARG 156 CZ 0.0075 -0.0097 0.0059 2850 ARG 156 NH1 0.0075 -0.0098 0.0060 2851 ARG 156 NH2 0.0070 -0.0087 0.0047 2852 LYS 157 N -0.0067 -0.0209 0.0162 2853 LYS 157 CA -0.0065 -0.0243 0.0169 2854 LYS 157 C -0.0036 -0.0253 0.0148 2855 LYS 157 O -0.0032 -0.0268 0.0149 2856 LYS 157 CB -0.0071 -0.0266 0.0179 2857 LYS 157 CG -0.0074 -0.0302 0.0190 2858 LYS 157 CD -0.0100 -0.0303 0.0211 2859 LYS 157 CE -0.0103 -0.0339 0.0222 2860 LYS 157 NZ -0.0104 -0.0362 0.0229 2861 ASP 158 N -0.0017 -0.0243 0.0131 2862 ASP 158 CA 0.0011 -0.0251 0.0110 2863 ASP 158 C 0.0022 -0.0237 0.0098 2864 ASP 158 O 0.0042 -0.0252 0.0085 2865 ASP 158 CB 0.0027 -0.0241 0.0094 2866 ASP 158 CG 0.0020 -0.0257 0.0104 2867 ASP 158 OD1 -0.0004 -0.0252 0.0122 2868 ASP 158 OD2 0.0039 -0.0274 0.0093 2869 ASP 159 N 0.0009 -0.0208 0.0101 2870 ASP 159 CA 0.0017 -0.0192 0.0091 2871 ASP 159 C 0.0006 -0.0204 0.0102 2872 ASP 159 O 0.0006 -0.0188 0.0098 2873 ASP 159 CB 0.0010 -0.0154 0.0087 2874 ASP 159 CG 0.0021 -0.0140 0.0075 2875 ASP 159 OD1 0.0042 -0.0155 0.0062 2876 ASP 159 OD2 0.0008 -0.0114 0.0079 2877 GLN 160 N -0.0040 -0.0245 0.0147 2878 GLN 160 CA -0.0018 -0.0218 0.0122 2879 GLN 160 C -0.0024 -0.0203 0.0074 2880 GLN 160 O -0.0056 -0.0218 0.0049 2881 GLN 160 CB -0.0028 -0.0226 0.0123 2882 GLN 160 CG -0.0013 -0.0233 0.0167 2883 GLN 160 CD -0.0023 -0.0239 0.0166 2884 GLN 160 OE1 -0.0042 -0.0241 0.0132 2885 GLN 160 NE2 -0.0009 -0.0244 0.0204 2886 GLU 161 N 0.0008 -0.0174 0.0060 2887 GLU 161 CA 0.0008 -0.0155 0.0014 2888 GLU 161 C -0.0021 -0.0163 -0.0022 2889 GLU 161 O -0.0040 -0.0164 -0.0055 2890 GLU 161 CB 0.0049 -0.0121 0.0006 2891 GLU 161 CG 0.0054 -0.0099 -0.0040 2892 GLU 161 CD 0.0097 -0.0067 -0.0040 2893 GLU 161 OE1 0.0118 -0.0064 -0.0009 2894 GLU 161 OE2 0.0109 -0.0044 -0.0073 2895 GLU 162 N -0.0026 -0.0170 -0.0015 2896 GLU 162 CA -0.0054 -0.0177 -0.0048 2897 GLU 162 C -0.0095 -0.0208 -0.0049 2898 GLU 162 O -0.0117 -0.0211 -0.0084 2899 GLU 162 CB -0.0051 -0.0179 -0.0038 2900 GLU 162 CG -0.0081 -0.0189 -0.0071 2901 GLU 162 CD -0.0081 -0.0194 -0.0059 2902 GLU 162 OE1 -0.0075 -0.0206 -0.0018 2903 GLU 162 OE2 -0.0087 -0.0185 -0.0090 2904 THR 163 N -0.0103 -0.0212 -0.0016 2905 THR 163 CA -0.0131 -0.0234 -0.0011 2906 THR 163 C -0.0137 -0.0234 -0.0023 