1 PRO 1 N 0.0080 -0.0019 -0.0073 2 PRO 1 CA 0.0082 -0.0013 -0.0075 3 PRO 1 C 0.0084 -0.0010 -0.0078 4 PRO 1 O 0.0083 -0.0013 -0.0079 5 PRO 1 CB 0.0084 -0.0010 -0.0069 6 PRO 1 CG 0.0082 -0.0012 -0.0064 7 PRO 1 CD 0.0079 -0.0018 -0.0066 8 GLN 2 N 0.0064 -0.0065 -0.0092 9 GLN 2 CA 0.0061 -0.0056 -0.0087 10 GLN 2 C 0.0072 -0.0064 -0.0096 11 GLN 2 O 0.0074 -0.0081 -0.0101 12 GLN 2 CB 0.0041 -0.0061 -0.0078 13 GLN 2 CG 0.0035 -0.0051 -0.0072 14 GLN 2 CD 0.0019 -0.0061 -0.0065 15 GLN 2 OE1 0.0019 -0.0077 -0.0070 16 GLN 2 NE2 0.0004 -0.0052 -0.0055 17 ILE 3 N 0.0079 -0.0052 -0.0099 18 ILE 3 CA 0.0083 -0.0053 -0.0100 19 ILE 3 C 0.0076 -0.0044 -0.0093 20 ILE 3 O 0.0076 -0.0034 -0.0086 21 ILE 3 CB 0.0099 -0.0054 -0.0102 22 ILE 3 CG1 0.0106 -0.0042 -0.0095 23 ILE 3 CG2 0.0106 -0.0061 -0.0108 24 ILE 3 CD1 0.0122 -0.0043 -0.0097 25 THR 4 N 0.0053 -0.0108 -0.0110 26 THR 4 CA 0.0040 -0.0098 -0.0098 27 THR 4 C 0.0063 -0.0088 -0.0097 28 THR 4 O 0.0088 -0.0091 -0.0108 29 THR 4 CB 0.0020 -0.0118 -0.0107 30 THR 4 OG1 0.0035 -0.0136 -0.0127 31 THR 4 CG2 -0.0007 -0.0127 -0.0105 32 LEU 5 N 0.0040 -0.0053 -0.0084 33 LEU 5 CA 0.0063 -0.0038 -0.0079 34 LEU 5 C 0.0069 -0.0039 -0.0080 35 LEU 5 O 0.0082 -0.0023 -0.0074 36 LEU 5 CB 0.0059 -0.0011 -0.0068 37 LEU 5 CG 0.0060 -0.0006 -0.0066 38 LEU 5 CD1 0.0049 0.0020 -0.0055 39 LEU 5 CD2 0.0088 -0.0010 -0.0069 40 TRP 6 N 0.0076 -0.0078 -0.0075 41 TRP 6 CA 0.0088 -0.0077 -0.0072 42 TRP 6 C 0.0129 -0.0086 -0.0065 43 TRP 6 O 0.0148 -0.0073 -0.0058 44 TRP 6 CB 0.0067 -0.0103 -0.0083 45 TRP 6 CG 0.0028 -0.0094 -0.0089 46 TRP 6 CD1 0.0004 -0.0109 -0.0098 47 TRP 6 CD2 0.0008 -0.0067 -0.0086 48 TRP 6 NE1 -0.0030 -0.0093 -0.0101 49 TRP 6 CE2 -0.0029 -0.0067 -0.0094 50 TRP 6 CE3 0.0017 -0.0043 -0.0078 51 TRP 6 CZ2 -0.0056 -0.0044 -0.0094 52 TRP 6 CZ3 -0.0011 -0.0019 -0.0078 53 TRP 6 CH2 -0.0047 -0.0021 -0.0085 54 GLN 7 N 0.0131 -0.0112 -0.0023 55 GLN 7 CA 0.0268 -0.0148 0.0017 56 GLN 7 C 0.0200 -0.0084 -0.0024 57 GLN 7 O 0.0036 -0.0053 -0.0066 58 GLN 7 CB 0.0286 -0.0340 0.0110 59 GLN 7 CG 0.0336 -0.0419 0.0156 60 GLN 7 CD 0.0545 -0.0422 0.0192 61 GLN 7 OE1 0.0638 -0.0294 0.0147 62 GLN 7 NE2 0.0620 -0.0572 0.0274 63 ARG 8 N 0.0209 -0.0085 -0.0045 64 ARG 8 CA 0.0191 -0.0075 -0.0053 65 ARG 8 C 0.0171 -0.0078 -0.0039 66 ARG 8 O 0.0173 -0.0088 -0.0022 67 ARG 8 CB 0.0199 -0.0073 -0.0060 68 ARG 8 CG 0.0213 -0.0066 -0.0079 69 ARG 8 CD 0.0225 -0.0067 -0.0083 70 ARG 8 NE 0.0232 -0.0057 -0.0104 71 ARG 8 CZ 0.0250 -0.0057 -0.0111 72 ARG 8 NH1 0.0263 -0.0066 -0.0100 73 ARG 8 NH2 0.0254 -0.0046 -0.0131 74 PRO 9 N 0.0171 -0.0033 -0.0043 75 PRO 9 CA 0.0158 -0.0040 -0.0039 76 PRO 9 C 0.0164 -0.0044 -0.0038 77 PRO 9 O 0.0159 -0.0036 -0.0041 78 PRO 9 CB 0.0144 -0.0028 -0.0043 79 PRO 9 CG 0.0152 -0.0013 -0.0049 80 PRO 9 CD 0.0167 -0.0016 -0.0049 81 LEU 10 N 0.0208 -0.0047 0.0016 82 LEU 10 CA 0.0193 -0.0043 0.0019 83 LEU 10 C 0.0181 -0.0039 0.0038 84 LEU 10 O 0.0190 -0.0040 0.0053 85 LEU 10 CB 0.0202 -0.0045 0.0023 86 LEU 10 CG 0.0210 -0.0049 0.0003 87 LEU 10 CD1 0.0224 -0.0052 0.0008 88 LEU 10 CD2 0.0193 -0.0046 -0.0011 89 VAL 11 N 0.0173 -0.0009 0.0046 90 VAL 11 CA 0.0160 -0.0012 0.0058 91 VAL 11 C 0.0145 -0.0016 0.0071 92 VAL 11 O 0.0141 -0.0018 0.0068 93 VAL 11 CB 0.0150 -0.0018 0.0043 94 VAL 11 CG1 0.0164 -0.0014 0.0031 95 VAL 11 CG2 0.0136 -0.0025 0.0028 96 THR 12 N 0.0150 -0.0001 0.0114 97 THR 12 N 0.0149 -0.0002 0.0114 98 THR 12 CA 0.0124 -0.0001 0.0127 99 THR 12 CA 0.0124 -0.0001 0.0128 100 THR 12 C 0.0096 -0.0007 0.0113 101 THR 12 C 0.0094 -0.0006 0.0117 102 THR 12 O 0.0094 -0.0009 0.0106 103 THR 12 O 0.0090 -0.0007 0.0116 104 THR 12 CB 0.0123 0.0006 0.0161 105 THR 12 CB 0.0126 0.0007 0.0162 106 THR 12 OG1 0.0151 0.0011 0.0173 107 THR 12 OG1 0.0125 0.0008 0.0171 108 THR 12 CG2 0.0097 0.0007 0.0176 109 THR 12 CG2 0.0155 0.0012 0.0172 110 ILE 13 N 0.0083 -0.0004 0.0110 111 ILE 13 CA 0.0054 -0.0005 0.0099 112 ILE 13 C 0.0030 -0.0001 0.0115 113 ILE 13 O 0.0036 0.0001 0.0126 114 ILE 13 CB 0.0050 -0.0011 0.0066 115 ILE 13 CG1 0.0047 -0.0012 0.0058 116 ILE 13 CG2 0.0075 -0.0015 0.0049 117 ILE 13 CD1 0.0041 -0.0018 0.0026 118 LYS 14 N 0.0036 0.0001 0.0121 119 LYS 14 CA -0.0010 0.0011 0.0140 120 LYS 14 C -0.0055 0.0011 0.0098 121 LYS 14 O -0.0066 0.0010 0.0083 122 LYS 14 CB -0.0026 0.0022 0.0196 123 LYS 14 CG -0.0071 0.0033 0.0220 124 LYS 14 CD -0.0091 0.0044 0.0273 125 LYS 14 CE -0.0133 0.0054 0.0294 126 LYS 14 NZ -0.0153 0.0065 0.0348 127 ILE 15 N -0.0054 0.0024 0.0090 128 ILE 15 CA -0.0074 0.0027 0.0067 129 ILE 15 C -0.0096 0.0036 0.0060 130 ILE 15 O -0.0091 0.0033 0.0058 131 ILE 15 CB -0.0063 0.0010 0.0041 132 ILE 15 CG1 -0.0085 0.0014 0.0018 133 ILE 15 CG2 -0.0048 -0.0003 0.0030 134 ILE 15 CD1 -0.0076 -0.0001 -0.0007 135 GLY 16 N -0.0115 0.0050 0.0051 136 GLY 16 CA -0.0142 0.0069 0.0034 137 GLY 16 C -0.0140 0.0075 0.0051 138 GLY 16 O -0.0150 0.0076 0.0030 139 GLY 17 N -0.0181 0.0075 0.0131 140 GLY 17 CA -0.0176 0.0098 0.0172 141 GLY 17 C -0.0135 0.0070 0.0170 142 GLY 17 O -0.0130 0.0088 0.0203 143 GLN 18 N -0.0117 0.0067 0.0129 144 GLN 18 CA -0.0076 0.0040 0.0120 145 GLN 18 C -0.0042 0.0019 0.0138 146 GLN 18 O -0.0048 0.0022 0.0136 147 GLN 18 CB -0.0070 0.0035 0.0065 148 GLN 18 CG -0.0102 0.0055 0.0042 149 GLN 18 CD -0.0098 0.0050 -0.0012 150 GLN 18 OE1 -0.0065 0.0028 -0.0030 151 GLN 18 NE2 -0.0130 0.0071 -0.0040 152 LEU 19 N -0.0021 0.0011 0.0163 153 LEU 19 CA 0.0018 0.0002 0.0170 154 LEU 19 C 0.0054 -0.0009 0.0134 155 LEU 19 O 0.0067 -0.0012 0.0130 156 LEU 19 CB 0.0040 -0.0001 0.0220 157 LEU 19 CG 0.0006 0.0009 0.0261 158 LEU 19 CD1 0.0032 0.0006 0.0308 159 LEU 19 CD2 -0.0013 0.0014 0.0262 160 LYS 20 N 0.0033 0.0006 0.0117 161 LYS 20 CA 0.0057 -0.0013 0.0086 162 LYS 20 C 0.0092 -0.0026 0.0095 163 LYS 20 O 0.0094 -0.0020 0.0119 164 LYS 20 CB 0.0036 -0.0016 0.0046 165 LYS 20 CG 0.0001 -0.0004 0.0033 166 LYS 20 CD -0.0017 -0.0008 -0.0006 167 LYS 20 CE -0.0050 0.0003 -0.0020 168 LYS 20 NZ -0.0040 -0.0003 -0.0023 169 GLU 21 N 0.0092 -0.0023 0.0083 170 GLU 21 CA 0.0117 -0.0023 0.0072 171 GLU 21 C 0.0113 -0.0024 0.0035 172 GLU 21 O 0.0108 -0.0025 0.0018 173 GLU 21 CB 0.0151 -0.0021 0.0079 174 GLU 21 CG 0.0160 -0.0020 0.0115 175 GLU 21 CD 0.0179 -0.0019 0.0125 176 GLU 21 OE1 0.0173 -0.0020 0.0111 177 GLU 21 OE2 0.0200 -0.0018 0.0148 178 ALA 22 N 0.0125 -0.0021 0.0028 179 ALA 22 CA 0.0124 -0.0025 0.0004 180 ALA 22 C 0.0142 -0.0027 -0.0003 181 ALA 22 O 0.0150 -0.0025 0.0011 182 ALA 22 CB 0.0100 -0.0025 -0.0002 183 LEU 23 N 0.0146 -0.0027 -0.0027 184 LEU 23 CA 0.0156 -0.0027 -0.0034 185 LEU 23 C 0.0148 -0.0028 -0.0040 186 LEU 23 O 0.0139 -0.0028 -0.0048 187 LEU 23 CB 0.0164 -0.0027 -0.0045 188 LEU 23 CG 0.0177 -0.0027 -0.0052 189 LEU 23 CD1 0.0189 -0.0026 -0.0042 190 LEU 23 CD2 0.0180 -0.0027 -0.0065 191 LEU 24 N 0.0140 -0.0015 -0.0047 192 LEU 24 CA 0.0137 -0.0016 -0.0053 193 LEU 24 C 0.0141 -0.0014 -0.0061 194 LEU 24 O 0.0148 -0.0012 -0.0063 195 LEU 24 CB 0.0138 -0.0015 -0.0051 196 LEU 24 CG 0.0135 -0.0016 -0.0043 197 LEU 24 CD1 0.0138 -0.0016 -0.0042 198 LEU 24 CD2 0.0127 -0.0020 -0.0042 199 ASP 25 N 0.0124 -0.0011 -0.0072 200 ASP 25 CA 0.0126 -0.0002 -0.0075 201 ASP 25 C 0.0119 0.0003 -0.0079 202 ASP 25 O 0.0119 0.0006 -0.0080 203 ASP 25 CB 0.0134 -0.0000 -0.0074 204 ASP 25 CG 0.0139 0.0009 -0.0076 205 ASP 25 