1 PHE 2 N 0.0113 0.0030 -0.0052 2 PHE 2 CA 0.0117 0.0033 -0.0061 3 PHE 2 C 0.0138 0.0033 -0.0080 4 PHE 2 O 0.0158 0.0023 -0.0078 5 PHE 2 CB 0.0119 0.0022 -0.0040 6 PHE 2 CG 0.0101 0.0020 -0.0019 7 PHE 2 CD1 0.0077 0.0030 -0.0019 8 PHE 2 CD2 0.0107 0.0009 0.0002 9 PHE 2 CE1 0.0060 0.0029 0.0000 10 PHE 2 CE2 0.0090 0.0006 0.0021 11 PHE 2 CZ 0.0066 0.0017 0.0020 12 ALA 3 N -0.0273 0.0294 0.0958 13 ALA 3 CA -0.0041 0.0134 0.0464 14 ALA 3 C 0.0209 -0.0295 0.0029 15 ALA 3 O 0.0346 -0.0755 -0.0126 16 ALA 3 CB -0.0004 0.0719 0.0155 17 LYS 4 N -0.0001 0.0084 0.0104 18 LYS 4 CA -0.0103 0.0235 0.0239 19 LYS 4 C -0.0071 0.0264 -0.0001 20 LYS 4 O 0.0052 0.0098 -0.0204 21 LYS 4 CB -0.0074 0.0064 0.0527 22 LYS 4 CG -0.0015 -0.0128 0.0720 23 LYS 4 CD 0.0103 -0.0411 0.0843 24 PRO 5 N 0.0024 0.0169 -0.0068 25 PRO 5 CA 0.0023 0.0147 -0.0117 26 PRO 5 C 0.0065 0.0096 -0.0124 27 PRO 5 O 0.0069 0.0069 -0.0169 28 PRO 5 CB 0.0008 0.0168 -0.0109 29 PRO 5 CG -0.0001 0.0204 -0.0055 30 PRO 5 CD -0.0001 0.0211 -0.0039 31 GLU 6 N 0.0068 0.0217 -0.0131 32 GLU 6 CA 0.0035 0.0136 -0.0100 33 GLU 6 C 0.0168 0.0024 -0.0206 34 GLU 6 O 0.0190 0.0011 -0.0223 35 GLU 6 CB -0.0100 -0.0002 0.0017 36 GLU 6 CG -0.0250 0.0112 0.0135 37 GLU 6 CD -0.0291 0.0145 0.0168 38 GLU 6 OE1 -0.0202 0.0132 0.0095 39 GLU 6 OE2 -0.0436 0.0197 0.0286 40 ASP 7 N 0.0064 0.0029 -0.0134 41 ASP 7 CA 0.0132 -0.0026 -0.0182 42 ASP 7 C 0.0163 0.0013 -0.0280 43 ASP 7 O 0.0220 -0.0028 -0.0328 44 ASP 7 CB 0.0140 -0.0059 -0.0157 45 ASP 7 CG 0.0122 -0.0110 -0.0063 46 ASP 7 OD1 0.0138 -0.0160 -0.0032 47 ASP 7 OD2 0.0096 -0.0109 -0.0022 48 ALA 8 N 0.0126 0.0044 -0.0212 49 ALA 8 CA 0.0113 0.0022 -0.0177 50 ALA 8 C 0.0123 0.0034 -0.0206 51 ALA 8 O 0.0118 0.0048 -0.0178 52 ALA 8 CB 0.0099 -0.0042 -0.0167 53 VAL 9 N 0.0084 0.0036 -0.0198 54 VAL 9 CA 0.0048 0.0091 -0.0175 55 VAL 9 C 0.0014 0.0120 -0.0172 56 VAL 9 O 0.0013 0.0167 -0.0137 57 VAL 9 CB 0.0004 0.0091 -0.0199 58 VAL 9 CG1 -0.0038 0.0148 -0.0178 59 VAL 9 CG2 0.0037 0.0068 -0.0199 60 LYS 10 N -0.0106 0.0407 0.0035 61 LYS 10 CA -0.0296 0.0139 -0.0008 62 LYS 10 C 0.0210 0.0121 -0.0225 63 LYS 10 O 0.0174 0.0195 -0.0176 64 LYS 10 CB -0.0607 -0.0454 -0.0148 65 LYS 10 CG -0.0676 -0.0862 -0.0305 66 LYS 10 CD -0.1121 -0.1408 -0.0369 67 TYR 11 N 0.0180 0.0175 -0.0302 68 TYR 11 CA 0.0185 0.0207 -0.0169 69 TYR 11 C 0.0184 0.0202 -0.0155 70 TYR 11 O 0.0203 0.0291 -0.0105 71 TYR 11 CB 0.0162 0.0118 -0.0068 72 TYR 11 CG 0.0161 0.0128 0.0071 73 TYR 11 CD1 0.0148 0.0077 0.0109 74 TYR 11 CD2 0.0174 0.0191 0.0167 75 TYR 11 CE1 0.0148 0.0086 0.0240 76 TYR 11 CE2 0.0173 0.0201 0.0299 77 TYR 11 CZ 0.0160 0.0149 0.0334 78 TYR 11 OH 0.0162 0.0167 0.0463 79 ARG 12 N 0.0107 0.0139 -0.0019 80 ARG 12 CA 0.0115 0.0157 0.0004 81 ARG 12 C 0.0103 0.0222 -0.0025 82 ARG 12 O 0.0114 0.0259 0.0009 83 ARG 12 CB 0.0115 0.0098 0.0000 84 ARG 12 CG 0.0090 0.0079 -0.0070 85 ARG 12 CD 0.0091 0.0005 -0.0074 86 ARG 12 NE 0.0069 -0.0017 -0.0136 87 ARG 12 CZ 0.0063 -0.0084 -0.0159 88 ARG 12 NH1 0.0075 -0.0136 -0.0129 89 ARG 12 NH2 0.0044 -0.0097 -0.0215 90 GLN 13 N 0.0182 0.0393 -0.0090 91 GLN 13 CA 0.0061 0.0510 -0.0049 92 GLN 13 C 0.0086 0.0480 -0.0060 93 GLN 13 O 0.0079 0.0596 -0.0021 94 GLN 13 CB -0.0138 0.0469 -0.0060 95 GLN 13 CG -0.0177 0.0553 -0.0032 96 GLN 13 CD -0.0371 0.0513 -0.0043 97 GLN 13 OE1 -0.0472 0.0410 -0.0075 98 GLN 13 NE2 -0.0428 0.0603 -0.0012 99 SER 14 N 0.0063 0.0429 -0.0027 100 SER 14 CA 0.0008 0.0351 -0.0083 101 SER 14 C 0.0024 0.0356 -0.0132 102 SER 14 O -0.0021 0.0306 -0.0129 103 SER 14 CB 0.0002 0.0321 -0.0172 104 SER 14 OG -0.0032 0.0294 -0.0126 105 ALA 15 N 0.0224 0.0289 -0.0169 106 ALA 15 CA 0.0221 0.0287 -0.0142 107 ALA 15 C 0.0225 0.0291 -0.0169 108 ALA 15 O 0.0237 0.0310 -0.0158 109 ALA 15 CB 0.0197 0.0251 -0.0115 110 LEU 16 N 0.0021 0.0353 0.0043 111 LEU 16 CA 0.0019 0.0390 0.0012 112 LEU 16 C 0.0032 0.0465 -0.0014 113 LEU 16 O 0.0049 0.0510 -0.0011 114 LEU 16 CB -0.0023 0.0351 -0.0043 115 LEU 16 CG -0.0031 0.0286 -0.0014 116 LEU 16 CD1 -0.0074 0.0240 -0.0068 117 LEU 16 CD2 -0.0011 0.0305 0.0012 118 THR 17 N 0.0057 0.0761 0.0141 119 THR 17 CA -0.0411 