2907 THR 163 O -0.0161 -0.0244 -0.0041 2908 THR 163 CB -0.0134 -0.0250 0.0025 2909 THR 163 OG1 -0.0125 -0.0247 0.0036 2910 THR 163 CG2 -0.0166 -0.0273 0.0028 2911 VAL 164 N -0.0115 -0.0221 -0.0013 2912 VAL 164 CA -0.0117 -0.0219 -0.0022 2913 VAL 164 C -0.0122 -0.0209 -0.0061 2914 VAL 164 O -0.0141 -0.0217 -0.0075 2915 VAL 164 CB -0.0089 -0.0206 -0.0006 2916 VAL 164 CG1 -0.0090 -0.0201 -0.0020 2917 VAL 164 CG2 -0.0087 -0.0218 0.0032 2918 ARG 165 N -0.0106 -0.0191 -0.0077 2919 ARG 165 CA -0.0111 -0.0181 -0.0113 2920 ARG 165 C -0.0140 -0.0195 -0.0132 2921 ARG 165 O -0.0151 -0.0192 -0.0160 2922 ARG 165 CB -0.0086 -0.0158 -0.0126 2923 ARG 165 CG -0.0058 -0.0142 -0.0116 2924 ARG 165 CD -0.0038 -0.0118 -0.0140 2925 ARG 165 NE -0.0021 -0.0104 -0.0145 2926 ARG 165 CZ 0.0006 -0.0091 -0.0129 2927 ARG 165 NH1 0.0020 -0.0090 -0.0107 2928 ARG 165 NH2 0.0020 -0.0079 -0.0135 2929 LYS 166 N -0.0187 -0.0227 -0.0153 2930 LYS 166 CA -0.0220 -0.0231 -0.0170 2931 LYS 166 C -0.0234 -0.0226 -0.0148 2932 LYS 166 O -0.0245 -0.0230 -0.0164 2933 LYS 166 CB -0.0249 -0.0232 -0.0173 2934 LYS 166 CG -0.0244 -0.0239 -0.0206 2935 LYS 166 CD -0.0269 -0.0240 -0.0205 2936 LYS 166 CE -0.0260 -0.0233 -0.0174 2937 LYS 166 NZ -0.0281 -0.0233 -0.0174 2938 ARG 167 N -0.0236 -0.0219 -0.0113 2939 ARG 167 CA -0.0248 -0.0214 -0.0091 2940 ARG 167 C -0.0227 -0.0215 -0.0099 2941 ARG 167 O -0.0242 -0.0216 -0.0103 2942 ARG 167 CB -0.0241 -0.0205 -0.0052 2943 ARG 167 CG -0.0272 -0.0201 -0.0033 2944 ARG 167 CD -0.0268 -0.0192 0.0007 2945 ARG 167 NE -0.0234 -0.0189 0.0022 2946 ARG 167 CZ -0.0231 -0.0185 0.0037 2947 ARG 167 NH1 -0.0259 -0.0185 0.0039 2948 ARG 167 NH2 -0.0199 -0.0182 0.0050 2949 LEU 168 N -0.0191 -0.0215 -0.0102 2950 LEU 168 CA -0.0167 -0.0217 -0.0110 2951 LEU 168 C -0.0176 -0.0225 -0.0145 2952 LEU 168 O -0.0180 -0.0225 -0.0146 2953 LEU 168 CB -0.0127 -0.0216 -0.0108 2954 LEU 168 CG -0.0112 -0.0207 -0.0071 2955 LEU 168 CD1 -0.0073 -0.0207 -0.0075 2956 LEU 168 CD2 -0.0115 -0.0201 -0.0044 2957 VAL 169 N -0.0189 -0.0239 -0.0148 2958 VAL 169 CA -0.0179 -0.0262 -0.0151 2959 VAL 169 C -0.0183 -0.0232 -0.0140 2960 VAL 169 O -0.0158 -0.0234 -0.0122 2961 VAL 169 CB -0.0201 -0.0295 -0.0183 2962 VAL 169 CG1 -0.0197 -0.0326 -0.0194 2963 VAL 169 CG2 -0.0242 -0.0273 -0.0205 2964 GLU 170 N -0.0215 -0.0201 -0.0151 2965 GLU 170 CA -0.0222 -0.0170 -0.0142 2966 GLU 170 C -0.0192 -0.0146 -0.0108 2967 GLU 170 O -0.0176 -0.0142 -0.0094 2968 GLU 170 CB -0.0260 -0.0138 -0.0158 2969 GLU 170 CG -0.0267 -0.0101 -0.0146 2970 GLU 170 CD -0.0308 -0.0083 -0.0170 2971 GLU 170 OE1 -0.0331 -0.0088 -0.0190 2972 GLU 170 OE2 -0.0316 -0.0065 -0.0168 2973 TYR 171 N -0.0183 -0.0132 -0.0095 2974 TYR 171 CA -0.0155 -0.0108 -0.0063 2975 TYR 171 C -0.0119 -0.0135 -0.0046 2976 TYR 171 O -0.0100 -0.0120 -0.0025 2977 TYR 171 CB -0.0150 -0.0096 -0.0053 2978 TYR 171 CG -0.0116 -0.0080 -0.0019 2979 TYR 171 CD1 -0.0117 -0.0037 -0.0000 2980 TYR 171 CD2 -0.0082 -0.0109 -0.0006 2981 TYR 171 CE1 -0.0085 -0.0023 0.0031 2982 TYR 171 CE2 -0.0050 -0.0095 0.0025 2983 TYR 171 CZ -0.0052 -0.0052 0.0044 2984 TYR 171 OH -0.0020 -0.0039 0.0075 2985 HIS 172 N -0.0125 -0.0144 -0.0042 2986 HIS 172 CA -0.0092 -0.0176 -0.0011 2987 HIS 172 C -0.0079 -0.0182 0.0001 2988 HIS 172 O -0.0046 -0.0183 0.0033 2989 HIS 172 CB -0.0095 -0.0227 -0.0018 2990 HIS 172 CG -0.0091 -0.0227 -0.0013 2991 HIS 172 ND1 -0.0060 -0.0211 0.0018 2992 HIS 172 CD2 -0.0114 -0.0240 -0.0037 2993 HIS 172 CE1 -0.0064 -0.0215 0.0014 2994 HIS 172 NE2 -0.0096 -0.0232 -0.0019 2995 GLN 173 N -0.0104 -0.0188 -0.0024 2996 GLN 173 CA -0.0094 -0.0194 -0.0014 2997 GLN 173 C -0.0078 -0.0145 0.0004 2998 GLN 173 O -0.0054 -0.0147 0.0028 2999 GLN 173 CB -0.0125 -0.0213 -0.0046 3000 GLN 173 CG -0.0159 -0.0180 -0.0078 3001 GLN 173 CD -0.0192 -0.0207 -0.0111 3002 GLN 173 OE1 -0.0194 -0.0254 -0.0116 3003 GLN 173 NE2 -0.0217 -0.0179 -0.0135 3004 MET 174 N -0.0091 -0.0102 -0.0006 3005 MET 174 CA -0.0080 -0.0051 0.0009 3006 MET 174 C -0.0042 -0.0039 0.0046 3007 MET 174 O -0.0019 -0.0017 0.0070 3008 MET 174 CB -0.0107 -0.0011 -0.0016 3009 MET 174 CG -0.0137 0.0011 -0.0044 3010 MET 174 SD -0.0144 0.0080 -0.0047 3011 MET 174 CE -0.0135 0.0087 -0.0037 3012 THR 175 N -0.0007 -0.0001 0.0073 3013 THR 175 CA -0.0002 -0.0001 0.0086 3014 THR 175 C 0.0002 -0.0018 0.0112 3015 THR 175 O 0.0010 -0.0015 0.0127 3016 THR 175 CB -0.0013 -0.0007 0.0068 3017 THR 175 OG1 -0.0015 0.0010 0.0044 3018 THR 175 CG2 -0.0006 -0.0004 0.0079 3019 ALA 176 N -0.0006 -0.0037 0.0117 3020 