OD1 0.0134 0.0013 -0.0079 206 ASP 25 OD2 0.0146 0.0010 -0.0075 207 THR 26 N 0.0100 0.0050 -0.0087 208 THR 26 CA 0.0091 0.0058 -0.0088 209 THR 26 C 0.0096 0.0072 -0.0086 210 THR 26 O 0.0091 0.0079 -0.0086 211 THR 26 CB 0.0078 0.0059 -0.0091 212 THR 26 OG1 0.0078 0.0065 -0.0090 213 THR 26 CG2 0.0072 0.0045 -0.0094 214 GLY 27 N 0.0085 0.0090 -0.0079 215 GLY 27 CA 0.0092 0.0105 -0.0085 216 GLY 27 C 0.0096 0.0104 -0.0083 217 GLY 27 O 0.0101 0.0115 -0.0087 218 ALA 28 N 0.0102 0.0030 -0.0079 219 ALA 28 CA 0.0104 0.0028 -0.0077 220 ALA 28 C 0.0093 0.0027 -0.0080 221 ALA 28 O 0.0086 0.0020 -0.0078 222 ALA 28 CB 0.0109 0.0020 -0.0071 223 ASP 29 N 0.0093 0.0072 -0.0088 224 ASP 29 CA 0.0071 0.0060 -0.0097 225 ASP 29 C 0.0074 0.0027 -0.0084 226 ASP 29 O 0.0053 0.0007 -0.0090 227 ASP 29 CB 0.0074 0.0079 -0.0103 228 ASP 29 CG 0.0070 0.0112 -0.0117 229 ASP 29 OD1 0.0058 0.0117 -0.0127 230 ASP 29 OD2 0.0078 0.0132 -0.0119 231 ASP 30 N 0.0030 0.0004 -0.0061 232 ASP 30 CA 0.0025 -0.0001 -0.0053 233 ASP 30 CA 0.0025 -0.0001 -0.0053 234 ASP 30 C 0.0030 -0.0001 -0.0043 235 ASP 30 O 0.0039 0.0003 -0.0041 236 ASP 30 CB 0.0022 -0.0002 -0.0054 237 ASP 30 CB 0.0019 -0.0003 -0.0055 238 ASP 30 CG 0.0021 0.0000 -0.0065 239 ASP 30 CG 0.0013 -0.0004 -0.0065 240 ASP 30 OD1 0.0016 -0.0000 -0.0071 241 ASP 30 OD1 0.0007 -0.0007 -0.0066 242 ASP 30 OD2 0.0024 0.0003 -0.0067 243 ASP 30 OD2 0.0013 -0.0002 -0.0071 244 THR 31 N 0.0036 -0.0031 -0.0049 245 THR 31 CA 0.0035 -0.0022 -0.0037 246 THR 31 C 0.0023 -0.0023 -0.0034 247 THR 31 O 0.0012 -0.0030 -0.0037 248 THR 31 CB 0.0031 -0.0016 -0.0029 249 THR 31 OG1 0.0043 -0.0014 -0.0031 250 THR 31 CG2 0.0026 -0.0007 -0.0016 251 VAL 32 N 0.0007 -0.0062 -0.0030 252 VAL 32 CA -0.0006 -0.0063 -0.0030 253 VAL 32 C -0.0013 -0.0053 -0.0034 254 VAL 32 O -0.0014 -0.0050 -0.0035 255 VAL 32 CB -0.0013 -0.0074 -0.0027 256 VAL 32 CG1 -0.0024 -0.0079 -0.0026 257 VAL 32 CG2 -0.0004 -0.0084 -0.0023 258 LEU 33 N -0.0015 -0.0061 -0.0048 259 LEU 33 CA -0.0023 -0.0047 -0.0047 260 LEU 33 C -0.0044 -0.0052 -0.0058 261 LEU 33 O -0.0056 -0.0059 -0.0067 262 LEU 33 CB -0.0026 -0.0024 -0.0040 263 LEU 33 CG -0.0006 -0.0016 -0.0028 264 LEU 33 CD1 -0.0009 0.0007 -0.0021 265 LEU 33 CD2 0.0012 -0.0021 -0.0021 266 GLU 34 N -0.0054 -0.0060 -0.0086 267 GLU 34 CA -0.0084 -0.0064 -0.0100 268 GLU 34 C -0.0092 -0.0042 -0.0110 269 GLU 34 O -0.0075 -0.0021 -0.0107 270 GLU 34 CB -0.0099 -0.0060 -0.0110 271 GLU 34 CG -0.0090 -0.0078 -0.0100 272 GLU 34 CD -0.0103 -0.0068 -0.0109 273 GLU 34 OE1 -0.0104 -0.0041 -0.0117 274 GLU 34 OE2 -0.0111 -0.0088 -0.0108 275 GLU 35 N -0.0118 -0.0054 -0.0137 276 GLU 35 CA -0.0134 -0.0029 -0.0150 277 GLU 35 C -0.0127 0.0007 -0.0147 278 GLU 35 O -0.0128 0.0016 -0.0148 279 GLU 35 CB -0.0163 -0.0038 -0.0173 280 GLU 35 CG -0.0181 -0.0019 -0.0189 281 GLU 35 CD -0.0170 -0.0018 -0.0180 282 GLU 35 OE1 -0.0165 -0.0045 -0.0174 283 GLU 35 OE2 -0.0166 0.0010 -0.0178 284 MET 36 N -0.0114 -0.0004 -0.0161 285 MET 36 CA -0.0117 0.0023 -0.0152 286 MET 36 C -0.0127 0.0048 -0.0156 287 MET 36 O -0.0128 0.0043 -0.0160 288 MET 36 CB -0.0101 0.0025 -0.0122 289 MET 36 CG -0.0091 0.0026 -0.0104 290 MET 36 SD -0.0074 0.0030 -0.0070 291 MET 36 CE -0.0082 0.0062 -0.0068 292 ASN 37 N -0.0144 0.0068 -0.0188 293 ASN 37 CA -0.0151 0.0104 -0.0188 294 ASN 37 C -0.0121 0.0124 -0.0147 295 ASN 37 O -0.0107 0.0148 -0.0125 296 ASN 37 CB -0.0179 0.0146 -0.0212 297 ASN 37 CG -0.0191 0.0178 -0.0220 298 ASN 37 OD1 -0.0179 0.0170 -0.0206 299 ASN 37 ND2 -0.0216 0.0215 -0.0242 300 LEU 38 N -0.0103 0.0065 -0.0158 301 LEU 38 CA -0.0084 0.0088 -0.0128 302 LEU 38 C -0.0075 0.0123 -0.0138 303 LEU 38 O -0.0080 0.0122 -0.0150 304 LEU 38 CB -0.0076 0.0068 -0.0091 305 LEU 38 CG -0.0078 0.0041 -0.0072 306 LEU 38 CD1 -0.0068 0.0028 -0.0034 307 LEU 38 CD2 -0.0072 0.0057 -0.0071 308 PRO 39 N -0.0064 0.0162 -0.0149 309 PRO 39 CA -0.0079 0.0192 -0.0162 310 PRO 39 C -0.0040 0.0159 -0.0136 311 PRO 39 O 0.0010 0.0134 -0.0105 312 PRO 39 CB -0.0062 0.0270 -0.0162 313 PRO 39 CG -0.0018 0.0277 -0.0139 314 PRO 39 CD -0.0017 0.0206 -0.0129 315 GLY 40 N 0.0011 0.0225 -0.0145 316 GLY 40 CA 0.0044 0.0196 -0.0130 317 GLY 40 C 0.0028 0.0147 -0.0113 318 GLY 40 O -0.0013 0.0135 -0.0113 319 ARG 41 N 0.0086 0.0123 -0.0138 320 ARG 41 CA 0.0070 0.0054 -0.0074 321 ARG 41 C 0.0034 0.0023 -0.0047 322 ARG 41 O 0.0056 0.0044 -0.0066 323 ARG 41 CB 0.0153 0.0022 -0.0038 324 ARG 41 CG 0.0231 0.0032 -0.0043 325 ARG 41 CD 0.0317 0.0019 -0.0024 326 ARG 41 NE 0.0380 -0.0008 0.0005 327 ARG 41 CZ 0.0460 -0.0027 0.0029 328 ARG 41 NH1 0.0489 -0.0024 0.0028 329 ARG 41 NH2 0.0511 -0.0051 0.0055 330 TRP 42 N 0.0046 0.0024 -0.0040 331 TRP 42 CA 0.0023 0.0007 -0.0021 332 TRP 42 C 0.0023 -0.0011 0.0010 333 TRP 42 O 0.0035 -0.0010 0.0015 334 TRP 42 CB -0.0013 0.0005 -0.0039 335 TRP 42 CG -0.0030 0.0006 -0.0051 336 TRP 42 CD1 -0.0028 0.0022 -0.0079 337 TRP 42 CD2 -0.0052 -0.0010 -0.0035 338 TRP 42 NE1 -0.0047 0.0018 -0.0081 339 TRP 42 CE2 -0.0062 -0.0002 -0.0055 340 TRP 42 CE3 -0.0064 -0.0030 -0.0006 341 TRP 42 CZ2 -0.0084 -0.0014 -0.0047 342 TRP 42 CZ3 -0.0085 -0.0042 0.0002 343 TRP 42 CH2 -0.0095 -0.0033 -0.0019 344 LYS 43 N 0.0024 -0.0030 0.0021 345 LYS 43 CA 0.0018 -0.0055 0.0073 346 LYS 43 C -0.0040 -0.0070 0.0087 347 LYS 43 O -0.0067 -0.0066 0.0071 348 LYS 43 CB 0.0057 -0.0065 0.0107 349 LYS 43 CG 0.0117 -0.0054 0.0101 350 LYS 43 CD 0.0152 -0.0070 0.0146 351 LYS 43 CE 0.0212 -0.0058 0.0138 352 LYS 43 NZ 0.0223 -0.0061 0.0148 353 PRO 44 N -0.0026 -0.0074 0.0100 354 PRO 44 CA -0.0051 -0.0063 0.0113 355 PRO 44 C -0.0050 -0.0063 0.0112 356 PRO 44 O -0.0031 -0.0078 0.0114 357 PRO 44 CB -0.0058 -0.0076 0.0143 358 PRO 44 CG -0.0040 -0.0089 0.0143 359 PRO 44 CD -0.0016 -0.0093 0.0120 360 LYS 45 N -0.0057 -0.0024 0.0112 361 LYS 45 CA -0.0064 -0.0011 0.0099 362 LYS 45 C -0.0072 0.0011 0.0106 363 LYS 45 O -0.0073 0.0017 0.0115 364 LYS 45 CB -0.0067 -0.0016 0.0075 365 LYS 45 CG -0.0072 -0.0010 0.0060 366 LYS 45 CD -0.0077 -0.0008 0.0037 367 LYS 45 CE -0.0085 0.0008 0.0025 368 LYS 45 NZ -0.0084 0.0003 0.0022 369 MET 46 N -0.0129 0.0182 0.0143 370 MET 46 CA -0.0128 0.0200 0.0146 371 MET 46 C -0.0227 0.0196 0.0145 372 MET 46 O -0.0292 0.0237 0.0152 373 MET 46 CB -0.0085 0.0295 0.0162 374 MET 46 CG -0.0033 0.0299 0.0163 375 MET 46 SD 0.0072 0.0369 0.0175 376 MET 46 CE 0.0123 0.0318 0.0166 377 ILE 47 N -0.0167 0.0084 0.0171 378 ILE 47 CA -0.0242 0.0084 0.0162 379 ILE 47 C -0.0267 0.0108 0.0176 380 ILE 47 O -0.0232 0.0100 0.0174 381 ILE 47 CB -0.0270 0.0022 0.0118 382 ILE 47 CG1 -0.0241 -0.0022 0.0092 383 ILE 47 CG2 -0.0254 0.0002 0.0106 384 ILE 47 CD1 -0.0276 -0.0079 0.0050 385 GLY 48 N -0.0531 0.0211 0.0253 386 GLY 48 CA -0.0539 0.0212 0.0256 387 GLY 48 C -0.0645 0.0109 0.0267 388 GLY 48 O -0.0755 0.0083 0.0299 389 GLY 49 N -0.0610 0.0046 0.0255 390 GLY 49 CA -0.0651 -0.0034 0.0290 391 GLY 49 C -0.0591 -0.0017 0.0262 392 GLY 49 O -0.0553 0.0085 0.0223 393 ILE 50 N -0.0478 -0.0158 0.0191 394 ILE 50 CA -0.0395 -0.0118 0.0171 395 ILE 50 C -0.0318 -0.0120 0.0191 396 ILE 50 O -0.0306 -0.0176 0.0249 397 ILE 50 CB -0.0371 -0.0152 0.0210 398 ILE 50 CG1 -0.0373 -0.0101 0.0160 399 ILE 50 CG2 -0.0279 -0.0181 0.0260 400 ILE 50 CD1 -0.0368 -0.0135 0.0194 401 GLY 51 N -0.0251 -0.0030 0.0139 402 GLY 51 CA -0.0091 -0.0030 0.0112 403 GLY 