0.0375 0.0351 120 THR 17 C -0.0040 0.0026 -0.0118 121 THR 17 O -0.0117 0.0129 -0.0006 122 THR 17 CB -0.0964 -0.0282 0.0506 123 THR 17 OG1 -0.1385 0.0095 0.1029 124 THR 17 CG2 -0.1394 -0.0798 0.0623 125 LEU 18 N -0.0127 0.0032 -0.0142 126 LEU 18 CA -0.0095 -0.0074 -0.0294 127 LEU 18 C 0.0030 0.0080 -0.0271 128 LEU 18 O -0.0014 0.0032 -0.0273 129 LEU 18 CB 0.0015 -0.0169 -0.0527 130 LEU 18 CG -0.0122 -0.0363 -0.0580 131 LEU 18 CD1 -0.0023 -0.0487 -0.0829 132 LEU 18 CD2 -0.0329 -0.0506 -0.0494 133 MET 19 N 0.0091 0.0178 -0.0108 134 MET 19 CA 0.0078 0.0156 -0.0100 135 MET 19 C 0.0086 0.0145 -0.0108 136 MET 19 O 0.0076 0.0140 -0.0101 137 MET 19 CB 0.0074 0.0137 -0.0100 138 MET 19 CG 0.0058 0.0114 -0.0091 139 MET 19 SD 0.0057 0.0096 -0.0093 140 MET 19 CE 0.0063 0.0124 -0.0093 141 ALA 20 N 0.0048 0.0151 -0.0235 142 ALA 20 CA 0.0058 0.0148 -0.0249 143 ALA 20 C 0.0157 0.0033 -0.0281 144 ALA 20 O 0.0201 0.0033 -0.0367 145 ALA 20 CB -0.0017 0.0160 -0.0120 146 SER 21 N 0.0233 0.0085 -0.0414 147 SER 21 CA 0.0210 0.0164 -0.0399 148 SER 21 C 0.0114 0.0158 -0.0320 149 SER 21 O 0.0087 0.0154 -0.0298 150 SER 21 CB 0.0234 0.0284 -0.0425 151 SER 21 OG 0.0202 0.0359 -0.0403 152 HIS 22 N 0.0032 0.0018 -0.0259 153 HIS 22 CA -0.0012 0.0023 -0.0167 154 HIS 22 C -0.0012 -0.0039 -0.0101 155 HIS 22 O -0.0052 -0.0025 -0.0027 156 HIS 22 CB -0.0016 0.0014 -0.0147 157 HIS 22 CG -0.0040 0.0101 -0.0185 158 HIS 22 ND1 -0.0095 0.0171 -0.0137 159 HIS 22 CD2 -0.0016 0.0130 -0.0268 160 HIS 22 CE1 -0.0102 0.0239 -0.0191 161 HIS 22 NE2 -0.0056 0.0216 -0.0269 162 PHE 23 N 0.0035 -0.0088 -0.0055 163 PHE 23 CA 0.0040 -0.0109 -0.0015 164 PHE 23 C 0.0017 -0.0166 0.0046 165 PHE 23 O -0.0024 -0.0209 0.0061 166 PHE 23 CB 0.0109 -0.0069 0.0013 167 PHE 23 CG 0.0124 -0.0089 0.0065 168 PHE 23 CD1 0.0109 -0.0088 0.0043 169 PHE 23 CD2 0.0152 -0.0110 0.0136 170 PHE 23 CE1 0.0121 -0.0106 0.0088 171 PHE 23 CE2 0.0166 -0.0127 0.0182 172 PHE 23 CZ 0.0151 -0.0125 0.0158 173 GLY 24 N 0.0101 -0.0154 -0.0055 174 GLY 24 CA 0.0096 -0.0199 -0.0007 175 GLY 24 C 0.0005 -0.0207 -0.0008 176 GLY 24 O -0.0020 -0.0256 0.0041 177 ARG 25 N 0.0108 -0.0207 -0.0118 178 ARG 25 CA -0.0042 -0.0116 -0.0095 179 ARG 25 C -0.0235 -0.0240 0.0043 180 ARG 25 O -0.0356 -0.0212 0.0081 181 ARG 25 CB -0.0120 0.0125 -0.0169 182 ARG 25 CG -0.0277 0.0175 -0.0125 183 ARG 25 CD -0.0343 0.0414 -0.0205 184 ARG 25 NE -0.0155 0.0520 -0.0332 185 ARG 25 CZ -0.0164 0.0733 -0.0423 186 ARG 25 NH1 -0.0346 0.0858 -0.0402 187 ARG 25 NH2 0.0021 0.0814 -0.0538 188 MET 26 N -0.0057 -0.0141 0.0112 189 MET 26 CA -0.0088 -0.0163 0.0136 190 MET 26 C -0.0079 -0.0197 0.0167 191 MET 26 O -0.0104 -0.0216 0.0188 192 MET 26 CB -0.0089 -0.0162 0.0135 193 MET 26 CG -0.0096 -0.0128 0.0105 194 MET 26 SD -0.0110 -0.0129 0.0108 195 MET 26 CE -0.0057 -0.0134 0.0105 196 THR 27 N -0.0031 -0.0248 0.0164 197 THR 27 CA -0.0057 -0.0179 0.0227 198 THR 27 C -0.0090 -0.0177 0.0246 199 THR 27 O -0.0061 -0.0120 0.0271 200 THR 27 CB -0.0116 -0.0162 0.0271 201 THR 27 OG1 -0.0083 -0.0164 0.0251 202 THR 27 CG2 -0.0122 -0.0081 0.0331 203 PRO 28 N -0.0098 -0.0115 0.0203 204 PRO 28 CA -0.0040 -0.0031 0.0190 205 PRO 28 C 0.0087 -0.0003 0.0214 206 PRO 28 O 0.0131 0.0093 0.0194 207 PRO 28 CB -0.0057 -0.0074 0.0200 208 PRO 28 CG -0.0138 -0.0181 0.0215 209 PRO 28 CD -0.0150 -0.0216 0.0224 210 VAL 29 N 0.0112 0.0055 0.0180 211 VAL 29 CA 0.0105 0.0048 0.0129 212 VAL 29 C 0.0113 0.0075 0.0124 213 VAL 29 O 0.0106 0.0058 0.0106 214 VAL 29 CB 0.0106 0.0066 0.0084 215 VAL 29 CG1 0.0099 0.0060 0.0032 216 VAL 29 CG2 0.0097 0.0036 0.0087 217 VAL 30 N 0.0104 -0.0002 0.0044 218 VAL 30 CA 0.0115 -0.0007 0.0058 219 VAL 30 C 0.0112 -0.0013 0.0076 220 VAL 30 O 0.0114 -0.0018 0.0091 221 VAL 30 CB 0.0136 -0.0005 0.0050 222 VAL 30 CG1 0.0151 -0.0010 0.0064 223 VAL 30 CG2 0.0140 -0.0002 0.0041 224 LYS 31 N 0.0090 -0.0085 0.0200 225 LYS 31 CA 0.0076 -0.0063 0.0214 226 LYS 31 C 0.0090 -0.0089 0.0200 227 LYS 31 O 0.0083 -0.0076 0.0207 228 LYS 31 CB 0.0037 -0.0067 0.0253 229 LYS 31 CG 0.0018 -0.0045 0.0272 230 LYS 31 CD -0.0020 -0.0039 0.0311 231 GLY 32 N 0.0149 0.0023 0.0267 232 GLY 32 CA 0.0102 