1 GLY 5 N -0.0108 0.0321 0.0425 2 GLY 5 CA -0.0102 0.0269 0.0361 3 GLY 5 C -0.0127 0.0167 0.0306 4 GLY 5 O -0.0178 0.0114 0.0347 5 LEU 6 N -0.0090 0.0140 0.0212 6 LEU 6 CA -0.0108 0.0044 0.0149 7 LEU 6 C -0.0050 0.0059 0.0059 8 LEU 6 O 0.0007 0.0120 0.0015 9 LEU 6 CB -0.0125 -0.0017 0.0120 10 LEU 6 CG -0.0167 -0.0128 0.0087 11 LEU 6 CD1 -0.0226 -0.0164 0.0159 12 LEU 6 CD2 -0.0191 -0.0180 0.0079 13 TYR 7 N -0.0070 0.0007 0.0082 14 TYR 7 CA -0.0053 0.0023 0.0041 15 TYR 7 C -0.0065 -0.0022 0.0015 16 TYR 7 O -0.0088 -0.0059 0.0038 17 TYR 7 CB -0.0042 0.0061 0.0063 18 TYR 7 CG -0.0023 0.0112 0.0077 19 TYR 7 CD1 -0.0030 0.0124 0.0121 20 TYR 7 CD2 0.0002 0.0149 0.0044 21 TYR 7 CE1 -0.0012 0.0170 0.0134 22 TYR 7 CE2 0.0020 0.0196 0.0056 23 TYR 7 CZ 0.0012 0.0206 0.0101 24 TYR 7 OH 0.0029 0.0253 0.0114 25 ARG 8 N -0.0051 -0.0018 -0.0034 26 ARG 8 CA -0.0060 -0.0057 -0.0065 27 ARG 8 C -0.0044 -0.0035 -0.0088 28 ARG 8 O -0.0021 0.0001 -0.0112 29 ARG 8 CB -0.0059 -0.0082 -0.0109 30 ARG 8 CG -0.0069 -0.0125 -0.0141 31 ARG 8 CD -0.0064 -0.0142 -0.0190 32 ARG 8 NE -0.0078 -0.0168 -0.0178 33 ARG 8 CZ -0.0070 -0.0160 -0.0198 34 ARG 8 NH1 -0.0046 -0.0128 -0.0232 35 ARG 8 NH2 -0.0085 -0.0186 -0.0184 36 MET 9 N -0.0031 -0.0087 -0.0016 37 MET 9 CA -0.0030 -0.0082 -0.0017 38 MET 9 C -0.0030 -0.0091 -0.0021 39 MET 9 O -0.0031 -0.0100 -0.0015 40 MET 9 CB -0.0032 -0.0077 -0.0005 41 MET 9 CG -0.0032 -0.0077 -0.0003 42 MET 9 SD -0.0033 -0.0071 0.0011 43 MET 9 CE -0.0032 -0.0056 0.0008 44 THR 10 N -0.0029 -0.0089 -0.0030 45 THR 10 CA -0.0028 -0.0097 -0.0034 46 THR 10 C -0.0028 -0.0091 -0.0034 47 THR 10 O -0.0027 -0.0081 -0.0038 48 THR 10 CB -0.0027 -0.0102 -0.0047 49 THR 10 CG2 -0.0025 -0.0092 -0.0055 50 THR 10 OG1 -0.0027 -0.0109 -0.0051 51 TYR 11 N -0.0008 -0.0056 0.0024 52 TYR 11 CA -0.0012 -0.0056 0.0030 53 TYR 11 C -0.0007 -0.0056 0.0037 54 TYR 11 O -0.0001 -0.0056 0.0036 55 TYR 11 CB -0.0015 -0.0055 0.0030 56 TYR 11 CG -0.0010 -0.0056 0.0033 57 TYR 11 CD1 -0.0006 -0.0056 0.0028 58 TYR 11 CD2 -0.0010 -0.0055 0.0040 59 TYR 11 CE1 -0.0001 -0.0056 0.0030 60 TYR 11 CE2 -0.0006 -0.0055 0.0042 61 TYR 11 CZ -0.0001 -0.0056 0.0038 62 TYR 11 OH 0.0003 -0.0056 0.0040 63 ILE 12 N -0.0011 -0.0055 0.0043 64 ILE 12 CA -0.0007 -0.0055 0.0050 65 ILE 12 C -0.0010 -0.0054 0.0055 66 ILE 12 O -0.0015 -0.0054 0.0054 67 ILE 12 CB -0.0009 -0.0054 0.0053 68 ILE 12 CG1 -0.0017 -0.0054 0.0055 69 ILE 12 CG2 -0.0006 -0.0055 0.0048 70 ILE 12 CD1 -0.0019 -0.0054 0.0056 71 SER 13 N -0.0011 0.0018 0.0105 72 SER 13 CA -0.0013 0.0019 0.0114 73 SER 13 C -0.0006 0.0026 0.0132 74 SER 13 O 0.0004 0.0031 0.0136 75 SER 13 CB -0.0003 0.0020 0.0102 76 SER 13 OG 0.0014 0.0027 0.0109 77 ARG 14 N -0.0011 0.0028 0.0144 78 ARG 14 CA -0.0005 0.0034 0.0162 79 ARG 14 C 0.0008 0.0039 0.0164 80 ARG 14 O 0.0003 0.0036 0.0160 81 ARG 14 CB -0.0021 0.0032 0.0176 82 ARG 14 CG -0.0035 0.0028 0.0176 83 ARG 14 CD -0.0048 0.0028 0.0193 84 ARG 14 NE -0.0061 0.0023 0.0192 85 ARG 14 CZ -0.0060 0.0025 0.0199 86 ARG 14 NH1 -0.0045 0.0032 0.0206 87 ARG 14 NH2 -0.0073 0.0021 0.0198 88 ALA 15 N -0.0065 0.0072 0.0125 89 ALA 15 CA -0.0004 0.0089 0.0135 90 ALA 15 C -0.0004 0.0128 0.0188 91 ALA 15 O -0.0044 0.0147 0.0222 92 ALA 15 CB 0.0044 0.0091 0.0129 93 VAL 16 N 0.0040 0.0139 0.0194 94 VAL 16 CA 0.0048 0.0177 0.0243 95 VAL 16 C 0.0071 0.0207 0.0279 96 VAL 16 O 0.0102 0.0199 0.0261 97 VAL 16 CB 0.0092 0.0179 0.0236 98 VAL 16 CG1 0.0060 0.0157 0.0214 99 VAL 16 CG2 0.0151 0.0163 0.0204 100 PRO 17 N -0.0010 0.0309 0.0587 101 PRO 17 CA 0.0082 0.0241 0.0621 102 PRO 17 C 0.0172 0.0170 0.0671 103 PRO 17 O 0.0267 0.0111 0.0647 104 PRO 17 CB 0.0030 0.0255 0.0723 105 PRO 17 CG -0.0082 0.0323 0.0760 106 PRO 17 CD -0.0113 0.0363 0.0662 107 GLY 18 N 0.0145 0.0175 0.0739 108 GLY 18 CA 0.0224 0.0110 0.0801 109 GLY 18 C 0.0282 0.0087 0.0722 110 GLY 18 O 0.0329 0.0044 0.0776 111 LEU 19 N 0.0274 0.0100 -0.0016 112 LEU 19 CA 0.0295 0.0036 -0.0024 113 LEU 19 C 0.0317 -0.0034 -0.0032 114 LEU 19 O 0.0303 -0.0040 -0.0066 115 LEU 19 CB 0.0265 0.0036 -0.0087 116 LEU 19 CG 0.0282 -0.0015 -0.0091 117 LEU 19 CD1 0.0288 0.0022 -0.0049 118 LEU 19 CD2 0.0255 -0.0040 -0.0168 119 GLY 20 N 0.0353 -0.0088 -0.0001 120 GLY 20 CA 0.0377 -0.0158 -0.0005 121 GLY 20 C 0.0392 -0.0224 -0.0026 122 GLY 20 O 0.0380 -0.0216 -0.0045 123 TYR 21 N 0.0141 -0.0345 -0.0452 124 TYR 21 CA 0.0040 -0.0328 -0.0286 125 TYR 21 C 0.0052 -0.0324 -0.0207 126 TYR 21 O 0.0052 -0.0315 -0.0043 127 TYR 21 CB -0.0154 -0.0315 -0.0318 128 TYR 21 CG -0.0182 -0.0314 -0.0348 129 TYR 21 CD1 -0.0169 -0.0325 -0.0517 130 TYR 21 CD2 -0.0222 -0.0303 -0.0206 131 TYR 21 CE1 -0.0194 -0.0325 -0.0545 132 TYR 21 CE2 -0.0248 -0.0303 -0.0232 133 TYR 21 CZ -0.0234 -0.0313 -0.0402 134 TYR 21 OH -0.0259 -0.0313 -0.0429 135 ASN 22 N 0.0059 -0.0331 -0.0321 136 ASN 22 CA 0.0067 -0.0328 -0.0256 137 ASN 22 C 0.0237 -0.0335 -0.0148 138 ASN 22 O 0.0233 -0.0326 -0.0002 139 ASN 22 CB 0.0056 -0.0336 -0.0412 140 ASN 22 CG -0.0114 -0.0329 -0.0521 141 ASN 22 ND2 -0.0111 -0.0339 -0.0688 142 ASN 22 OD1 -0.0246 -0.0316 -0.0456 143 ASP 23 N 0.0250 -0.0111 -0.0239 144 ASP 23 CA 0.0284 -0.0147 -0.0219 145 ASP 23 C 0.0274 -0.0155 -0.0165 146 ASP 23 O 0.0290 -0.0176 -0.0146 147 ASP 23 CB 0.0310 -0.0166 -0.0232 148 ASP 23 CG 0.0329 -0.0167 -0.0284 149 ASP 23 OD1 0.0354 -0.0185 -0.0298 150 ASP 23 OD2 0.0317 -0.0148 -0.0311 151 LEU 24 N 0.0247 -0.0138 -0.0141 152 LEU 24 CA 0.0236 -0.0144 -0.0090 153 LEU 24 C 0.0221 -0.0135 -0.0075 154 LEU 24 O 0.0231 -0.0155 -0.0042 155 LEU 24 CB 0.0207 -0.0124 -0.0071 156 LEU 24 CG 0.0222 -0.0139 -0.0066 157 LEU 24 CD1 0.0190 -0.0115 -0.0052 158 LEU 24 CD2 0.0247 -0.0173 -0.0030 159 ARG 25 N 0.0155 -0.0111 -0.0172 160 ARG 25 CA 0.0078 -0.0050 -0.0116 161 ARG 25 C 0.0045 -0.0017 -0.0085 162 ARG 25 O 0.0023 0.0052 -0.0022 163 ARG 25 CB -0.0017 -0.0079 -0.0142 164 ARG 25 CG -0.0080 -0.0142 -0.0200 165 ARG 25 CD -0.0183 -0.0156 -0.0212 166 ARG 25 NE -0.0211 -0.0237 -0.0286 167 ARG 25 CZ -0.0224 -0.0276 -0.0322 168 ARG 25 NH1 -0.0211 -0.0243 -0.0292 169 ARG 25 NH2 -0.0250 -0.0350 -0.0390 170 ASP 26 N 0.0043 -0.0064 -0.0128 171 ASP 26 CA 0.0023 -0.0033 -0.0100 172 ASP 26 C 0.0108 0.0024 -0.0048 173 ASP 26 O 0.0084 0.0087 0.0010 174 ASP 26 CB 0.0016 -0.0098 -0.0160 175 ASP 26 CG -0.0016 -0.0070 -0.0134 176 ASP 26 OD1 -0.0095 -0.0028 -0.0096 177 ASP 26 OD2 0.0038 -0.0090 -0.0152 178 ILE 27 N 0.0081 -0.0051 -0.0163 179 ILE 27 CA 0.0118 -0.0065 -0.0119 180 ILE 27 C 0.0107 -0.0021 -0.0070 181 ILE 27 O 0.0118 -0.0017 -0.0046 182 ILE 27 CB 0.0158 -0.0100 -0.0102 183 ILE 27 CG1 0.0172 -0.0146 -0.0150 184 ILE 27 CG2 0.0196 -0.0110 -0.0052 185 ILE 27 CD1 0.0196 -0.0172 -0.0147 186 MET 28 N 0.0086 0.0013 -0.0055 187 MET 28 CA 0.0076 0.0055 -0.0007 188 MET 28 C 0.0045 0.0084 -0.0016 189 MET 28 O 0.0052 0.0100 0.0021 190 MET 28 CB 0.0057 0.0085 0.0005 191 MET 28 CG 0.0052 0.0126 0.0060 192 MET 28 SD 0.0022 0.0171 0.0078 193 MET 28 CE -0.0031 0.0196 0.0023 194 GLY 29 N -0.0068 0.0208 -0.0138 195 GLY 29 CA -0.0069 0.0234 -0.0215 196 GLY 29 C -0.0072 0.0156 -0.0260 197 GLY 29 O -0.0072 0.0160 -0.0281 198 LYS 30 N -0.0075 0.0084 -0.0275 199 LYS 30 CA -0.0078 0.0006 -0.0318 200 LYS 30 C -0.0079 -0.0033 -0.0260 201 LYS 30 O -0.0080 -0.0059 -0.0294 202 LYS 30 CB -0.0081 -0.0065 -0.0336 203 LYS 30 CG -0.0082 -0.0041 -0.0410 204 LYS 30 CD -0.0084 -0.0114 -0.0422 205 LYS 30 CE -0.0085 -0.0090 -0.0495 206 LYS 30 NZ -0.0087 -0.0159 -0.0503 207 SER 31 N -0.0094 -0.0060 -0.0089 208 SER 31 CA -0.0056 -0.0044 -0.0048 209 SER 31 C -0.0065 0.0025 -0.0034 210 SER 31 O -0.0062 0.0045 -0.0024 211 SER 31 CB -0.0009 -0.0066 -0.0010 212 SER 31 OG -0.0006 -0.0034 0.0003 213 GLU 32 N -0.0078 0.0063 -0.0034 214 GLU 32 CA -0.0088 0.0130 -0.0021 215 GLU 32 C -0.0128 0.0151 -0.0053 216 GLU 32 O -0.0124 0.0185 -0.0037 217 GLU 32 CB -0.0099 0.0164 -0.0021 218 GLU 32 CG -0.0064 0.0203 0.0026 219 GLU 32 CD -0.0066 0.0219 0.0029 220 GLU 32 OE1 -0.0104 0.0217 -0.0007 221 GLU 32 OE2 -0.0032 0.0234 0.0067 222 VAL 33 N -0.0260 0.0267 -0.0170 223 VAL 33 CA -0.0285 0.0274 -0.0242 224 VAL 33 C -0.0225 0.0179 -0.0214 225 VAL 33 O -0.0229 0.0204 -0.0179 226 VAL 33 CB -0.0323 0.0266 -0.0387 227 VAL 33 CG1 -0.0328 0.0231 -0.0466 228 VAL 33 CG2 -0.0396 0.0381 -0.0419 229 ASN 34 N -0.0168 0.0069 -0.0226 230 ASN 34 CA -0.0111 -0.0028 -0.0211 231 ASN 34 C -0.0076 -0.0019 -0.0074 232 ASN 34 O -0.0063 -0.0033 -0.0055 233 ASN 34 CB -0.0058 -0.0146 -0.0249 234 ASN 34 CG -0.0087 -0.0170 -0.0391 235 ASN 34 ND2 -0.0123 -0.0125 -0.0430 236 ASN 34 OD1 -0.0077 -0.0228 -0.0466 237 ASN 35 N -0.0127 -0.0016 -0.0024 238 ASN 35 CA -0.0123 -0.0043 0.0077 239 ASN 35 C -0.0171 -0.0013 0.0133 240 ASN 35 O -0.0157 -0.0045 0.0209 241 ASN 35 CB -0.0143 -0.0034 0.0113 242 ASN 35 CG -0.0087 -0.0075 0.0073 243 ASN 35 ND2 -0.0060 -0.0115 0.0135 244 ASN 35 OD1 -0.0064 -0.0076 -0.0012 245 SER 36 N -0.0229 0.0048 0.0098 246 SER 36 CA -0.0268 0.0073 0.0140 247 SER 36 C -0.0220 0.0032 0.0130 248 SER 36 O -0.0222 0.0018 0.0196 249 SER 36 CB -0.0336 0.0146 0.0096 250 SER 36 OG -0.0321 0.0151 0.0015 251 HIS 37 N -0.0229 0.0036 0.0096 252 HIS 37 CA -0.0157 -0.0017 0.0088 253 HIS 37 C -0.0100 -0.0098 0.0161 254 HIS 37 O -0.0077 -0.0141 0.0212 255 HIS 37 CB -0.0098 -0.0009 -0.0024 256 HIS 37 CG -0.0008 -0.0074 -0.0035 257 HIS 37 CD2 0.0077 -0.0118 -0.0084 258 HIS 37 ND1 0.0000 -0.0102 0.0008 259 HIS 37 CE1 0.0087 -0.0159 -0.0014 260 HIS 37 NE2 0.0135 -0.0170 -0.0069 261 VAL 38 N -0.0075 -0.0121 0.0168 262 VAL 38 CA -0.0016 -0.0199 0.0233 263 VAL 38 C -0.0067 -0.0214 0.0346 264 VAL 38 O -0.0031 -0.0277 0.0415 265 VAL 38 CB 0.0043 -0.0225 0.0190 266 VAL 38 CG1 0.0126 -0.0310 0.0231 267 VAL 38 CG2 0.0072 -0.0190 0.0073 268 GLY 39 N -0.0138 -0.0138 0.0239 269 GLY 39 CA -0.0153 -0.0147 0.0246 270 GLY 39 C -0.0155 -0.0139 0.0228 271 GLY 39 O -0.0153 -0.0143 0.0237 272 LEU 40 N -0.0158 -0.0129 0.0204 273 LEU 40 CA -0.0162 -0.0121 0.0185 274 LEU 40 C -0.0189 -0.0125 0.0171 275 LEU 40 O -0.0200 -0.0127 0.0166 276 LEU 40 CB -0.0143 -0.0104 0.0167 277 LEU 40 CG -0.0114 -0.0097 0.0178 278 LEU 40 CD1 -0.0099 -0.0082 0.0159 279 LEU 40 CD2 -0.0104 -0.0096 0.0184 280 THR 41 N -0.0105 -0.0099 0.0030 281 THR 41 CA -0.0100 -0.0095 0.0035 282 THR 41 C -0.0122 -0.0079 0.0049 283 THR 41 O -0.0142 -0.0071 0.0053 284 THR 41 CB -0.0100 -0.0112 0.0015 285 THR 41 CG2 -0.0077 -0.0128 0.0002 286 THR 41 OG1 -0.0127 -0.0118 0.0002 287 GLY 42 N -0.0119 -0.0072 0.0057 288 GLY 42 CA -0.0140 -0.0058 0.0069 289 GLY 42 C -0.0127 -0.0045 0.0087 290 GLY 42 O -0.0104 -0.0051 0.0085 291 LEU 43 N -0.0074 0.0033 0.0079 292 LEU 43 CA -0.0064 0.0043 0.0097 293 LEU 43 C -0.0072 0.0027 0.0112 294 LEU 43 O -0.0084 0.0011 0.0119 295 LEU 43 CB -0.0052 0.0054 0.0112 296 LEU 43 CG -0.0039 0.0066 0.0131 297 LEU 43 CD1 -0.0029 0.0082 0.0119 298 LEU 43 CD2 -0.0029 0.0075 0.0145 299 LEU 44 N -0.0067 0.0033 0.0119 300 LEU 44 CA -0.0074 0.0020 0.0133 301 LEU 44 C -0.0062 0.0029 0.0156 302 LEU 44 O -0.0049 0.0047 0.0154 303 LEU 44 CB -0.0080 0.0016 0.0118 304 LEU 44 CG -0.0085 0.0007 0.0131 305 LEU 44 CD1 -0.0098 -0.0014 0.0144 306 LEU 44 CD2 -0.0089 0.0006 0.0113 307 CYS 45 N 0.0002 0.0050 0.0191 308 CYS 45 CA 0.0006 0.0029 0.0172 309 CYS 45 C 0.0010 0.0011 0.0156 310 CYS 45 O 0.0023 0.0017 0.0156 311 CYS 45 CB 0.0032 0.0036 0.0168 312 CYS 45 SG 0.0043 0.0010 0.0143 313 PHE 46 N -0.0001 -0.0011 0.0142 314 PHE 46 CA 0.0001 -0.0031 0.0125 315 PHE 46 C 0.0014 -0.0049 0.0106 316 PHE 46 O 0.0007 -0.0054 0.0105 317 PHE 46 CB -0.0029 -0.0043 0.0126 318 PHE 46 CG -0.0029 -0.0064 0.0110 319 PHE 46 CD1 -0.0010 -0.0062 0.0104 320 PHE 46 CD2 -0.0049 -0.0085 0.0100 321 PHE 46 CE1 -0.0010 -0.0081 0.0089 322 PHE 46 CE2 -0.0049 -0.0104 0.0084 323 PHE 46 CZ -0.0030 -0.0102 0.0079 324 GLY 47 N 0.0003 -0.0033 0.0059 325 GLY 47 CA 0.0014 -0.0054 0.0028 326 GLY 47 C 0.0018 -0.0029 0.0016 327 GLY 47 O 0.0017 0.0011 0.0016 328 ASN 48 N 0.0021 -0.0052 0.0005 329 ASN 48 CA 0.0025 -0.0031 -0.0006 330 ASN 48 C 0.0013 0.0000 0.0027 331 ASN 48 O 0.0016 0.0034 0.0018 332 ASN 48 CB 0.0039 -0.0008 -0.0047 333 ASN 48 CG 0.0046 -0.0004 -0.0068 334 ASN 48 ND2 0.0053 0.0032 -0.0090 335 ASN 48 OD1 0.0045 -0.0032 -0.0064 336 SER 49 N 0.0010 0.0008 0.0083 337 SER 49 CA 0.0014 0.0020 0.0097 338 SER 49 C 0.0013 0.0028 0.0095 339 SER 49 O 0.0014 0.0043 0.0099 340 SER 49 CB 0.0014 0.0033 0.0099 341 SER 49 OG 0.0018 0.0027 0.0109 342 ILE 50 N 0.0011 0.0019 0.0088 343 ILE 50 CA 0.0010 0.0026 0.0086 344 ILE 50 C 0.0013 0.0012 0.0091 345 ILE 50 O 0.0012 -0.0003 0.0086 346 ILE 50 CB 0.0004 0.0032 0.0069 347 ILE 50 CG1 0.0003 0.0050 0.0067 348 ILE 50 CG2 0.0003 0.0030 0.0065 349 ILE 50 CD1 -0.0003 0.0057 0.0051 350 PHE 51 N 0.0008 -0.0002 0.0061 351 PHE 51 CA 0.0009 -0.0008 0.0063 352 PHE 51 C 0.0007 -0.0006 0.0056 353 PHE 51 O 0.0005 0.0003 0.0054 354 PHE 51 CB 0.0012 -0.0007 0.0073 355 PHE 51 CG 0.0015 -0.0011 0.0080 356 PHE 51 CD1 0.0017 -0.0021 0.0081 357 PHE 51 CD2 0.0016 -0.0005 0.0087 358 PHE 51 CE1 0.0020 -0.0025 0.0088 359 PHE 51 CE2 0.0019 -0.0009 0.0093 360 PHE 51 CZ 0.0021 -0.0019 0.0094 361 LEU 52 N 0.0007 -0.0013 0.0053 362 LEU 52 CA 0.0005 -0.0012 0.0047 363 LEU 52 C 0.0007 -0.0019 0.0051 364 LEU 52 O 0.0008 -0.0028 0.0050 365 LEU 52 CB 0.0002 -0.0014 0.0037 366 LEU 52 CG 0.0000 -0.0016 0.0031 367 LEU 52 CD1 -0.0002 -0.0007 0.0029 368 LEU 52 CD2 -0.0002 -0.0021 0.0021 369 GLN 53 N -0.0083 -0.0019 0.0048 370 GLN 53 CA -0.0079 -0.0024 0.0047 371 GLN 53 C -0.0085 -0.0016 0.0030 372 GLN 53 O -0.0096 -0.0002 0.0028 373 GLN 53 CB -0.0082 -0.0022 0.0065 374 GLN 53 CG -0.0079 -0.0026 0.0064 375 GLN 53 CD -0.0078 -0.0028 0.0084 376 GLN 53 NE2 -0.0070 -0.0037 0.0086 377 GLN 53 OE1 -0.0084 -0.0020 0.0097 378 ILE 54 N -0.0078 -0.0024 0.0020 379 ILE 54 CA -0.0082 -0.0018 0.0005 380 ILE 54 C -0.0080 -0.0022 0.0011 381 ILE 54 O -0.0070 -0.0035 0.0014 382 ILE 54 CB -0.0077 -0.0024 -0.0014 383 ILE 54 CG1 -0.0079 -0.0020 -0.0029 384 ILE 54 CG2 -0.0064 -0.0041 -0.0013 385 ILE 54 CD1 -0.0076 -0.0024 -0.0049 386 LEU 55 N -0.0132 -0.0096 -0.0014 387 LEU 55 CA -0.0131 -0.0101 0.0021 388 LEU 55 C -0.0130 -0.0092 0.0013 389 LEU 55 O -0.0129 -0.0067 -0.0010 390 LEU 55 CB -0.0126 -0.0075 0.0052 391 LEU 55 CG -0.0126 -0.0083 0.0072 392 LEU 55 CD1 -0.0122 -0.0046 0.0077 393 LEU 55 CD2 -0.0125 -0.0100 0.0111 394 GLU 56 N -0.0131 -0.0113 0.0031 395 GLU 56 CA -0.0131 -0.0108 0.0027 396 GLU 56 C -0.0129 -0.0110 0.0066 397 GLU 56 O -0.0130 -0.0136 0.0088 398 GLU 56 CB -0.0136 -0.0138 0.0001 399 GLU 56 CG -0.0138 -0.0138 -0.0038 400 GLU 56 CD -0.0142 -0.0157 -0.0067 401 GLU 56 OE1 -0.0144 -0.0182 -0.0056 402 GLU 56 OE2 -0.0143 -0.0146 -0.0100 403 GLY 57 N -0.0172 -0.0129 0.0100 404 GLY 57 CA -0.0184 -0.0118 0.0156 405 GLY 57 C -0.0154 -0.0068 0.0177 406 GLY 57 O -0.0125 -0.0043 0.0150 407 SER 58 N -0.0160 -0.0055 0.0224 408 SER 58 CA -0.0133 -0.0008 0.0248 409 SER 58 C -0.0108 0.0015 0.0223 410 SER 58 O -0.0115 -0.0007 0.0200 411 SER 58 CB -0.0149 -0.0002 0.0307 412 SER 58 OG -0.0163 -0.0015 0.0317 413 ARG 59 N -0.0067 0.0005 0.0179 414 ARG 59 CA -0.0054 0.0028 0.0167 415 ARG 59 C -0.0057 0.0028 0.0186 416 ARG 59 O -0.0056 0.0025 0.0170 417 ARG 59 CB -0.0039 0.0061 0.0170 418 ARG 59 CG -0.0025 0.0084 0.0146 419 ARG 59 CD -0.0010 0.0114 0.0146 420 ARG 59 NE -0.0008 0.0131 0.0179 421 ARG 59 CZ 0.0002 0.0155 0.0187 422 ARG 59 NH1 0.0011 0.0166 0.0163 423 ARG 59 NH2 0.0004 0.0169 0.0218 424 GLN 60 N -0.0062 0.0030 0.0220 425 GLN 60 CA -0.0064 0.0033 0.0241 426 GLN 60 C -0.0077 0.0003 0.0237 427 GLN 60 O -0.0076 0.0005 0.0234 428 GLN 60 CB -0.0066 0.0041 0.0279 429 GLN 60 CG -0.0067 0.0047 0.0302 430 GLN 60 CD -0.0083 0.0018 0.0319 431 GLN 60 NE2 -0.0091 0.0012 0.0347 432 GLN 60 OE1 -0.0089 0.0002 0.0307 433 ALA 61 N -0.0071 -0.0064 0.0255 434 ALA 61 CA -0.0097 -0.0087 0.0240 435 ALA 61 C -0.0095 -0.0089 0.0195 436 ALA 61 O -0.0101 -0.0095 0.0178 437 ALA 61 CB -0.0126 -0.0110 0.0255 438 ILE 62 N -0.0086 -0.0083 0.0176 439 ILE 62 CA -0.0083 -0.0084 0.0133 440 ILE 62 C -0.0058 -0.0064 0.0119 441 ILE 62 O -0.0062 -0.0070 0.0092 442 ILE 62 CB -0.0075 -0.0079 0.0116 443 ILE 62 CG1 -0.0101 -0.0099 0.0126 444 ILE 62 CG2 -0.0069 -0.0077 0.0072 445 ILE 62 CD1 -0.0090 -0.0090 0.0128 446 SER 63 N -0.0017 -0.0085 0.0104 447 SER 63 CA 0.0002 -0.0077 0.0092 448 SER 63 C 0.0004 -0.0074 0.0083 449 SER 63 O 0.0009 -0.0067 0.0065 450 SER 63 CB 0.0022 -0.0079 0.0106 451 SER 63 OG 0.0020 -0.0082 0.0115 452 HIS 64 N -0.0001 -0.0079 0.0095 453 HIS 64 CA 0.0001 -0.0076 0.0088 454 HIS 64 C -0.0017 -0.0073 0.0071 455 HIS 64 O -0.0012 -0.0067 0.0056 456 HIS 64 CB -0.0001 -0.0083 0.0106 457 HIS 64 CG -0.0007 -0.0082 0.0100 458 HIS 64 CD2 -0.0025 -0.0086 0.0105 459 HIS 64 ND1 0.0005 -0.0075 0.0088 460 HIS 64 CE1 -0.0005 -0.0076 0.0085 461 HIS 64 NE2 -0.0023 -0.0083 0.0095 462 THR 65 N -0.0005 -0.0122 0.0068 463 THR 65 CA -0.0028 -0.0109 0.0049 464 THR 65 C -0.0023 -0.0099 0.0029 465 THR 65 O -0.0027 -0.0087 0.0006 466 THR 65 CB -0.0057 -0.0111 0.0064 467 THR 65 CG2 -0.0079 -0.0098 0.0046 468 THR 65 OG1 -0.0066 -0.0115 0.0073 469 TYR 66 N -0.0015 -0.0104 0.0037 470 TYR 66 CA -0.0008 -0.0096 0.0018 471 TYR 66 C 0.0017 -0.0091 -0.0000 472 TYR 66 O 0.0017 -0.0079 -0.0024 473 TYR 66 CB -0.0003 -0.0104 0.0032 474 TYR 66 CG 0.0001 -0.0096 0.0015 475 TYR 66 CD1 -0.0020 -0.0084 -0.0002 476 TYR 66 CD2 0.0025 -0.0100 0.0015 477 TYR 66 CE1 -0.0017 -0.0076 -0.0018 478 TYR 66 CE2 0.0028 -0.0092 -0.0001 479 TYR 66 CZ 0.0008 -0.0080 -0.0018 480 TYR 66 OH 0.0011 -0.0073 -0.0033 481 HIS 67 N 0.0081 -0.0099 -0.0061 482 HIS 67 CA 0.0098 -0.0098 -0.0076 483 HIS 67 C 0.0089 -0.0090 -0.0094 484 HIS 67 O 0.0097 -0.0085 -0.0113 485 HIS 67 CB 0.0115 -0.0107 -0.0065 486 HIS 67 CG 0.0130 -0.0106 -0.0079 487 HIS 67 CD2 0.0141 -0.0103 -0.0098 488 HIS 67 ND1 0.0135 -0.0109 -0.0075 489 HIS 67 CE1 0.0149 -0.0108 -0.0091 490 HIS 67 NE2 0.0153 -0.0104 -0.0105 491 ARG 68 N 0.0073 -0.0087 -0.0088 492 ARG 68 CA 0.0063 -0.0079 -0.0104 493 ARG 68 C 0.0051 -0.0070 -0.0119 494 ARG 68 O 0.0051 -0.0064 -0.0138 495 ARG 68 CB 0.0048 -0.0078 -0.0094 496 ARG 68 CG 0.0059 -0.0083 -0.0090 497 ARG 68 CD 0.0043 -0.0083 -0.0078 498 ARG 68 NE 0.0021 -0.0075 -0.0082 499 ARG 68 CZ 0.0005 -0.0075 -0.0067 500 ARG 68 NH1 0.0007 -0.0083 -0.0046 501 ARG 68 NH2 -0.0015 -0.0068 -0.0072 502 ILE 69 N 0.0090 -0.0085 -0.0064 503 ILE 69 CA 0.0068 -0.0062 -0.0067 504 ILE 69 C 0.0070 -0.0041 -0.0074 505 ILE 69 O 0.0067 -0.0015 -0.0080 506 ILE 69 CB 0.0038 -0.0074 -0.0060 507 ILE 69 CG1 0.0032 -0.0082 -0.0057 508 ILE 69 CG2 0.0015 -0.0053 -0.0063 509 ILE 69 CD1 0.0001 -0.0090 -0.0051 510 LEU 70 N 0.0076 -0.0051 -0.0071 511 LEU 70 CA 0.0077 -0.0033 -0.0077 512 LEU 70 C 0.0101 -0.0012 -0.0086 513 LEU 70 O 0.0099 0.0010 -0.0092 514 LEU 70 CB 0.0082 -0.0051 -0.0072 515 LEU 70 CG 0.0055 -0.0061 -0.0066 516 LEU 70 CD1 0.0063 -0.0080 -0.0061 517 LEU 70 CD2 0.0035 -0.0037 -0.0070 518 GLN 71 N 0.0176 0.0022 -0.0178 519 GLN 71 CA 0.0204 0.0046 -0.0152 520 GLN 71 C 0.0211 0.0045 -0.0147 521 GLN 71 O 0.0234 0.0066 -0.0126 522 GLN 71 CB 0.0236 0.0029 -0.0130 523 GLN 71 CG 0.0234 0.0036 -0.0131 524 GLN 71 CD 0.0264 0.0013 -0.0111 525 GLN 71 NE2 0.0291 0.0034 -0.0087 526 GLN 71 OE1 0.0263 -0.0023 -0.0118 527 ASP 72 N 0.0193 0.0022 -0.0165 528 ASP 72 CA 0.0198 0.0021 -0.0161 529 ASP 72 C 0.0186 0.0064 -0.0163 530 ASP 72 O 0.0158 0.0082 -0.0182 531 ASP 72 CB 0.0179 -0.0014 -0.0181 532 ASP 72 CG 0.0197 -0.0035 -0.0171 533 ASP 72 OD1 0.0200 -0.0012 -0.0164 534 ASP 72 OD2 0.0207 -0.0073 -0.0169 535 PRO 73 N 0.0272 0.0024 -0.0161 536 PRO 73 CA 0.0247 0.0096 -0.0141 537 PRO 73 C 0.0210 0.0127 -0.0135 538 PRO 73 O 0.0196 0.0190 -0.0117 539 PRO 73 CB 0.0317 0.0134 -0.0125 540 PRO 73 CG 0.0378 0.0086 -0.0135 541 PRO 73 CD 0.0347 0.0019 -0.0157 542 ARG 74 N 0.0195 0.0086 -0.0148 543 ARG 74 CA 0.0160 0.0112 -0.0143 544 ARG 74 C 0.0079 0.0108 -0.0150 545 ARG 74 O 0.0044 0.0127 -0.0146 546 ARG 74 CB 0.0189 0.0072 -0.0152 547 ARG 74 CG 0.0267 0.0089 -0.0142 548 ARG 74 CD 0.0287 0.0062 -0.0148 549 ARG 74 NE 0.0315 -0.0009 -0.0167 550 ARG 74 CZ 0.0382 -0.0027 -0.0168 551 ARG 74 NH1 0.0430 0.0021 -0.0150 552 ARG 74 NH2 0.0402 -0.0093 -0.0186 553 HIS 75 N 0.0115 0.0086 0.0049 554 HIS 75 CA 0.0070 0.0068 0.0087 555 HIS 75 C 0.0019 0.0020 0.0084 556 HIS 75 O 0.0020 -0.0003 0.0045 557 HIS 75 CB 0.0076 0.0061 0.0066 558 HIS 75 CG 0.0077 0.0023 0.0001 559 HIS 75 CD2 0.0079 -0.0003 -0.0044 560 HIS 75 ND1 0.0076 0.0008 -0.0023 561 HIS 75 CE1 0.0078 -0.0025 -0.0080 562 HIS 75 NE2 0.0079 -0.0032 -0.0094 563 HIS 76 N -0.0026 0.0004 0.0126 564 HIS 76 CA -0.0078 -0.0041 0.0130 565 HIS 76 C -0.0120 -0.0061 0.0160 566 HIS 76 O -0.0109 -0.0038 0.0180 567 HIS 76 CB -0.0090 -0.0029 0.0167 568 HIS 76 CG -0.0093 0.0007 0.0233 569 HIS 76 CD2 -0.0131 0.0005 