51 C -0.0047 0.0053 0.0090 404 GLY 51 O 0.0082 0.0084 0.0062 405 GLY 52 N -0.0190 0.0086 0.0145 406 GLY 52 CA -0.0159 0.0198 0.0120 407 GLY 52 C -0.0199 0.0158 0.0140 408 GLY 52 O -0.0294 0.0076 0.0188 409 PHE 53 N -0.0106 0.0262 0.0147 410 PHE 53 CA -0.0121 0.0235 0.0149 411 PHE 53 CA -0.0119 0.0236 0.0148 412 PHE 53 C -0.0010 0.0127 0.0113 413 PHE 53 O 0.0108 0.0111 0.0083 414 PHE 53 CB -0.0114 0.0383 0.0158 415 PHE 53 CB -0.0100 0.0384 0.0155 416 PHE 53 CG -0.0246 0.0477 0.0198 417 PHE 53 CG 0.0051 0.0448 0.0122 418 PHE 53 CD1 -0.0346 0.0491 0.0224 419 PHE 53 CD1 0.0093 0.0542 0.0119 420 PHE 53 CD2 -0.0271 0.0551 0.0210 421 PHE 53 CD2 0.0151 0.0413 0.0095 422 PHE 53 CE1 -0.0469 0.0577 0.0261 423 PHE 53 CE1 0.0232 0.0602 0.0089 424 PHE 53 CE2 -0.0393 0.0638 0.0247 425 PHE 53 CE2 0.0291 0.0472 0.0065 426 PHE 53 CZ -0.0492 0.0651 0.0273 427 PHE 53 CZ 0.0331 0.0567 0.0062 428 ILE 54 N -0.0095 0.0049 0.0125 429 ILE 54 CA -0.0032 0.0009 0.0091 430 ILE 54 C -0.0017 0.0043 0.0095 431 ILE 54 O -0.0070 0.0069 0.0121 432 ILE 54 CB -0.0046 -0.0084 0.0070 433 ILE 54 CG1 -0.0123 -0.0111 0.0091 434 ILE 54 CG2 -0.0042 -0.0121 0.0058 435 ILE 54 CD1 -0.0129 -0.0199 0.0069 436 LYS 55 N -0.0000 0.0090 0.0102 437 LYS 55 CA 0.0043 0.0063 0.0099 438 LYS 55 C 0.0018 -0.0060 0.0053 439 LYS 55 O 0.0038 -0.0130 0.0031 440 LYS 55 CB 0.0173 0.0078 0.0120 441 LYS 55 CG 0.0213 0.0201 0.0168 442 LYS 55 CD 0.0346 0.0210 0.0187 443 LYS 55 CE 0.0399 0.0185 0.0186 444 LYS 55 NZ 0.0522 0.0206 0.0208 445 VAL 56 N -0.0047 -0.0043 0.0041 446 VAL 56 CA -0.0054 -0.0065 0.0035 447 VAL 56 C -0.0047 -0.0069 0.0034 448 VAL 56 O -0.0042 -0.0053 0.0038 449 VAL 56 CB -0.0080 -0.0070 0.0033 450 VAL 56 CG1 -0.0087 -0.0070 0.0033 451 VAL 56 CG2 -0.0095 -0.0053 0.0037 452 ARG 57 N -0.0103 -0.0061 0.0003 453 ARG 57 CA -0.0069 -0.0048 -0.0003 454 ARG 57 C -0.0044 -0.0042 -0.0001 455 ARG 57 O -0.0054 -0.0035 -0.0017 456 ARG 57 CB -0.0071 -0.0030 -0.0034 457 ARG 57 CG -0.0091 -0.0035 -0.0035 458 ARG 57 CD -0.0093 -0.0016 -0.0067 459 ARG 57 NE -0.0123 -0.0012 -0.0088 460 ARG 57 CZ -0.0122 0.0005 -0.0115 461 ARG 57 NH1 -0.0091 0.0019 -0.0125 462 ARG 57 NH2 -0.0152 0.0007 -0.0133 463 GLN 58 N -0.0045 -0.0031 -0.0000 464 GLN 58 CA -0.0039 -0.0031 -0.0006 465 GLN 58 C -0.0029 -0.0032 -0.0014 466 GLN 58 O -0.0022 -0.0036 -0.0010 467 GLN 58 CB -0.0035 -0.0035 0.0002 468 GLN 58 CG -0.0029 -0.0035 -0.0004 469 GLN 58 CD -0.0025 -0.0039 0.0003 470 GLN 58 OE1 -0.0030 -0.0040 0.0012 471 GLN 58 NE2 -0.0015 -0.0042 0.0000 472 TYR 59 N -0.0031 -0.0017 -0.0026 473 TYR 59 CA -0.0018 0.0000 -0.0034 474 TYR 59 C -0.0004 0.0003 -0.0021 475 TYR 59 O -0.0008 -0.0005 -0.0016 476 TYR 59 CB -0.0027 0.0007 -0.0054 477 TYR 59 CG -0.0039 0.0008 -0.0069 478 TYR 59 CD1 -0.0032 0.0023 -0.0081 479 TYR 59 CD2 -0.0057 -0.0005 -0.0072 480 TYR 59 CE1 -0.0043 0.0024 -0.0095 481 TYR 59 CE2 -0.0068 -0.0004 -0.0086 482 TYR 59 CZ -0.0061 0.0011 -0.0098 483 TYR 59 OH -0.0071 0.0013 -0.0112 484 ASP 60 N -0.0024 -0.0010 -0.0027 485 ASP 60 CA -0.0024 -0.0010 -0.0028 486 ASP 60 C -0.0022 -0.0013 -0.0035 487 ASP 60 O -0.0019 -0.0014 -0.0038 488 ASP 60 CB -0.0020 -0.0010 -0.0023 489 ASP 60 CG -0.0022 -0.0008 -0.0017 490 ASP 60 OD1 -0.0027 -0.0006 -0.0016 491 ASP 60 OD2 -0.0017 -0.0007 -0.0012 492 GLN 61 N -0.0088 -0.0039 -0.0056 493 GLN 61 CA -0.0104 -0.0067 -0.0053 494 GLN 61 C -0.0091 -0.0050 0.0024 495 GLN 61 O -0.0115 -0.0094 0.0065 496 GLN 61 CB -0.0149 -0.0143 -0.0069 497 GLN 61 CG -0.0161 -0.0160 -0.0143 498 GLN 61 CD -0.0205 -0.0234 -0.0151 499 GLN 61 OE1 -0.0222 -0.0268 -0.0100 500 GLN 61 NE2 -0.0222 -0.0260 -0.0218 501 ILE 62 N -0.0058 0.0010 0.0006 502 ILE 62 CA -0.0054 0.0004 0.0008 503 ILE 62 C -0.0058 0.0000 0.0010 504 ILE 62 O -0.0061 0.0002 0.0010 505 ILE 62 CB -0.0047 0.0006 0.0007 506 ILE 62 CG1 -0.0043 0.0009 0.0006 507 ILE 62 CG2 -0.0044 0.0000 0.0009 508 ILE 62 CD1 -0.0041 0.0006 0.0007 509 LEU 63 N -0.0087 -0.0016 0.0022 510 LEU 63 CA -0.0077 -0.0014 0.0035 511 LEU 63 C -0.0056 -0.0011 0.0042 512 LEU 63 O -0.0054 -0.0010 0.0050 513 LEU 63 CB -0.0091 -0.0015 0.0055 514 LEU 63 CG -0.0081 -0.0012 0.0071 515 LEU 63 CD1 -0.0078 -0.0012 0.0063 516 LEU 63 CD2 -0.0092 -0.0012 0.0091 517 ILE 64 N -0.0039 -0.0017 0.0040 518 ILE 64 CA -0.0022 -0.0016 0.0046 519 ILE 64 C -0.0015 -0.0015 0.0056 520 ILE 64 O -0.0018 -0.0015 0.0052 521 ILE 64 CB -0.0009 -0.0016 0.0032 522 ILE 64 CG1 -0.0015 -0.0017 0.0019 523 ILE 64 CG2 0.0007 -0.0014 0.0039 524 ILE 64 CD1 0.0000 -0.0017 0.0010 525 GLU 65 N -0.0012 -0.0017 0.0076 526 GLU 65 CA 0.0004 -0.0013 0.0090 527 GLU 65 C 0.0033 -0.0012 0.0085 528 GLU 65 O 0.0042 -0.0011 0.0090 529 GLU 65 CB -0.0002 -0.0009 0.0120 530 GLU 65 CG 0.0009 -0.0006 0.0134 531 GLU 65 CD -0.0003 -0.0003 0.0161 532 GLU 65 OE1 -0.0025 -0.0003 0.0167 533 GLU 65 OE2 0.0010 0.0001 0.0177 534 ILE 66 N 0.0052 -0.0024 0.0065 535 ILE 66 CA 0.0075 -0.0018 0.0058 536 ILE 66 C 0.0087 -0.0014 0.0069 537 ILE 66 O 0.0082 -0.0016 0.0064 538 ILE 66 CB 0.0078 -0.0018 0.0031 539 ILE 66 CG1 0.0065 -0.0022 0.0020 540 ILE 66 CG2 0.0102 -0.0011 0.0024 541 ILE 66 CD1 0.0059 -0.0024 -0.0004 542 CYS 67 N 0.0106 -0.0015 0.0079 543 CYS 67 CA 0.0114 -0.0015 0.0090 544 CYS 67 C 0.0098 -0.0021 0.0096 545 CYS 67 O 0.0100 -0.0020 0.0095 546 CYS 67 CB 0.0129 -0.0007 0.0078 547 CYS 67 SG 0.0144 -0.0006 0.0090 548 GLY 68 N 0.0080 -0.0005 0.0130 549 GLY 68 CA 0.0062 -0.0008 0.0142 550 GLY 68 C 0.0045 -0.0017 0.0118 551 GLY 68 O 0.0031 -0.0019 0.0126 552 HIS 69 N 0.0058 -0.0029 0.0069 553 HIS 69 CA 0.0043 -0.0040 0.0043 554 HIS 69 C 0.0031 -0.0053 0.0048 555 HIS 69 O 0.0040 -0.0044 0.0051 556 HIS 69 CB 0.0053 -0.0024 0.0016 557 HIS 69 CG 0.0062 -0.0013 0.0005 558 HIS 69 ND1 0.0078 0.0000 0.0021 559 HIS 69 CD2 0.0056 -0.0013 -0.0021 560 HIS 69 CE1 0.0082 0.0007 0.0006 561 HIS 69 NE2 0.0069 -0.0001 -0.0020 562 LYS 70 N 0.0006 -0.0025 0.0066 563 LYS 70 CA -0.0020 -0.0030 0.0055 564 LYS 70 C -0.0025 -0.0034 0.0018 565 LYS 70 O -0.0025 -0.0035 0.0006 566 LYS 70 CB -0.0051 -0.0034 0.0073 567 LYS 70 CG -0.0050 -0.0030 0.0109 568 LYS 70 CD -0.0081 -0.0034 0.0126 569 LYS 70 CE -0.0077 -0.0030 0.0161 570 LYS 70 NZ -0.0064 -0.0026 0.0181 571 ALA 71 N -0.0013 -0.0022 0.0026 572 ALA 71 CA -0.0018 -0.0026 0.0003 573 ALA 71 C -0.0036 -0.0030 -0.0001 574 ALA 71 O -0.0039 -0.0028 0.0012 575 ALA 71 CB 0.0004 -0.0024 -0.0012 576 ILE 72 N -0.0040 -0.0028 -0.0021 577 ILE 72 CA -0.0056 -0.0034 -0.0024 578 ILE 72 C -0.0052 -0.0035 -0.0048 579 ILE 72 O -0.0051 -0.0037 -0.0065 580 ILE 72 CB -0.0081 -0.0042 -0.0021 581 ILE 72 CG1 -0.0087 -0.0041 0.0005 582 ILE 72 CG2 -0.0097 -0.0048 -0.0030 583 ILE 72 CD1 -0.0110 -0.0048 0.0010 584 GLY 73 N -0.0044 -0.0025 -0.0042 585 GLY 73 CA -0.0040 -0.0023 -0.0059 586 GLY 73 C -0.0039 -0.0022 -0.0052 587 GLY 73 O -0.0043 -0.0024 -0.0034 588 THR 74 N -0.0036 -0.0028 -0.0043 589 THR 74 CA -0.0033 -0.0026 -0.0040 590 THR 74 C -0.0024 -0.0020 -0.0033 591 THR 74 O -0.0018 -0.0014 -0.0037 592 THR 74 CB -0.0033 -0.0024 -0.0050 593 THR 74 OG1 -0.0042 -0.0031 -0.0053 594 THR 74 CG2 -0.0029 -0.0021 -0.0047 595 VAL 75 N -0.0029 -0.0020 -0.0025 596 VAL 75 CA -0.0030 -0.0021 -0.0026 597 VAL 75 C -0.0035 -0.0025 -0.0032 598 VAL 75 O -0.0041 -0.0024 -0.0034 599 VAL 75 CB -0.0032 -0.0014 -0.0023 600 VAL 75 CG1 -0.0033 -0.0015 -0.0024 601 VAL 75 CG2 -0.0026 -0.0010 -0.0018 602 LEU 76 N -0.0061 -0.0041 -0.0038 603 LEU 76 CA -0.0058 -0.0038 -0.0034 604 LEU 76 C -0.0057 -0.0042 -0.0038 605 LEU 76 O -0.0063 -0.0045 -0.0042 606 LEU 76 CB -0.0063 -0.0033 -0.0027 607 LEU 76 CG -0.0066 -0.0029 -0.0023 608 LEU 76 CD1 -0.0072 -0.0025 -0.0017 609 LEU 76 CD2 -0.0058 -0.0027 -0.0020 610 VAL 77 N -0.0060 -0.0050 -0.0043 611 VAL 77 CA -0.0074 -0.0050 -0.0060 612 VAL 77 C -0.0087 -0.0063 -0.0061 613 VAL 77 O -0.0085 -0.0063 -0.0058 614 VAL 77 CB -0.0070 -0.0032 -0.0074 615 VAL 77 CG1 -0.0085 -0.0031 -0.0092 616 VAL 77 CG2 -0.0056 -0.0018 -0.0072 617 GLY 78 N -0.0077 -0.0090 -0.0069 618 GLY 78 CA -0.0083 -0.0100 -0.0077 619 GLY 78 C -0.0099 -0.0124 -0.0083 620 GLY 78 O -0.0104 -0.0132 -0.0083 621 PRO 79 N -0.0087 -0.0141 -0.0096 622 PRO 79 CA -0.0097 -0.0186 -0.0113 623 PRO 79 C -0.0124 -0.0214 -0.0077 624 PRO 79 O -0.0132 -0.0234 -0.0077 625 PRO 79 CB -0.0082 -0.0179 -0.0139 626 PRO 79 CG -0.0075 -0.0136 -0.0119 627 PRO 79 CD -0.0074 -0.0108 -0.0097 628 THR 80 N -0.0125 -0.0175 -0.0066 629 THR 80 CA -0.0123 -0.0196 -0.0045 630 THR 80 C -0.0150 -0.0198 -0.0072 631 THR 80 O -0.0155 -0.0171 -0.0101 632 THR 80 CB -0.0087 -0.0178 -0.0021 633 THR 80 OG1 -0.0088 -0.0196 -0.0007 634 THR 80 CG2 -0.0073 -0.0135 -0.0043 635 PRO 81 N -0.0160 -0.0243 -0.0029 636 PRO 81 CA -0.0206 -0.0263 -0.0086 637 PRO 81 C -0.0144 -0.0171 -0.0023 638 PRO 81 O -0.0183 -0.0152 -0.0079 639 PRO 81 CB -0.0218 -0.0446 -0.0062 640 PRO 81 CG -0.0143 -0.0499 0.0048 641 PRO 81 CD -0.0127 -0.0392 0.0047 642 VAL 82 N -0.0083 -0.0148 -0.0073 643 VAL 82 CA -0.0025 -0.0088 -0.0053 644 VAL 82 C -0.0001 -0.0076 -0.0047 645 VAL 82 O 0.0006 -0.0134 -0.0058 646 VAL 82 CB 0.0046 -0.0117 -0.0050 647 VAL 82 CG1 0.0120 -0.0077 -0.0031 648 VAL 82 CG2 0.0027 -0.0107 -0.0050 649 ASN 83 N 0.0053 -0.0059 -0.0050 650 ASN 83 CA 0.0056 -0.0048 -0.0042 651 ASN 83 C 0.0080 -0.0057 -0.0034 652 ASN 83 O 0.0095 -0.0057 -0.0026 653 ASN 83 CB 0.0054 -0.0023 -0.0031 654 ASN 83 CG 0.0031 -0.0011 -0.0038 655 ASN 83 OD1 0.0015 -0.0016 -0.0048 656 ASN 83 ND2 0.0030 0.0005 -0.0030 657 ILE 84 N 0.0083 -0.0046 -0.0031 658 ILE 84 N 0.0083 -0.0045 -0.0031 659 ILE 84 CA 0.0098 -0.0053 -0.0024 660 ILE 84 CA 0.0097 -0.0053 -0.0025 661 ILE 84 C 0.0106 -0.0045 -0.0019 662 ILE 84 C 0.0106 -0.0043 -0.0019 663 ILE 84 O 0.0101 -0.0045 -0.0021 664 ILE 84 O 0.0101 -0.0040 -0.0021 665 ILE 84 CB 0.0098 -0.0072 -0.0026 666 ILE 84 CB 0.0095 -0.0070 -0.0027 667 ILE 84 CG1 0.0090 -0.0078 -0.0031 668 ILE 84 CG1 0.0088 -0.0081 -0.0032 669 ILE 84 CG2 0.0092 -0.0079 -0.0030 670 ILE 84 CG2 0.0109 -0.0078 -0.0021 671 ILE 84 CD1 0.0091 -0.0097 -0.0032 672 ILE 84 CD1 0.0081 -0.0096 -0.0037 673 ILE 85 N 0.0104 -0.0022 -0.0035 674 ILE 85 CA 0.0098 -0.0024 -0.0037 675 ILE 85 C 0.0103 -0.0027 -0.0050 676 ILE 85 O 0.0114 -0.0025 -0.0052 677 ILE 85 CB 0.0101 -0.0020 -0.0027 678 ILE 85 CG1 0.0098 -0.0017 -0.0014 679 ILE 85 CG2 0.0094 -0.0023 -0.0029 680 ILE 85 CD1 0.0084 -0.0020 -0.0012 681 GLY 86 N 0.0087 -0.0009 -0.0051 682 GLY 86 CA 0.0085 -0.0004 -0.0058 683 GLY 86 C 0.0077 -0.0005 -0.0061 684 GLY 86 O 0.0072 -0.0010 -0.0057 685 ARG 87 N 0.0101 0.0035 -0.0082 686 ARG 87 CA 0.0083 0.0034 -0.0088 687 ARG 87 C 0.0081 0.0024 -0.0088 688 ARG 87 O 0.0069 0.0016 -0.0092 689 ARG 87 CB 0.0075 0.0051 -0.0091 690 ARG 87 CG 0.0076 0.0061 -0.0092 691 ARG 87 CD 0.0066 0.0077 -0.0096 692 ARG 87 NE 0.0073 0.0089 -0.0094 693 ARG 87 CZ 0.0069 0.0092 -0.0096 694 ARG 87 NH1 0.0056 0.0084 -0.0099 695 ARG 87 NH2 0.0077 0.0104 -0.0094 696 ASN 88 N 0.0059 0.0000 -0.0091 697 ASN 88 CA 0.0047 -0.0011 -0.0089 698 ASN 88 C 0.0046 -0.0007 -0.0078 699 ASN 88 O 0.0040 -0.0014 -0.0080 700 ASN 88 CB 0.0035 -0.0019 -0.0083 701 ASN 88 CG 0.0031 -0.0014 -0.0065 702 ASN 88 OD1 0.0039 -0.0004 -0.0059 703 ASN 88 ND2 0.0019 -0.0021 -0.0056 704 LEU 89 N 0.0050 -0.0017 -0.0077 705 LEU 89 CA 0.0049 -0.0013 -0.0061 706 LEU 89 C 0.0064 -0.0006 -0.0061 707 LEU 89 O 0.0062 -0.0005 -0.0054 708 LEU 89 CB 0.0046 -0.0010 -0.0043 709 LEU 89 CG 0.0030 -0.0017 -0.0040 710 LEU 89 CD1 0.0028 -0.0013 -0.0022 711 LEU 89 CD2 0.0015 -0.0025 -0.0041 712 LEU 90 N 0.0084 -0.0001 -0.0075 713 LEU 90 CA 0.0085 0.0000 -0.0076 714 LEU 90 C 0.0079 -0.0001 -0.0080 715 LEU 90 O 0.0077 -0.0004 -0.0078 716 LEU 90 CB 0.0091 0.0006 -0.0079 717 LEU 90 CG 0.0098 0.0008 -0.0075 718 LEU 90 CD1 0.0103 0.0014 -0.0079 719 LEU 90 CD2 0.0101 0.0005 -0.0068 720 THR 91 N 0.0075 0.0005 -0.0093 721 THR 91 CA 0.0066 0.0002 -0.0101 722 THR 91 C 0.0062 -0.0011 -0.0100 723 THR 91 O 0.0056 -0.0014 -0.0106 724 THR 91 CB 0.0064 0.0005 -0.0106 725 THR 91 OG1 0.0067 -0.0000 -0.0099 726 THR 91 CG2 0.0066 0.0017 -0.0109 727 GLN 92 N 0.0052 -0.0013 -0.0093 728 GLN 92 CA 0.0040 -0.0022 -0.0082 729 GLN 92 C 0.0046 -0.0019 -0.0069 730 GLN 92 O 0.0037 -0.0026 -0.0063 731 GLN 92 CB 0.0031 -0.0029 -0.0071 732 GLN 92 CG 0.0028 -0.0030 -0.0083 733 GLN 92 CD 0.0015 -0.0040 -0.0076 734 GLN 92 OE1 0.0007 -0.0043 -0.0088 735 GLN 92 NE2 0.0011 -0.0044 -0.0058 736 ILE 93 N 0.0055 -0.0028 -0.0074 737 ILE 93 CA 0.0062 -0.0024 -0.0063 738 ILE 93 C 0.0070 -0.0017 -0.0075 739 ILE 93 O 0.0077 -0.0012 -0.0068 740 ILE 93 CB 0.0072 -0.0018 -0.0046 741 ILE 93 CG1 0.0086 -0.0007 -0.0053 742 ILE 93 CG2 0.0063 -0.0026 -0.0035 743 ILE 93 CD1 0.0097 -0.0001 -0.0038 744 GLY 94 N 0.0069 -0.0009 -0.0089 745 GLY 94 CA 0.0062 -0.0003 -0.0099 746 GLY 94 C 0.0067 0.0008 -0.0098 747 GLY 94 O 0.0064 0.0010 -0.0103 748 CYS 95 N 0.0076 0.0008 -0.0091 749 CYS 95 CA 0.0080 0.0013 -0.0090 750 CYS 95 C 0.0073 0.0028 -0.0093 751 CYS 95 O 0.0073 0.0038 -0.0094 752 CYS 95 CB 0.0096 0.0016 -0.0086 753 CYS 95 SG 0.0102 0.0018 -0.0084 754 THR 96 N 0.0067 0.0033 -0.0087 755 THR 96 CA 0.0057 0.0044 -0.0086 756 THR 96 C 0.0060 0.0045 -0.0086 757 THR 96 O 0.0064 0.0034 -0.0087 758 THR 96 CB 0.0040 0.0042 -0.0087 759 THR 96 OG1 0.0035 0.0028 -0.0088 760 THR 96 CG2 0.0037 0.0041 -0.0087 761 LEU 97 N 0.0044 0.0067 -0.0077 762 LEU 97 CA 0.0037 0.0064 -0.0076 763 LEU 97 C 0.0023 0.0062 -0.0072 764 LEU 97 O 0.0019 0.0068 -0.0066 765 LEU 97 CB 0.0041 0.0073 -0.0071 766 LEU 97 CG 0.0052 0.0074 -0.0075 767 LEU 97 CD1 0.0054 0.0086 -0.0068 768 LEU 97 CD2 0.0050 0.0064 -0.0081 769 ASN 98 N 0.0017 0.0043 -0.0066 770 ASN 98 CA -0.0005 0.0038 -0.0061 771 ASN 98 C -0.0016 0.0034 -0.0060 772 ASN 98 O -0.0010 0.0023 -0.0069 773 ASN 98 CB -0.0011 0.0020 -0.0070 774 ASN 98 CG 0.0004 0.0019 -0.0075 775 ASN 98 OD1 0.0020 0.0012 -0.0085 776 ASN 98 ND2 -0.0003 0.0026 -0.0069 777 PHE 99 N -0.0057 0.0048 -0.0037 778 PHE 99 CA -0.0075 0.0042 -0.0035 779 PHE 99 C -0.0100 0.0048 -0.0021 780 PHE 99 O -0.0119 0.0043 -0.0018 781 PHE 99 CB -0.0065 0.0052 -0.0031 782 PHE 99 CG -0.0063 0.0076 -0.0014 783 PHE 99 CD1 -0.0042 0.0089 -0.0012 784 PHE 99 CD2 -0.0081 0.0085 -0.0001 785 PHE 99 CE1 -0.0040 0.0111 0.0003 786 PHE 99 CE2 -0.0079 0.0107 0.0015 787 PHE 99 CZ -0.0058 0.0120 0.0017 788 PHE 99 OXT -0.0102 0.0058 -0.0013 789 PRO 1 N -0.0116 0.0093 -0.0000 790 PRO 1 CA -0.0104 0.0092 -0.0004 791 PRO 1 C -0.0072 0.0082 -0.0023 792 PRO 1 O -0.0060 0.0075 -0.0033 793 PRO 1 CB -0.0098 0.0120 0.0019 794 PRO 1 CG -0.0087 0.0134 0.0028 795 PRO 1 CD -0.0106 0.0118 0.0019 796 GLN 2 N -0.0054 0.0076 -0.0046 797 GLN 2 CA -0.0033 