0.0088 0.0311 233 GLY 32 C 0.0076 0.0157 0.0255 234 GLY 32 O 0.0037 0.0213 0.0284 235 GLN 33 N -0.0026 0.0125 0.0358 236 GLN 33 CA -0.0053 0.0239 0.0258 237 GLN 33 C -0.0139 0.0388 0.0195 238 GLN 33 O -0.0194 0.0499 0.0137 239 GLN 33 CB 0.0078 0.0198 0.0129 240 GLN 33 CG 0.0163 0.0044 0.0199 241 GLN 33 CD 0.0294 -0.0000 0.0076 242 GLN 33 OE1 0.0383 -0.0014 -0.0028 243 GLN 33 NE2 0.0304 -0.0018 0.0084 244 ALA 34 N 0.0208 0.0068 0.0268 245 ALA 34 CA 0.0219 0.0049 0.0275 246 ALA 34 C 0.0241 0.0051 0.0273 247 ALA 34 O 0.0242 0.0063 0.0268 248 ALA 34 CB 0.0207 0.0032 0.0283 249 PRO 35 N -0.0015 0.0134 0.0091 250 PRO 35 CA 0.0020 0.0138 0.0029 251 PRO 35 C 0.0036 0.0173 0.0003 252 PRO 35 O 0.0024 0.0174 0.0024 253 PRO 35 CB 0.0032 0.0068 0.0005 254 PRO 35 CG 0.0004 0.0021 0.0052 255 PRO 35 CD -0.0026 0.0062 0.0109 256 TYR 36 N 0.0050 0.0207 -0.0249 257 TYR 36 CA 0.0023 0.0210 -0.0238 258 TYR 36 C 0.0046 0.0199 -0.0218 259 TYR 36 O 0.0072 0.0199 -0.0239 260 TYR 36 CB 0.0002 0.0226 -0.0276 261 TYR 36 CG -0.0026 0.0229 -0.0266 262 TYR 36 CD1 -0.0054 0.0225 -0.0231 263 TYR 36 CD2 -0.0023 0.0235 -0.0290 264 TYR 36 CE1 -0.0080 0.0228 -0.0222 265 TYR 36 CE2 -0.0048 0.0238 -0.0281 266 TYR 36 CZ -0.0076 0.0235 -0.0247 267 TYR 36 OH -0.0101 0.0237 -0.0238 268 ASP 37 N 0.0050 0.0343 -0.0290 269 ASP 37 CA 0.0128 0.0302 -0.0187 270 ASP 37 C 0.0082 0.0214 -0.0136 271 ASP 37 O -0.0000 0.0139 -0.0128 272 ASP 37 CB 0.0146 0.0275 -0.0146 273 ASP 37 CG 0.0240 0.0248 -0.0044 274 ASP 37 OD1 0.0212 0.0158 0.0024 275 ASP 37 OD2 0.0330 0.0305 -0.0028 276 ALA 38 N 0.0140 0.0215 -0.0188 277 ALA 38 CA 0.0083 0.0123 -0.0137 278 ALA 38 C 0.0058 0.0031 -0.0051 279 ALA 38 O -0.0025 -0.0048 -0.0047 280 ALA 38 CB 0.0138 0.0130 -0.0084 281 ALA 39 N 0.0252 0.0009 -0.0020 282 ALA 39 CA 0.0233 -0.0137 0.0095 283 ALA 39 C 0.0077 -0.0201 0.0091 284 ALA 39 O -0.0013 -0.0308 0.0147 285 ALA 39 CB 0.0390 -0.0157 0.0172 286 GLN 40 N 0.0023 -0.0072 0.0145 287 GLN 40 CA -0.0070 -0.0103 0.0109 288 GLN 40 C -0.0251 -0.0164 0.0043 289 GLN 40 O -0.0362 -0.0250 0.0092 290 GLN 40 CB -0.0006 -0.0002 -0.0017 291 GLN 40 CG -0.0116 -0.0023 -0.0089 292 GLN 40 CD -0.0053 0.0083 -0.0226 293 GLN 40 OE1 -0.0050 0.0089 -0.0233 294 GLN 40 NE2 0.0004 0.0169 -0.0332 295 ILE 41 N -0.0102 -0.0059 -0.0012 296 ILE 41 CA -0.0167 -0.0083 -0.0044 297 ILE 41 C -0.0198 -0.0131 0.0006 298 ILE 41 O -0.0253 -0.0164 0.0002 299 ILE 41 CB -0.0172 -0.0052 -0.0104 300 ILE 41 CG1 -0.0155 -0.0007 -0.0163 301 ILE 41 CG2 -0.0240 -0.0082 -0.0128 302 ILE 41 CD1 -0.0191 -0.0019 -0.0184 303 LYS 42 N -0.0179 -0.0172 0.0021 304 LYS 42 CA -0.0185 -0.0194 0.0041 305 LYS 42 C -0.0220 -0.0248 0.0095 306 LYS 42 O -0.0269 -0.0259 0.0113 307 LYS 42 CB -0.0109 -0.0205 0.0038 308 LYS 42 CG -0.0107 -0.0221 0.0052 309 LYS 42 CD -0.0035 -0.0222 0.0041 310 ALA 43 N -0.0215 -0.0196 0.0094 311 ALA 43 CA -0.0236 -0.0237 0.0124 312 ALA 43 C -0.0286 -0.0214 0.0179 313 ALA 43 O -0.0303 -0.0212 0.0200 314 ALA 43 CB -0.0230 -0.0313 0.0129 315 ASN 44 N -0.0367 0.0030 0.0265 316 ASN 44 CA -0.0351 0.0009 0.0213 317 ASN 44 C -0.0316 -0.0051 0.0220 318 ASN 44 O -0.0295 -0.0081 0.0177 319 ASN 44 CB -0.0364 0.0031 0.0208 320 ASN 44 CG -0.0349 0.0011 0.0153 321 ASN 44 OD1 -0.0333 -0.0017 0.0160 322 ASN 44 ND2 -0.0354 0.0024 0.0100 323 VAL 45 N -0.0149 -0.0127 0.0161 324 VAL 45 CA -0.0131 -0.0139 0.0168 325 VAL 45 C -0.0120 -0.0149 0.0156 326 VAL 45 O -0.0106 -0.0160 0.0150 327 VAL 45 CB -0.0127 -0.0139 0.0192 328 VAL 45 CG1 -0.0107 -0.0152 0.0197 329 VAL 45 CG2 -0.0136 -0.0131 0.0202 330 GLU 46 N -0.0140 -0.0178 0.0182 331 GLU 46 CA -0.0116 -0.0170 0.0139 332 GLU 46 C -0.0079 -0.0161 0.0079 333 GLU 46 O -0.0029 -0.0171 0.0055 334 GLU 46 CB -0.0165 -0.0146 0.0126 335 VAL 47 N -0.0161 -0.0130 0.0054 336 VAL 47 CA -0.0124 -0.0118 -0.0016 337 VAL 47 C -0.0038 -0.0147 0.0013 338 VAL 47 O 0.0029 -0.0149 -0.0037 339 VAL 47 CB -0.0194 -0.0095 -0.0035 340 VAL 47 CG1 -0.0149 -0.0089 -0.0092 341 VAL 47 CG2 -0.0269 -0.0063 -0.0083 342 LEU 48 N -0.0021 -0.0061 0.0094 343 LEU 48 CA 0.0011 -0.0076 0.0107 344 LEU 48 C 0.0051 -0.0093 0.0107 345 LEU 48 O 0.0083 -0.0104 0.0096 346 LEU 48 CB 0.0001 -0.0079 0.0152 347 LEU 48 CG 0.0033 -0.0095 0.0169 348 LEU 48 CD1 0.0044 -0.0095 0.0138 349 LEU 48 CD2 0.0018 -0.0095 0.0212 350 LYS 49 N 0.0115 -0.0101 0.0129 351 LYS 49 CA 0.0191 -0.0111 0.0128 352 LYS 49 C 0.0224 -0.0122 0.0050 353 LYS 49 O 0.0289 -0.0131 0.0040 354 LYS 49 CB 0.0187 -0.0108 0.0151 355 LYS 49 CG 0.0263 -0.0116 0.0157 356 LYS 49 CD 0.0267 -0.0121 0.0113 357 THR 50 N 0.0409 -0.0141 -0.0077 358 THR 50 CA 0.0417 -0.0338 -0.0231 359 THR 50 C 0.0181 -0.0283 0.0002 360 THR 50 O 0.0269 -0.0203 -0.0010 361 THR 50 CB 0.0305 -0.0731 -0.0433 362 THR 50 OG1 0.0577 -0.0770 -0.0683 363 THR 50 CG2 0.0233 -0.0958 -0.0543 364 LEU 51 N 0.0236 -0.0110 -0.0020 365 LEU 51 CA 0.0197 -0.0112 -0.0021 366 LEU 51 C 0.0209 -0.0087 -0.0007 367 LEU 51 O 0.0194 -0.0098 -0.0013 368 LEU 51 CB 0.0148 -0.0092 -0.0011 369 LEU 51 CG 0.0128 -0.0119 -0.0027 370 LEU 51 CD1 0.0090 -0.0091 -0.0010 371 LEU 51 CD2 0.0103 -0.0161 -0.0051 372 THR 52 N 0.0107 -0.0014 0.0133 373 THR 52 CA 0.0101 0.0008 0.0134 374 THR 52 C 0.0104 0.0005 0.0133 375 THR 52 O 0.0095 0.0020 0.0135 376 THR 52 CB 0.0113 0.0030 0.0128 377 THR 52 OG1 0.0137 0.0025 0.0120 378 THR 52 CG2 0.0105 0.0037 0.0130 379 ALA 53 N 0.0134 -0.0050 0.0100 380 ALA 53 CA 0.0086 -0.0018 0.0116 381 ALA 53 C 0.0037 -0.0037 0.0203 382 ALA 53 O -0.0013 -0.0007 0.0226 383 ALA 53 CB 0.0133 -0.0050 0.0100 384 LEU 54 N 0.0076 0.0025 0.0243 385 LEU 54 CA 0.0085 0.0047 0.0305 386 LEU 54 C 0.0065 0.0037 0.0284 387 LEU 54 O 0.0028 0.0051 0.0339 388 LEU 54 CB 0.0183 0.0067 0.0330 389 LEU 54 CG 0.0201 0.0097 0.0414 390 LEU 54 CD1 0.0134 0.0099 0.0444 391 LEU 54 CD2 0.0294 0.0107 0.0411 392 PRO 55 N 0.0089 0.0037 0.0169 393 PRO 55 CA 0.0056 0.0009 0.0109 394 PRO 55 C 0.0028 -0.0060 0.0109 395 PRO 55 O 0.0003 -0.0094 0.0076 396 PRO 55 CB 0.0052 0.0050 0.0057 397 PRO 55 CG 0.0088 0.0109 0.0088 398 PRO 55 CD 0.0108 0.0093 0.0160 399 TRP 56 N -0.0063 -0.0170 0.0072 400 TRP 56 CA -0.0093 -0.0215 0.0071 401 TRP 56 C -0.0114 -0.0266 0.0091 402 TRP 56 O -0.0150 -0.0298 0.0068 403 TRP 56 CB -0.0077 -0.0211 0.0093 404 TRP 56 CG -0.0048 -0.0156 0.0082 405 TRP 56 CD1 -0.0010 -0.0129 0.0115 406 TRP 56 CD2 -0.0057 -0.0123 0.0032 407 TRP 56 NE1 0.0006 -0.0079 0.0088 408 TRP 56 CE2 -0.0022 -0.0074 0.0037 409 TRP 56 CE3 -0.0091 -0.0129 -0.0017 410 TRP 56 CZ2 -0.0021 -0.0033 -0.0006 411 TRP 56 CZ3 -0.0090 -0.0088 -0.0060 412 TRP 56 CH2 -0.0055 -0.0040 -0.0054 413 ALA 57 N -0.0168 -0.0253 0.0319 414 ALA 57 CA -0.0195 -0.0266 0.0369 415 ALA 57 C -0.0086 -0.0218 0.0163 416 ALA 57 O -0.0099 -0.0267 0.0156 417 ALA 57 CB -0.0231 -0.0083 0.0581 418 ALA 58 N -0.0040 -0.0154 0.0130 419 ALA 58 CA -0.0009 -0.0138 0.0067 420 ALA 58 C -0.0026 -0.0201 -0.0025 421 ALA 58 O 0.0004 -0.0189 -0.0096 422 ALA 58 CB 0.0060 -0.0050 0.0047 423 PHE 59 N -0.0094 -0.0280 -0.0068 424 PHE 59 CA -0.0088 -0.0306 -0.0086 425 PHE 59 C -0.0087 -0.0335 -0.0081 426 PHE 59 O -0.0087 -0.0361 -0.0077 427 PHE 59 CB -0.0090 -0.0316 -0.0075 428 PHE 59 CG -0.0089 -0.0293 -0.0085 429 PHE 59 CD1 -0.0081 -0.0294 -0.0114 430 PHE 59 CD2 -0.0096 -0.0270 -0.0065 431 PHE 59 CE1 -0.0080 -0.0273 -0.0123 432 PHE 59 CE2 -0.0095 -0.0249 -0.0074 433 PHE 59 CZ -0.0087 -0.0250 -0.0103 434 GLY 60 N -0.0130 -0.0292 -0.0130 435 GLY 60 CA -0.0142 -0.0235 -0.0136 436 GLY 60 C -0.0091 -0.0210 -0.0106 437 GLY 60 O -0.0042 -0.0235 -0.0077 438 PRO 61 N -0.0222 0.0098 -0.0315 439 PRO 61 CA -0.0141 0.0252 -0.0163 440 PRO 61 C -0.0069 0.0240 -0.0005 441 PRO 61 O -0.0088 0.0229 -0.0044 442 PRO 61 CB -0.0168 0.0479 -0.0259 443 PRO 61 CG -0.0272 0.0441 -0.0481 444 PRO 61 CD -0.0305 0.0204 -0.0514 445 GLY 62 N 0.0118 0.0116 -0.0090 446 GLY 62 CA 0.0196 0.0143 -0.0057 447 GLY 62 C 0.0107 0.0038 -0.0025 448 GLY 62 O 0.0149 0.0070 -0.0024 449 THR 63 N 0.0043 -0.0110 -0.0076 450 THR 63 CA 0.0051 -0.0133 -0.0071 451 THR 63 C 0.0081 -0.0180 -0.0056 452 THR 63 O 0.0076 -0.0214 -0.0056 453 THR 63 CB 0.0004 -0.0144 -0.0088 454 THR 63 OG1 -0.0025 -0.0180 -0.0097 455 THR 63 CG2 -0.0022 -0.0093 -0.0102 456 GLU 64 N 0.0091 -0.0141 0.0033 457 GLU 64 CA 0.0120 -0.0179 0.0048 458 