0.0286 570 HIS 76 ND1 -0.0053 0.0053 0.0249 571 HIS 76 CE1 -0.0067 0.0078 0.0310 572 HIS 76 NE2 -0.0114 0.0049 0.0333 573 SER 77 N -0.0041 -0.0006 0.0166 574 SER 77 CA -0.0050 -0.0014 0.0180 575 SER 77 C -0.0040 -0.0005 0.0166 576 SER 77 O -0.0033 0.0001 0.0181 577 SER 77 CB -0.0046 -0.0011 0.0214 578 SER 77 OG -0.0056 -0.0021 0.0227 579 ALA 78 N -0.0039 -0.0003 0.0136 580 ALA 78 CA -0.0031 0.0005 0.0120 581 ALA 78 C -0.0047 -0.0009 0.0123 582 ALA 78 O -0.0067 -0.0027 0.0124 583 ALA 78 CB -0.0027 0.0009 0.0088 584 GLU 79 N 0.0031 -0.0043 0.0128 585 GLU 79 CA 0.0014 -0.0042 0.0110 586 GLU 79 C 0.0023 -0.0049 0.0085 587 GLU 79 O 0.0045 -0.0056 0.0082 588 GLU 79 CB 0.0008 -0.0039 0.0116 589 GLU 79 CG -0.0008 -0.0030 0.0137 590 GLU 79 CD -0.0012 -0.0028 0.0144 591 GLU 79 OE1 -0.0009 -0.0025 0.0166 592 GLU 79 OE2 -0.0017 -0.0029 0.0128 593 ILE 80 N 0.0008 -0.0048 0.0067 594 ILE 80 CA 0.0015 -0.0055 0.0041 595 ILE 80 C 0.0010 -0.0055 0.0029 596 ILE 80 O -0.0010 -0.0050 0.0030 597 ILE 80 CB 0.0001 -0.0053 0.0027 598 ILE 80 CG1 0.0004 -0.0051 0.0041 599 ILE 80 CG2 0.0011 -0.0061 0.0002 600 ILE 80 CD1 -0.0015 -0.0048 0.0033 601 ILE 81 N 0.0059 -0.0071 -0.0012 602 ILE 81 CA 0.0061 -0.0071 -0.0027 603 ILE 81 C 0.0058 -0.0066 -0.0040 604 ILE 81 O 0.0052 -0.0059 -0.0050 605 ILE 81 CB 0.0074 -0.0083 -0.0029 606 ILE 81 CG1 0.0076 -0.0087 -0.0019 607 ILE 81 CG2 0.0078 -0.0084 -0.0046 608 ILE 81 CD1 0.0088 -0.0099 -0.0019 609 ALA 82 N 0.0062 -0.0069 -0.0043 610 ALA 82 CA 0.0059 -0.0065 -0.0056 611 ALA 82 C 0.0060 -0.0065 -0.0053 612 ALA 82 O 0.0065 -0.0072 -0.0043 613 ALA 82 CB 0.0068 -0.0071 -0.0070 614 PHE 83 N 0.0062 -0.0017 -0.0112 615 PHE 83 CA 0.0041 -0.0002 -0.0083 616 PHE 83 C 0.0051 0.0036 -0.0104 617 PHE 83 O 0.0050 0.0077 -0.0111 618 PHE 83 CB 0.0016 0.0016 -0.0046 619 PHE 83 CG -0.0007 0.0032 -0.0015 620 PHE 83 CD1 -0.0010 0.0077 -0.0017 621 PHE 83 CD2 -0.0024 0.0001 0.0017 622 PHE 83 CE1 -0.0030 0.0091 0.0012 623 PHE 83 CE2 -0.0044 0.0015 0.0046 624 PHE 83 CZ -0.0048 0.0060 0.0043 625 ASP 84 N 0.0059 0.0024 -0.0115 626 ASP 84 CA 0.0071 0.0057 -0.0139 627 ASP 84 C 0.0063 0.0053 -0.0125 628 ASP 84 O 0.0057 0.0016 -0.0109 629 ASP 84 CB 0.0101 0.0049 -0.0183 630 ASP 84 CG 0.0112 -0.0004 -0.0191 631 ASP 84 OD1 0.0108 -0.0027 -0.0181 632 ASP 84 OD2 0.0125 -0.0021 -0.0208 633 PRO 85 N 0.0084 0.0202 -0.0157 634 PRO 85 CA 0.0054 0.0175 -0.0101 635 PRO 85 C 0.0043 0.0118 -0.0150 636 PRO 85 O 0.0068 0.0124 -0.0223 637 PRO 85 CB 0.0079 0.0252 -0.0063 638 PRO 85 CG 0.0124 0.0316 -0.0113 639 PRO 85 CD 0.0129 0.0282 -0.0180 640 VAL 86 N 0.0003 0.0063 -0.0107 641 VAL 86 CA -0.0014 0.0000 -0.0145 642 VAL 86 C -0.0036 -0.0008 -0.0088 643 VAL 86 O -0.0046 0.0020 -0.0013 644 VAL 86 CB -0.0046 -0.0080 -0.0165 645 VAL 86 CG1 -0.0022 -0.0083 -0.0247 646 VAL 86 CG2 -0.0074 -0.0092 -0.0093 647 LEU 87 N -0.0110 -0.0430 -0.0057 648 LEU 87 CA -0.0130 -0.0231 -0.0088 649 LEU 87 C -0.0204 -0.0107 -0.0167 650 LEU 87 O -0.0306 -0.0009 -0.0273 651 LEU 87 CB 0.0012 -0.0134 0.0046 652 LEU 87 CG 0.0024 0.0038 0.0049 653 LEU 87 CD1 0.0179 0.0101 0.0197 654 LEU 87 CD2 -0.0060 0.0214 -0.0044 655 GLN 88 N -0.0155 -0.0111 -0.0119 656 GLN 88 CA -0.0218 0.0002 -0.0187 657 GLN 88 C -0.0227 -0.0123 -0.0188 658 GLN 88 O -0.0149 -0.0262 -0.0104 659 GLN 88 CB -0.0133 0.0194 -0.0114 660 GLN 88 CG 0.0023 0.0165 0.0040 661 GLN 88 CD 0.0105 0.0358 0.0110 662 GLN 88 NE2 0.0235 0.0344 0.0239 663 GLN 88 OE1 0.0052 0.0517 0.0049 664 ARG 89 N -0.0138 -0.0131 -0.0138 665 ARG 89 CA -0.0136 -0.0140 -0.0125 666 ARG 89 C -0.0130 -0.0165 -0.0150 667 ARG 89 O -0.0126 -0.0181 -0.0171 668 ARG 89 CB -0.0132 -0.0156 -0.0090 669 ARG 89 CG -0.0135 -0.0144 -0.0067 670 ARG 89 CD -0.0130 -0.0166 -0.0036 671 ARG 89 NE -0.0133 -0.0153 -0.0006 672 ARG 89 CZ -0.0137 -0.0139 0.0020 673 ARG 89 NH1 -0.0138 -0.0134 0.0021 674 ARG 89 NH2 -0.0140 -0.0128 0.0046 675 GLU 90 N -0.0129 -0.0167 -0.0146 676 GLU 90 CA -0.0123 -0.0191 -0.0165 677 GLU 90 C -0.0117 -0.0214 -0.0142 678 GLU 90 O -0.0111 -0.0237 -0.0155 679 GLU 90 CB -0.0128 -0.0172 -0.0189 680 GLU 90 CG -0.0133 -0.0151 -0.0215 681 GLU 90 CD -0.0134 -0.0146 -0.0248 682 GLU 90 OE1 -0.0139 -0.0128 -0.0247 683 GLU 90 OE2 -0.0130 -0.0160 -0.0275 684 PHE 91 N -0.0078 -0.0112 -0.0127 685 PHE 91 CA -0.0049 -0.0103 -0.0105 686 PHE 91 C -0.0014 -0.0124 -0.0097 687 PHE 91 O 0.0010 -0.0111 -0.0075 688 PHE 91 CB -0.0051 -0.0063 -0.0084 689 PHE 91 CG -0.0084 -0.0040 -0.0090 690 PHE 91 CD1 -0.0086 -0.0029 -0.0085 691 PHE 91 CD2 -0.0114 -0.0028 -0.0102 692 PHE 91 CE1 -0.0116 -0.0008 -0.0091 693 PHE 91 CE2 -0.0144 -0.0007 -0.0108 694 PHE 91 CZ -0.0145 0.0003 -0.0102 695 VAL 92 N -0.0012 -0.0159 -0.0114 696 VAL 92 CA 0.0019 -0.0183 -0.0109 697 VAL 92 C 0.0052 -0.0185 -0.0091 698 VAL 92 O 0.0081 -0.0187 -0.0075 699 VAL 92 CB 0.0012 -0.0220 -0.0134 700 VAL 92 CG1 -0.0002 -0.0233 -0.0149 701 VAL 92 CG2 0.0046 -0.0247 -0.0129 702 GLN 93 N 0.0044 -0.0073 -0.0200 703 GLN 93 CA 0.0123 -0.0060 -0.0178 704 GLN 93 C 0.0142 -0.0027 -0.0126 705 GLN 93 O 0.0205 -0.0028 -0.0127 706 GLN 93 CB 0.0141 -0.0044 -0.0153 707 GLN 93 CG 0.0095 -0.0064 -0.0185 708 GLN 93 CD 0.0019 -0.0042 -0.0152 709 GLN 93 NE2 -0.0040 -0.0066 -0.0191 710 GLN 93 OE1 0.0014 -0.0003 -0.0094 711 TRP 94 N 0.0091 0.0004 -0.0081 712 TRP 94 CA 0.0108 0.0041 -0.0024 713 TRP 94 C 0.0075 0.0038 -0.0029 714 TRP 94 O 0.0006 0.0031 -0.0041 715 TRP 94 CB 0.0078 0.0080 0.0035 716 TRP 94 CG 0.0098 0.0082 0.0039 717 TRP 94 CD1 0.0052 0.0076 0.0029 718 TRP 94 CD2 0.0172 0.0091 0.0055 719 TRP 94 CE2 0.0166 0.0090 0.0053 720 TRP 94 CE3 0.0242 0.0101 0.0071 721 TRP 94 NE1 0.0092 0.0081 0.0037 722 TRP 94 CZ2 0.0227 0.0098 0.0066 723 TRP 94 CZ3 0.0303 0.0108 0.0084 724 TRP 94 CH2 0.0295 0.0107 0.0081 725 SER 95 N -0.0055 0.0057 0.0124 726 SER 95 CA -0.0062 0.0035 0.0110 727 SER 95 C -0.0065 0.0020 0.0122 728 SER 95 O -0.0070 -0.0002 0.0125 729 SER 95 CB -0.0064 0.0043 0.0083 730 SER 95 OG -0.0065 0.0045 0.0067 731 MET 96 N -0.0060 0.0033 0.0130 732 MET 96 CA -0.0061 0.0023 0.0147 733 MET 96 C -0.0054 0.0044 0.0157 734 MET 96 O -0.0052 0.0060 0.0142 735 MET 96 CB -0.0067 0.0004 0.0135 736 MET 96 CG -0.0070 -0.0017 0.0153 737 MET 96 SD -0.0075 -0.0038 0.0157 738 MET 96 CE -0.0082 -0.0050 0.0127 739 LYS 97 N -0.0032 0.0069 0.0137 740 LYS 97 CA -0.0009 0.0084 0.0162 741 LYS 97 C -0.0008 0.0049 0.0197 742 LYS 97 O -0.0017 0.0021 0.0210 743 LYS 97 CB 0.0020 0.0117 0.0177 744 LYS 97 CG 0.0044 0.0143 0.0193 745 LYS 97 CD 0.0034 0.0151 0.0169 746 LYS 97 CE 0.0060 0.0186 0.0177 747 LYS 97 NZ 0.0051 0.0193 0.0156 748 LEU 98 N 0.0002 0.0052 0.0211 749 LEU 98 CA 0.0004 0.0021 0.0245 750 LEU 98 C 0.0036 0.0039 0.0281 751 LEU 98 O 0.0054 0.0073 0.0278 752 LEU 98 CB -0.0009 0.0009 0.0235 753 LEU 98 CG -0.0019 -0.0032 0.0259 754 LEU 98 CD1 0.0006 -0.0032 0.0301 755 LEU 98 CD2 -0.0038 -0.0065 0.0259 756 VAL 99 N -0.0209 0.0085 0.0274 757 VAL 99 CA -0.0176 0.0070 0.0267 758 VAL 99 C -0.0139 0.0005 0.0224 759 VAL 99 O -0.0088 -0.0007 0.0220 760 VAL 99 CB -0.0118 0.0116 0.0307 761 VAL 99 CG1 -0.0070 0.0089 0.0294 762 VAL 99 CG2 -0.0158 0.0176 0.0348 763 GLN 100 N -0.0163 -0.0036 0.0191 764 GLN 100 CA -0.0130 -0.0098 0.0148 765 GLN 100 C -0.0076 -0.0106 0.0148 766 GLN 100 O -0.0085 -0.0077 0.0169 767 GLN 100 CB -0.0193 -0.0144 0.0108 768 GLN 100 CG -0.0165 -0.0210 0.0062 769 GLN 100 CD -0.0199 -0.0255 0.0025 770 GLN 100 NE2 -0.0163 -0.0309 -0.0011 771 GLN 100 OE1 -0.0258 -0.0240 0.0029 772 ILE 101 N -0.0302 -0.0031 0.0098 773 ILE 101 CA -0.0174 -0.0061 0.0050 774 ILE 101 C -0.0175 -0.0213 -0.0062 775 ILE 101 O -0.0047 -0.0261 -0.0123 776 ILE 101 CB -0.0005 0.0005 0.0064 777 ILE 101 CG1 0.0027 -0.0033 0.0030 778 ILE 101 CG2 0.0006 0.0157 0.0174 779 ILE 101 CD1 0.0139 -0.0142 -0.0073 780 ASP 102 N -0.0319 -0.0288 -0.0088 781 ASP 102 CA -0.0339 -0.0435 -0.0192 782 ASP 102 C -0.0257 -0.0483 -0.0244 783 ASP 102 O -0.0139 -0.0547 -0.0315 784 ASP 102 CB -0.0521 -0.0488 -0.0195 785 ASP 102 CG -0.0621 -0.0405 -0.0113 786 ASP 102 OD1 -0.0548 -0.0312 -0.0059 787 ASP 102 OD2 -0.0773 -0.0433 -0.0103 788 SER 105 N 0.0173 0.0057 0.0413 789 SER 105 CA 0.0164 0.0038 0.0370 790 SER 105 C 0.0156 0.0009 0.0314 791 SER 105 O 0.0139 0.0024 0.0299 792 SER 105 CB 0.0131 0.0084 0.0360 793 SER 105 OG 0.0096 0.0111 0.0322 794 PRO 106 N 0.0167 -0.0032 0.0283 795 PRO 106 CA 0.0157 -0.0060 0.0227 796 PRO 106 C 0.0115 -0.0021 0.0187 797 PRO 106 O 0.0094 0.0016 0.0192 798 PRO 106 CB 0.0176 -0.0105 0.0207 799 PRO 106 CG 0.0185 -0.0090 0.0245 800 PRO 106 CD 0.0191 -0.0059 0.0300 801 GLU 107 N -0.0036 -0.0066 0.0023 802 GLU 107 CA -0.0044 0.0022 -0.0074 803 GLU 107 C -0.0036 0.0042 -0.0064 804 GLU 107 O -0.0031 0.0134 -0.0121 805 GLU 107 CB -0.0094 -0.0024 -0.0201 806 GLU 107 CG -0.0132 -0.0150 -0.0227 807 GLU 107 CD -0.0149 -0.0139 -0.0289 808 GLU 107 OE1 -0.0153 -0.0054 -0.0371 809 GLU 107 OE2 -0.0157 -0.0215 -0.0255 810 LYS 108 N -0.0034 -0.0040 0.0007 811 LYS 108 CA -0.0025 -0.0021 0.0023 812 LYS 108 C 0.0025 0.0093 0.0095 813 LYS 108 O 0.0034 0.0158 0.0073 814 LYS 108 CB -0.0035 -0.0138 0.0086 815 LYS 108 CG -0.0086 -0.0247 0.0004 816 LYS 108 CD -0.0112 -0.0218 -0.0105 817 LYS 108 CE -0.0087 -0.0164 -0.0064 818 LYS 108 NZ -0.0087 -0.0259 0.0010 819 MET 109 N 0.0026 0.0143 0.0084 820 MET 109 CA 0.0044 0.0185 0.0108 821 MET 109 C 0.0052 0.0225 0.0074 822 MET 109 O 0.0064 0.0260 0.0077 823 MET 109 CB 0.0049 0.0183 0.0145 824 MET 109 CG 0.0053 0.0170 0.0194 825 MET 109 SD 0.0056 0.0160 0.0235 826 MET 109 CE 0.0056 0.0135 0.0284 827 ARG 110 N 0.0045 0.0221 0.0039 828 ARG 110 CA 0.0051 0.0257 0.0004 829 ARG 110 C 0.0048 0.0262 -0.0028 830 ARG 110 O 0.0057 0.0299 -0.0046 831 ARG 110 CB 0.0044 0.0249 -0.0025 832 ARG 110 CG 0.0045 0.0239 0.0006 833 ARG 110 CD 0.0038 0.0231 -0.0024 834 ARG 110 NE 0.0024 0.0186 -0.0016 835 ARG 110 CZ 0.0009 0.0155 -0.0047 836 ARG 110 NH1 0.0005 0.0162 -0.0089 837 ARG 110 NH2 -0.0003 0.0114 -0.0035 838 ARG 111 N 0.0007 0.0198 -0.0054 839 ARG 111 CA 0.0005 0.0207 -0.0096 840 ARG 111 C 0.0009 0.0246 -0.0074 841 ARG 111 O 0.0011 0.0284 -0.0104 842 ARG 111 CB -0.0001 0.0151 -0.0112 843 ARG 111 CG -0.0004 0.0153 -0.0162 844 ARG 111 CD -0.0006 0.0168 -0.0215 845 ARG 111 NE -0.0012 0.0119 -0.0246 846 ARG 111 CZ -0.0017 0.0090 -0.0280 847 ARG 111 NH1 -0.0016 0.0102 -0.0288 848 ARG 111 NH2 -0.0022 0.0046 -0.0306 849 LEU 112 N 0.0012 0.0238 -0.0022 