ALA 176 CA -0.0003 -0.0054 0.0142 3021 ALA 176 C 0.0014 -0.0042 0.0165 3022 ALA 176 O 0.0019 -0.0046 0.0182 3023 ALA 176 CB -0.0012 -0.0074 0.0144 3024 PRO 177 N 0.0023 -0.0026 0.0168 3025 PRO 177 CA 0.0040 -0.0014 0.0191 3026 PRO 177 C 0.0049 0.0004 0.0192 3027 PRO 177 O 0.0060 0.0006 0.0212 3028 PRO 177 CB 0.0046 -0.0001 0.0189 3029 PRO 177 CG 0.0035 0.0003 0.0162 3030 PRO 177 CD 0.0020 -0.0020 0.0153 3031 LEU 178 N 0.0120 0.0119 0.0120 3032 LEU 178 CA 0.0117 0.0103 0.0109 3033 LEU 178 C 0.0098 0.0100 0.0103 3034 LEU 178 O 0.0088 0.0094 0.0096 3035 LEU 178 CB 0.0131 0.0091 0.0104 3036 LEU 178 CG 0.0131 0.0075 0.0093 3037 LEU 178 CD1 0.0136 0.0075 0.0094 3038 LEU 178 CD2 0.0143 0.0064 0.0088 3039 ILE 179 N 0.0093 0.0105 0.0105 3040 ILE 179 CA 0.0076 0.0104 0.0100 3041 ILE 179 C 0.0062 0.0113 0.0103 3042 ILE 179 O 0.0048 0.0107 0.0096 3043 ILE 179 CB 0.0074 0.0110 0.0104 3044 ILE 179 CG1 0.0088 0.0102 0.0101 3045 ILE 179 CG2 0.0055 0.0109 0.0098 3046 ILE 179 CD1 0.0088 0.0085 0.0090 3047 GLY 180 N 0.0065 0.0126 0.0113 3048 GLY 180 CA 0.0053 0.0136 0.0117 3049 GLY 180 C 0.0052 0.0128 0.0111 3050 GLY 180 O 0.0038 0.0129 0.0109 3051 TYR 181 N 0.0099 0.0198 0.0131 3052 TYR 181 CA 0.0101 0.0167 0.0111 3053 TYR 181 C 0.0082 0.0153 0.0077 3054 TYR 181 O 0.0065 0.0147 0.0053 3055 TYR 181 CB 0.0133 0.0138 0.0126 3056 TYR 181 CG 0.0138 0.0102 0.0104 3057 TYR 181 CD1 0.0136 0.0078 0.0084 3058 TYR 181 CD2 0.0145 0.0091 0.0105 3059 TYR 181 CE1 0.0141 0.0044 0.0064 3060 TYR 181 CE2 0.0150 0.0058 0.0085 3061 TYR 181 CZ 0.0147 0.0034 0.0065 3062 TYR 181 OH 0.0152 0.0002 0.0045 3063 TYR 182 N 0.0084 0.0149 0.0077 3064 TYR 182 CA 0.0066 0.0135 0.0046 3065 TYR 182 C 0.0035 0.0159 0.0027 3066 TYR 182 O 0.0018 0.0147 -0.0002 3067 TYR 182 CB 0.0078 0.0124 0.0051 3068 TYR 182 CG 0.0103 0.0087 0.0053 3069 TYR 182 CD1 0.0102 0.0060 0.0031 3070 TYR 182 CD2 0.0129 0.0081 0.0077 3071 TYR 182 CE1 0.0126 0.0026 0.0034 3072 TYR 182 CE2 0.0153 0.0047 0.0080 3073 TYR 182 CZ 0.0151 0.0020 0.0058 3074 TYR 182 OH 0.0175 -0.0013 0.0061 3075 SER 183 N 0.0026 0.0194 0.0043 3076 SER 183 CA -0.0005 0.0219 0.0026 3077 SER 183 C -0.0018 0.0216 0.0008 3078 SER 183 O -0.0043 0.0218 -0.0018 3079 SER 183 CB -0.0010 0.0257 0.0049 3080 SER 183 OG 