0.0072 -0.0057 798 GLN 2 C -0.0017 0.0090 -0.0049 799 GLN 2 O -0.0021 0.0103 -0.0038 800 GLN 2 CB -0.0033 0.0061 -0.0065 801 GLN 2 CG -0.0012 0.0054 -0.0077 802 GLN 2 CD -0.0008 0.0050 -0.0081 803 GLN 2 OE1 -0.0003 0.0063 -0.0073 804 GLN 2 NE2 -0.0011 0.0033 -0.0093 805 ILE 3 N -0.0009 0.0095 -0.0073 806 ILE 3 CA 0.0007 0.0109 -0.0064 807 ILE 3 C 0.0028 0.0103 -0.0073 808 ILE 3 O 0.0036 0.0093 -0.0082 809 ILE 3 CB 0.0009 0.0117 -0.0059 810 ILE 3 CG1 -0.0012 0.0123 -0.0050 811 ILE 3 CG2 0.0026 0.0131 -0.0050 812 ILE 3 CD1 -0.0015 0.0125 -0.0048 813 THR 4 N 0.0002 0.0091 -0.0105 814 THR 4 CA 0.0010 0.0082 -0.0101 815 THR 4 C 0.0022 0.0090 -0.0095 816 THR 4 O 0.0023 0.0103 -0.0095 817 THR 4 CB 0.0003 0.0077 -0.0105 818 THR 4 OG1 -0.0003 0.0090 -0.0108 819 THR 4 CG2 -0.0006 0.0065 -0.0109 820 LEU 5 N 0.0035 0.0065 -0.0103 821 LEU 5 CA 0.0049 0.0071 -0.0099 822 LEU 5 C 0.0051 0.0074 -0.0098 823 LEU 5 O 0.0063 0.0076 -0.0094 824 LEU 5 CB 0.0060 0.0062 -0.0093 825 LEU 5 CG 0.0061 0.0062 -0.0093 826 LEU 5 CD1 0.0069 0.0049 -0.0088 827 LEU 5 CD2 0.0068 0.0077 -0.0093 828 TRP 6 N 0.0041 0.0085 -0.0098 829 TRP 6 CA 0.0048 0.0083 -0.0093 830 TRP 6 C 0.0054 0.0107 -0.0082 831 TRP 6 O 0.0067 0.0107 -0.0071 832 TRP 6 CB 0.0033 0.0076 -0.0107 833 TRP 6 CG 0.0028 0.0053 -0.0118 834 TRP 6 CD1 0.0012 0.0050 -0.0131 835 TRP 6 CD2 0.0039 0.0029 -0.0115 836 TRP 6 NE1 0.0013 0.0026 -0.0138 837 TRP 6 CE2 0.0029 0.0013 -0.0128 838 TRP 6 CE3 0.0057 0.0021 -0.0103 839 TRP 6 CZ2 0.0036 -0.0012 -0.0129 840 TRP 6 CZ3 0.0064 -0.0004 -0.0105 841 TRP 6 CH2 0.0053 -0.0020 -0.0117 842 GLN 7 N 0.0043 0.0138 -0.0069 843 GLN 7 CA 0.0053 0.0162 -0.0068 844 GLN 7 CA 0.0053 0.0162 -0.0068 845 GLN 7 C 0.0064 0.0148 -0.0073 846 GLN 7 O 0.0058 0.0122 -0.0075 847 GLN 7 CB 0.0027 0.0184 -0.0059 848 GLN 7 CB 0.0028 0.0183 -0.0059 849 GLN 7 CG -0.0002 0.0169 -0.0054 850 GLN 7 CG 0.0018 0.0201 -0.0054 851 GLN 7 CD -0.0029 0.0189 -0.0044 852 GLN 7 CD -0.0004 0.0226 -0.0045 853 GLN 7 OE1 -0.0029 0.0211 -0.0041 854 GLN 7 OE1 -0.0024 0.0219 -0.0041 855 GLN 7 NE2 -0.0051 0.0182 -0.0039 856 GLN 7 NE2 0.0002 0.0253 -0.0043 857 ARG 8 N 0.0049 0.0171 -0.0054 858 ARG 8 CA 0.0044 0.0162 -0.0059 859 ARG 8 C 0.0031 0.0154 -0.0053 860 ARG 8 O 0.0025 0.0159 -0.0042 861 ARG 8 CB 0.0046 0.0167 -0.0056 862 ARG 8 CG 0.0058 0.0171 -0.0064 863 ARG 8 CD 0.0060 0.0177 -0.0060 864 ARG 8 NE 0.0068 0.0176 -0.0069 865 ARG 8 CZ 0.0078 0.0185 -0.0071 866 ARG 8 NH1 0.0082 0.0195 -0.0063 867 ARG 8 NH2 0.0085 0.0183 -0.0080 868 PRO 9 N 0.0046 0.0140 -0.0054 869 PRO 9 CA 0.0025 0.0136 -0.0055 870 PRO 9 C 0.0015 0.0147 -0.0046 871 PRO 9 O 0.0011 0.0142 -0.0049 872 PRO 9 CB 0.0024 0.0120 -0.0069 873 PRO 9 CG 0.0043 0.0119 -0.0072 874 PRO 9 CD 0.0058 0.0129 -0.0064 875 LEU 10 N -0.0003 0.0185 -0.0012 876 LEU 10 CA -0.0012 0.0182 -0.0001 877 LEU 10 C -0.0029 0.0174 0.0012 878 LEU 10 O -0.0030 0.0178 0.0021 879 LEU 10 CB -0.0004 0.0197 0.0012 880 LEU 10 CG 0.0011 0.0205 0.0001 881 LEU 10 CD1 0.0021 0.0222 0.0015 882 LEU 10 CD2 0.0007 0.0197 -0.0007 883 VAL 11 N -0.0036 0.0169 0.0036 884 VAL 11 CA -0.0050 0.0162 0.0045 885 VAL 11 C -0.0056 0.0163 0.0054 886 VAL 11 O -0.0052 0.0164 0.0050 887 VAL 11 CB -0.0058 0.0148 0.0036 888 VAL 11 CG1 -0.0053 0.0147 0.0029 889 VAL 11 CG2 -0.0057 0.0139 0.0024 890 THR 12 N -0.0062 0.0168 0.0083 891 THR 12 CA -0.0069 0.0157 0.0091 892 THR 12 C -0.0078 0.0133 0.0081 893 THR 12 O -0.0084 0.0122 0.0082 894 THR 12 CB -0.0076 0.0160 0.0117 895 THR 12 OG1 -0.0067 0.0183 0.0126 896 THR 12 CG2 -0.0084 0.0149 0.0127 897 ILE 13 N -0.0063 0.0126 0.0070 898 ILE 13 CA -0.0066 0.0102 0.0063 899 ILE 13 C -0.0069 0.0091 0.0070 900 ILE 13 O -0.0068 0.0101 0.0072 901 ILE 13 CB -0.0063 0.0099 0.0038 902 ILE 13 CG1 -0.0060 0.0105 0.0024 903 ILE 13 CG2 -0.0060 0.0111 0.0032 904 ILE 13 CD1 -0.0057 0.0099 -0.0001 905 LYS 14 N -0.0044 0.0113 0.0064 906 LYS 14 CA -0.0052 0.0069 0.0076 907 LYS 14 C -0.0062 0.0021 0.0033 908 LYS 14 O -0.0065 0.0001 0.0027 909 LYS 14 CB -0.0053 0.0048 0.0140 910 LYS 14 CG -0.0061 0.0004 0.0156 911 LYS 14 CD -0.0063 -0.0020 0.0217 912 LYS 14 CE -0.0070 -0.0063 0.0229 913 LYS 14 NZ -0.0072 -0.0085 0.0289 914 ILE 15 N -0.0021 0.0004 0.0030 915 ILE 15 CA -0.0021 -0.0016 0.0008 916 ILE 15 C -0.0020 -0.0036 -0.0006 917 ILE 15 O -0.0023 -0.0025 -0.0014 918 ILE 15 CB -0.0028 0.0000 -0.0016 919 ILE 15 CG1 -0.0027 -0.0022 -0.0036 920 ILE 15 CG2 -0.0036 0.0021 -0.0033 921 ILE 15 CD1 -0.0034 -0.0008 -0.0059 922 GLY 16 N 0.0007 -0.0090 -0.0005 923 GLY 16 CA 0.0010 -0.0139 -0.0028 924 GLY 16 C 0.0018 -0.0140 0.0005 925 GLY 16 O 0.0013 -0.0152 -0.0024 926 GLY 17 N -0.0017 -0.0142 0.0051 927 GLY 17 CA -0.0023 -0.0128 0.0077 928 GLY 17 C -0.0034 -0.0078 0.0072 929 GLY 17 O -0.0040 -0.0063 0.0092 930 GLN 18 N -0.0023 -0.0068 0.0044 931 GLN 18 CA -0.0040 -0.0033 0.0032 932 GLN 18 C -0.0046 0.0006 0.0055 933 GLN 18 O -0.0045 0.0011 0.0064 934 GLN 18 CB -0.0055 -0.0030 -0.0014 935 GLN 18 CG -0.0051 -0.0068 -0.0041 936 GLN 18 CD -0.0066 -0.0066 -0.0085 937 GLN 18 OE1 -0.0081 -0.0038 -0.0104 938 GLN 18 NE2 -0.0062 -0.0094 -0.0103 939 LEU 19 N -0.0067 0.0067 0.0076 940 LEU 19 CA -0.0072 0.0097 0.0092 941 LEU 19 C -0.0068 0.0132 0.0058 942 LEU 19 O -0.0066 0.0153 0.0042 943 LEU 19 CB -0.0081 0.0121 0.0133 944 LEU 19 CG -0.0086 0.0091 0.0168 945 LEU 19 CD1 -0.0095 0.0118 0.0207 946 LEU 19 CD2 -0.0086 0.0057 0.0182 947 LYS 20 N -0.0060 0.0078 0.0065 948 LYS 20 CA -0.0069 0.0106 0.0038 949 LYS 20 C -0.0070 0.0138 0.0053 950 LYS 20 O -0.0064 0.0136 0.0080 951 LYS 20 CB -0.0074 0.0090 0.0004 952 LYS 20 CG -0.0074 0.0059 -0.0015 953 LYS 20 CD -0.0079 0.0043 -0.0046 954 LYS 20 CE -0.0079 0.0014 -0.0066 955 LYS 20 NZ -0.0085 0.0031 -0.0084 956 GLU 21 N -0.0064 0.0141 0.0051 957 GLU 21 CA -0.0055 0.0155 0.0044 958 GLU 21 C -0.0047 0.0144 0.0007 959 GLU 21 O -0.0039 0.0144 -0.0013 960 GLU 21 CB -0.0042 0.0192 0.0049 961 GLU 21 CG -0.0049 0.0206 0.0085 962 GLU 21 CD -0.0050 0.0218 0.0101 963 GLU 21 OE1 -0.0050 0.0205 0.0087 964 GLU 21 OE2 -0.0049 0.0240 0.0125 965 ALA 22 N -0.0028 0.0136 0.0019 966 ALA 22 CA -0.0025 0.0131 0.0000 967 ALA 22 C -0.0021 0.0137 -0.0004 968 ALA 22 O -0.0023 0.0140 0.0008 969 ALA 22 CB -0.0033 0.0112 -0.0004 970 LEU 23 N 0.0002 0.0138 -0.0015 971 LEU 23 CA 0.0010 0.0141 -0.0023 972 LEU 23 C 0.0003 0.0131 -0.0033 973 LEU 23 O -0.0001 0.0124 -0.0041 974 LEU 23 CB 0.0021 0.0147 -0.0031 975 LEU 23 CG 0.0031 0.0152 -0.0041 976 LEU 23 CD1 0.0037 0.0161 -0.0032 977 LEU 23 CD2 0.0039 0.0156 -0.0049 978 LEU 24 N 0.0015 0.0129 -0.0025 979 LEU 24 CA 0.0010 0.0117 -0.0037 980 LEU 24 C 0.0023 0.0116 -0.0051 981 LEU 24 O 0.0033 0.0121 -0.0053 982 LEU 24 CB 0.0003 0.0114 -0.0036 983 LEU 24 CG -0.0010 0.0115 -0.0022 984 LEU 24 CD1 -0.0014 0.0112 -0.0023 985 LEU 24 CD2 -0.0023 0.0108 -0.0021 986 ASP 25 N 0.0027 0.0105 -0.0053 987 ASP 25 CA 0.0038 0.0102 -0.0056 988 ASP 25 C 0.0041 0.0090 -0.0058 989 ASP 25 O 0.0045 0.0087 -0.0060 990 ASP 25 CB 0.0046 0.0111 -0.0057 991 ASP 25 CG 0.0058 0.0109 -0.0060 992 ASP 25 OD1 0.0059 0.0101 -0.0061 993 ASP 25 OD2 0.0065 0.0117 -0.0061 994 THR 26 N 0.0094 0.0064 -0.0070 995 THR 26 CA 0.0096 0.0049 -0.0076 996 THR 26 C 0.0113 0.0046 -0.0074 997 THR 26 O 0.0115 0.0036 -0.0078 998 THR 26 CB 0.0091 0.0036 -0.0081 999 THR 26 OG1 0.0101 