850 LEU 112 CA 0.0017 0.0275 0.0002 851 LEU 112 C 0.0022 0.0334 0.0009 852 LEU 112 O 0.0025 0.0375 0.0002 853 LEU 112 CB 0.0018 0.0252 0.0058 854 LEU 112 CG 0.0013 0.0196 0.0055 855 LEU 112 CD1 0.0014 0.0169 0.0113 856 LEU 112 CD2 0.0012 0.0203 0.0031 857 TYR 113 N 0.0068 0.0213 0.0003 858 TYR 113 CA 0.0072 0.0209 0.0000 859 TYR 113 C 0.0079 0.0208 0.0001 860 TYR 113 O 0.0084 0.0208 0.0002 861 TYR 113 CB 0.0069 0.0205 -0.0005 862 TYR 113 CG 0.0065 0.0204 -0.0007 863 TYR 113 CD1 0.0066 0.0206 -0.0005 864 TYR 113 CD2 0.0059 0.0202 -0.0010 865 TYR 113 CE1 0.0062 0.0205 -0.0006 866 TYR 113 CE2 0.0054 0.0202 -0.0011 867 TYR 113 CZ 0.0056 0.0204 -0.0009 868 TYR 113 OH 0.0052 0.0203 -0.0010 869 LEU 114 N 0.0080 0.0208 -0.0000 870 LEU 114 CA 0.0087 0.0207 0.0000 871 LEU 114 C 0.0091 0.0211 0.0006 872 LEU 114 O 0.0097 0.0210 0.0006 873 LEU 114 CB 0.0086 0.0206 -0.0001 874 LEU 114 CG 0.0092 0.0202 -0.0004 875 LEU 114 CD1 0.0091 0.0197 -0.0009 876 LEU 114 CD2 0.0092 0.0203 -0.0003 877 LYS 115 N 0.0045 0.0208 0.0050 878 LYS 115 CA 0.0046 0.0195 0.0073 879 LYS 115 C 0.0050 0.0149 0.0059 880 LYS 115 O 0.0052 0.0123 0.0088 881 LYS 115 CB 0.0043 0.0229 0.0064 882 LYS 115 CG 0.0044 0.0214 0.0081 883 LYS 115 CD 0.0040 0.0248 0.0112 884 LYS 115 CE 0.0037 0.0292 0.0090 885 LYS 115 NZ 0.0038 0.0287 0.0045 886 TYR 116 N 0.0052 0.0137 0.0017 887 TYR 116 CA 0.0056 0.0095 0.0000 888 TYR 116 C 0.0059 0.0061 -0.0012 889 TYR 116 O 0.0063 0.0029 -0.0036 890 TYR 116 CB 0.0056 0.0103 -0.0040 891 TYR 116 CG 0.0053 0.0132 -0.0030 892 TYR 116 CD1 0.0054 0.0116 -0.0005 893 TYR 116 CD2 0.0050 0.0175 -0.0045 894 TYR 116 CE1 0.0052 0.0142 0.0004 895 TYR 116 CE2 0.0047 0.0202 -0.0036 896 TYR 116 CZ 0.0048 0.0185 -0.0012 897 TYR 116 OH 0.0046 0.0211 -0.0003 898 SER 117 N 0.0097 0.0133 0.0013 899 SER 117 CA 0.0091 0.0104 0.0014 900 SER 117 C 0.0095 0.0103 0.0049 901 SER 117 O 0.0102 0.0129 0.0068 902 SER 117 CB 0.0089 0.0107 -0.0018 903 SER 117 OG 0.0096 0.0142 -0.0021 904 GLY 118 N 0.0089 0.0072 0.0058 905 GLY 118 CA 0.0091 0.0067 0.0090 906 GLY 118 C 0.0091 0.0069 0.0085 907 GLY 118 O 0.0093 0.0067 0.0111 908 GLU 119 N 0.0099 0.0060 0.0081 909 GLU 119 CA 0.0102 0.0073 0.0067 910 GLU 119 C 0.0112 0.0129 0.0053 911 GLU 119 O 0.0118 0.0149 0.0029 912 GLU 119 CB 0.0102 0.0040 0.0022 913 GLU 119 CG 0.0093 -0.0007 0.0039 914 GLU 119 CD 0.0085 -0.0054 0.0044 915 GLU 119 OE1 0.0087 -0.0049 0.0035 916 GLU 119 OE2 0.0078 -0.0094 0.0057 917 VAL 120 N 0.0115 0.0154 0.0068 918 VAL 120 CA 0.0124 0.0208 0.0058 919 VAL 120 C 0.0131 0.0217 0.0001 920 VAL 120 O 0.0139 0.0254 -0.0020 921 VAL 120 CB 0.0124 0.0230 0.0089 922 VAL 120 CG1 0.0120 0.0243 0.0143 923 VAL 120 CG2 0.0118 0.0192 0.0089 924 ALA 121 N 0.0068 0.0074 -0.0105 925 ALA 121 CA 0.0067 0.0074 -0.0104 926 ALA 121 C 0.0072 0.0074 -0.0091 927 ALA 121 O 0.0078 0.0074 -0.0082 928 ALA 121 CB 0.0076 0.0075 -0.0116 929 PHE 122 N 0.0070 0.0073 -0.0088 930 PHE 122 CA 0.0074 0.0073 -0.0076 931 PHE 122 C 0.0089 0.0074 -0.0076 932 PHE 122 O 0.0093 0.0075 -0.0082 933 PHE 122 CB 0.0066 0.0072 -0.0073 934 PHE 122 CG 0.0068 0.0072 -0.0059 935 PHE 122 CD1 0.0070 0.0072 -0.0048 936 PHE 122 CD2 0.0069 0.0072 -0.0058 937 PHE 122 CE1 0.0073 0.0071 -0.0036 938 PHE 122 CE2 0.0071 0.0072 -0.0045 939 PHE 122 CZ 0.0073 0.0071 -0.0034 940 MET 123 N 0.0067 0.0019 -0.0074 941 MET 123 CA 0.0076 0.0003 -0.0077 942 MET 123 C 0.0078 -0.0008 -0.0068 943 MET 123 O 0.0076 -0.0014 -0.0054 944 MET 123 CB 0.0076 -0.0001 -0.0070 945 MET 123 CG 0.0072 0.0011 -0.0076 946 MET 123 SD 0.0076 0.0002 -0.0076 947 MET 123 CE 0.0073 0.0018 -0.0087 948 PRO 124 N 0.0082 -0.0010 -0.0076 949 PRO 124 CA 0.0084 -0.0020 -0.0068 950 PRO 124 C 0.0092 -0.0037 -0.0067 951 PRO 124 O 0.0093 -0.0046 -0.0058 952 PRO 124 CB 0.0086 -0.0015 -0.0078 953 PRO 124 CG 0.0087 -0.0005 -0.0093 954 PRO 124 CD 0.0086 -0.0004 -0.0093 955 GLU 125 N 0.0072 -0.0084 -0.0062 956 GLU 125 CA 0.0060 -0.0078 -0.0064 957 GLU 125 C 0.0043 -0.0077 -0.0073 958 GLU 125 O 0.0032 -0.0074 -0.0077 959 GLU 125 CB 0.0061 -0.0063 -0.0051 960 GLU 125 CG 0.0053 -0.0051 -0.0045 961 GLU 125 CD 0.0065 -0.0049 -0.0036 962 GLU 125 OE1 0.0080 -0.0055 -0.0032 963 GLU 125 OE2 0.0059 -0.0042 -0.0033 964 THR 126 N 0.0039 -0.0078 -0.0077 965 THR 126 CA 0.0023 -0.0077 -0.0085 966 THR 126 C 0.0021 -0.0092 -0.0100 967 THR 126 O 0.0008 -0.0092 -0.0108 968 THR 126 CB 0.0019 -0.0068 -0.0080 969 THR 126 CG2 0.0019 -0.0053 -0.0066 970 THR 126 OG1 0.0031 -0.0075 -0.0079 971 MET 127 N 0.0045 -0.0146 -0.0152 972 MET 127 CA 0.0039 -0.0145 -0.0138 973 MET 127 C 0.0045 -0.0182 -0.0161 974 MET 127 O 0.0059 -0.0196 -0.0196 975 MET 127 CB 0.0047 -0.0098 -0.0144 976 MET 127 CG 0.0069 -0.0087 -0.0189 977 MET 127 SD 0.0079 -0.0027 -0.0197 978 MET 127 CE 0.0074 -0.0013 -0.0181 979 THR 128 N 0.0034 -0.0198 -0.0139 980 THR 128 CA 0.0036 -0.0236 -0.0154 981 THR 128 C 0.0053 -0.0223 -0.0190 982 THR 128 O 0.0060 -0.0183 -0.0196 983 THR 128 CB 0.0018 -0.0254 -0.0119 984 THR 128 CG2 0.0000 -0.0254 -0.0079 985 THR 128 OG1 0.0018 -0.0225 -0.0112 986 PRO 129 N 0.0078 -0.0200 -0.0201 987 PRO 129 CA 0.0070 -0.0187 -0.0210 988 PRO 129 C 0.0056 -0.0166 -0.0190 989 PRO 129 O 0.0044 -0.0146 -0.0201 990 PRO 129 CB 0.0083 -0.0208 -0.0210 991 PRO 129 CG 0.0098 -0.0231 -0.0198 992 PRO 129 CD 0.0096 -0.0228 -0.0201 993 ALA 130 N 0.0057 -0.0168 -0.0161 994 ALA 130 CA 0.0044 -0.0147 -0.0141 995 ALA 130 C 0.0029 -0.0125 -0.0147 996 ALA 130 O 0.0016 -0.0103 -0.0147 997 ALA 130 CB 0.0049 -0.0156 -0.0109 998 GLN 131 N 0.0038 -0.0079 -0.0108 999 GLN 131 CA 0.0034 -0.0064 -0.0108 1000 GLN 131 C 0.0020 -0.0053 -0.0139 1001 GLN 131 O 0.0014 -0.0027 -0.0142 1002 GLN 131 CB 0.0042 -0.0085 -0.0099 1003 GLN 131 CG 0.0055 -0.0087 -0.0065 1004 GLN 131 CD 0.0064 -0.0116 -0.0057 1005 GLN 131 NE2 0.0075 -0.0132 -0.0037 1006 GLN 131 OE1 0.0061 -0.0123 -0.0070 1007 CYS 132 N 0.0016 -0.0073 -0.0163 1008 CYS 132 CA 0.0003 -0.0063 -0.0193 1009 CYS 132 C -0.0005 -0.0034 -0.0198 1010 CYS 132 O -0.0015 -0.0012 -0.0211 1011 CYS 132 CB 0.0000 -0.0090 -0.0216 1012 CYS 132 SG 0.0005 -0.0122 -0.0221 1013 LEU 133 N -0.0085 -0.0043 -0.0185 1014 LEU 133 CA -0.0086 -0.0010 -0.0201 1015 LEU 133 C -0.0080 0.0032 -0.0176 1016 LEU 133 O -0.0081 0.0068 -0.0196 1017 LEU 133 CB -0.0087 -0.0027 -0.0200 1018 LEU 133 CG -0.0087 0.0006 -0.0211 1019 LEU 133 CD1 -0.0093 0.0024 -0.0256 1020 LEU 133 CD2 -0.0087 -0.0014 -0.0208 1021 GLN 134 N -0.0073 0.0029 -0.0134 1022 GLN 134 CA -0.0066 0.0069 -0.0108 1023 GLN 134 C -0.0066 0.0094 -0.0118 1024 GLN 134 O -0.0065 0.0134 -0.0124 1025 GLN 134 CB -0.0059 0.0058 -0.0060 1026 GLN 134 CG -0.0057 0.0050 -0.0045 1027 GLN 134 CD -0.0055 0.0090 -0.0046 1028 GLN 134 NE2 -0.0056 0.0084 -0.0051 1029 GLN 134 OE1 -0.0052 0.0127 -0.0043 1030 PHE 135 N -0.0044 0.0107 -0.0129 1031 PHE 135 CA -0.0039 0.0103 -0.0120 1032 PHE 135 C -0.0034 0.0099 -0.0113 1033 PHE 135 O -0.0027 0.0092 -0.0110 1034 PHE 135 CB -0.0043 0.0109 -0.0113 1035 PHE 135 CG -0.0039 0.0107 -0.0102 1036 PHE 135 CD1 -0.0032 0.0099 -0.0101 1037 PHE 135 CD2 -0.0043 0.0113 -0.0093 1038 PHE 135 CE1 -0.0028 0.0097 -0.0091 1039 PHE 135 CE2 -0.0039 0.0110 -0.0082 1040 PHE 135 CZ -0.0031 0.0103 -0.0081 1041 MET 136 N -0.0038 0.0103 -0.0111 1042 MET 136 CA -0.0034 0.0100 -0.0105 1043 MET 136 C -0.0027 0.0092 -0.0110 1044 MET 136 O -0.0021 0.0087 -0.0105 1045 MET 136 CB -0.0039 0.0107 -0.0103 1046 MET 136 CG -0.0043 0.0113 -0.0092 1047 MET 136 SD -0.0038 0.0110 -0.0080 1048 MET 136 CE -0.0029 0.0101 -0.0078 1049 ILE 137 N -0.0114 0.0097 -0.0154 1050 ILE 137 CA -0.0108 0.0116 -0.0158 1051 ILE 137 C -0.0105 0.0155 -0.0138 1052 ILE 137 O -0.0094 0.0182 -0.0154 1053 ILE 137 CB -0.0118 0.0093 -0.0143 1054 ILE 137 CG1 -0.0118 0.0060 -0.0170 1055 ILE 137 CG2 -0.0115 0.0117 -0.0137 1056 ILE 137 CD1 -0.0129 0.0034 -0.0155 1057 ASP 138 N -0.0116 0.0158 -0.0105 1058 ASP 138 CA -0.0115 0.0193 -0.0083 1059 ASP 138 C -0.0102 0.0225 -0.0097 1060 ASP 138 O -0.0099 0.0257 -0.0085 1061 ASP 138 CB -0.0129 0.0188 -0.0044 1062 ASP 138 CG -0.0142 0.0163 -0.0024 1063 ASP 138 OD1 -0.0140 0.0147 -0.0041 1064 ASP 138 OD2 -0.0154 0.0161 0.0009 1065 ILE 139 N -0.0074 0.0170 -0.0052 1066 ILE 139 CA -0.0059 0.0183 -0.0048 1067 ILE 139 C -0.0037 0.0174 -0.0051 1068 ILE 139 O -0.0022 0.0185 -0.0047 1069 ILE 139 CB -0.0059 0.0203 -0.0041 1070 ILE 139 CG1 -0.0049 0.0202 -0.0042 1071 ILE 139 CG2 -0.0081 0.0211 -0.0039 1072 ILE 139 CD1 -0.0044 0.0222 -0.0035 1073 ASP 140 N -0.0036 0.0155 -0.0057 1074 ASP 140 CA -0.0016 0.0145 -0.0060 1075 ASP 140 C -0.0005 0.0146 -0.0060 1076 ASP 140 O -0.0015 0.0140 -0.0062 1077 ASP 140 CB -0.0019 0.0124 -0.0067 1078 ASP 140 CG 0.0001 0.0114 -0.0070 1079 ASP 140 OD1 0.0017 0.0125 -0.0067 1080 ASP 140 OD2 0.0001 0.0096 -0.0076 1081 PRO 141 N 0.0063 0.0166 0.0029 1082 PRO 141 CA 0.0136 0.0182 0.0028 1083 PRO 141 C 0.0165 0.0144 -0.0034 1084 PRO 141 O 0.0207 0.0153 -0.0034 1085 PRO 141 CB 0.0187 0.0203 0.0043 1086 PRO 141 CG 0.0135 0.0218 0.0080 1087 PRO 141 CD 0.0062 0.0183 0.0052 1088 ALA 142 N 0.0145 0.0102 -0.0086 1089 ALA 142 CA 0.0170 0.0064 -0.0147 1090 ALA 142 C 0.0125 0.0045 -0.0161 1091 ALA 142 O 0.0136 0.0010 -0.0213 1092 ALA 142 CB 0.0165 0.0027 -0.0199 1093 ARG 143 N 0.0092 0.0122 -0.0118 1094 ARG 143 CA -0.0007 0.0088 -0.0119 1095 ARG 143 C -0.0055 0.0148 -0.0102 1096 ARG 143 O -0.0136 0.0121 -0.0103 1097 ARG 143 CB -0.0076 0.0087 -0.0115 1098 ARG 143 CG -0.0073 -0.0008 -0.0137 1099 ARG 143 CD -0.0167 -0.0021 -0.0134 1100 ARG 143 NE -0.0160 -0.0101 -0.0154 1101 ARG 143 CZ -0.0097 -0.0103 -0.0158 1102 ARG 143 NH1 -0.0035 -0.0030 -0.0145 1103 ARG 143 NH2 -0.0098 -0.0181 -0.0176 1104 SER 144 N -0.0006 0.0226 -0.0087 1105 SER 144 CA -0.0044 0.0292 -0.0069 1106 SER 144 C -0.0152 0.0321 -0.0055 1107 SER 144 O -0.0215 0.0319 -0.0052 1108 SER 144 CB -0.0037 0.0246 -0.0080 1109 SER 144 OG -0.0070 0.0148 -0.0101 1110 GLY 5 N 0.0179 -0.0026 0.0271 1111 GLY 5 CA 0.0142 -0.0020 0.0231 1112 GLY 5 C 0.0078 -0.0018 0.0189 1113 GLY 5 O 0.0040 -0.0034 0.0213 1114 LEU 6 N 0.0068 0.0001 0.0126 1115 LEU 6 CA 0.0009 0.0005 0.0079 1116 LEU 6 C 0.0038 0.0030 0.0021 1117 LEU 6 O 0.0093 0.0049 -0.0004 1118 LEU 6 CB -0.0033 0.0005 0.0053 1119 LEU 6 CG -0.0110 -0.0003 0.0030 1120 LEU 6 CD1 -0.0147 -0.0029 0.0087 1121 LEU 6 CD2 -0.0148 -0.0003 0.0008 1122 TYR 7 N 0.0008 0.0026 0.0010 1123 TYR 7 CA 0.0035 0.0018 -0.0015 1124 TYR 7 C 