0.0007 0.0260 0.0071 3081 LYS 184 N -0.0075 0.0296 0.0055 3082 LYS 184 CA -0.0097 0.0296 0.0036 3083 LYS 184 C -0.0094 0.0233 -0.0011 3084 LYS 184 O -0.0132 0.0229 -0.0047 3085 LYS 184 CB -0.0064 0.0317 0.0081 3086 LYS 184 CG -0.0085 0.0387 0.0119 3087 LYS 184 CD -0.0053 0.0403 0.0159 3088 LYS 184 CE -0.0075 0.0472 0.0194 3089 LYS 184 NZ -0.0039 0.0487 0.0236 3090 GLU 185 N -0.0049 0.0185 -0.0010 3091 GLU 185 CA -0.0045 0.0123 -0.0055 3092 GLU 185 C -0.0101 0.0120 -0.0106 3093 GLU 185 O -0.0128 0.0095 -0.0149 3094 GLU 185 CB 0.0007 0.0076 -0.0048 3095 GLU 185 CG 0.0065 0.0062 -0.0008 3096 GLU 185 CD 0.0068 0.0031 -0.0029 3097 GLU 185 OE1 0.0070 -0.0022 -0.0070 3098 GLU 185 OE2 0.0069 0.0061 -0.0005 3099 ALA 186 N -0.0120 0.0149 -0.0099 3100 ALA 186 CA -0.0173 0.0153 -0.0142 3101 ALA 186 C -0.0228 0.0190 -0.0160 3102 ALA 186 O -0.0267 0.0172 -0.0209 3103 ALA 186 CB -0.0175 0.0181 -0.0122 3104 GLU 187 N -0.0283 0.0327 -0.0204 3105 GLU 187 CA -0.0347 0.0381 -0.0235 3106 GLU 187 C -0.0360 0.0326 -0.0281 3107 GLU 187 O -0.0421 0.0336 -0.0335 3108 GLU 187 CB -0.0334 0.0458 -0.0177 3109 GLU 187 CG -0.0348 0.0540 -0.0142 3110 GLU 187 CD -0.0332 0.0613 -0.0083 3111 GLU 187 OE1 -0.0338 0.0616 -0.0088 3112 GLU 187 OE2 -0.0313 0.0667 -0.0033 3113 ALA 188 N -0.0302 0.0269 -0.0256 3114 ALA 188 CA -0.0303 0.0210 -0.0293 3115 ALA 188 C -0.0331 0.0143 -0.0360 3116 ALA 188 O -0.0362 0.0106 -0.0412 3117 ALA 188 CB -0.0228 0.0165 -0.0245 3118 GLY 189 N -0.0319 0.0125 -0.0358 3119 GLY 189 CA -0.0344 0.0064 -0.0419 3120 GLY 189 C -0.0289 -0.0026 -0.0418 3121 GLY 189 O -0.0306 -0.0085 -0.0469 3122 ASN 190 N -0.0140 -0.0019 -0.0218 3123 ASN 190 CA -0.0134 -0.0071 -0.0191 3124 ASN 190 C -0.0104 -0.0084 -0.0151 3125 ASN 190 O -0.0102 -0.0130 -0.0131 3126 ASN 190 CB -0.0126 -0.0079 -0.0179 3127 ASN 190 CG -0.0157 -0.0072 -0.0217 3128 ASN 190 OD1 -0.0189 -0.0082 -0.0251 3129 ASN 190 ND2 -0.0148 -0.0054 -0.0213 3130 THR 191 N -0.0081 -0.0043 -0.0140 3131 THR 191 CA -0.0051 -0.0049 -0.0103 3132 THR 191 C -0.0039 0.0002 -0.0109 3133 THR 191 O -0.0056 0.0036 -0.0141 3134 THR 191 CB -0.0019 -0.0058 -0.0062 3135 THR 191 OG1 0.0007 -0.0076 -0.0025 3136 THR 191 CG2 0.0002 -0.0008 -0.0057 3137 LYS 192 N -0.0013 0.0005 -0.0080 3138 LYS 192 