0.0035 -0.0080 1000 THR 26 CG2 0.0073 0.0039 -0.0083 1001 GLY 27 N 0.0125 0.0028 -0.0073 1002 GLY 27 CA 0.0153 0.0026 -0.0082 1003 GLY 27 C 0.0149 0.0033 -0.0075 1004 GLY 27 O 0.0171 0.0031 -0.0083 1005 ALA 28 N 0.0074 0.0069 -0.0053 1006 ALA 28 CA 0.0070 0.0067 -0.0052 1007 ALA 28 C 0.0063 0.0059 -0.0055 1008 ALA 28 O 0.0057 0.0057 -0.0051 1009 ALA 28 CB 0.0068 0.0071 -0.0042 1010 ASP 29 N 0.0118 0.0044 -0.0055 1011 ASP 29 CA 0.0088 0.0023 -0.0068 1012 ASP 29 C 0.0050 0.0045 -0.0047 1013 ASP 29 O 0.0012 0.0032 -0.0053 1014 ASP 29 CB 0.0113 0.0012 -0.0079 1015 ASP 29 CG 0.0147 -0.0014 -0.0102 1016 ASP 29 OD1 0.0147 -0.0028 -0.0114 1017 ASP 29 OD2 0.0173 -0.0019 -0.0110 1018 ASP 30 N 0.0008 0.0046 -0.0017 1019 ASP 30 N 0.0008 0.0046 -0.0017 1020 ASP 30 CA 0.0006 0.0042 -0.0012 1021 ASP 30 CA 0.0005 0.0041 -0.0012 1022 ASP 30 C 0.0007 0.0045 -0.0005 1023 ASP 30 C 0.0007 0.0044 -0.0006 1024 ASP 30 O 0.0011 0.0051 -0.0004 1025 ASP 30 O 0.0010 0.0049 -0.0007 1026 ASP 30 CB 0.0004 0.0039 -0.0017 1027 ASP 30 CB 0.0002 0.0036 -0.0016 1028 ASP 30 CG 0.0002 0.0037 -0.0025 1029 ASP 30 CG -0.0001 0.0032 -0.0022 1030 ASP 30 OD1 0.0001 0.0036 -0.0026 1031 ASP 30 OD1 -0.0002 0.0030 -0.0020 1032 ASP 30 OD2 0.0003 0.0038 -0.0029 1033 ASP 30 OD2 -0.0001 0.0032 -0.0028 1034 THR 31 N -0.0024 0.0066 0.0000 1035 THR 31 CA -0.0020 0.0059 0.0001 1036 THR 31 C -0.0026 0.0051 -0.0004 1037 THR 31 O -0.0029 0.0046 -0.0007 1038 THR 31 CB -0.0011 0.0055 0.0006 1039 THR 31 OG1 -0.0006 0.0063 0.0010 1040 THR 31 CG2 -0.0007 0.0046 0.0006 1041 VAL 32 N -0.0069 0.0035 -0.0016 1042 VAL 32 CA -0.0075 0.0027 -0.0020 1043 VAL 32 C -0.0073 0.0018 -0.0028 1044 VAL 32 O -0.0076 0.0015 -0.0029 1045 VAL 32 CB -0.0088 0.0026 -0.0016 1046 VAL 32 CG1 -0.0093 0.0020 -0.0018 1047 VAL 32 CG2 -0.0092 0.0035 -0.0007 1048 LEU 33 N -0.0083 0.0039 -0.0034 1049 LEU 33 CA -0.0078 0.0025 -0.0042 1050 LEU 33 C -0.0092 0.0011 -0.0052 1051 LEU 33 O -0.0100 0.0009 -0.0055 1052 LEU 33 CB -0.0058 0.0017 -0.0042 1053 LEU 33 CG -0.0041 0.0029 -0.0032 1054 LEU 33 CD1 -0.0022 0.0019 -0.0034 1055 LEU 33 CD2 -0.0042 0.0039 -0.0027 1056 GLU 34 N -0.0109 0.0015 -0.0074 1057 GLU 34 CA -0.0129 -0.0011 -0.0092 1058 GLU 34 C -0.0108 -0.0027 -0.0105 1059 GLU 34 O -0.0076 -0.0021 -0.0102 1060 GLU 34 CB -0.0137 -0.0031 -0.0106 1061 GLU 34 CG -0.0157 -0.0016 -0.0093 1062 GLU 34 CD -0.0165 -0.0036 -0.0108 1063 GLU 34 OE1 -0.0181 -0.0060 -0.0124 1064 GLU 34 OE2 -0.0156 -0.0028 -0.0102 1065 GLU 35 N -0.0136 -0.0057 -0.0110 1066 GLU 35 CA -0.0128 -0.0076 -0.0118 1067 GLU 35 C -0.0098 -0.0087 -0.0118 1068 GLU 35 O -0.0089 -0.0094 -0.0120 1069 GLU 35 CB -0.0147 -0.0097 -0.0133 1070 GLU 35 CG -0.0146 -0.0113 -0.0140 1071 GLU 35 CD -0.0151 -0.0097 -0.0134 1072 GLU 35 OE1 -0.0171 -0.0082 -0.0130 1073 GLU 35 OE2 -0.0135 -0.0101 -0.0132 1074 MET 36 N -0.0100 -0.0081 -0.0138 1075 MET 36 CA -0.0074 -0.0097 -0.0129 1076 MET 36 C -0.0063 -0.0115 -0.0133 1077 MET 36 O -0.0073 -0.0109 -0.0137 1078 MET 36 CB -0.0059 -0.0081 -0.0105 1079 MET 36 CG -0.0056 -0.0064 -0.0090 1080 MET 36 SD -0.0033 -0.0049 -0.0062 1081 MET 36 CE -0.0006 -0.0077 -0.0061 1082 ASN 37 N -0.0047 -0.0158 -0.0170 1083 ASN 37 CA -0.0004 -0.0174 -0.0169 1084 ASN 37 C 0.0028 -0.0157 -0.0124 1085 ASN 37 O 0.0052 -0.0157 -0.0111 1086 ASN 37 CB 0.0025 -0.0208 -0.0203 1087 ASN 37 CG 0.0008 -0.0231 -0.0248 1088 ASN 37 OD1 -0.0032 -0.0222 -0.0257 1089 ASN 37 ND2 0.0037 -0.0262 -0.0277 1090 LEU 38 N 0.0022 -0.0158 -0.0102 1091 LEU 38 CA 0.0039 -0.0163 -0.0078 1092 LEU 38 C 0.0043 -0.0206 -0.0090 1093 LEU 38 O 0.0026 -0.0218 -0.0122 1094 LEU 38 CB 0.0030 -0.0128 -0.0077 1095 LEU 38 CG 0.0034 -0.0088 -0.0053 1096 LEU 38 CD1 0.0027 -0.0057 -0.0052 1097 LEU 38 CD2 0.0062 -0.0096 -0.0015 1098 PRO 39 N 0.0119 -0.0265 -0.0087 1099 PRO 39 CA 0.0165 -0.0311 -0.0109 1100 PRO 39 C 0.0174 -0.0291 -0.0074 1101 PRO 39 O 0.0168 -0.0245 -0.0019 1102 PRO 39 CB 0.0233 -0.0340 -0.0091 1103 PRO 39 CG 0.0230 -0.0300 -0.0039 1104 PRO 39 CD 0.0156 -0.0253 -0.0040 1105 GLY 40 N 0.0153 -0.0335 -0.0051 1106 GLY 40 CA 0.0138 -0.0270 -0.0027 1107 GLY 40 C 0.0042 -0.0244 -0.0021 1108 GLY 40 O -0.0020 -0.0287 -0.0038 1109 ARG 41 N 0.0074 -0.0251 -0.0005 1110 ARG 41 CA -0.0106 -0.0179 -0.0022 1111 ARG 41 C -0.0117 -0.0081 -0.0036 1112 ARG 41 O 0.0009 0.0020 -0.0045 1113 ARG 41 CB -0.0156 -0.0047 -0.0042 1114 ARG 41 CG -0.0179 -0.0128 -0.0031 1115 ARG 41 CD -0.0368 -0.0202 -0.0028 1116 ARG 41 NE -0.0382 -0.0318 -0.0012 1117 ARG 41 CZ -0.0317 -0.0483 0.0013 1118 ARG 41 NH1 -0.0229 -0.0555 0.0026 1119 ARG 41 NH2 -0.0338 -0.0577 0.0025 1120 TRP 42 N -0.0149 -0.0073 -0.0020 1121 TRP 42 CA -0.0163 -0.0053 -0.0019 1122 TRP 42 C -0.0216 -0.0033 -0.0015 1123 TRP 42 O -0.0243 -0.0043 -0.0011 1124 TRP 42 CB -0.0157 -0.0091 -0.0018 1125 TRP 42 CG -0.0182 -0.0138 -0.0012 1126 TRP 42 CD1 -0.0164 -0.0177 -0.0012 1127 TRP 42 CD2 -0.0229 -0.0152 -0.0006 1128 TRP 42 NE1 -0.0197 -0.0215 -0.0006 1129 TRP 42 CE2 -0.0238 -0.0201 -0.0003 1130 TRP 42 CE3 -0.0266 -0.0129 -0.0004 1131 TRP 42 CZ2 -0.0282 -0.0226 0.0003 1132 TRP 42 CZ3 -0.0310 -0.0155 0.0002 1133 TRP 42 CH2 -0.0317 -0.0203 0.0006 1134 LYS 43 N -0.0267 0.0022 0.0030 1135 LYS 43 CA -0.0319 0.0042 0.0034 1136 LYS 43 C -0.0291 0.0013 0.0049 1137 LYS 43 O -0.0227 0.0004 0.0029 1138 LYS 43 CB -0.0334 0.0107 -0.0019 1139 LYS 43 CG -0.0366 0.0143 -0.0038 1140 LYS 43 CD -0.0447 0.0152 -0.0011 1141 LYS 43 CE -0.0478 0.0186 -0.0029 1142 LYS 43 NZ -0.0443 0.0158 -0.0019 1143 PRO 44 N -0.0336 0.0016 0.0111 1144 PRO 44 CA -0.0308 -0.0016 0.0128 1145 PRO 44 C -0.0288 0.0013 0.0079 1146 PRO 44 O -0.0321 0.0060 0.0048 1147 PRO 44 CB -0.0365 -0.0025 0.0179 1148 PRO 44 CG -0.0414 -0.0009 0.0196 1149 PRO 44 CD -0.0406 0.0032 0.0143 1150 LYS 45 N -0.0156 -0.0025 0.0096 1151 LYS 45 CA -0.0132 -0.0030 0.0055 1152 LYS 45 C -0.0084 -0.0032 0.0065 1153 LYS 45 O -0.0068 -0.0029 0.0101 1154 LYS 45 CB -0.0139 -0.0032 0.0032 1155 LYS 45 CG -0.0140 -0.0037 -0.0017 1156 LYS 45 CD -0.0124 -0.0039 -0.0036 1157 LYS 45 CE -0.0114 -0.0044 -0.0085 1158 LYS 45 NZ -0.0090 -0.0047 -0.0102 1159 MET 46 N 0.0126 -0.0218 0.0120 1160 MET 46 CA 0.0170 -0.0236 0.0128 1161 MET 46 C 0.0110 -0.0368 0.0101 1162 MET 46 O 0.0105 -0.0477 0.0089 1163 MET 46 CB 0.0327 -0.0235 0.0160 1164 MET 46 CG 0.0385 -0.0089 0.0187 1165 MET 46 SD 0.0558 -0.0073 0.0224 1166 MET 46 CE 0.0648 -0.0062 0.0244 1167 ILE 47 N 0.0048 -0.0216 0.0157 1168 ILE 47 CA 0.0012 -0.0318 0.0118 1169 ILE 47 C 0.0064 -0.0367 0.0140 1170 ILE 47 O 0.0092 -0.0310 0.0166 1171 ILE 47 CB -0.0096 -0.0308 0.0058 1172 ILE 47 CG1 -0.0122 -0.0225 0.0057 1173 ILE 47 CG2 -0.0152 -0.0281 0.0031 1174 ILE 47 CD1 -0.0215 -0.0236 0.0002 1175 GLY 48 N 0.0039 -0.0762 0.0245 1176 GLY 48 CA 0.0038 -0.0767 0.0247 1177 GLY 48 C -0.0122 -0.0806 0.0260 1178 GLY 48 O -0.0212 -0.0897 0.0297 1179 GLY 49 N -0.0148 -0.0761 0.0257 1180 GLY 49 CA -0.0259 -0.0758 0.0297 1181 GLY 49 C -0.0218 -0.0720 0.0270 1182 GLY 49 O -0.0101 -0.0744 0.0234 1183 ILE 50 N -0.0301 -0.0483 0.0216 1184 ILE 50 CA -0.0240 -0.0409 0.0182 1185 ILE 50 C -0.0212 -0.0359 0.0177 1186 ILE 50 O -0.0243 -0.0340 0.0236 1187 ILE 50 CB -0.0250 -0.0349 0.0240 1188 ILE 50 CG1 -0.0215 -0.0340 0.0195 1189 ILE 50 CG2 -0.0236 -0.0258 0.0284 1190 ILE 50 CD1 -0.0236 -0.0302 0.0253 1191 