0.0008 0.0021 -0.0029 1125 TYR 7 O -0.0024 0.0029 -0.0008 1126 TYR 7 CB 0.0076 0.0014 0.0011 1127 TYR 7 CG 0.0112 0.0008 0.0013 1128 TYR 7 CD1 0.0143 -0.0002 -0.0019 1129 TYR 7 CD2 0.0115 0.0012 0.0047 1130 TYR 7 CE1 0.0176 -0.0008 -0.0018 1131 TYR 7 CE2 0.0148 0.0006 0.0048 1132 TYR 7 CZ 0.0178 -0.0004 0.0016 1133 TYR 7 OH 0.0211 -0.0009 0.0018 1134 ARG 8 N 0.0021 0.0014 -0.0065 1135 ARG 8 CA 0.0001 0.0015 -0.0082 1136 ARG 8 C 0.0037 0.0008 -0.0091 1137 ARG 8 O 0.0068 -0.0001 -0.0114 1138 ARG 8 CB -0.0026 0.0015 -0.0124 1139 ARG 8 CG -0.0049 0.0016 -0.0142 1140 ARG 8 CD -0.0070 0.0014 -0.0187 1141 ARG 8 NE -0.0105 0.0021 -0.0185 1142 ARG 8 CZ -0.0113 0.0018 -0.0214 1143 ARG 8 NH1 -0.0087 0.0009 -0.0248 1144 ARG 8 NH2 -0.0146 0.0025 -0.0208 1145 MET 9 N 0.0007 0.0012 -0.0024 1146 MET 9 CA 0.0006 0.0007 -0.0017 1147 MET 9 C 0.0003 0.0014 -0.0011 1148 MET 9 O 0.0002 0.0020 -0.0008 1149 MET 9 CB 0.0006 0.0002 -0.0011 1150 MET 9 CG 0.0004 -0.0003 -0.0003 1151 MET 9 SD 0.0005 -0.0011 0.0002 1152 MET 9 CE 0.0005 -0.0019 0.0006 1153 THR 10 N 0.0003 0.0013 -0.0010 1154 THR 10 CA 0.0001 0.0019 -0.0005 1155 THR 10 C 0.0000 0.0013 0.0003 1156 THR 10 O 0.0002 0.0006 0.0001 1157 THR 10 CB 0.0001 0.0024 -0.0010 1158 THR 10 CG2 0.0004 0.0017 -0.0015 1159 THR 10 OG1 -0.0001 0.0028 -0.0005 1160 TYR 11 N -0.0007 -0.0015 0.0045 1161 TYR 11 CA -0.0019 -0.0017 0.0049 1162 TYR 11 C -0.0018 -0.0012 0.0056 1163 TYR 11 O -0.0009 -0.0008 0.0056 1164 TYR 11 CB -0.0025 -0.0025 0.0041 1165 TYR 11 CG -0.0023 -0.0028 0.0037 1166 TYR 11 CD1 -0.0030 -0.0028 0.0041 1167 TYR 11 CD2 -0.0014 -0.0029 0.0030 1168 TYR 11 CE1 -0.0029 -0.0030 0.0038 1169 TYR 11 CE2 -0.0012 -0.0031 0.0026 1170 TYR 11 CZ -0.0020 -0.0032 0.0030 1171 TYR 11 OH -0.0018 -0.0033 0.0027 1172 ILE 12 N -0.0028 -0.0012 0.0061 1173 ILE 12 CA -0.0029 -0.0008 0.0068 1174 ILE 12 C -0.0039 -0.0013 0.0067 1175 ILE 12 O -0.0046 -0.0019 0.0062 1176 ILE 12 CB -0.0031 -0.0001 0.0079 1177 ILE 12 CG1 -0.0042 -0.0003 0.0082 1178 ILE 12 CG2 -0.0021 0.0004 0.0080 1179 ILE 12 CD1 -0.0044 0.0004 0.0092 1180 SER 13 N -0.0006 -0.0047 0.0081 1181 SER 13 CA -0.0013 -0.0045 0.0062 1182 SER 13 C -0.0011 -0.0049 0.0057 1183 SER 13 O -0.0002 -0.0057 0.0065 1184 SER 13 CB -0.0010 -0.0054 0.0048 1185 SER 13 OG -0.0013 -0.0057 0.0030 1186 ARG 14 N -0.0020 -0.0045 0.0042 1187 ARG 14 CA -0.0019 -0.0048 0.0035 1188 ARG 14 C -0.0017 -0.0058 0.0016 1189 ARG 14 O -0.0022 -0.0056 0.0005 1190 ARG 14 CB -0.0031 -0.0034 0.0034 1191 ARG 14 CG -0.0033 -0.0025 0.0053 1192 ARG 14 CD -0.0045 -0.0011 0.0051 1193 ARG 14 NE -0.0047 -0.0003 0.0069 1194 ARG 14 CZ -0.0041 -0.0006 0.0079 1195 ARG 14 NH1 -0.0033 -0.0017 0.0073 1196 ARG 14 NH2 -0.0043 0.0002 0.0095 1197 ALA 15 N 0.0011 -0.0093 -0.0013 1198 ALA 15 CA 0.0031 -0.0056 -0.0001 1199 ALA 15 C 0.0068 -0.0062 0.0022 1200 ALA 15 O 0.0080 -0.0096 0.0030 1201 ALA 15 CB 0.0027 -0.0040 -0.0004 1202 VAL 16 N 0.0086 -0.0029 0.0033 1203 VAL 16 CA 0.0122 -0.0029 0.0055 1204 VAL 16 C 0.0138 -0.0030 0.0065 1205 VAL 16 O 0.0122 -0.0016 0.0055 1206 VAL 16 CB 0.0135 0.0008 0.0063 1207 VAL 16 CG1 0.0126 0.0003 0.0057 1208 VAL 16 CG2 0.0120 0.0045 0.0053 1209 PRO 17 N 0.0139 -0.0047 0.0205 1210 PRO 17 CA 0.0085 0.0063 0.0221 1211 PRO 17 C 0.0032 0.0145 0.0275 1212 PRO 17 O -0.0011 0.0247 0.0263 1213 PRO 17 CB 0.0074 0.0030 0.0304 1214 PRO 17 CG 0.0116 -0.0092 0.0349 1215 PRO 17 CD 0.0162 -0.0145 0.0274 1216 GLY 18 N 0.0032 0.0104 0.0332 1217 GLY 18 CA -0.0020 0.0176 0.0397 1218 GLY 18 C -0.0023 0.0228 0.0331 1219 GLY 18 O -0.0055 0.0262 0.0386 1220 LEU 19 N 0.0071 0.0143 -0.0012 1221 LEU 19 CA 0.0042 0.0164 -0.0022 1222 LEU 19 C 0.0002 0.0198 -0.0024 1223 LEU 19 O -0.0008 0.0200 -0.0044 1224 LEU 19 CB 0.0045 0.0148 -0.0069 1225 LEU 19 CG 0.0073 0.0127 -0.0059 1226 LEU 19 CD1 0.0066 0.0121 -0.0099 1227 LEU 19 CD2 0.0071 0.0143 -0.0010 1228 GLY 20 N -0.0021 0.0224 -0.0003 1229 GLY 20 CA -0.0061 0.0257 -0.0002 1230 GLY 20 C -0.0090 0.0277 -0.0018 1231 GLY 20 O -0.0081 0.0265 -0.0036 1232 TYR 21 N -0.0174 0.0152 -0.0165 1233 TYR 21 CA -0.0171 0.0107 -0.0098 1234 TYR 21 C -0.0168 0.0105 -0.0072 1235 TYR 21 O -0.0159 0.0102 -0.0006 1236 TYR 21 CB -0.0183 0.0030 -0.0112 1237 TYR 21 CG -0.0185 0.0024 -0.0118 1238 TYR 21 CD1 -0.0193 0.0033 -0.0185 1239 TYR 21 CD2 -0.0178 0.0010 -0.0057 1240 TYR 21 CE1 -0.0195 0.0028 -0.0192 1241 TYR 21 CE2 -0.0180 0.0005 -0.0063 1242 TYR 21 CZ -0.0188 0.0014 -0.0130 1243 TYR 21 OH -0.0190 0.0008 -0.0136 1244 ASN 22 N -0.0175 0.0105 -0.0122 1245 ASN 22 CA -0.0172 0.0102 -0.0101 1246 ASN 22 C -0.0157 0.0169 -0.0058 1247 ASN 22 O -0.0150 0.0163 -0.0002 1248 ASN 22 CB -0.0182 0.0094 -0.0168 1249 ASN 22 CG -0.0197 0.0022 -0.0205 1250 ASN 22 ND2 -0.0207 0.0020 -0.0275 1251 ASN 22 OD1 -0.0200 -0.0032 -0.0171 1252 ASP 23 N -0.0037 0.0153 -0.0096 1253 ASP 23 CA -0.0041 0.0176 -0.0083 1254 ASP 23 C -0.0042 0.0173 -0.0056 1255 ASP 23 O -0.0044 0.0183 -0.0041 1256 ASP 23 CB -0.0044 0.0196 -0.0094 1257 ASP 23 CG -0.0044 0.0204 -0.0119 1258 ASP 23 OD1 -0.0046 0.0218 -0.0121 1259 ASP 23 OD2 -0.0042 0.0197 -0.0137 1260 LEU 24 N -0.0040 0.0160 -0.0048 1261 LEU 24 CA -0.0041 0.0157 -0.0022 1262 LEU 24 C -0.0039 0.0143 -0.0010 1263 LEU 24 O -0.0041 0.0149 0.0011 1264 LEU 24 CB -0.0039 0.0144 -0.0019 1265 LEU 24 CG -0.0041 0.0160 -0.0023 1266 LEU 24 CD1 -0.0039 0.0146 -0.0018 1267 LEU 24 CD2 -0.0045 0.0182 -0.0007 1268 ARG 25 N -0.0039 0.0117 -0.0050 1269 ARG 25 CA -0.0019 0.0062 -0.0025 1270 ARG 25 C -0.0001 0.0027 -0.0006 1271 ARG 25 O 0.0040 0.0000 0.0022 1272 ARG 25 CB -0.0063 0.0025 -0.0037 1273 ARG 25 CG -0.0060 0.0039 -0.0039 1274 ARG 25 CD -0.0110 0.0010 -0.0056 1275 ARG 25 NE -0.0121 0.0043 -0.0070 1276 ARG 25 CZ -0.0167 0.0067 -0.0100 1277 ARG 25 NH1 -0.0207 0.0062 -0.0119 1278 ARG 25 NH2 -0.0171 0.0096 -0.0111 1279 ASP 26 N -0.0030 0.0025 -0.0020 1280 ASP 26 CA -0.0012 -0.0004 -0.0003 1281 ASP 26 C 0.0043 0.0026 0.0017 1282 ASP 26 O 0.0079 -0.0004 0.0043 1283 ASP 26 CB -0.0055 -0.0004 -0.0024 1284 ASP 26 CG -0.0044 -0.0043 -0.0008 1285 ASP 26 OD1 -0.0034 -0.0095 0.0011 1286 ASP 26 OD2 -0.0044 -0.0021 -0.0014 1287 ILE 27 N -0.0013 0.0043 -0.0033 1288 ILE 27 CA 0.0007 0.0076 -0.0003 1289 ILE 27 C 0.0047 0.0057 0.0031 1290 ILE 27 O 0.0068 0.0057 0.0053 1291 ILE 27 CB -0.0004 0.0127 -0.0000 1292 ILE 27 CG1 -0.0041 0.0150 -0.0031 1293 ILE 27 CG2 0.0022 0.0158 0.0035 1294 ILE 27 CD1 -0.0056 0.0195 -0.0033 1295 MET 28 N 0.0056 0.0040 0.0036 1296 MET 28 CA 0.0093 0.0019 0.0068 1297 MET 28 C 0.0107 -0.0022 0.0070 1298 MET 28 O 0.0135 -0.0022 0.0098 1299 MET 28 CB 0.0096 0.0001 0.0066 1300 MET 28 CG 0.0131 0.0003 0.0102 1301 MET 28 SD 0.0130 0.0059 0.0117 1302 MET 28 CE 0.0128 0.0039 0.0109 1303 GLY 29 N 0.0221 -0.0112 -0.0037 1304 GLY 29 CA 0.0253 -0.0165 -0.0107 1305 GLY 29 C 0.0190 -0.0146 -0.0137 1306 GLY 29 O 0.0224 -0.0164 -0.0138 1307 LYS 30 N 0.0097 -0.0107 -0.0159 1308 LYS 30 CA 0.0032 -0.0088 -0.0192 1309 LYS 30 C 0.0036 -0.0051 -0.0114 1310 LYS 30 O 0.0039 -0.0062 -0.0133 1311 LYS 30 CB -0.0067 -0.0051 -0.0226 1312 LYS 30 CG -0.0083 -0.0090 -0.0321 1313 LYS 30 CD -0.0182 -0.0050 -0.0349 1314 LYS 30 CE -0.0199 -0.0089 -0.0445 1315 LYS 30 NZ -0.0294 -0.0051 -0.0471 1316 SER 31 N 0.0027 -0.0054 0.0018 1317 SER 31 CA 0.0051 -0.0031 0.0042 1318 SER 31 C 0.0091 -0.0052 0.0056 1319 SER 31 O 0.0111 -0.0053 0.0068 1320 SER 31 CB 0.0045 0.0008 0.0058 1321 SER 31 OG 0.0048 0.0005 0.0058 1322 GLU 32 N 0.0105 -0.0070 0.0056 1323 GLU 32 CA 0.0143 -0.0090 0.0069 1324 GLU 32 C 0.0152 -0.0124 0.0058 1325 GLU 32 O 0.0180 -0.0128 0.0072 1326 GLU 32 CB 0.0153 -0.0104 0.0068 1327 GLU 32 CG 0.0175 -0.0080 0.0092 1328 GLU 32 CD 0.0172 -0.0084 0.0088 1329 GLU 32 OE1 0.0163 -0.0114 0.0069 1330 GLU 32 OE2 0.0179 -0.0058 0.0105 1331 VAL 33 N 0.0244 -0.0228 -0.0056 1332 VAL 33 CA 0.0242 -0.0244 -0.0125 1333 VAL 33 C 0.0166 -0.0168 -0.0102 1334 VAL 33 O 0.0180 -0.0174 -0.0077 1335 VAL 33 CB 0.0233 -0.0271 -0.0256 1336 VAL 33 CG1 0.0199 -0.0259 -0.0330 1337 VAL 33 CG2 0.0322 -0.0360 -0.0284 1338 ASN 34 N 0.0086 -0.0095 -0.0108 1339 ASN 34 CA 0.0010 -0.0021 -0.0095 1340 ASN 34 C 0.0021 0.0002 0.0026 1341 ASN 34 O -0.0001 0.0025 0.0038 1342 ASN 34 CB -0.0075 0.0052 -0.0120 1343 ASN 34 CG -0.0103 0.0043 -0.0249 1344 ASN 34 ND2 -0.0063 -0.0005 -0.0289 1345 ASN 34 OD1 -0.0159 0.0079 -0.0311 1346 ASN 35 N 0.0024 -0.0047 0.0052 1347 ASN 35 CA 0.0004 -0.0036 0.0153 1348 ASN 35 C 0.0024 -0.0089 0.0204 1349 ASN 35 O 0.0001 -0.0064 0.0276 1350 ASN 35 CB 0.0009 -0.0057 0.0193 1351 ASN 35 CG -0.0020 0.0008 0.0161 1352 ASN 35 ND2 -0.0047 0.0041 0.0227 1353 ASN 35 OD1 -0.0021 0.0032 0.0077 1354 SER 36 N 0.0067 -0.0161 0.0169 1355 SER 36 CA 0.0086 -0.0207 0.0208 1356 SER 36 C 0.0061 -0.0156 0.0192 1357 SER 36 O 0.0053 -0.0155 0.0253 1358 SER 36 CB 0.0137 -0.0292 0.0165 1359 SER 36 OG 0.0159 -0.0351 0.0225 1360 HIS 37 N 0.0138 -0.0180 0.0078 1361 HIS 37 CA 0.0081 -0.0102 0.0016 1362 HIS 37 C -0.0023 0.0004 0.0115 1363 HIS 37 O -0.0057 0.0040 0.0142 1364 HIS 37 CB 0.0068 -0.0056 -0.0154 1365 HIS 37 CG 0.0016 0.0019 -0.0230 1366 HIS 37 CD2 -0.0084 0.0136 -0.0221 1367 HIS 37 ND1 0.0069 -0.0026 -0.0330 1368 HIS 37 CE1 0.0004 0.0060 -0.0380 1369 HIS 37 NE2 -0.0089 0.0159 -0.0315 1370 VAL 38 N -0.0074 0.0055 0.0169 1371 VAL 38 CA -0.0179 0.0166 0.0248 1372 VAL 38 C -0.0185 0.0142 0.0423 1373 VAL 38 O -0.0252 0.0210 0.0489 1374 VAL 38 CB -0.0238 0.0242 0.0214 1375 VAL 38 CG1 -0.0323 0.0319 0.0346 1376 VAL 38 CG2 -0.0282 0.0321 0.0061 1377 GLY 39 N -0.0134 0.0040 0.0335 1378 GLY 39 CA -0.0157 0.0022 0.0348 1379 GLY 39 C -0.0143 0.0013 0.0314 1380 GLY 39 O -0.0143 0.0023 0.0327 1381 LEU 40 N -0.0130 -0.0006 0.0270 1382 LEU 40 CA -0.0116 -0.0017 0.0234 1383 LEU 40 C -0.0140 -0.0064 0.0211 1384 LEU 40 O -0.0157 -0.0085 0.0211 1385 LEU 40 CB -0.0076 0.0003 0.0200 1386 LEU 40 CG -0.0044 0.0046 0.0206 1387 LEU 40 CD1 -0.0008 0.0060 0.0168 1388 LEU 40 CD2 -0.0044 0.0046 0.0205 1389 THR 41 N -0.0103 -0.0022 0.0056 1390 THR 41 CA -0.0113 -0.0033 0.0044 1391 THR 41 C -0.0090 -0.0062 0.0035 1392 THR 41 O -0.0068 -0.0074 0.0037 1393 THR 41 CB -0.0148 -0.0037 0.0025 1394 THR 41 CG2 -0.0171 -0.0007 0.0035 1395 THR 41 OG1 -0.0151 -0.0057 0.0010 1396 GLY 42 N -0.0094 -0.0074 0.0025 1397 GLY 42 CA -0.0075 -0.0103 0.0015 1398 GLY 42 C -0.0069 -0.0105 0.0016 1399 GLY 42 O -0.0086 -0.0088 0.0019 1400 LEU 43 N 0.0005 -0.0111 0.0001 1401 