GLU 64 C 0.0134 -0.0171 0.0044 459 GLU 64 O 0.0144 -0.0131 0.0029 460 GLU 64 CB 0.0167 -0.0188 0.0051 461 GLU 64 CG 0.0155 -0.0207 0.0058 462 GLU 64 CD 0.0132 -0.0171 0.0044 463 GLU 64 OE1 0.0135 -0.0130 0.0028 464 GLU 64 OE2 0.0115 -0.0188 0.0051 465 GLY 65 N 0.0153 -0.0232 0.0026 466 GLY 65 CA 0.0214 -0.0153 -0.0021 467 GLY 65 C 0.0219 -0.0127 -0.0014 468 GLY 65 O 0.0174 -0.0169 0.0028 469 GLY 66 N 0.0232 -0.0058 -0.0125 470 GLY 66 CA 0.0161 -0.0090 -0.0083 471 GLY 66 C 0.0185 -0.0131 -0.0004 472 GLY 66 O 0.0251 -0.0135 0.0020 473 ASP 67 N 0.0174 -0.0020 0.0184 474 ASP 67 CA 0.0159 0.0016 0.0109 475 ASP 67 C 0.0160 -0.0080 0.0206 476 ASP 67 O 0.0171 -0.0039 0.0194 477 ASP 67 CB 0.0221 0.0205 0.0082 478 ASP 67 CG 0.0202 0.0301 -0.0059 479 ASP 67 OD1 0.0120 0.0211 -0.0178 480 ASP 67 OD2 0.0257 0.0442 -0.0057 481 ALA 68 N 0.0167 -0.0278 0.0285 482 ALA 68 CA 0.0163 -0.0264 0.0270 483 ALA 68 C 0.0143 -0.0246 0.0271 484 ALA 68 O 0.0130 -0.0245 0.0289 485 ALA 68 CB 0.0164 -0.0270 0.0276 486 ARG 69 N 0.0174 -0.0154 0.0235 487 ARG 69 CA 0.0068 -0.0111 0.0221 488 ARG 69 C 0.0021 -0.0126 0.0259 489 ARG 69 O 0.0074 -0.0144 0.0261 490 ARG 69 CB 0.0068 -0.0039 0.0128 491 ARG 69 CG 0.0100 -0.0013 0.0082 492 ARG 69 CD 0.0048 0.0062 0.0007 493 ARG 69 NE 0.0083 0.0100 -0.0056 494 ARG 69 CZ 0.0048 0.0166 -0.0128 495 ARG 69 NH1 -0.0019 0.0198 -0.0142 496 ARG 69 NH2 0.0080 0.0203 -0.0188 497 PRO 70 N -0.0060 -0.0086 0.0338 498 PRO 70 CA -0.0079 -0.0078 0.0347 499 PRO 70 C -0.0041 -0.0014 0.0274 500 PRO 70 O -0.0025 -0.0024 0.0269 501 PRO 70 CB -0.0178 -0.0039 0.0400 502 PRO 70 CG -0.0218 -0.0032 0.0427 503 PRO 70 CD -0.0144 -0.0060 0.0387 504 GLU 71 N -0.0127 0.0006 0.0225 505 GLU 71 CA -0.0076 0.0094 0.0131 506 GLU 71 C 0.0057 0.0031 0.0112 507 GLU 71 O 0.0096 0.0074 0.0059 508 GLU 71 CB -0.0060 0.0207 0.0036 509 GLU 71 CG -0.0203 0.0294 0.0042 510 GLU 71 CD -0.0263 0.0245 0.0110 511 GLU 71 OE1 -0.0196 0.0128 0.0167 512 GLU 71 OE2 -0.0357 0.0308 0.0109 513 ILE 72 N 0.0058 -0.0053 0.0146 514 ILE 72 CA 0.0082 -0.0075 0.0115 515 ILE 72 C 0.0074 -0.0054 0.0112 516 ILE 72 O 0.0087 -0.0046 0.0077 517 ILE 72 CB 0.0096 -0.0126 0.0131 518 ILE 72 CG1 0.0111 -0.0147 0.0119 519 ILE 72 CG2 0.0114 -0.0148 0.0112 520 ILE 72 CD1 0.0116 -0.0192 0.0147 521 TRP 73 N 0.0067 -0.0137 0.0093 522 TRP 73 CA 0.0074 -0.0110 0.0080 523 TRP 73 C 0.0081 -0.0048 0.0080 524 TRP 73 O 0.0095 -0.0022 0.0051 525 TRP 73 CB 0.0061 -0.0130 0.0111 526 TRP 73 CG 0.0058 -0.0190 0.0101 527 TRP 73 CD1 0.0068 -0.0211 0.0066 528 TRP 73 CD2 0.0044 -0.0235 0.0126 529 TRP 73 NE1 0.0061 -0.0267 0.0068 530 TRP 73 CE2 0.0047 -0.0283 0.0103 531 TRP 73 CE3 0.0029 -0.0239 0.0165 532 TRP 73 CZ2 0.0035 -0.0335 0.0119 533 TRP 73 CZ3 0.0018 -0.0290 0.0180 534 TRP 73 CH2 0.0020 -0.0337 0.0159 535 SER 74 N -0.0012 0.0061 0.0153 536 SER 74 CA -0.0020 0.0210 0.0163 537 SER 74 C 0.0129 0.0320 0.0104 538 SER 74 O 0.0196 0.0390 0.0078 539 SER 74 CB -0.0161 0.0326 0.0230 540 SER 74 OG -0.0304 0.0236 0.0288 541 ASP 75 N -0.0039 0.0105 0.0090 542 ASP 75 CA -0.0026 0.0109 0.0024 543 ASP 75 C 0.0008 0.0076 0.0001 544 ASP 75 O 0.0040 0.0049 -0.0037 545 ASP 75 CB -0.0011 0.0097 0.0005 546 ASP 75 CG -0.0033 0.0134 -0.0037 547 ASP 75 OD1 -0.0055 0.0166 -0.0061 548 ASP 75 OD2 -0.0031 0.0135 -0.0048 549 ALA 76 N 0.0009 0.0037 0.0031 550 ALA 76 CA -0.0002 0.0032 0.0015 551 ALA 76 C -0.0008 0.0028 0.0010 552 ALA 76 O -0.0020 0.0019 0.0004 553 ALA 76 CB 0.0003 0.0041 -0.0000 554 ALA 77 N -0.0264 0.0092 0.0126 555 ALA 77 CA -0.0338 0.0048 0.0035 556 ALA 77 C -0.0193 -0.0012 -0.0132 557 ALA 77 O -0.0144 -0.0017 -0.0152 558 ALA 77 CB -0.0562 0.0006 -0.0030 559 SER 78 N -0.0146 -0.0043 -0.0086 560 SER 78 CA -0.0084 -0.0066 -0.0154 561 SER 78 C 0.0012 -0.0051 -0.0119 562 SER 78 O 0.0066 -0.0063 -0.0155 563 SER 78 CB -0.0083 -0.0086 -0.0211 564 SER 78 OG -0.0174 -0.0097 -0.0234 565 PHE 79 N 0.0052 -0.0052 -0.0049 566 PHE 79 CA 0.0058 -0.0073 -0.0044 567 PHE 79 C 0.0082 -0.0085 -0.0056 568 PHE 79 O 0.0095 -0.0092 -0.0061 569 PHE 79 CB 0.0044 -0.0091 -0.0027 570 PHE 79 CG 0.0050 -0.0114 -0.0021 571 PHE 79 CD1 0.0044 -0.0113 -0.0016 572 PHE 79 CD2 0.0062 -0.0135 -0.0020 573 PHE 79 CE1 0.0048 -0.0134 -0.0011 574 PHE 79 CE2 0.0068 -0.0156 -0.0014 575 PHE 79 CZ 0.0060 -0.0156 -0.0009 576 LYS 80 N 0.0062 -0.0137 -0.0045 577 LYS 80 CA 0.0124 -0.0152 -0.0024 578 LYS 80 C 0.0164 -0.0088 -0.0006 579 LYS 80 O 0.0195 -0.0074 0.0006 580 LYS 80 CB 0.0155 -0.0206 -0.0017 581 LYS 80 CG 0.0211 -0.0241 0.0001 582 LYS 80 CD 0.0187 -0.0286 -0.0011 583 GLN 81 N 0.0139 -0.0064 -0.0025 584 GLN 81 CA 0.0156 -0.0027 0.0003 585 GLN 81 C 0.0107 -0.0017 0.0017 586 GLN 81 O 0.0114 -0.0008 0.0023 587 GLN 81 CB 0.0175 0.0015 0.0034 588 LYS 82 N 0.0087 -0.0067 -0.0032 589 LYS 82 CA 0.0046 -0.0018 -0.0040 590 LYS 82 C 0.0032 0.0001 -0.0042 591 LYS 82 O 0.0015 0.0046 -0.0018 592 LYS 82 CB 0.0018 -0.0017 -0.0086 593 LYS 82 CG 0.0026 -0.0010 -0.0064 594 LYS 82 CD -0.0013 0.0026 -0.0087 595 LYS 82 CE -0.0007 0.0012 -0.0092 596 LYS 82 NZ 0.0014 0.0029 -0.0041 597 GLN 83 N -0.0011 -0.0063 -0.0005 598 GLN 83 CA -0.0007 -0.0047 0.0007 599 GLN 83 C 0.0021 -0.0035 0.0061 600 GLN 83 O 0.0022 0.0006 0.0078 601 GLN 83 CB -0.0012 -0.0088 -0.0016 602 GLN 83 CG 0.0007 -0.0093 0.0015 603 GLN 83 CD 0.0011 -0.0147 0.0003 604 GLN 83 OE1 0.0029 -0.0166 0.0028 605 GLN 83 NE2 -0.0006 -0.0172 -0.0037 606 GLN 84 N 0.0065 -0.0020 0.0066 607 GLN 84 CA 0.0107 -0.0012 0.0094 608 GLN 84 C 0.0071 0.0038 0.0176 609 GLN 84 O 0.0045 0.0047 0.0185 610 GLN 84 CB 0.0214 -0.0025 0.0100 611 ALA 85 N 0.0055 0.0078 0.0134 612 ALA 85 CA 0.0028 0.0109 0.0191 613 ALA 85 C -0.0051 0.0098 0.0183 614 ALA 85 O -0.0073 0.0111 0.0209 615 ALA 85 CB 0.0023 0.0141 0.0248 616 PHE 86 N -0.0111 0.0049 0.0130 617 PHE 86 CA -0.0104 0.0057 0.0129 618 PHE 86 C -0.0086 0.0054 0.0144 619 PHE 86 O -0.0072 0.0067 0.0146 620 PHE 86 CB -0.0118 0.0050 0.0124 621 PHE 86 CG -0.0109 0.0054 0.0129 622 PHE 86 CD1 -0.0103 0.0071 0.0120 623 PHE 86 CD2 -0.0107 0.0040 0.0140 624 PHE 86 CE1 -0.0094 0.0075 0.0123 625 PHE 86 CE2 -0.0098 0.0043 0.0144 626 PHE 86 CZ -0.0092 0.0061 0.0136 627 GLN 87 N -0.0012 0.0029 0.0141 628 GLN 87 CA -0.0000 0.0021 0.0143 629 GLN 87 C 0.0021 0.0036 0.0167 630 GLN 87 O 0.0024 0.0042 0.0173 631 GLN 87 CB 0.0013 -0.0011 0.0130 632 GLN 87 CG -0.0012 -0.0023 0.0105 633 GLN 87 CD -0.0005 -0.0053 0.0089 634 GLN 87 OE1 -0.0009 -0.0056 0.0085 635 GLN 87 NE2 0.0004 -0.0074 0.0081 636 ASP 88 N -0.0068 0.0025 0.0122 637 ASP 88 CA -0.0010 0.0068 0.0163 638 ASP 88 C -0.0085 0.0109 0.0219 639 ASP 88 O -0.0070 0.0120 0.0229 640 ASP 88 CB 0.0071 0.0122 0.0212 641 ASP 88 CG 0.0174 0.0090 0.0163 642 ASP 88 OD1 0.0191 0.0028 0.0091 643 ASP 88 OD2 0.0239 0.0136 0.0206 644 ASN 89 N -0.0157 0.0107 0.0200 645 ASN 89 CA -0.0105 0.0097 0.0163 646 ASN 89 C -0.0054 0.0108 0.0198 647 ASN 89 O -0.0017 0.0102 0.0176 648 ASN 89 CB -0.0088 0.0088 0.0134 649 ASN 89 CG -0.0123 0.0071 0.0078 650 ASN 89 OD1 -0.0116 0.0059 0.0041 651 ASN 89 ND2 -0.0167 0.0069 0.0075 652 ILE 90 N 0.0044 0.0073 0.0166 653 ILE 90 CA 0.0066 0.0059 0.0181 654 ILE 90 C 0.0082 0.0057 0.0176 655 ILE 90 O 0.0106 0.0050 0.0175 656 ILE 90 CB 0.0057 0.0049 0.0209 657 ILE 90 CG1 0.0045 0.0049 0.0217 658 ILE 90 CG2 0.0078 0.0035 0.0226 659 ILE 90 CD1 0.0065 0.0044 0.0214 660 VAL 91 N -0.0000 0.0039 0.0158 661 VAL 91 CA 0.0023 0.0033 0.0115 662 VAL 91 C 0.0052 0.0024 0.0062 663 VAL 91 O 0.0089 -0.0006 0.0037 664 VAL 91 CB -0.0008 0.0074 0.0100 665 VAL 91 CG1 0.0015 0.0073 0.0046 666 VAL 91 CG2 -0.0029 0.0075 0.0151 667 LYS 92 N -0.0024 0.0028 0.0083 668 LYS 92 CA 0.0008 0.0017 0.0008 669 LYS 92 C 0.0086 -0.0015 0.0014 670 LYS 92 O 0.0131 -0.0031 -0.0026 671 LYS 92 CB -0.0033 0.0035 -0.0040 672 LYS 92 CG -0.0021 0.0032 -0.0125 673 LYS 92 CD -0.0076 0.0056 -0.0169 674 LYS 92 CE -0.0055 0.0047 -0.0183 675 LYS 92 NZ -0.0111 0.0069 -0.0160 676 LEU 93 N 0.0026 0.0005 0.0061 677 LEU 93 CA 0.0045 -0.0023 0.0069 678 LEU 93 C 0.0052 -0.0035 0.0061 679 LEU 93 O 0.0065 -0.0058 0.0048 680 LEU 93 CB 0.0051 -0.0021 0.0104 681 LEU 93 CG 0.0071 -0.0049 0.0116 682 LEU 93 CD1 0.0079 -0.0066 0.0103 683 LEU 93 CD2 0.0075 -0.0047 0.0152 684 SER 94 N 0.0043 -0.0016 0.0107 685 SER 94 CA 0.0038 -0.0036 0.0070 686 