GLY 51 N -0.0104 -0.0372 0.0154 1192 GLY 51 CA -0.0027 -0.0239 0.0116 1193 GLY 51 C 0.0080 -0.0227 0.0100 1194 GLY 51 O 0.0168 -0.0134 0.0069 1195 GLY 52 N 0.0089 -0.0372 0.0169 1196 GLY 52 CA 0.0254 -0.0392 0.0145 1197 GLY 52 C 0.0220 -0.0398 0.0155 1198 GLY 52 O 0.0084 -0.0454 0.0210 1199 PHE 53 N 0.0433 -0.0350 0.0174 1200 PHE 53 CA 0.0373 -0.0325 0.0167 1201 PHE 53 CA 0.0369 -0.0327 0.0167 1202 PHE 53 C 0.0310 -0.0116 0.0135 1203 PHE 53 O 0.0382 0.0027 0.0120 1204 PHE 53 CB 0.0545 -0.0381 0.0185 1205 PHE 53 CB 0.0532 -0.0401 0.0187 1206 PHE 53 CG 0.0704 -0.0224 0.0172 1207 PHE 53 CG 0.0550 -0.0625 0.0218 1208 PHE 53 CD1 0.0865 -0.0222 0.0181 1209 PHE 53 CD1 0.0480 -0.0730 0.0229 1210 PHE 53 CD2 0.0691 -0.0077 0.0151 1211 PHE 53 CD2 0.0638 -0.0728 0.0237 1212 PHE 53 CE1 0.1012 -0.0078 0.0169 1213 PHE 53 CE1 0.0496 -0.0936 0.0258 1214 PHE 53 CE2 0.0837 0.0070 0.0139 1215 PHE 53 CE2 0.0655 -0.0934 0.0266 1216 PHE 53 CZ 0.0998 0.0068 0.0149 1217 PHE 53 CZ 0.0584 -0.1038 0.0277 1218 ILE 54 N 0.0126 -0.0151 0.0150 1219 ILE 54 CA 0.0110 -0.0039 0.0121 1220 ILE 54 C 0.0135 -0.0033 0.0124 1221 ILE 54 O 0.0122 -0.0113 0.0140 1222 ILE 54 CB -0.0005 0.0005 0.0092 1223 ILE 54 CG1 -0.0097 -0.0068 0.0094 1224 ILE 54 CG2 -0.0021 0.0019 0.0086 1225 ILE 54 CD1 -0.0208 -0.0013 0.0063 1226 LYS 55 N 0.0194 -0.0041 0.0160 1227 LYS 55 CA 0.0146 0.0049 0.0156 1228 LYS 55 C -0.0030 0.0117 0.0087 1229 LYS 55 O -0.0079 0.0187 0.0078 1230 LYS 55 CB 0.0244 0.0197 0.0232 1231 LYS 55 CG 0.0419 0.0149 0.0304 1232 LYS 55 CD 0.0504 0.0306 0.0376 1233 LYS 55 CE 0.0547 0.0381 0.0411 1234 LYS 55 NZ 0.0655 0.0508 0.0487 1235 VAL 56 N -0.0095 0.0018 0.0059 1236 VAL 56 CA -0.0132 0.0024 0.0056 1237 VAL 56 C -0.0159 0.0034 0.0057 1238 VAL 56 O -0.0151 0.0029 0.0055 1239 VAL 56 CB -0.0143 -0.0004 0.0033 1240 VAL 56 CG1 -0.0119 -0.0012 0.0032 1241 VAL 56 CG2 -0.0143 -0.0032 0.0012 1242 ARG 57 N -0.0188 -0.0052 0.0024 1243 ARG 57 CA -0.0167 -0.0028 0.0019 1244 ARG 57 C -0.0138 0.0002 0.0012 1245 ARG 57 O -0.0120 -0.0008 -0.0004 1246 ARG 57 CB -0.0151 -0.0055 -0.0001 1247 ARG 57 CG -0.0180 -0.0083 0.0007 1248 ARG 57 CD -0.0163 -0.0113 -0.0015 1249 ARG 57 NE -0.0140 -0.0133 -0.0037 1250 ARG 57 CZ -0.0117 -0.0155 -0.0060 1251 ARG 57 NH1 -0.0114 -0.0160 -0.0063 1252 ARG 57 NH2 -0.0097 -0.0172 -0.0079 1253 GLN 58 N -0.0165 -0.0004 -0.0007 1254 GLN 58 CA -0.0143 0.0024 -0.0016 1255 GLN 58 C -0.0124 0.0024 -0.0021 1256 GLN 58 O -0.0138 0.0027 -0.0017 1257 GLN 58 CB -0.0162 0.0058 -0.0014 1258 GLN 58 CG -0.0140 0.0089 -0.0023 1259 GLN 58 CD -0.0159 0.0123 -0.0021 1260 GLN 58 OE1 -0.0181 0.0128 -0.0015 1261 GLN 58 NE2 -0.0149 0.0146 -0.0026 1262 TYR 59 N -0.0050 0.0015 -0.0037 1263 TYR 59 CA -0.0015 0.0007 -0.0036 1264 TYR 59 C 0.0010 0.0044 -0.0030 1265 TYR 59 O 0.0023 0.0062 -0.0028 1266 TYR 59 CB 0.0011 -0.0026 -0.0039 1267 TYR 59 CG -0.0007 -0.0067 -0.0045 1268 TYR 59 CD1 0.0000 -0.0095 -0.0048 1269 TYR 59 CD2 -0.0031 -0.0079 -0.0047 1270 TYR 59 CE1 -0.0017 -0.0133 -0.0053 1271 TYR 59 CE2 -0.0048 -0.0116 -0.0053 1272 TYR 59 CZ -0.0040 -0.0143 -0.0056 1273 TYR 59 OH -0.0057 -0.0180 -0.0061 1274 ASP 60 N 0.0060 0.0040 -0.0055 1275 ASP 60 CA 0.0120 0.0126 -0.0013 1276 ASP 60 C 0.0235 0.0111 -0.0033 1277 ASP 60 O 0.0276 0.0042 -0.0075 1278 ASP 60 CB 0.0104 0.0189 0.0023 1279 ASP 60 CG -0.0011 0.0211 0.0047 1280 ASP 60 OD1 -0.0064 0.0226 0.0060 1281 ASP 60 OD2 -0.0048 0.0213 0.0051 1282 GLN 61 N 0.0344 0.0191 0.0232 1283 GLN 61 CA 0.0558 0.0170 0.0263 1284 GLN 61 C 0.0414 0.0170 -0.0225 1285 GLN 61 O 0.0744 0.0130 -0.0475 1286 GLN 61 CB 0.1145 0.0115 0.0368 1287 GLN 61 CG 0.1282 0.0114 0.0806 1288 GLN 61 CD 0.1826 0.0059 0.0757 1289 GLN 61 OE1 0.1897 0.0047 0.0615 1290 GLN 61 NE2 0.2216 0.0023 0.0873 1291 ILE 62 N 0.0183 0.0052 -0.0026 1292 ILE 62 CA 0.0167 0.0041 -0.0070 1293 ILE 62 C 0.0155 0.0042 -0.0059 1294 ILE 62 O 0.0130 0.0046 -0.0023 1295 ILE 62 CB 0.0121 0.0032 -0.0090 1296 ILE 62 CG1 0.0133 0.0030 -0.0109 1297 ILE 62 CG2 0.0097 0.0022 -0.0130 1298 ILE 62 CD1 0.0168 0.0025 -0.0152 1299 LEU 63 N 0.0083 0.0085 -0.0023 1300 LEU 63 CA 0.0050 0.0083 -0.0011 1301 LEU 63 C 0.0020 0.0099 -0.0023 1302 LEU 63 O 0.0020 0.0119 -0.0049 1303 LEU 63 CB 0.0050 0.0088 -0.0018 1304 LEU 63 CG 0.0015 0.0089 -0.0009 1305 LEU 63 CD1 0.0004 0.0067 0.0023 1306 LEU 63 CD2 0.0016 0.0098 -0.0020 1307 ILE 64 N -0.0024 0.0062 0.0011 1308 ILE 64 CA -0.0042 0.0071 0.0006 1309 ILE 64 C -0.0060 0.0067 0.0017 1310 ILE 64 O -0.0061 0.0054 0.0030 1311 ILE 64 CB -0.0043 0.0069 0.0009 1312 ILE 64 CG1 -0.0024 0.0070 0.0002 1313 ILE 64 CG2 -0.0060 0.0081 0.0001 1314 ILE 64 CD1 -0.0030 0.0075 -0.0001 1315 GLU 65 N -0.0066 0.0084 0.0042 1316 GLU 65 CA -0.0076 0.0086 0.0053 1317 GLU 65 C -0.0076 0.0098 0.0051 1318 GLU 65 O -0.0073 0.0109 0.0046 1319 GLU 65 CB -0.0083 0.0090 0.0062 1320 GLU 65 CG -0.0093 0.0086 0.0074 1321 GLU 65 CD -0.0100 0.0088 0.0082 1322 GLU 65 OE1 -0.0099 0.0097 0.0079 1323 GLU 65 OE2 -0.0107 0.0081 0.0092 1324 ILE 66 N -0.0088 0.0103 0.0058 1325 ILE 66 CA -0.0078 0.0112 0.0054 1326 ILE 66 C -0.0088 0.0113 0.0062 1327 ILE 66 O -0.0094 0.0101 0.0062 1328 ILE 66 CB -0.0068 0.0102 0.0040 1329 ILE 66 CG1 -0.0058 0.0100 0.0032 1330 ILE 66 CG2 -0.0059 0.0110 0.0037 1331 ILE 66 CD1 -0.0053 0.0085 0.0020 1332 CYS 67 N -0.0087 0.0131 0.0071 1333 CYS 67 CA -0.0098 0.0136 0.0081 1334 CYS 67 C -0.0118 0.0122 0.0089 1335 CYS 67 O -0.0127 0.0114 0.0092 1336 CYS 67 CB -0.0087 0.0135 0.0072 1337 CYS 67 SG -0.0095 0.0148 0.0085 1338 GLY 68 N -0.0125 0.0117 0.0104 1339 GLY 68 CA -0.0144 0.0105 0.0112 1340 GLY 68 C -0.0149 0.0084 0.0100 1341 GLY 68 O -0.0165 0.0073 0.0105 1342 HIS 69 N -0.0134 0.0094 0.0080 1343 HIS 69 CA -0.0137 0.0072 0.0067 1344 HIS 69 C -0.0130 0.0072 0.0064 1345 HIS 69 O -0.0111 0.0082 0.0060 1346 HIS 69 CB -0.0121 0.0062 0.0052 1347 HIS 69 CG -0.0127 0.0057 0.0052 1348 HIS 69 ND1 -0.0126 0.0072 0.0062 1349 HIS 69 CD2 -0.0135 0.0038 0.0044 1350 HIS 69 CE1 -0.0134 0.0063 0.0060 1351 HIS 69 NE2 -0.0139 0.0042 0.0049 1352 LYS 70 N -0.0118 0.0037 0.0071 1353 LYS 70 CA -0.0102 0.0037 0.0064 1354 LYS 70 C -0.0084 0.0018 0.0057 1355 LYS 70 O -0.0089 -0.0002 0.0060 1356 LYS 70 CB -0.0113 0.0033 0.0069 1357 LYS 70 CG -0.0128 0.0053 0.0075 1358 LYS 70 CD -0.0139 0.0049 0.0079 1359 LYS 70 CE -0.0161 0.0062 0.0087 1360 LYS 70 NZ -0.0157 0.0088 0.0085 1361 ALA 71 N -0.0061 0.0035 0.0065 1362 ALA 71 CA -0.0043 0.0021 0.0066 1363 ALA 71 C -0.0021 0.0025 0.0052 1364 ALA 71 O -0.0021 0.0041 0.0039 1365 ALA 71 CB -0.0045 0.0024 0.0064 1366 ILE 72 N 0.0017 -0.0005 0.0123 1367 ILE 72 CA 0.0059 0.0000 0.0100 1368 ILE 72 C 0.0065 -0.0008 0.0123 1369 ILE 72 O 0.0065 -0.0023 0.0166 1370 ILE 72 CB 0.0108 -0.0005 0.0103 1371 ILE 72 CG1 0.0106 0.0007 0.0070 1372 ILE 72 CG2 0.0153 -0.0003 0.0090 1373 ILE 72 CD1 0.0150 0.0003 0.0073 1374 GLY 73 N 0.0048 0.0058 0.0140 1375 GLY 73 CA 0.0044 0.0055 0.0161 1376 GLY 73 C 0.0045 0.0061 0.0117 1377 GLY 73 O 0.0054 0.0067 0.0069 1378 THR 74 N 0.0073 0.0128 0.0066 1379 THR 74 CA 0.0029 0.0102 0.0042 1380 THR 74 C -0.0011 0.0073 0.0014 1381 THR 74 O -0.0040 0.0085 0.0030 1382 THR 74 CB -0.0011 0.0129 0.0077 1383 THR 74 OG1 0.0027 0.0150 0.0095 1384 THR 74 CG2 -0.0064 0.0103 0.0054 1385 VAL 75 N -0.0016 0.0054 -0.0010 1386 VAL 75 CA -0.0025 