CA 0.0001 0.0053 -0.0081 3139 LYS 192 C 0.0042 0.0070 -0.0040 3140 LYS 192 O 0.0060 0.0037 -0.0007 3141 LYS 192 CB -0.0006 0.0043 -0.0085 3142 LYS 192 CG -0.0044 0.0041 -0.0129 3143 LYS 192 CD -0.0071 -0.0014 -0.0140 3144 LYS 192 CE -0.0065 -0.0055 -0.0117 3145 LYS 192 NZ -0.0088 -0.0111 -0.0122 3146 TYR 193 N 0.0033 0.0052 0.0052 3147 TYR 193 CA 0.0039 0.0054 0.0054 3148 TYR 193 C 0.0018 0.0048 0.0050 3149 TYR 193 O -0.0002 0.0049 0.0056 3150 TYR 193 CB 0.0047 0.0067 0.0076 3151 TYR 193 CG 0.0047 0.0071 0.0082 3152 TYR 193 CD1 0.0066 0.0070 0.0076 3153 TYR 193 CD2 0.0028 0.0074 0.0093 3154 TYR 193 CE1 0.0065 0.0072 0.0080 3155 TYR 193 CE2 0.0027 0.0076 0.0097 3156 TYR 193 CZ 0.0045 0.0075 0.0090 3157 TYR 193 OH 0.0042 0.0077 0.0094 3158 ALA 194 N 0.0021 0.0043 0.0039 3159 ALA 194 CA 0.0001 0.0037 0.0035 3160 ALA 194 C 0.0006 0.0038 0.0034 3161 ALA 194 O 0.0024 0.0036 0.0026 3162 ALA 194 CB -0.0009 0.0025 0.0015 3163 LYS 195 N -0.0010 0.0041 0.0044 3164 LYS 195 CA -0.0007 0.0041 0.0044 3165 LYS 195 C -0.0020 0.0029 0.0026 3166 LYS 195 O -0.0039 0.0024 0.0023 3167 LYS 195 CB -0.0018 0.0051 0.0064 3168 LYS 195 CG -0.0013 0.0053 0.0067 3169 LYS 195 CD 0.0005 0.0065 0.0083 3170 LYS 195 CE -0.0003 0.0075 0.0103 3171 LYS 195 NZ 0.0014 0.0086 0.0119 3172 VAL 196 N -0.0012 -0.0002 0.0100 3173 VAL 196 CA -0.0033 0.0003 0.0074 3174 VAL 196 C -0.0063 -0.0006 0.0076 3175 VAL 196 O -0.0062 -0.0007 0.0077 3176 VAL 196 CB -0.0019 0.0021 0.0044 3177 VAL 196 CG1 -0.0042 0.0026 0.0018 3178 VAL 196 CG2 0.0010 0.0030 0.0042 3179 ASP 197 N -0.0088 -0.0015 0.0079 3180 ASP 197 CA -0.0119 -0.0024 0.0080 3181 ASP 197 C -0.0129 -0.0013 0.0048 3182 ASP 197 O -0.0137 -0.0006 0.0028 3183 ASP 197 CB -0.0141 -0.0035 0.0088 3184 ASP 197 CG -0.0174 -0.0045 0.0089 3185 ASP 197 OD1 -0.0180 -0.0045 0.0085 3186 ASP 197 OD2 -0.0194 -0.0053 0.0094 3187 GLY 198 N -0.0127 -0.0011 0.0045 3188 GLY 198 CA -0.0135 -0.0000 0.0016 3189 GLY 198 C -0.0168 -0.0007 0.0010 3190 GLY 198 O -0.0176 -0.0001 -0.0009 3191 THR 199 N -0.0282 -0.0034 0.0011 3192 THR 199 CA -0.0320 -0.0039 0.0009 3193 THR 199 C -0.0322 -0.0012 -0.0007 3194 THR 199 O -0.0353 -0.0001 -0.0017 3195 THR 199 CB -0.0329 -0.0075 0.0029 3196 THR 199 OG1 -0.0303 -0.0081 0.0036 3197 THR 