LEU 43 CA 0.0004 -0.0105 0.0008 1402 LEU 43 C 0.0004 -0.0111 0.0016 1403 LEU 43 O 0.0005 -0.0120 0.0016 1404 LEU 43 CB 0.0004 -0.0099 0.0002 1405 LEU 43 CG 0.0002 -0.0091 0.0007 1406 LEU 43 CD1 0.0001 -0.0082 0.0009 1407 LEU 43 CD2 0.0002 -0.0088 -0.0000 1408 LEU 44 N 0.0003 -0.0105 0.0024 1409 LEU 44 CA 0.0003 -0.0110 0.0033 1410 LEU 44 C 0.0002 -0.0104 0.0037 1411 LEU 44 O 0.0001 -0.0095 0.0037 1412 LEU 44 CB 0.0003 -0.0111 0.0041 1413 LEU 44 CG 0.0002 -0.0113 0.0051 1414 LEU 44 CD1 0.0003 -0.0124 0.0052 1415 LEU 44 CD2 0.0002 -0.0112 0.0059 1416 CYS 45 N 0.0007 -0.0107 0.0063 1417 CYS 45 CA -0.0000 -0.0097 0.0061 1418 CYS 45 C -0.0012 -0.0095 0.0059 1419 CYS 45 O -0.0012 -0.0094 0.0059 1420 CYS 45 CB 0.0008 -0.0085 0.0060 1421 CYS 45 SG -0.0001 -0.0071 0.0057 1422 PHE 46 N -0.0023 -0.0096 0.0059 1423 PHE 46 CA -0.0035 -0.0094 0.0057 1424 PHE 46 C -0.0041 -0.0082 0.0055 1425 PHE 46 O -0.0040 -0.0079 0.0055 1426 PHE 46 CB -0.0044 -0.0105 0.0058 1427 PHE 46 CG -0.0057 -0.0104 0.0057 1428 PHE 46 CD1 -0.0059 -0.0100 0.0056 1429 PHE 46 CD2 -0.0067 -0.0107 0.0056 1430 PHE 46 CE1 -0.0072 -0.0098 0.0055 1431 PHE 46 CE2 -0.0079 -0.0105 0.0055 1432 PHE 46 CZ -0.0081 -0.0101 0.0054 1433 GLY 47 N -0.0023 -0.0141 0.0067 1434 GLY 47 CA -0.0027 -0.0137 0.0062 1435 GLY 47 C -0.0032 -0.0122 0.0055 1436 GLY 47 O -0.0030 -0.0112 0.0059 1437 ASN 48 N -0.0039 -0.0121 0.0045 1438 ASN 48 CA -0.0045 -0.0108 0.0037 1439 ASN 48 C -0.0048 -0.0104 0.0034 1440 ASN 48 O -0.0048 -0.0091 0.0034 1441 ASN 48 CB -0.0041 -0.0095 0.0043 1442 ASN 48 CG -0.0048 -0.0082 0.0035 1443 ASN 48 ND2 -0.0044 -0.0069 0.0040 1444 ASN 48 OD1 -0.0055 -0.0084 0.0024 1445 SER 49 N -0.0015 -0.0114 0.0024 1446 SER 49 CA -0.0018 -0.0102 0.0016 1447 SER 49 C -0.0025 -0.0091 0.0028 1448 SER 49 O -0.0029 -0.0077 0.0024 1449 SER 49 CB -0.0019 -0.0095 0.0003 1450 SER 49 OG -0.0024 -0.0083 0.0008 1451 ILE 50 N -0.0025 -0.0096 0.0042 1452 ILE 50 CA -0.0031 -0.0086 0.0054 1453 ILE 50 C -0.0029 -0.0093 0.0061 1454 ILE 50 O -0.0025 -0.0106 0.0066 1455 ILE 50 CB -0.0034 -0.0084 0.0066 1456 ILE 50 CG1 -0.0034 -0.0079 0.0059 1457 ILE 50 CG2 -0.0040 -0.0073 0.0077 1458 ILE 50 CD1 -0.0040 -0.0062 0.0057 1459 PHE 51 N -0.0040 -0.0058 0.0039 1460 PHE 51 CA -0.0032 -0.0063 0.0038 1461 PHE 51 C -0.0027 -0.0060 0.0040 1462 PHE 51 O -0.0031 -0.0059 0.0040 1463 PHE 51 CB -0.0034 -0.0071 0.0034 1464 PHE 51 CG -0.0038 -0.0074 0.0031 1465 PHE 51 CD1 -0.0046 -0.0074 0.0030 1466 PHE 51 CD2 -0.0034 -0.0078 0.0030 1467 PHE 51 CE1 -0.0050 -0.0077 0.0028 1468 PHE 51 CE2 -0.0038 -0.0082 0.0028 1469 PHE 51 CZ -0.0046 -0.0081 0.0027 1470 LEU 52 N -0.0020 -0.0060 0.0042 1471 LEU 52 CA -0.0014 -0.0058 0.0043 1472 LEU 52 C -0.0007 -0.0064 0.0041 1473 LEU 52 O -0.0003 -0.0065 0.0041 1474 LEU 52 CB -0.0010 -0.0051 0.0047 1475 LEU 52 CG -0.0003 -0.0049 0.0049 1476 LEU 52 CD1 -0.0004 -0.0050 0.0049 1477 LEU 52 CD2 0.0000 -0.0042 0.0054 1478 GLN 53 N -0.0012 -0.0071 0.0026 1479 GLN 53 CA -0.0014 -0.0068 0.0025 1480 GLN 53 C -0.0008 -0.0075 0.0009 1481 GLN 53 O -0.0000 -0.0088 0.0007 1482 GLN 53 CB -0.0013 -0.0072 0.0040 1483 GLN 53 CG -0.0014 -0.0070 0.0039 1484 GLN 53 CD -0.0017 -0.0068 0.0056 1485 GLN 53 NE2 -0.0021 -0.0060 0.0056 1486 GLN 53 OE1 -0.0015 -0.0074 0.0069 1487 ILE 54 N -0.0012 -0.0066 -0.0001 1488 ILE 54 CA -0.0007 -0.0071 -0.0015 1489 ILE 54 C -0.0009 -0.0069 -0.0012 1490 ILE 54 O -0.0016 -0.0057 -0.0008 1491 ILE 54 CB -0.0010 -0.0062 -0.0032 1492 ILE 54 CG1 -0.0008 -0.0065 -0.0036 1493 ILE 54 CG2 -0.0006 -0.0067 -0.0046 1494 ILE 54 CD1 -0.0007 -0.0063 -0.0054 1495 LEU 55 N -0.0058 -0.0042 -0.0024 1496 LEU 55 CA -0.0063 -0.0035 0.0012 1497 LEU 55 C -0.0060 -0.0037 0.0001 1498 LEU 55 O -0.0036 -0.0048 -0.0022 1499 LEU 55 CB -0.0033 -0.0038 0.0045 1500 LEU 55 CG -0.0041 -0.0032 0.0071 1501 LEU 55 CD1 -0.0002 -0.0040 0.0085 1502 LEU 55 CD2 -0.0063 -0.0020 0.0107 1503 GLU 56 N -0.0084 -0.0028 0.0019 1504 GLU 56 CA -0.0084 -0.0029 0.0012 1505 GLU 56 C -0.0087 -0.0022 0.0052 1506 GLU 56 O -0.0112 -0.0012 0.0075 1507 GLU 56 CB -0.0117 -0.0025 -0.0016 1508 GLU 56 CG -0.0106 -0.0034 -0.0059 1509 GLU 56 CD -0.0141 -0.0029 -0.0088 1510 GLU 56 OE1 -0.0174 -0.0018 -0.0073 1511 GLU 56 OE2 -0.0136 -0.0036 -0.0124 1512 GLY 57 N -0.0100 0.0004 0.0088 1513 GLY 57 CA -0.0097 -0.0001 0.0130 1514 GLY 57 C -0.0055 0.0005 0.0143 1515 GLY 57 O -0.0030 0.0013 0.0120 1516 SER 58 N -0.0048 0.0002 0.0181 1517 SER 58 CA -0.0009 0.0007 0.0198 1518 SER 58 C 0.0018 0.0015 0.0183 1519 SER 58 O 0.0005 0.0014 0.0170 1520 SER 58 CB -0.0009 0.0002 0.0243 1521 SER 58 OG -0.0021 -0.0002 0.0256 1522 ARG 59 N 0.0009 0.0047 0.0095 1523 ARG 59 CA 0.0020 0.0031 0.0104 1524 ARG 59 C 0.0016 0.0023 0.0138 1525 ARG 59 O 0.0012 0.0023 0.0151 1526 ARG 59 CB 0.0043 0.0009 0.0090 1527 ARG 59 CG 0.0055 -0.0004 0.0087 1528 ARG 59 CD 0.0078 -0.0024 0.0072 1529 ARG 59 NE 0.0088 -0.0041 0.0089 1530 ARG 59 CZ 0.0107 -0.0060 0.0079 1531 ARG 59 NH1 0.0119 -0.0064 0.0053 1532 ARG 59 NH2 0.0114 -0.0074 0.0096 1533 GLN 60 N 0.0017 0.0016 0.0152 1534 GLN 60 CA 0.0014 0.0008 0.0185 1535 GLN 60 C -0.0008 0.0027 0.0201 1536 GLN 60 O -0.0011 0.0023 0.0222 1537 GLN 60 CB 0.0018 -0.0001 0.0195 1538 GLN 60 CG 0.0012 -0.0007 0.0229 1539 GLN 60 CD 0.0025 -0.0027 0.0244 1540 GLN 60 NE2 0.0019 -0.0031 0.0274 1541 GLN 60 OE1 0.0040 -0.0039 0.0230 1542 ALA 61 N -0.0024 0.0036 0.0239 1543 ALA 61 CA -0.0052 0.0034 0.0235 1544 ALA 61 C -0.0050 0.0033 0.0202 1545 ALA 61 O -0.0055 0.0033 0.0201 1546 ALA 61 CB -0.0086 0.0031 0.0237 1547 ILE 62 N -0.0041 0.0033 0.0174 1548 ILE 62 CA -0.0037 0.0033 0.0142 1549 ILE 62 C -0.0009 0.0035 0.0143 1550 ILE 62 O -0.0013 0.0035 0.0131 1551 ILE 62 CB -0.0031 0.0033 0.0114 1552 ILE 62 CG1 -0.0064 0.0030 0.0104 1553 ILE 62 CG2 -0.0015 0.0034 0.0083 1554 ILE 62 CD1 -0.0060 0.0030 0.0072 1555 SER 63 N -0.0063 0.0032 0.0121 1556 SER 63 CA -0.0030 0.0038 0.0120 1557 SER 63 C -0.0032 0.0042 0.0138 1558 SER 63 O -0.0017 0.0042 0.0126 1559 SER 63 CB -0.0004 0.0047 0.0136 1560 SER 63 OG -0.0001 0.0043 0.0118 1561 HIS 64 N -0.0050 0.0046 0.0167 1562 HIS 64 CA -0.0053 0.0050 0.0185 1563 HIS 64 C -0.0072 0.0042 0.0166 1564 HIS 64 O -0.0063 0.0043 0.0165 1565 HIS 64 CB -0.0070 0.0056 0.0220 1566 HIS 64 CG -0.0064 0.0064 0.0244 1567 HIS 64 CD2 -0.0035 0.0071 0.0253 1568 HIS 64 ND1 -0.0091 0.0063 0.0261 1569 HIS 64 CE1 -0.0078 0.0070 0.0280 1570 HIS 64 NE2 -0.0045 0.0076 0.0276 1571 THR 65 N -0.0103 0.0057 0.0124 1572 THR 65 CA -0.0104 0.0038 0.0106 1573 THR 65 C -0.0084 0.0030 0.0083 1574 THR 65 O -0.0072 0.0024 0.0069 1575 THR 65 CB -0.0131 0.0017 0.0108 1576 THR 65 CG2 -0.0131 -0.0004 0.0088 1577 THR 65 OG1 -0.0149 0.0024 0.0128 1578 TYR 66 N -0.0079 0.0029 0.0078 1579 TYR 66 CA -0.0058 0.0023 0.0057 1580 TYR 66 C -0.0032 0.0041 0.0054 1581 TYR 66 O -0.0016 0.0035 0.0036 1582 TYR 66 CB -0.0058 0.0020 0.0054 1583 TYR 66 CG -0.0039 0.0011 0.0032 1584 TYR 66 CD1 -0.0043 -0.0012 0.0013 1585 TYR 66 CD2 -0.0018 0.0025 0.0028 1586 TYR 66 CE1 -0.0026 -0.0021 -0.0008 1587 TYR 66 CE2 -0.0000 0.0017 0.0007 1588 TYR 66 CZ -0.0004 -0.0006 -0.0011 1589 TYR 66 OH 0.0013 -0.0014 -0.0032 1590 HIS 67 N -0.0043 0.0074 0.0007 1591 HIS 67 CA -0.0027 0.0086 0.0007 1592 HIS 67 C -0.0033 0.0080 0.0004 1593 HIS 67 O -0.0021 0.0084 -0.0007 1594 HIS 67 CB -0.0020 0.0100 0.0029 1595 HIS 67 CG -0.0006 0.0111 0.0033 1596 HIS 67 CD2 0.0009 0.0117 0.0020 1597 HIS 67 ND1 -0.0008 0.0119 0.0054 1598 HIS 67 CE1 0.0006 0.0128 0.0053 1599 HIS 67 NE2 0.0017 0.0127 0.0032 1600 ARG 68 N -0.0051 0.0072 0.0015 1601 ARG 68 CA -0.0058 0.0066 0.0012 1602 ARG 68 C -0.0060 0.0054 -0.0012 1603 ARG 68 O -0.0057 0.0053 -0.0021 1604 ARG 68 CB -0.0077 0.0059 0.0028 1605 ARG 68 CG -0.0085 0.0054 0.0028 1606 ARG 68 CD -0.0104 0.0047 0.0043 1607 ARG 68 NE -0.0110 0.0049 0.0059 1608 ARG 68 CZ -0.0128 0.0040 0.0067 1609 ARG 68 NH1 -0.0143 0.0027 0.0062 1610 ARG 68 NH2 -0.0132 0.0043 0.0081 1611 ILE 69 N -0.0040 0.0045 -0.0034 1612 ILE 69 CA -0.0031 0.0020 -0.0048 1613 ILE 69 C -0.0006 0.0019 -0.0059 1614 ILE 69 O 0.0012 0.0010 -0.0071 1615 ILE 69 CB -0.0051 -0.0003 -0.0048 1616 ILE 69 CG1 -0.0071 -0.0009 -0.0042 1617 ILE 69 CG2 -0.0039 -0.0026 -0.0063 1618 ILE 69 CD1 -0.0091 -0.0031 -0.0042 1619 LEU 70 N -0.0003 0.0028 -0.0057 1620 LEU 70 CA 0.0020 0.0026 -0.0068 1621 LEU 70 C 0.0045 0.0040 -0.0073 1622 LEU 70 O 0.0066 0.0033 -0.0085 1623 LEU 70 CB 0.0018 0.0036 -0.0063 1624 LEU 70 CG 0.0009 0.0015 -0.0068 1625 LEU 70 CD1 0.0006 0.0027 -0.0062 1626 LEU 70 CD2 0.0028 -0.0004 -0.0083 1627 GLN 71 N 0.0054 0.0083 -0.0115 1628 GLN 71 CA 0.0084 0.0100 -0.0093 1629 GLN 71 C 0.0089 0.0100 -0.0092 1630 GLN 71 O 0.0118 0.0107 -0.0078 1631 GLN 71 CB 0.0075 0.0133 -0.0067 1632 GLN 71 CG 0.0063 0.0137 -0.0067 1633 GLN 71 CD 0.0094 0.0123 -0.0071 1634 GLN 71 NE2 0.0112 0.0141 -0.0050 1635 GLN 71 OE1 0.0102 0.0095 -0.0093 1636 ASP 72 N 0.0061 0.0090 -0.0107 1637 ASP 72 CA 0.0060 0.0093 -0.0105 1638 ASP 72 C 0.0091 0.0069 -0.0117 1639 ASP 72 O 0.0091 0.0042 -0.0141 1640 ASP 72 CB 0.0020 0.0089 -0.0119 1641 ASP 72 CG 0.0010 0.0108 -0.0105 1642 ASP 72 OD1 0.0033 0.0105 -0.0102 1643 ASP 72 OD2 -0.0022 0.0126 -0.0098 1644 PRO 73 N 0.0092 0.0137 -0.0055 1645 PRO 73 CA 0.0143 0.0093 -0.0030 1646 PRO 73 C 0.0139 0.0075 -0.0036 1647 PRO 73 O 0.0177 0.0034 -0.0019 1648 PRO 73 CB 0.0192 0.0142 0.0009 1649 PRO 73 CG 0.0160 0.0166 -0.0008 1650 PRO 73 CD 0.0118 0.0194 -0.0029 1651 ARG 74 N 0.0097 0.0107 -0.0056 1652 ARG 74 CA 0.0091 0.0093 -0.0063 1653 ARG 74 C 0.0072 0.0022 -0.0086 1654 ARG 74 O 0.0080 -0.0003 -0.0085 1655 ARG 74 CB 0.0047 0.0149 -0.0081 1656 ARG 74 CG 0.0030 0.0138 -0.0093 1657 ARG 74 CD 0.0014 0.0204 -0.0092 1658 ARG 74 NE -0.0021 0.0258 -0.0105 1659 ARG 74 CZ 0.0001 0.0306 -0.0083 1660 ARG 74 NH1 0.0059 0.0309 -0.0046 1661 ARG 74 NH2 -0.0035 0.0352 -0.0098 1662 HIS 75 N 0.0064 0.0016 -0.0041 1663 HIS 75 CA 0.0051 -0.0004 -0.0025 1664 HIS 75 C 0.0028 -0.0015 -0.0025 1665 HIS 75 O 0.0021 -0.0007 -0.0038 1666 HIS 75 CB 0.0042 -0.0004 -0.0030 1667 HIS 75 CG 0.0021 0.0004 -0.0052 1668 HIS 75 CD2 0.0020 0.0019 -0.0070 1669 HIS 75 ND1 -0.0003 -0.0003 -0.0058 1670 HIS 75 CE1 -0.0017 0.0007 -0.0078 1671 HIS 75 NE2 -0.0003 0.0021 -0.0086 1672 HIS 76 N 0.0016 -0.0035 -0.0008 1673 HIS 76 CA -0.0005 -0.0048 -0.0006 1674 HIS 76 C -0.0022 -0.0066 0.0005 1675 HIS 76 O -0.0015 -0.0070 0.0014 1676 HIS 76 CB 0.0007 -0.0054 