SER 94 C 0.0031 -0.0049 0.0016 687 SER 94 O 0.0027 -0.0090 -0.0009 688 SER 94 CB 0.0038 0.0011 0.0064 689 SER 94 OG 0.0034 -0.0006 0.0038 690 ALA 95 N 0.0069 -0.0063 -0.0069 691 ALA 95 CA 0.0065 -0.0071 -0.0114 692 ALA 95 C 0.0060 -0.0117 -0.0105 693 ALA 95 O 0.0054 -0.0147 -0.0140 694 ALA 95 CB 0.0070 -0.0025 -0.0124 695 ALA 96 N 0.0053 -0.0117 -0.0126 696 ALA 96 CA 0.0034 -0.0122 -0.0109 697 ALA 96 C 0.0008 -0.0100 -0.0123 698 ALA 96 O -0.0020 -0.0099 -0.0108 699 ALA 96 CB 0.0055 -0.0136 -0.0102 700 ALA 97 N -0.0083 -0.0072 -0.0045 701 ALA 97 CA -0.0103 -0.0101 -0.0056 702 ALA 97 C -0.0092 -0.0114 -0.0085 703 ALA 97 O -0.0106 -0.0132 -0.0090 704 ALA 97 CB -0.0115 -0.0114 -0.0058 705 ASP 98 N -0.0118 -0.0114 -0.0102 706 ASP 98 CA -0.0101 -0.0133 -0.0159 707 ASP 98 C -0.0096 -0.0128 -0.0162 708 ASP 98 O -0.0098 -0.0158 -0.0197 709 ASP 98 CB -0.0059 -0.0103 -0.0197 710 ASP 98 CG -0.0060 -0.0105 -0.0198 711 ASP 98 OD1 -0.0089 -0.0141 -0.0191 712 ASP 98 OD2 -0.0024 -0.0064 -0.0209 713 ALA 99 N -0.0077 -0.0137 -0.0148 714 ALA 99 CA -0.0082 -0.0107 -0.0082 715 ALA 99 C -0.0135 -0.0053 -0.0079 716 ALA 99 O -0.0146 -0.0022 -0.0028 717 ALA 99 CB -0.0049 -0.0127 -0.0044 718 GLY 100 N -0.0092 -0.0031 -0.0122 719 GLY 100 CA -0.0121 0.0021 -0.0129 720 GLY 100 C -0.0126 0.0046 -0.0109 721 GLY 100 O -0.0141 0.0090 -0.0090 722 ASP 101 N -0.0147 0.0031 -0.0150 723 ASP 101 CA -0.0148 0.0029 -0.0059 724 ASP 101 C -0.0138 0.0022 -0.0140 725 ASP 101 O -0.0056 -0.0050 -0.0199 726 ASP 101 CB -0.0060 -0.0055 0.0045 727 ASP 101 CG -0.0059 -0.0059 0.0141 728 ASP 101 OD1 -0.0108 -0.0018 0.0247 729 ASP 101 OD2 -0.0002 -0.0109 0.0092 730 LEU 102 N -0.0151 0.0094 -0.0151 731 LEU 102 CA -0.0098 0.0082 -0.0166 732 LEU 102 C -0.0057 0.0029 -0.0152 733 LEU 102 O -0.0004 0.0025 -0.0172 734 LEU 102 CB -0.0108 0.0078 -0.0159 735 LEU 102 CG -0.0082 0.0113 -0.0191 736 LEU 102 CD1 -0.0085 0.0095 -0.0179 737 LEU 102 CD2 -0.0021 0.0118 -0.0219 738 ASP 103 N -0.0176 0.0027 -0.0076 739 ASP 103 CA -0.0028 -0.0039 0.0034 740 ASP 103 C 0.0173 -0.0177 -0.0076 741 ASP 103 O 0.0270 -0.0240 -0.0115 742 ASP 103 CB 0.0024 -0.0023 0.0296 743 ASP 103 CG -0.0140 0.0097 0.0436 744 ASP 103 OD1 -0.0148 0.0099 0.0421 745 ASP 103 OD2 -0.0258 0.0184 0.0540 746 LYS 104 N 0.0085 -0.0103 -0.0079 747 LYS 104 CA 0.0119 -0.0164 -0.0098 748 LYS 104 C 0.0144 -0.0143 -0.0196 749 LYS 104 O 0.0185 -0.0197 -0.0245 750 LYS 104 CB 0.0096 -0.0155 -0.0043 751 LYS 104 CG 0.0076 -0.0188 0.0055 752 LYS 104 CD 0.0088 -0.0246 0.0094 753 LEU 105 N 0.0054 -0.0086 -0.0143 754 LEU 105 CA 0.0072 -0.0069 -0.0167 755 LEU 105 C 0.0098 -0.0084 -0.0179 756 LEU 105 O 0.0120 -0.0085 -0.0195 757 LEU 105 CB 0.0055 -0.0041 -0.0173 758 LEU 105 CG 0.0068 -0.0018 -0.0197 759 LEU 105 CD1 0.0061 -0.0006 -0.0200 760 LEU 105 CD2 0.0057 0.0005 -0.0203 761 ARG 106 N 0.0112 -0.0074 -0.0186 762 ARG 106 CA 0.0103 -0.0073 -0.0219 763 ARG 106 C 0.0114 -0.0117 -0.0224 764 ARG 106 O 0.0110 -0.0135 -0.0260 765 ARG 106 CB 0.0098 -0.0037 -0.0200 766 ARG 106 CG 0.0081 -0.0010 -0.0234 767 ARG 106 CD 0.0075 0.0030 -0.0214 768 ARG 106 NE 0.0087 0.0021 -0.0176 769 ARG 106 CZ 0.0083 0.0035 -0.0175 770 ARG 106 NH1 0.0068 0.0055 -0.0211 771 ARG 106 NH2 0.0094 0.0029 -0.0141 772 ALA 107 N 0.0139 -0.0159 -0.0270 773 ALA 107 CA 0.0099 -0.0191 -0.0282 774 ALA 107 C 0.0091 -0.0116 -0.0246 775 ALA 107 O 0.0116 -0.0124 -0.0251 776 ALA 107 CB -0.0003 -0.0237 -0.0295 777 ALA 108 N 0.0152 -0.0081 -0.0230 778 ALA 108 CA 0.0120 -0.0045 -0.0168 779 ALA 108 C 0.0155 -0.0039 -0.0113 780 ALA 108 O 0.0124 -0.0013 -0.0077 781 ALA 108 CB 0.0120 -0.0035 -0.0140 782 PHE 109 N 0.0205 0.0020 -0.0112 783 PHE 109 CA 0.0179 -0.0006 -0.0049 784 PHE 109 C 0.0152 0.0047 -0.0003 785 PHE 109 O 0.0129 0.0056 0.0045 786 PHE 109 CB 0.0183 -0.0072 -0.0040 787 PHE 109 CG 0.0159 -0.0108 0.0023 788 PHE 109 CD1 0.0159 -0.0154 0.0034 789 PHE 109 CD2 0.0136 -0.0097 0.0071 790 PHE 109 CE1 0.0138 -0.0188 0.0091 791 PHE 109 CE2 0.0113 -0.0130 0.0129 792 PHE 109 CZ 0.0114 -0.0176 0.0139 793 GLY 110 N 0.0159 -0.0025 -0.0210 794 GLY 110 CA 0.0105 -0.0002 -0.0239 795 GLY 110 C -0.0013 0.0052 -0.0204 796 GLY 110 O -0.0060 0.0075 -0.0156 797 ASP 111 N 0.0038 0.0059 -0.0183 798 ASP 111 CA -0.0082 0.0089 -0.0149 799 ASP 111 C -0.0104 0.0089 -0.0016 800 ASP 111 O -0.0192 0.0110 0.0013 801 ASP 111 CB -0.0111 0.0098 -0.0176 802 ASP 111 CG -0.0121 0.0108 -0.0306 803 ASP 111 OD1 -0.0129 0.0113 -0.0381 804 ASP 111 OD2 -0.0121 0.0109 -0.0339 805 VAL 112 N -0.0019 0.0124 0.0024 806 VAL 112 CA -0.0035 0.0102 0.0087 807 VAL 112 C -0.0064 0.0105 0.0105 808 VAL 112 O -0.0112 0.0110 0.0138 809 VAL 112 CB 0.0015 0.0065 0.0122 810 VAL 112 CG1 -0.0004 0.0043 0.0188 811 VAL 112 CG2 0.0034 0.0060 0.0116 812 GLY 113 N 0.0049 0.0110 0.0045 813 GLY 113 CA 0.0076 0.0109 -0.0034 814 GLY 113 C -0.0084 0.0061 -0.0128 815 GLY 113 O -0.0128 0.0051 -0.0117 816 ALA 114 N 0.0035 -0.0118 -0.0524 817 ALA 114 CA -0.0230 -0.0308 -0.0733 818 ALA 114 C -0.0568 -0.0122 -0.0392 819 ALA 114 O -0.0642 -0.0168 -0.0440 820 ALA 114 CB -0.0551 -0.0613 -0.1091 821 SER 115 N -0.0489 0.0228 0.0178 822 SER 115 CA -0.0473 0.0184 0.0162 823 SER 115 C -0.0511 0.0159 0.0133 824 SER 115 O -0.0511 0.0132 0.0119 825 SER 115 CB -0.0443 0.0161 0.0162 826 SER 115 OG -0.0400 0.0153 0.0176 827 CYS 116 N -0.0322 0.0128 0.0068 828 CYS 116 CA -0.0276 0.0158 0.0116 829 CYS 116 C -0.0315 0.0112 -0.0014 830 CYS 116 O -0.0380 0.0093 0.0018 831 CYS 116 CB -0.0100 0.0230 0.0112 832 CYS 116 SG -0.0012 0.0292 0.0226 833 LYS 117 N -0.0349 0.0283 0.0129 834 LYS 117 CA -0.0145 0.0024 -0.0118 835 LYS 117 C -0.0539 -0.0056 -0.0163 836 LYS 117 O -0.0374 -0.0056 -0.0175 837 LYS 117 CB 0.0092 -0.0373 -0.0492 838 LYS 117 CG 0.0533 -0.0497 -0.0633 839 LYS 117 CD 0.0580 -0.0955 -0.1049 840 ALA 118 N -0.0395 -0.0040 -0.0109 841 ALA 118 CA -0.0278 0.0007 -0.0098 842 ALA 118 C -0.0183 0.0119 -0.0181 843 ALA 118 O -0.0050 0.0153 -0.0145 844 ALA 118 CB -0.0340 0.0009 -0.0137 845 CYS 119 N -0.0107 0.0052 -0.0118 846 CYS 119 CA -0.0084 0.0067 -0.0150 847 CYS 119 C -0.0057 0.0073 -0.0174 848 CYS 119 O -0.0023 0.0067 -0.0191 849 CYS 119 CB -0.0109 0.0100 -0.0164 850 CYS 119 SG -0.0079 0.0116 -0.0201 851 HIS 120 N -0.0111 0.0069 -0.0164 852 HIS 120 CA -0.0097 0.0062 -0.0129 853 HIS 120 C -0.0011 0.0065 -0.0037 854 HIS 120 O 0.0046 0.0086 -0.0026 855 HIS 120 CB -0.0198 0.0007 -0.0097 856 HIS 120 CG -0.0280 0.0005 -0.0189 857 HIS 120 ND1 -0.0382 -0.0043 -0.0176 858 HIS 120 CD2 -0.0273 0.0047 -0.0294 859 HIS 120 CE1 -0.0433 -0.0030 -0.0272 860 HIS 120 NE2 -0.0371 0.0025 -0.0347 861 ASP 121 N -0.0171 0.0075 -0.0124 862 ASP 121 CA -0.0083 0.0166 0.0081 863 ASP 121 C 0.0189 0.0076 -0.0039 864 ASP 121 O 0.0168 0.0091 -0.0014 865 ASP 121 CB 0.0021 0.0312 0.0401 866 ASP 121 CG -0.0268 0.0431 0.0576 867 ASP 121 OD1 -0.0564 0.0426 0.0501 868 ASP 121 OD2 -0.0164 0.0529 0.0800 869 ALA 122 N 0.0197 0.0133 -0.0143 870 ALA 122 CA 0.0204 0.0137 -0.0146 871 ALA 122 C 0.0204 0.0136 -0.0153 872 ALA 122 O 0.0209 0.0138 -0.0152 873 ALA 122 CB 0.0210 0.0139 -0.0151 874 TYR 123 N 0.0193 0.0055 -0.0177 875 TYR 123 CA 0.0184 0.0038 -0.0134 876 TYR 123 C 0.0207 0.0035 -0.0116 877 TYR 123 O 0.0201 0.0020 -0.0077 878 TYR 123 CB 0.0193 0.0029 -0.0104 879 TYR 123 CG 0.0163 0.0027 -0.0113 880 TYR 123 CD1 0.0116 0.0018 -0.0110 881 TYR 123 CD2 0.0179 0.0034 -0.0125 882 TYR 123 CE1 0.0086 0.0016 -0.0118 883 TYR 123 CE2 0.0150 0.0032 -0.0132 884 TYR 123 CZ 0.0104 0.0023 -0.0127 885 TYR 123 OH 0.0074 0.0020 -0.0135 886 ARG 124 N 0.0289 0.0225 -0.0072 887 ARG 124 CA 0.0236 0.0196 -0.0084 888 ARG 124 C 0.0308 0.0179 0.0048 889 ARG 124 O 0.0322 0.0127 0.0169 890 ARG 124 CB 0.0085 0.0101 -0.0095 891 ARG 124 CG 0.0034 0.0049 -0.0058 892 ARG 124 CD -0.0106 -0.0002 -0.0142 893 ARG 124 NE -0.0210 -0.0101 -0.0083 894 ARG 124 CZ -0.0328 -0.0179 -0.0084 895 ARG 124 NH1 -0.0354 -0.0171 -0.0134 896 ARG 124 NH2 -0.0416 -0.0264 -0.0030 897 LYS 125 N 0.0310 0.0067 0.0089 898 LYS 125 CA 0.0277 0.0076 0.0062 899 LYS 125 C 0.0315 0.0101 0.0030 900 LYS 125 O 0.0359 0.0098 0.0051 901 LYS 125 CB 0.0249 0.0051 0.0098 902 LYS 125 CG 0.0207 0.0024 0.0131 903 LYS 125 CD 0.0181 0.0001 0.0162 904 LYS 125 CE 0.0153 -0.0029 0.0206 905 LYS 125 NZ 0.0104 -0.0045 0.0218