199 CG2 -0.0322 -0.0100 0.0045 3198 LYS 200 N -0.0289 -0.0001 -0.0010 3199 LYS 200 CA -0.0286 0.0024 -0.0024 3200 LYS 200 C -0.0300 0.0058 -0.0046 3201 LYS 200 O -0.0306 0.0064 -0.0050 3202 LYS 200 CB -0.0245 0.0031 -0.0023 3203 LYS 200 CG -0.0228 0.0001 -0.0003 3204 LYS 200 CD -0.0187 0.0009 -0.0003 3205 LYS 200 CE -0.0170 -0.0021 0.0017 3206 LYS 200 NZ -0.0131 -0.0012 0.0017 3207 PRO 201 N -0.0310 0.0078 -0.0059 3208 PRO 201 CA -0.0324 0.0111 -0.0080 3209 PRO 201 C -0.0290 0.0131 -0.0087 3210 PRO 201 O -0.0256 0.0128 -0.0082 3211 PRO 201 CB -0.0334 0.0125 -0.0089 3212 PRO 201 CG -0.0314 0.0104 -0.0074 3213 PRO 201 CD -0.0317 0.0070 -0.0055 3214 VAL 202 N -0.0327 0.0165 -0.0030 3215 VAL 202 CA -0.0295 0.0172 -0.0044 3216 VAL 202 C -0.0263 0.0191 -0.0068 3217 VAL 202 O -0.0227 0.0183 -0.0073 3218 VAL 202 CB -0.0311 0.0191 -0.0053 3219 VAL 202 CG1 -0.0277 0.0197 -0.0068 3220 VAL 202 CG2 -0.0339 0.0170 -0.0029 3221 ALA 203 N -0.0276 0.0217 -0.0081 3222 ALA 203 CA -0.0249 0.0237 -0.0104 3223 ALA 203 C -0.0221 0.0214 -0.0097 3224 ALA 203 O -0.0187 0.0222 -0.0113 3225 ALA 203 CB -0.0272 0.0267 -0.0118 3226 GLU 204 N -0.0234 0.0187 -0.0074 3227 GLU 204 CA -0.0209 0.0164 -0.0065 3228 GLU 204 C -0.0180 0.0136 -0.0055 3229 GLU 204 O -0.0146 0.0125 -0.0057 3230 GLU 204 CB -0.0234 0.0147 -0.0046 3231 GLU 204 CG -0.0213 0.0142 -0.0048 3232 GLU 204 CD -0.0234 0.0121 -0.0027 3233 GLU 204 OE1 -0.0273 0.0125 -0.0018 3234 GLU 204 OE2 -0.0213 0.0100 -0.0019 3235 VAL 205 N -0.0149 0.0141 -0.0032 3236 VAL 205 CA -0.0129 0.0123 -0.0025 3237 VAL 205 C -0.0108 0.0126 -0.0046 3238 VAL 205 O -0.0088 0.0116 -0.0050 3239 VAL 205 CB -0.0134 0.0114 -0.0010 3240 VAL 205 CG1 -0.0112 0.0095 -0.0003 3241 VAL 205 CG2 -0.0156 0.0112 0.0010 3242 ARG 206 N -0.0113 0.0140 -0.0061 3243 ARG 206 CA -0.0095 0.0145 -0.0082 3244 ARG 206 C -0.0084 0.0149 -0.0096 3245 ARG 206 O -0.0062 0.0142 -0.0104 3246 ARG 206 CB -0.0108 0.0162 -0.0094 3247 ARG 206 CG -0.0093 0.0169 -0.0115 3248 ARG 206 CD -0.0110 0.0185 -0.0122 3249 ARG 206 NE -0.0100 0.0196 -0.0145 3250 ARG 206 CZ -0.0094 0.0206 -0.0163 3251 ARG 206 NH1 -0.0096 0.0206 -0.0161 3252 ARG 206 NH2 -0.0085 0.0216 -0.0183 3253 ALA 207 N -0.0099 0.0159 -0.0097 3254 ALA 207 CA -0.0090 0.0163 -0.0109 