0.0008 1677 HIS 76 CG 0.0021 -0.0067 0.0032 1678 HIS 76 CD2 0.0018 -0.0085 0.0052 1679 HIS 76 ND1 0.0040 -0.0063 0.0039 1680 HIS 76 CE1 0.0049 -0.0077 0.0061 1681 HIS 76 NE2 0.0036 -0.0091 0.0069 1682 SER 77 N 0.0004 -0.0021 0.0035 1683 SER 77 CA -0.0009 -0.0018 0.0062 1684 SER 77 C 0.0005 -0.0021 0.0070 1685 SER 77 O 0.0013 -0.0022 0.0096 1686 SER 77 CB -0.0008 -0.0018 0.0088 1687 SER 77 OG -0.0023 -0.0015 0.0082 1688 ALA 78 N 0.0008 -0.0022 0.0048 1689 ALA 78 CA 0.0020 -0.0024 0.0054 1690 ALA 78 C -0.0001 -0.0020 0.0074 1691 ALA 78 O -0.0028 -0.0015 0.0072 1692 ALA 78 CB 0.0026 -0.0025 0.0024 1693 GLU 79 N -0.0035 0.0031 0.0113 1694 GLU 79 CA -0.0037 0.0032 0.0116 1695 GLU 79 C -0.0012 0.0035 0.0096 1696 GLU 79 O 0.0011 0.0048 0.0093 1697 GLU 79 CB -0.0039 0.0052 0.0145 1698 GLU 79 CG -0.0059 0.0047 0.0156 1699 GLU 79 CD -0.0061 0.0067 0.0185 1700 GLU 79 OE1 -0.0070 0.0074 0.0202 1701 GLU 79 OE2 -0.0053 0.0076 0.0190 1702 ILE 80 N -0.0016 0.0022 0.0083 1703 ILE 80 CA 0.0007 0.0024 0.0064 1704 ILE 80 C 0.0015 0.0040 0.0078 1705 ILE 80 O -0.0002 0.0038 0.0091 1706 ILE 80 CB -0.0002 0.0001 0.0041 1707 ILE 80 CG1 -0.0014 -0.0017 0.0029 1708 ILE 80 CG2 0.0023 0.0002 0.0020 1709 ILE 80 CD1 -0.0031 -0.0040 0.0013 1710 ILE 81 N 0.0007 0.0073 0.0045 1711 ILE 81 CA 0.0016 0.0088 0.0042 1712 ILE 81 C 0.0028 0.0079 0.0017 1713 ILE 81 O 0.0028 0.0073 0.0014 1714 ILE 81 CB 0.0024 0.0117 0.0048 1715 ILE 81 CG1 0.0012 0.0128 0.0074 1716 ILE 81 CG2 0.0039 0.0131 0.0035 1717 ILE 81 CD1 0.0018 0.0155 0.0081 1718 ALA 82 N 0.0039 0.0077 -0.0001 1719 ALA 82 CA 0.0051 0.0068 -0.0025 1720 ALA 82 C 0.0058 0.0058 -0.0041 1721 ALA 82 O 0.0057 0.0063 -0.0037 1722 ALA 82 CB 0.0066 0.0090 -0.0033 1723 PHE 83 N 0.0063 0.0061 -0.0092 1724 PHE 83 CA 0.0069 0.0044 -0.0079 1725 PHE 83 C 0.0097 0.0040 -0.0111 1726 PHE 83 O 0.0125 0.0017 -0.0119 1727 PHE 83 CB 0.0075 0.0011 -0.0046 1728 PHE 83 CG 0.0081 -0.0007 -0.0030 1729 PHE 83 CD1 0.0110 -0.0026 -0.0046 1730 PHE 83 CD2 0.0057 -0.0006 0.0001 1731 PHE 83 CE1 0.0115 -0.0043 -0.0031 1732 PHE 83 CE2 0.0061 -0.0023 0.0015 1733 PHE 83 CZ 0.0090 -0.0041 -0.0000 1734 ASP 84 N 0.0091 0.0060 -0.0128 1735 ASP 84 CA 0.0117 0.0059 -0.0161 1736 ASP 84 C 0.0114 0.0062 -0.0161 1737 ASP 84 O 0.0087 0.0078 -0.0145 1738 ASP 84 CB 0.0117 0.0086 -0.0195 1739 ASP 84 CG 0.0087 0.0121 -0.0198 1740 ASP 84 OD1 0.0062 0.0130 -0.0176 1741 ASP 84 OD2 0.0088 0.0139 -0.0221 1742 PRO 85 N 0.0231 0.0063 -0.0160 1743 PRO 85 CA 0.0185 0.0062 -0.0118 1744 PRO 85 C 0.0128 0.0061 -0.0165 1745 PRO 85 O 0.0138 0.0060 -0.0229 1746 PRO 85 CB 0.0237 0.0064 -0.0089 1747 PRO 85 CG 0.0307 0.0065 -0.0125 1748 PRO 85 CD 0.0300 0.0065 -0.0178 1749 VAL 86 N 0.0068 0.0059 -0.0131 1750 VAL 86 CA 0.0006 0.0058 -0.0169 1751 VAL 86 C -0.0024 0.0057 -0.0129 1752 VAL 86 O -0.0013 0.0058 -0.0065 1753 VAL 86 CB -0.0051 0.0056 -0.0180 1754 VAL 86 CG1 -0.0034 0.0056 -0.0244 1755 VAL 86 CG2 -0.0058 0.0057 -0.0113 1756 LEU 87 N -0.0435 0.0121 0.0029 1757 LEU 87 CA -0.0271 0.0051 0.0007 1758 LEU 87 C -0.0167 -0.0058 -0.0093 1759 LEU 87 O -0.0107 -0.0156 -0.0199 1760 LEU 87 CB -0.0150 0.0127 0.0162 1761 LEU 87 CG 0.0029 0.0069 0.0163 1762 LEU 87 CD1 0.0007 -0.0011 0.0046 1763 LEU 87 CD2 0.0104 0.0163 0.0321 1764 GLN 88 N -0.0143 -0.0043 -0.0063 1765 GLN 88 CA -0.0042 -0.0142 -0.0151 1766 GLN 88 C -0.0120 -0.0124 -0.0161 1767 GLN 88 O -0.0206 -0.0025 -0.0065 1768 GLN 88 CB 0.0161 -0.0155 -0.0080 1769 GLN 88 CG 0.0199 -0.0039 0.0092 1770 GLN 88 CD 0.0401 -0.0056 0.0157 1771 GLN 88 NE2 0.0492 -0.0121 0.0110 1772 GLN 88 OE1 0.0474 -0.0012 0.0249 1773 ARG 89 N -0.0148 -0.0044 -0.0097 1774 ARG 89 CA -0.0158 -0.0043 -0.0099 1775 ARG 89 C -0.0186 -0.0041 -0.0131 1776 ARG 89 O -0.0204 -0.0040 -0.0146 1777 ARG 89 CB -0.0174 -0.0038 -0.0062 1778 ARG 89 CG -0.0152 -0.0039 -0.0028 1779 ARG 89 CD -0.0161 -0.0036 0.0005 1780 ARG 89 NE -0.0149 -0.0035 0.0041 1781 ARG 89 CZ -0.0139 -0.0034 0.0071 1782 ARG 89 NH1 -0.0140 -0.0034 0.0070 1783 ARG 89 NH2 -0.0129 -0.0033 0.0102 1784 GLU 90 N -0.0189 -0.0042 -0.0142 1785 GLU 90 CA -0.0217 -0.0040 -0.0169 1786 GLU 90 C -0.0242 -0.0036 -0.0154 1787 GLU 90 O -0.0271 -0.0034 -0.0172 1788 GLU 90 CB -0.0199 -0.0045 -0.0205 1789 GLU 90 CG -0.0178 -0.0049 -0.0225 1790 GLU 90 CD -0.0194 -0.0049 -0.0263 1791 GLU 90 OE1 -0.0229 -0.0045 -0.0267 1792 GLU 90 OE2 -0.0173 -0.0053 -0.0290 1793 PHE 91 N -0.0169 -0.0052 -0.0117 1794 PHE 91 CA -0.0154 -0.0040 -0.0110 1795 PHE 91 C -0.0165 -0.0008 -0.0094 1796 PHE 91 O -0.0144 0.0011 -0.0083 1797 PHE 91 CB -0.0116 -0.0044 -0.0110 1798 PHE 91 CG -0.0103 -0.0074 -0.0125 1799 PHE 91 CD1 -0.0100 -0.0097 -0.0137 1800 PHE 91 CD2 -0.0093 -0.0080 -0.0128 1801 PHE 91 CE1 -0.0088 -0.0125 -0.0150 1802 PHE 91 CE2 -0.0082 -0.0109 -0.0141 1803 PHE 91 CZ -0.0079 -0.0131 -0.0153 1804 VAL 92 N -0.0198 -0.0001 -0.0092 1805 VAL 92 CA -0.0210 0.0030 -0.0077 1806 VAL 92 C -0.0206 0.0046 -0.0069 1807 VAL 92 O -0.0199 0.0072 -0.0055 1808 VAL 92 CB -0.0247 0.0032 -0.0078 1809 VAL 92 CG1 -0.0267 0.0008 -0.0091 1810 VAL 92 CG2 -0.0263 0.0063 -0.0063 1811 GLN 93 N -0.0106 -0.0011 -0.0176 1812 GLN 93 CA -0.0094 0.0034 -0.0159 1813 GLN 93 C -0.0061 0.0043 -0.0122 1814 GLN 93 O -0.0056 0.0083 -0.0112 1815 GLN 93 CB -0.0093 0.0037 -0.0158 1816 GLN 93 CG -0.0118 0.0009 -0.0188 1817 GLN 93 CD -0.0105 -0.0039 -0.0177 1818 GLN 93 NE2 -0.0126 -0.0067 -0.0203 1819 GLN 93 OE1 -0.0076 -0.0051 -0.0146 1820 TRP 94 N -0.0040 0.0007 -0.0101 1821 TRP 94 CA -0.0006 0.0012 -0.0063 1822 TRP 94 C -0.0000 -0.0003 -0.0057 1823 TRP 94 O -0.0007 -0.0043 -0.0069 1824 TRP 94 CB 0.0016 -0.0016 -0.0040 1825 TRP 94 CG 0.0010 -0.0008 -0.0047 1826 TRP 94 CD1 -0.0002 -0.0040 -0.0063 1827 TRP 94 CD2 0.0015 0.0034 -0.0037 1828 TRP 94 CE2 0.0006 0.0026 -0.0049 1829 TRP 94 CE3 0.0027 0.0078 -0.0021 1830 TRP 94 NE1 -0.0005 -0.0019 -0.0064 1831 TRP 94 CZ2 0.0008 0.0060 -0.0044 1832 TRP 94 CZ3 0.0029 0.0112 -0.0016 1833 TRP 94 CH2 0.0019 0.0103 -0.0027 1834 SER 95 N 0.0008 -0.0083 0.0109 1835 SER 95 CA 0.0010 -0.0076 0.0107 1836 SER 95 C 0.0013 -0.0076 0.0103 1837 SER 95 O 0.0013 -0.0071 0.0103 1838 SER 95 CB 0.0011 -0.0074 0.0106 1839 SER 95 OG 0.0008 -0.0071 0.0111 1840 MET 96 N 0.0015 -0.0080 0.0099 1841 MET 96 CA 0.0018 -0.0081 0.0095 1842 MET 96 C 0.0019 -0.0088 0.0093 1843 MET 96 O 0.0020 -0.0090 0.0092 1844 MET 96 CB 0.0021 -0.0077 0.0091 1845 MET 96 CG 0.0023 -0.0075 0.0089 1846 MET 96 SD 0.0020 -0.0070 0.0093 1847 MET 96 CE 0.0019 -0.0063 0.0094 1848 LYS 97 N 0.0034 -0.0096 0.0033 1849 LYS 97 CA 0.0033 -0.0077 0.0042 1850 LYS 97 C 0.0021 -0.0073 0.0056 1851 LYS 97 O 0.0018 -0.0079 0.0056 1852 LYS 97 CB 0.0047 -0.0062 0.0035 1853 LYS 97 CG 0.0049 -0.0045 0.0040 1854 LYS 97 CD 0.0044 -0.0049 0.0043 1855 LYS 97 CE 0.0051 -0.0033 0.0044 1856 LYS 97 NZ 0.0046 -0.0037 0.0047 1857 LEU 98 N 0.0013 -0.0064 0.0068 1858 LEU 98 CA 0.0001 -0.0059 0.0082 1859 LEU 98 C 0.0004 -0.0038 0.0087 1860 LEU 98 O 0.0011 -0.0027 0.0085 1861 LEU 98 CB -0.0013 -0.0065 0.0092 1862 LEU 98 CG -0.0028 -0.0063 0.0107 1863 LEU 98 CD1 -0.0029 -0.0068 0.0107 1864 LEU 98 CD2 -0.0040 -0.0076 0.0114 1865 VAL 99 N -0.0020 -0.0092 0.0053 1866 VAL 99 CA -0.0025 -0.0078 0.0046 1867 VAL 99 C -0.0030 -0.0077 0.0052 1868 VAL 99 O -0.0024 -0.0084 0.0051 1869 VAL 99 CB -0.0015 -0.0074 0.0031 1870 VAL 99 CG1 -0.0005 -0.0085 0.0027 1871 VAL 99 CG2 -0.0020 -0.0059 0.0024 1872 GLN 100 N -0.0041 -0.0068 0.0060 1873 GLN 100 CA -0.0047 -0.0066 0.0066 1874 GLN 100 C -0.0048 -0.0054 0.0056 1875 GLN 100 O -0.0047 -0.0045 0.0046 1876 GLN 100 CB -0.0059 -0.0064 0.0079 1877 GLN 100 CG -0.0060 -0.0077 0.0091 1878 GLN 100 CD -0.0068 -0.0075 0.0101 1879 GLN 100 NE2 -0.0074 -0.0082 0.0114 1880 GLN 100 OE1 -0.0070 -0.0068 0.0096 1881 ILE 101 N -0.0027 -0.0162 0.0081 1882 ILE 101 CA -0.0028 -0.0139 0.0068 1883 ILE 101 C -0.0053 -0.0128 0.0069 1884 ILE 101 O -0.0056 -0.0111 0.0060 1885 ILE 101 CB -0.0010 -0.0133 0.0061 1886 ILE 101 CG1 -0.0017 -0.0140 0.0066 1887 ILE 101 CG2 0.0015 -0.0143 0.0060 1888 ILE 101 CD1 -0.0009 -0.0128 0.0057 1889 ASP 102 N -0.0071 -0.0137 0.0079 1890 ASP 102 CA -0.0095 -0.0129 0.0081 1891 ASP 102 C -0.0101 -0.0106 0.0069 1892 ASP 102 O -0.0104 -0.0091 0.0062 1893 ASP 102 CB -0.0112 -0.0143 0.0092 1894 ASP 102 CG -0.0104 -0.0148 0.0093 1895 ASP 102 OD1 -0.0093 -0.0135 0.0083 1896 ASP 102 OD2 -0.0110 -0.0165 0.0104 1897 SER 105 N -0.0014 -0.0017 0.0136 1898 SER 105 CA 0.0013 -0.0024 0.0086 1899 SER 105 C 0.0023 0.0018 0.0061 1900 SER 105 O 0.0012 0.0035 0.0079 1901 SER 105 CB 0.0023 -0.0079 0.0075 1902 SER 105 OG 0.0025 -0.0080 0.0071 1903 PRO 106 N 0.0045 0.0035 0.0019 1904 PRO 106 CA 0.0056 0.0074 -0.0008 1905 PRO 106 C 0.0064 0.0052 -0.0020 1906 PRO 106 O 0.0069 0.0004 -0.0024 1907 PRO 106 CB 0.0079 0.0085 -0.0052 1908 PRO 106 CG 0.0083 0.0040 -0.0054 1909 PRO 106 CD 0.0058 0.0022 -0.0005 1910 GLU 107 N 0.0078 0.0005 -0.0079 1911 GLU 107 CA 0.0093 -0.0008 -0.0097 1912 GLU 107 C 0.0094 -0.0012 -0.0105 1913 GLU 107 O 0.0109 -0.0023 -0.0118 1914 GLU 107 CB 0.0085 -0.0013 -0.0119 1915 GLU 107 CG 0.0060 -0.0008 -0.0132 1916 GLU 107 CD 0.0061 -0.0017 -0.0153 1917 GLU 107 OE1 0.0077 -0.0028 -0.0167 1918 GLU 107 OE2 0.0046 -0.0012 -0.0156 1919 LYS 108 N 0.0079 -0.0003 -0.0097 1920 LYS 108 CA 0.0080 -0.0005 -0.0103 1921 LYS 108 C 0.0103 -0.0010 -0.0091 1922 LYS 108 O 0.0113 -0.0018 -0.0102 1923 LYS 108 CB 0.0058 0.0007 -0.0095 1924 LYS 108 CG 0.0058 0.0005 -0.0099 1925 LYS 108 CD 0.0057 0.0014 -0.0076 1926 LYS 108 CE 0.0054 0.0014 -0.0081 1927 LYS 108 NZ 0.0045 0.0025 -0.0061 1928 MET 109 N 0.0067 -0.0025 -0.0069 1929 MET 109 CA 0.0082 -0.0042 -0.0060 1930 MET 109 C 0.0093 -0.0050 -0.0067 1931 MET 109 O 0.0108 -0.0064 -0.0072 1932 MET 109 CB 0.0078 -0.0045 -0.0035 1933 MET 109 CG 0.0078 -0.0048 -0.0026 1934 MET 109 SD 0.0075 -0.0053 0.0003 1935 MET 109 CE 0.0062 -0.0042 0.0008 1936 ARG 110 N 0.0085 -0.0043 -0.0067 1937 ARG 110 CA 0.0095 -0.0050 -0.0076 1938 ARG 110 C 0.0102 -0.0050 -0.0100 1939 ARG 110 O 0.0116 -0.0061 -0.0107 1940 ARG 110 CB 0.0084 -0.0040 -0.0071 1941 ARG 110 CG 0.0079 -0.0043 -0.0047 1942 ARG 110 CD 0.0064 -0.0030 -0.0043 1943 ARG 110 NE 0.0050 -0.0020 -0.0028 1944 ARG 110 CZ 0.0035 -0.0005 -0.0031 1945 ARG 110 NH1 0.0031 0.0004 -0.0047 1946 ARG 110 NH2 0.0022 0.0003 -0.0016 1947 ARG 111 N 0.0108 -0.0103 -0.0164 1948 ARG 111 CA 0.0081 -0.0123 -0.0168 1949 ARG 111 C 0.0078 -0.0093 -0.0143 1950 ARG 111 O 0.0083 -0.0101 -0.0152 1951 ARG 111 CB 0.0031 -0.0145 -0.0165 1952 ARG 111 CG 0.0002 -0.0171 -0.0174 1953 ARG 111 CD 0.0019 -0.0209 -0.0212 1954 ARG 111 NE -0.0007 -0.0242 -0.0227 1955 ARG 111 CZ -0.0051 -0.0264 -0.0226 1956 ARG 111 NH1 -0.0075 -0.0256 -0.0210 1957 ARG 111 NH2 -0.0071 -0.0294 -0.0242 1958 LEU 112 N 0.0071 -0.0058 -0.0111 1959 LEU 112 CA 0.0071 -0.0027 -0.0086 1960 LEU 112 C 0.0120 -0.0011 -0.0094 1961 LEU 112 O 0.0124 -0.0004 -0.0090 1962 LEU 112 CB 0.0053 0.0008 -0.0051 1963 LEU 112 CG 0.0003 -0.0003 -0.0039 1964 LEU 112 CD1 -0.0017 0.0034 -0.0001 1965 LEU 112 CD2 -0.0030 -0.0035 -0.0051 1966 TYR 113 N 0.0090 0.0023 -0.0065 1967 TYR 113 CA 0.0094 0.0015 -0.0061 1968 TYR 113 C 0.0105 0.0027 -0.0078 1969 TYR 113 O 0.0122 0.0018 -0.0082 1970 TYR 113 CB 0.0072 0.0016 -0.0048 1971 TYR 113 CG 0.0066 -0.0002 -0.0029 1972 TYR 113 CD1 0.0082 -0.0021 -0.0022 1973 TYR 113 CD2 0.0045 -0.0001 -0.0016 1974 TYR 113 CE1 0.0077 -0.0038 -0.0005 1975 TYR 113 CE2 0.0040 -0.0018 0.0001 1976 TYR 113 CZ 0.0056 -0.0036 0.0007 1977 TYR 113 OH 0.0050 -0.0053 0.0025 1978 LEU 114 N 0.0095 0.0046 -0.0089 1979 LEU 114 CA 0.0104 0.0059 -0.0106 1980 LEU 114 C 0.0127 0.0057 -0.0119 1981 LEU 114 O 0.0141 0.0059 -0.0129 1982 LEU 114 CB 0.0088 0.0081 -0.0115 1983 LEU 114 CG 0.0089 0.0094 -0.0128 1984 LEU 114 CD1 0.0078 0.0091 -0.0117 1985 LEU 114 CD2 0.0080 0.0116 -0.0140 1986 LYS 115 N 0.0061 0.0021 -0.0088 1987 LYS 115 CA 0.0059 0.0026 -0.0066 1988 LYS 115 C 0.0055 0.0048 -0.0064 1989 LYS 115 O 0.0053 0.0060 -0.0051 1990 LYS 115 CB 0.0060 0.0010 -0.0055 1991 LYS 115 CG 0.0059 0.0009 -0.0032 1992 LYS 115 CD 0.0060 0.0001 -0.0020 1993 LYS 115 CE 0.0063 -0.0021 -0.0012 1994 LYS 115 NZ 0.0063 -0.0027 0.0003 1995 TYR 116 N 0.0055 0.0053 -0.0076 1996 TYR 116 CA 0.0052 0.0072 -0.0073 1997 TYR 116 C 0.0050 0.0088 -0.0090 1998 TYR 116 O 0.0049 0.0100 -0.0095 1999 TYR 116 CB 0.0052 0.0068 -0.0070 2000 TYR 116 CG 0.0054 0.0054 -0.0052 2001 TYR 116 CD1 0.0052 0.0061 -0.0032 2002 TYR 116 CD2 0.0057 0.0034 -0.0055 2003 TYR 116 CE1 0.0053 0.0049 -0.0015 2004 TYR 116 CE2 0.0058 0.0022 -0.0039 2005 TYR 116 CZ 0.0056 0.0029 -0.0019 2006 TYR 116 OH 0.0057 0.0016 -0.0002 2007 SER 117 N 0.0073 0.0055 -0.0096 2008 SER 117 CA 0.0063 0.0028 -0.0066 2009 SER 117 C 0.0061 0.0026 -0.0040 2010 SER 117 O 0.0069 0.0050 -0.0040 2011 SER 117 CB 0.0065 0.0037 -0.0042 2012 SER 117 OG 0.0074 0.0068 -0.0017 2013 GLY 118 N 0.0050 -0.0004 -0.0017 2014 GLY 118 CA 0.0047 -0.0009 0.0012 2015 GLY 118 C 0.0048 -0.0002 0.0054 2016 GLY 118 O 0.0045 -0.0009 0.0081 2017 GLU 119 N 0.0034 -0.0026 0.0158 2018 GLU 119 CA 0.0013 -0.0024 0.0173 2019 GLU 119 C 0.0027 -0.0013 0.0172 2020 GLU 119 O 0.0048 -0.0018 0.0154 2021 GLU 119 CB -0.0010 -0.0051 0.0168 2022 GLU 119 CG -0.0020 -0.0067 0.0162 2023 GLU 119 CD -0.0048 -0.0068 0.0182 2024 GLU 119 OE1 -0.0055 -0.0048 0.0202 2025 GLU 119 OE2 -0.0064 -0.0088 0.0177 2026 VAL 120 N 0.0015 0.0001 0.0192 2027 VAL 120 CA 0.0028 0.0014 0.0193 2028 VAL 120 C 0.0025 -0.0007 0.0179 2029 VAL 120 O 0.0045 -0.0005 0.0166 2030 VAL 120 CB 0.0015 0.0034 0.0219 2031 VAL 120 CG1 0.0028 0.0060 0.0230 2032 VAL 120 CG2 -0.0016 0.0023 0.0232 2033 ALA 121 N -0.0002 -0.0038 0.0162 2034 ALA 121 CA -0.0002 -0.0046 0.0143 2035 ALA 121 C -0.0003 -0.0051 0.0132 2036 ALA 121 O -0.0007 -0.0047 0.0138 2037 ALA 121 CB -0.0019 -0.0046 0.0138 2038 PHE 122 N 0.0002 -0.0059 0.0115 2039 PHE 122 CA 0.0001 -0.0064 0.0103 2040 PHE 122 C -0.0020 -0.0063 0.0099 2041 PHE 122 O -0.0031 -0.0065 0.0091 2042 PHE 122 CB 0.0010 -0.0073 0.0086 2043 PHE 122 CG 0.0012 -0.0079 0.0073 2044 PHE 122 CD1 0.0013 -0.0076 0.0079 2045 PHE 122 CD2 0.0012 -0.0086 0.0055 2046 PHE 122 CE1 0.0014 -0.0081 0.0067 2047 PHE 122 CE2 0.0013 -0.0092 0.0044 2048 PHE 122 CZ 0.0014 -0.0089 0.0050 2049 MET 123 N 0.0009 0.0037 0.0116 2050 MET 123 CA -0.0013 0.0059 0.0112 2051 MET 123 C -0.0015 0.0066 0.0128 2052 MET 123 O -0.0018 0.0075 0.0153 2053 MET 123 CB -0.0024 0.0074 0.0123 2054 MET 123 CG -0.0043 0.0088 0.0103 2055 MET 123 SD -0.0058 0.0107 0.0118 2056 MET 123 CE -0.0038 0.0090 0.0127 2057 PRO 124 N -0.0015 0.0061 0.0114 2058 PRO 124 CA -0.0014 0.0065 0.0129 2059 PRO 124 C -0.0035 0.0088 0.0131 2060 PRO 124 O -0.0037 0.0094 0.0148 2061 PRO 124 CB -0.0004 0.0049 0.0110 2062 PRO 124 CG -0.0004 0.0041 0.0083 2063 PRO 124 CD -0.0014 0.0051 0.0084 2064 GLU 125 N -0.0045 0.0126 0.0159 2065 GLU 125 CA -0.0037 0.0119 0.0159 2066 GLU 125 C -0.0030 0.0123 0.0149 2067 GLU 125 O -0.0022 0.0118 0.0147 2068 GLU 125 CB -0.0040 0.0113 0.0166 2069 GLU 125 CG -0.0045 0.0119 0.0165 2070 GLU 125 CD -0.0057 0.0124 0.0170 2071 GLU 125 OE1 -0.0061 0.0121 0.0176 2072 GLU 125 OE2 -0.0062 0.0131 0.0167 2073 THR 126 N -0.0034 0.0133 0.0144 2074 THR 126 CA -0.0028 0.0139 0.0134 2075 THR 126 C -0.0023 0.0141 0.0127 2076 THR 126 O -0.0018 0.0147 0.0119 2077 THR 126 CB -0.0035 0.0148 0.0132 2078 THR 126 CG2 -0.0041 0.0145 0.0139 2079 THR 126 OG1 -0.0043 0.0155 0.0132 2080 MET 127 N -0.0012 0.0194 -0.0043 2081 MET 127 CA 0.0008 0.0186 -0.0027 2082 MET 127 C 0.0008 0.0191 -0.0022 2083 MET 127 O -0.0003 0.0191 -0.0036 2084 MET 127 CB 0.0022 0.0163 -0.0036 2085 MET 127 CG 0.0032 0.0156 -0.0031 2086 MET 127 SD 0.0048 0.0128 -0.0043 2087 MET 127 CE 0.0052 0.0125 -0.0041 2088 THR 128 N 0.0020 0.0196 -0.0001 2089 THR 128 CA 0.0024 0.0198 0.0005 2090 THR 128 C 0.0037 0.0176 -0.0002 2091 THR 128 O 0.0048 0.0161 -0.0006 2092 THR 128 CB 0.0033 0.0210 0.0030 2093 THR 128 CG2 0.0023 0.0227 0.0038 2094 THR 128 OG1 0.0053 0.0196 0.0040 2095 PRO 129 N 0.0036 0.0246 -0.0063 2096 PRO 129 CA 0.0040 0.0209 -0.0045 2097 PRO 129 C 0.0047 0.0195 -0.0032 2098 PRO 129 O 0.0038 0.0163 -0.0028 2099 PRO 129 CB 0.0063 0.0212 -0.0025 2100 PRO 129 CG 0.0073 0.0251 -0.0031 2101 PRO 129 CD 0.0051 0.0269 -0.0059 2102 ALA 130 N 0.0065 0.0218 -0.0025 2103 ALA 130 CA 0.0073 0.0206 -0.0013 2104 ALA 130 C 0.0048 0.0193 -0.0031 2105 ALA 130 O 0.0044 0.0166 -0.0022 2106 ALA 130 CB 0.0096 0.0235 -0.0004 2107 GLN 131 N 0.0059 0.0151 -0.0022 2108 GLN 131 CA 0.0045 0.0147 -0.0031 2109 GLN 131 C 0.0032 0.0118 -0.0042 2110 GLN 131 O 0.0032 0.0102 -0.0044 2111 GLN 131 CB 0.0027 0.0172 -0.0040 2112 GLN 131 CG 0.0038 0.0200 -0.0029 2113 GLN 131 CD 0.0020 0.0227 -0.0039 2114 GLN 131 NE2 0.0028 0.0252 -0.0031 2115 GLN 131 OE1 -0.0001 0.0224 -0.0053 2116 CYS 132 N 0.0022 0.0110 -0.0050 2117 CYS 132 CA 0.0010 0.0082 -0.0060 2118 CYS 132 C 0.0029 0.0057 -0.0051 2119 CYS 132 O 0.0024 0.0036 -0.0056 2120 CYS 132 CB -0.0002 0.0080 -0.0069 2121 CYS 132 SG -0.0030 0.0102 -0.0085 2122 LEU 133 N -0.0032 0.0012 -0.0066 2123 LEU 133 CA -0.0014 0.0001 -0.0070 2124 LEU 133 C 0.0006 -0.0003 -0.0057 2125 LEU 133 O 0.0021 -0.0015 -0.0066 2126 LEU 133 CB -0.0017 0.0005 -0.0064 2127 LEU 133 CG 0.0001 -0.0005 -0.0065 2128 LEU 133 CD1 0.0005 -0.0017 -0.0087 2129 LEU 133 CD2 -0.0003 0.0001 -0.0058 2130 GLN 134 N 0.0006 0.0006 -0.0037 2131 GLN 134 CA 0.0025 0.0002 -0.0025 2132 GLN 134 C 0.0031 -0.0005 -0.0034 2133 GLN 134 O 0.0049 -0.0015 -0.0035 2134 GLN 134 CB 0.0023 0.0014 -0.0002 2135 GLN 134 CG 0.0027 0.0019 0.0011 2136 GLN 134 CD 0.0049 0.0008 0.0012 2137 GLN 134 NE2 0.0051 0.0008 0.0014 2138 GLN 134 OE1 0.0063 -0.0000 0.0012 2139 PHE 135 N 0.0035 -0.0042 -0.0071 2140 PHE 135 CA 0.0027 -0.0040 -0.0069 2141 PHE 135 C 0.0025 -0.0047 -0.0066 2142 PHE 135 O 0.0021 -0.0045 -0.0065 2143 PHE 135 CB 0.0022 -0.0040 -0.0068 2144 PHE 135 CG 0.0013 -0.0039 -0.0065 2145 PHE 135 CD1 0.0010 -0.0034 -0.0066 2146 PHE 135 CD2 0.0008 -0.0044 -0.0062 2147 PHE 135 CE1 0.0002 -0.0034 -0.0064 2148 PHE 135 CE2 0.0001 -0.0044 -0.0060 2149 PHE 135 CZ -0.0002 -0.0039 -0.0061 2150 MET 136 N 0.0027 -0.0054 -0.0064 2151 MET 136 CA 0.0025 -0.0060 -0.0062 2152 MET 136 C 0.0029 -0.0061 -0.0063 2153 MET 136 O 0.0027 -0.0065 -0.0061 2154 MET 136 CB 0.0026 -0.0067 -0.0060 2155 MET 136 CG 0.0020 -0.0068 -0.0058 2156 MET 136 SD 0.0011 -0.0072 -0.0054 2157 MET 136 CE 0.0016 -0.0080 -0.0053 2158 ILE 137 N -0.0025 -0.0092 -0.0076 2159 ILE 137 CA -0.0011 -0.0087 -0.0084 2160 ILE 137 C 0.0009 -0.0082 -0.0072 2161 ILE 137 O 0.0025 -0.0077 -0.0081 2162 ILE 137 CB -0.0021 -0.0090 -0.0084 2163 ILE 137 CG1 -0.0035 -0.0094 -0.0103 2164 ILE 137 CG2 -0.0005 -0.0085 -0.0083 2165 ILE 137 CD1 -0.0047 -0.0097 -0.0102 2166 ASP 138 N 0.0008 -0.0082 -0.0051 2167 ASP 138 CA 0.0026 -0.0077 -0.0038 2168 ASP 138 C 0.0040 -0.0073 -0.0039 2169 ASP 138 O 0.0058 -0.0068 -0.0033 2170 ASP 138 CB 0.0020 -0.0079 -0.0015 2171 ASP 138 CG 0.0010 -0.0082 -0.0012 2172 ASP 138 OD1 0.0008 -0.0082 -0.0027 2173 ASP 138 OD2 0.0005 -0.0084 0.0007 2174 ILE 139 N 0.0008 -0.0076 -0.0057 2175 ILE 139 CA 0.0018 -0.0072 -0.0056 2176 ILE 139 C 0.0021 -0.0067 -0.0070 2177 ILE 139 O 0.0027 -0.0063 -0.0071 2178 ILE 139 CB 0.0015 -0.0076 -0.0046 2179 ILE 139 CG1 0.0004 -0.0079 -0.0053 2180 ILE 139 CG2 0.0011 -0.0081 -0.0033 2181 ILE 139 CD1 0.0004 -0.0081 -0.0047 2182 ASP 140 N 0.0016 -0.0066 -0.0081 2183 ASP 140 CA 0.0019 -0.0061 -0.0095 2184 ASP 140 C 0.0033 -0.0054 -0.0097 2185 ASP 140 O 0.0038 -0.0052 -0.0094 2186 ASP 140 CB 0.0011 -0.0063 -0.0106 2187 ASP 140 CG 0.0010 -0.0060 -0.0120 2188 ASP 140 OD1 0.0016 -0.0056 -0.0123 2189 ASP 140 OD2 0.0002 -0.0061 -0.0130 2190 PRO 141 N 0.0041 -0.0048 -0.0087 2191 PRO 141 CA 0.0075 -0.0003 -0.0088 2192 PRO 141 C 0.0089 0.0018 -0.0137 2193 PRO 141 O 0.0117 0.0054 -0.0136 2194 PRO 141 CB 0.0078 0.0002 -0.0080 2195 PRO 141 CG 0.0049 -0.0038 -0.0059 2196 PRO 141 CD 0.0025 -0.0070 -0.0066 2197 ALA 142 N 0.0072 -0.0004 -0.0180 2198 ALA 142 CA 0.0084 0.0014 -0.0228 2199 ALA 142 C 0.0085 0.0015 -0.0233 2200 ALA 142 O 0.0090 0.0022 -0.0275 2201 ALA 142 CB 0.0066 -0.0010 -0.0273 2202 ARG 143 N 0.0220 0.0032 -0.0196 2203 ARG 143 CA 0.0217 0.0021 -0.0131 2204 ARG 143 C 0.0293 0.0027 -0.0056 2205 ARG 143 O 0.0302 0.0021 -0.0001 2206 ARG 143 CB 0.0122 -0.0007 -0.0086 2207 ARG 143 CG 0.0050 -0.0014 -0.0145 2208 ARG 143 CD -0.0043 -0.0042 -0.0098 2209 ARG 143 NE -0.0110 -0.0049 -0.0149 2210 ARG 143 CZ -0.0163 -0.0051 -0.0219 2211 ARG 143 NH1 -0.0159 -0.0045 -0.0250 2212 ARG 143 NH2 -0.0222 -0.0058 -0.0260 2213 SER 144 N 0.0348 0.0038 -0.0052 2214 SER 144 CA 0.0424 0.0045 0.0017 2215 SER 144 C 0.0395 0.0024 0.0117 2216 SER 144 O 0.0437 0.0026 0.0165 2217 SER 144 CB 0.0506 0.0067 -0.0007 2218 SER 144 OG 0.0480 0.0065 -0.0030