0.0039 -0.0016 1387 VAL 75 C -0.0044 0.0031 -0.0016 1388 VAL 75 O -0.0043 0.0027 -0.0018 1389 VAL 75 CB -0.0011 0.0025 -0.0027 1390 VAL 75 CG1 -0.0021 0.0008 -0.0033 1391 VAL 75 CG2 0.0007 0.0033 -0.0027 1392 LEU 76 N -0.0092 -0.0003 -0.0028 1393 LEU 76 CA -0.0089 -0.0004 -0.0019 1394 LEU 76 C -0.0089 -0.0005 -0.0019 1395 LEU 76 O -0.0090 -0.0011 -0.0025 1396 LEU 76 CB -0.0086 -0.0012 -0.0014 1397 LEU 76 CG -0.0085 -0.0011 -0.0010 1398 LEU 76 CD1 -0.0087 -0.0003 -0.0013 1399 LEU 76 CD2 -0.0083 -0.0020 -0.0009 1400 VAL 77 N -0.0103 -0.0001 -0.0025 1401 VAL 77 CA -0.0107 -0.0018 -0.0039 1402 VAL 77 C -0.0129 -0.0024 -0.0041 1403 VAL 77 O -0.0134 -0.0023 -0.0039 1404 VAL 77 CB -0.0091 -0.0029 -0.0050 1405 VAL 77 CG1 -0.0096 -0.0046 -0.0064 1406 VAL 77 CG2 -0.0069 -0.0022 -0.0048 1407 GLY 78 N -0.0143 0.0010 -0.0047 1408 GLY 78 CA -0.0142 0.0012 -0.0052 1409 GLY 78 C -0.0169 0.0010 -0.0057 1410 GLY 78 O -0.0188 0.0008 -0.0060 1411 PRO 79 N -0.0156 0.0031 -0.0071 1412 PRO 79 CA -0.0191 0.0046 -0.0083 1413 PRO 79 C -0.0225 0.0015 -0.0056 1414 PRO 79 O -0.0226 0.0010 -0.0052 1415 PRO 79 CB -0.0155 0.0064 -0.0099 1416 PRO 79 CG -0.0106 0.0042 -0.0081 1417 PRO 79 CD -0.0102 0.0029 -0.0070 1418 THR 80 N -0.0218 -0.0009 -0.0048 1419 THR 80 CA -0.0240 -0.0010 -0.0030 1420 THR 80 C -0.0261 -0.0028 -0.0060 1421 THR 80 O -0.0246 -0.0035 -0.0092 1422 THR 80 CB -0.0215 0.0005 -0.0011 1423 THR 80 OG1 -0.0238 0.0002 0.0001 1424 THR 80 CG2 -0.0182 0.0006 -0.0038 1425 PRO 81 N -0.0314 -0.0032 -0.0018 1426 PRO 81 CA -0.0352 -0.0062 -0.0073 1427 PRO 81 C -0.0265 -0.0055 -0.0031 1428 PRO 81 O -0.0276 -0.0088 -0.0081 1429 PRO 81 CB -0.0492 -0.0007 -0.0048 1430 PRO 81 CG -0.0498 0.0066 0.0050 1431 PRO 81 CD -0.0411 0.0043 0.0051 1432 VAL 82 N -0.0217 -0.0026 -0.0055 1433 VAL 82 CA -0.0134 -0.0003 -0.0047 1434 VAL 82 C -0.0102 0.0027 -0.0040 1435 VAL 82 O -0.0145 0.0070 -0.0037 1436 VAL 82 CB -0.0135 0.0065 -0.0037 1437 VAL 82 CG1 -0.0056 0.0108 -0.0026 1438 VAL 82 CG2 -0.0157 0.0031 -0.0044 1439 ASN 83 N -0.0065 0.0083 -0.0050 1440 ASN 83 CA -0.0052 0.0082 -0.0042 1441 ASN 83 C -0.0051 0.0098 -0.0031 1442 ASN 83 O -0.0050 0.0106 -0.0024 1443 ASN 83 CB -0.0037 0.0073 -0.0039 1444 ASN 83 CG -0.0035 0.0056 -0.0049 1445 ASN 83 OD1 -0.0040 0.0049 -0.0057 1446 ASN 83 ND2 -0.0028 0.0050 -0.0048 1447 ILE 84 N -0.0031 0.0093 -0.0021 1448 ILE 84 N -0.0031 0.0093 -0.0022 1449 ILE 84 CA -0.0032 0.0101 -0.0012 1450 ILE 84 CA -0.0031 0.0101 -0.0012 1451 ILE 84 C -0.0021 0.0106 -0.0007 1452 ILE 84 C -0.0020 0.0105 -0.0007 1453 ILE 84 O -0.0017 0.0105 -0.0007 1454 ILE 84 O -0.0014 0.0104 -0.0009 1455 ILE 84 CB -0.0044 0.0105 -0.0007 1456 ILE 84 CB -0.0041 0.0104 -0.0008 1457 ILE 84 CG1 -0.0045 0.0105 -0.0007 1458 ILE 84 CG1 -0.0053 0.0101 -0.0011 1459 ILE 84 CG2 -0.0054 0.0101 -0.0011 1460 ILE 84 CG2 -0.0040 0.0113 0.0002 1461 ILE 84 CD1 -0.0056 0.0109 -0.0002 1462 ILE 84 CD1 -0.0062 0.0102 -0.0010 1463 ILE 85 N -0.0004 0.0105 -0.0011 1464 ILE 85 CA -0.0007 0.0098 -0.0010 1465 ILE 85 C -0.0005 0.0096 -0.0016 1466 ILE 85 O -0.0004 0.0099 -0.0016 1467 ILE 85 CB -0.0011 0.0098 -0.0003 1468 ILE 85 CG1 -0.0013 0.0101 0.0003 1469 ILE 85 CG2 -0.0015 0.0091 -0.0003 1470 ILE 85 CD1 -0.0014 0.0097 0.0003 1471 GLY 86 N 0.0016 0.0086 -0.0011 1472 GLY 86 CA 0.0020 0.0079 -0.0018 1473 GLY 86 C 0.0015 0.0069 -0.0017 1474 GLY 86 O 0.0007 0.0066 -0.0011 1475 ARG 87 N 0.0076 0.0079 -0.0042 1476 ARG 87 CA 0.0059 0.0049 -0.0045 1477 ARG 87 C 0.0043 0.0040 -0.0042 1478 ARG 87 O 0.0019 0.0025 -0.0038 1479 ARG 87 CB 0.0079 0.0025 -0.0058 1480 ARG 87 CG 0.0090 0.0030 -0.0060 1481 ARG 87 CD 0.0108 0.0003 -0.0074 1482 ARG 87 NE 0.0134 -0.0001 -0.0083 1483 ARG 87 CZ 0.0136 -0.0021 -0.0089 1484 ARG 87 NH1 0.0113 -0.0041 -0.0087 1485 ARG 87 NH2 0.0161 -0.0021 -0.0098 1486 ASN 88 N 0.0029 0.0048 -0.0008 1487 ASN 88 CA 0.0018 0.0045 -0.0006 1488 ASN 88 C 0.0012 0.0045 0.0001 1489 ASN 88 O 0.0004 0.0041 0.0000 1490 ASN 88 CB 0.0017 0.0045 -0.0004 1491 ASN 88 CG 0.0018 0.0050 0.0006 1492 ASN 88 OD1 0.0025 0.0054 0.0009 1493 ASN 88 ND2 0.0010 0.0049 0.0012 1494 LEU 89 N -0.0001 0.0047 0.0021 1495 LEU 89 CA -0.0007 0.0049 0.0023 1496 LEU 89 C -0.0010 0.0047 0.0023 1497 LEU 89 O -0.0016 0.0046 0.0024 1498 LEU 89 CB -0.0007 0.0056 0.0026 1499 LEU 89 CG -0.0005 0.0058 0.0026 1500 LEU 89 CD1 -0.0005 0.0065 0.0029 1501 LEU 89 CD2 -0.0009 0.0056 0.0026 1502 LEU 90 N 0.0005 0.0055 -0.0022 1503 LEU 90 CA -0.0000 0.0052 -0.0021 1504 LEU 90 C -0.0009 0.0036 -0.0023 1505 LEU 90 O -0.0020 0.0034 -0.0019 1506 LEU 90 CB 0.0012 0.0053 -0.0025 1507 LEU 90 CG 0.0020 0.0069 -0.0023 1508 LEU 90 CD1 0.0033 0.0068 -0.0028 1509 LEU 90 CD2 0.0010 0.0081 -0.0014 1510 THR 91 N 0.0001 0.0026 -0.0028 1511 THR 91 CA -0.0013 0.0008 -0.0039 1512 THR 91 C -0.0037 0.0012 -0.0033 1513 THR 91 O -0.0052 0.0001 -0.0039 1514 THR 91 CB -0.0004 -0.0003 -0.0048 1515 THR 91 OG1 -0.0003 0.0007 -0.0041 1516 THR 91 CG2 0.0018 -0.0010 -0.0055 1517 GLN 92 N -0.0028 0.0003 0.0005 1518 GLN 92 CA -0.0043 0.0008 0.0006 1519 GLN 92 C -0.0063 0.0014 0.0008 1520 GLN 92 O -0.0078 0.0013 0.0008 1521 GLN 92 CB -0.0036 0.0024 0.0007 1522 GLN 92 CG -0.0015 0.0023 0.0005 1523 GLN 92 CD -0.0012 0.0006 0.0004 1524 GLN 92 OE1 -0.0005 -0.0010 0.0002 1525 GLN 92 NE2 -0.0016 0.0009 0.0004 1526 ILE 93 N -0.0075 0.0029 -0.0007 1527 ILE 93 CA -0.0085 0.0035 -0.0000 1528 ILE 93 C -0.0084 0.0024 -0.0009 1529 ILE 93 O -0.0090 0.0028 -0.0005 1530 ILE 93 CB -0.0078 0.0054 0.0011 1531 ILE 93 CG1 -0.0056 0.0056 0.0007 1532 ILE 93 CG2 -0.0080 0.0065 0.0020 1533 ILE 93 CD1 -0.0047 0.0074 0.0018 1534 GLY 94 N -0.0075 0.0007 -0.0033 1535 GLY 94 CA -0.0072 -0.0008 -0.0048 1536 GLY 94 C -0.0049 -0.0004 -0.0048 1537 GLY 94 O -0.0049 -0.0010 -0.0055 1538 CYS 95 N -0.0026 0.0012 -0.0047 1539 CYS 95 CA -0.0012 0.0021 -0.0046 1540 CYS 95 C 0.0004 0.0004 -0.0058 1541 CYS 95 O 0.0016 -0.0007 -0.0066 1542 CYS 95 CB 0.0003 0.0043 -0.0040 1543 CYS 95 SG 0.0018 0.0057 -0.0038 1544 THR 96 N 0.0027 -0.0005 -0.0071 1545 THR 96 CA 0.0039 -0.0016 -0.0082 1546 THR 96 C 0.0052 -0.0003 -0.0082 1547 THR 96 O 0.0047 0.0012 -0.0072 1548 THR 96 CB 0.0025 -0.0034 -0.0085 1549 THR 96 OG1 0.0013 -0.0026 -0.0076 1550 THR 96 CG2 0.0010 -0.0047 -0.0085 1551 LEU 97 N 0.0075 -0.0003 -0.0082 1552 LEU 97 CA 0.0079 -0.0001 -0.0083 1553 LEU 97 C 0.0074 -0.0011 -0.0083 1554 LEU 97 O 0.0074 -0.0021 -0.0085 1555 LEU 97 CB 0.0093 -0.0001 -0.0086 1556 LEU 97 CG 0.0101 0.0010 -0.0085 1557 LEU 97 CD1 0.0114 0.0006 -0.0089 1558 LEU 97 CD2 0.0099 0.0020 -0.0083 1559 ASN 98 N 0.0072 0.0004 -0.0085 1560 ASN 98 CA 0.0068 -0.0003 -0.0085 1561 ASN 98 C 0.0073 0.0003 -0.0085 1562 ASN 98 O 0.0074 0.0015 -0.0083 1563 ASN 98 CB 0.0055 -0.0005 -0.0079 1564 ASN 98 CG 0.0050 -0.0014 -0.0080 1565 ASN 98 OD1 0.0054 -0.0014 -0.0082 1566 ASN 98 ND2 0.0040 -0.0022 -0.0078 1567 PHE 99 N 0.0096 0.0013 -0.0079 1568 PHE 99 CA 0.0088 0.0003 -0.0078 1569 PHE 99 C 0.0083 -0.0012 -0.0071 1570 PHE 99 O 0.0076 -0.0022 -0.0069 1571 PHE 99 CB 0.0095 0.0003 -0.0073 1572 PHE 99 CG 0.0107 -0.0001 -0.0061 1573 PHE 99 CD1 0.0120 0.0008 -0.0058 1574 PHE 99 CD2 0.0106 -0.0015 -0.0052 1575 PHE 99 CE1 0.0131 0.0004 -0.0047 1576 PHE 99 CE2 0.0117 -0.0019 -0.0040 1577 PHE 99 CZ 0.0129 -0.0010 -0.0038 1578 PHE 99 OXT 0.0088 -0.0013 -0.0067