3255 ALA 207 C -0.0075 0.0145 -0.0098 3256 ALA 207 O -0.0057 0.0142 -0.0109 3257 ALA 207 CB -0.0111 0.0177 -0.0110 3258 ASP 208 N -0.0078 0.0122 -0.0064 3259 ASP 208 CA -0.0068 0.0111 -0.0050 3260 ASP 208 C -0.0044 0.0096 -0.0057 3261 ASP 208 O -0.0033 0.0089 -0.0062 3262 ASP 208 CB -0.0075 0.0107 -0.0022 3263 ASP 208 CG -0.0097 0.0120 -0.0013 3264 ASP 208 OD1 -0.0104 0.0129 -0.0025 3265 ASP 208 OD2 -0.0107 0.0122 0.0007 3266 LEU 209 N -0.0036 0.0090 -0.0058 3267 LEU 209 CA -0.0013 0.0076 -0.0064 3268 LEU 209 C -0.0004 0.0077 -0.0091 3269 LEU 209 O 0.0014 0.0066 -0.0096 3270 LEU 209 CB -0.0008 0.0071 -0.0061 3271 LEU 209 CG -0.0017 0.0070 -0.0035 3272 LEU 209 CD1 -0.0013 0.0067 -0.0033 3273 LEU 209 CD2 -0.0006 0.0057 -0.0017 3274 GLU 210 N -0.0016 0.0091 -0.0108 3275 GLU 210 CA -0.0008 0.0093 -0.0134 3276 GLU 210 C -0.0006 0.0092 -0.0135 3277 GLU 210 O 0.0009 0.0085 -0.0149 3278 GLU 210 CB -0.0023 0.0108 -0.0151 3279 GLU 210 CG -0.0025 0.0110 -0.0152 3280 GLU 210 CD -0.0036 0.0124 -0.0174 3281 GLU 210 OE1 -0.0025 0.0122 -0.0194 3282 GLU 210 OE2 -0.0055 0.0137 -0.0169 3283 LYS 211 N -0.0043 0.0100 -0.0121 3284 LYS 211 CA -0.0048 0.0106 -0.0131 3285 LYS 211 C -0.0033 0.0087 -0.0123 3286 LYS 211 O -0.0030 0.0081 -0.0140 3287 LYS 211 CB -0.0065 0.0129 -0.0117 3288 LYS 211 CG -0.0081 0.0150 -0.0125 3289 LYS 211 CD -0.0094 0.0169 -0.0100 3290 LYS 211 CE -0.0096 0.0173 -0.0089 3291 LYS 211 NZ -0.0105 0.0187 -0.0062 3292 ILE 212 N -0.0025 0.0078 -0.0098 3293 ILE 212 CA -0.0011 0.0061 -0.0087 3294 ILE 212 C 0.0006 0.0037 -0.0102 3295 ILE 212 O 0.0014 0.0026 -0.0110 3296 ILE 212 CB -0.0006 0.0058 -0.0054 3297 ILE 212 CG1 -0.0022 0.0080 -0.0038 3298 ILE 212 CG2 0.0010 0.0037 -0.0044 3299 ILE 212 CD1 -0.0022 0.0084 -0.0008 3300 LEU 213 N 0.0011 0.0030 -0.0108 3301 LEU 213 CA 0.0027 0.0008 -0.0121 3302 LEU 213 C 0.0026 0.0006 -0.0154 3303 LEU 213 O 0.0040 -0.0013 -0.0166 3304 LEU 213 CB 0.0034 -0.0000 -0.0108 3305 LEU 213 CG 0.0038 -0.0002 -0.0076 3306 LEU 213 CD1 0.0044 -0.0009 -0.0065 3307 LEU 213 CD2 0.0052 -0.0019 -0.0069 3308 GLY 214 N 0.0001 0.0032 -0.0169 3309 GLY 214 CA -0.0007 0.0026 -0.0227 3310 GLY 214 C -0.0012 0.0033 -0.0233 3311 GLY 214 O -0.0030 0.0049 -0.0276 3312 GLY 214 OXT 0.0001 0.0024 -0.0194