1 GLY 1 N -0.0179 -0.0152 0.0319 2 GLY 1 CA -0.0121 -0.0227 0.0286 3 GLY 1 C -0.0059 -0.0251 0.0249 4 GLY 1 O -0.0041 -0.0195 0.0235 5 ARG 2 N -0.0008 -0.0231 0.0180 6 ARG 2 CA 0.0083 -0.0287 0.0181 7 ARG 2 C 0.0176 -0.0264 0.0175 8 ARG 2 O 0.0170 -0.0281 0.0176 9 ARG 2 CB 0.0064 -0.0408 0.0192 10 ARG 2 CG 0.0147 -0.0469 0.0194 11 ARG 2 CD 0.0133 -0.0590 0.0205 12 ARG 2 NE 0.0039 -0.0614 0.0212 13 ARG 2 CZ 0.0025 -0.0703 0.0220 14 ARG 2 NH1 0.0094 -0.0783 0.0224 15 ARG 2 NH2 -0.0063 -0.0711 0.0225 16 ILE 3 N 0.0309 -0.0291 0.0163 17 ILE 3 CA 0.0416 -0.0277 0.0159 18 ILE 3 C 0.0466 -0.0349 0.0231 19 ILE 3 O 0.0423 -0.0404 0.0278 20 ILE 3 CB 0.0438 -0.0237 0.0124 21 ILE 3 CG1 0.0402 -0.0158 0.0047 22 ILE 3 CG2 0.0549 -0.0235 0.0132 23 ILE 3 CD1 0.0406 -0.0116 0.0009 24 ALA 4 N 0.0356 -0.0362 0.0116 25 ALA 4 CA 0.0312 -0.0331 0.0052 26 ALA 4 C 0.0373 -0.0370 0.0027 27 ALA 4 O 0.0407 -0.0395 0.0103 28 ALA 4 CB 0.0219 -0.0274 0.0109 29 SER 5 N 0.0394 -0.0424 0.0026 30 SER 5 CA 0.0453 -0.0451 -0.0013 31 SER 5 C 0.0456 -0.0499 -0.0069 32 SER 5 O 0.0510 -0.0523 -0.0103 33 SER 5 CB 0.0441 -0.0463 -0.0025 34 SER 5 OG 0.0370 -0.0488 -0.0045 35 ILE 6 N 0.0178 -0.0094 -0.0144 36 ILE 6 CA 0.0153 -0.0059 -0.0176 37 ILE 6 C 0.0095 -0.0071 -0.0177 38 ILE 6 O 0.0076 -0.0102 -0.0155 39 ILE 6 CB 0.0169 -0.0045 -0.0185 40 ILE 6 CG1 0.0226 -0.0029 -0.0188 41 ILE 6 CG2 0.0137 -0.0011 -0.0218 42 ILE 6 CD1 0.0251 -0.0028 -0.0185 43 PRO 7 N 0.0025 0.0004 -0.0216 44 PRO 7 CA -0.0058 0.0002 -0.0213 45 PRO 7 C -0.0061 0.0005 -0.0214 46 PRO 7 O -0.0032 0.0062 -0.0234 47 PRO 7 CB -0.0103 0.0072 -0.0236 48 PRO 7 CG -0.0061 0.0079 -0.0239 49 PRO 7 CD 0.0030 0.0056 -0.0233 50 GLY 8 N -0.0084 -0.0058 -0.0199 51 GLY 8 CA -0.0081 -0.0060 -0.0199 52 GLY 8 C -0.0043 -0.0088 -0.0196 53 GLY 8 O -0.0042 -0.0100 -0.0194 54 GLU 9 N 0.0016 -0.0129 -0.0148 55 GLU 9 CA 0.0036 -0.0145 -0.0117 56 GLU 9 C 0.0024 -0.0178 -0.0096 57 GLU 9 O 0.0019 -0.0201 -0.0079 58 GLU 9 CB 0.0073 -0.0124 -0.0108 59 GLU 9 CG 0.0099 -0.0135 -0.0076 60 GLU 9 CD 0.0134 -0.0113 -0.0070 61 GLU 9 OE1 0.0137 -0.0089 -0.0089 62 GLU 9 OE2 0.0159 -0.0119 -0.0045 63 ALA 10 N 0.0026 -0.0240 -0.0162 64 ALA 10 CA 0.0005 -0.0311 -0.0174 65 ALA 10 C -0.0020 -0.0292 -0.0164 66 ALA 10 O 0.0002 -0.0331 -0.0178 67 ALA 10 CB -0.0061 -0.0359 -0.0171 68 GLU 11 N -0.0098 -0.0277 -0.0288 69 GLU 11 CA -0.0139 -0.0268 -0.0286 70 GLU 11 C -0.0102 -0.0258 -0.0287 71 GLU 11 O -0.0119 -0.0284 -0.0287 72 GLU 11 CB -0.0181 -0.0208 -0.0285 73 GLU 11 CG -0.0236 -0.0194 -0.0283 74 GLU 11 CD -0.0266 -0.0127 -0.0282 75 GLU 11 OE1 -0.0248 -0.0094 -0.0282 76 GLU 11 OE2 -0.0306 -0.0108 -0.0281 77 TYR 12 N -0.0044 -0.0163 -0.0257 78 TYR 12 CA -0.0003 -0.0154 -0.0253 79 TYR 12 C 0.0042 -0.0181 -0.0263 80 TYR 12 O 0.0083 -0.0171 -0.0258 81 TYR 12 CB 0.0010 -0.0102 -0.0233 82 TYR 12 CG -0.0029 -0.0075 -0.0223 83 TYR 12 CD1 -0.0029 -0.0074 -0.0223 84 TYR 12 CD2 -0.0065 -0.0052 -0.0215 85 TYR 12 CE1 -0.0067 -0.0051 -0.0215 86 TYR 12 CE2 -0.0103 -0.0030 -0.0207 87 TYR 12 CZ -0.0105 -0.0030 -0.0207 88 TYR 12 OH -0.0145 -0.0011 -0.0200 89 LEU 13 N 0.0027 -0.0216 -0.0264 90 LEU 13 CA 0.0062 -0.0245 -0.0254 91 LEU 13 C 0.0098 -0.0306 -0.0268 92 LEU 13 O 0.0082 -0.0337 -0.0311 93 LEU 13 CB 0.0031 -0.0242 -0.0283 94 LEU 13 CG 0.0063 -0.0262 -0.0267 95 LEU 13 CD1 0.0088 -0.0225 -0.0209 96 LEU 13 CD2 0.0029 -0.0262 -0.0302 97 GLY 14 N 0.0142 -0.0256 -0.0323 98 GLY 14 CA 0.0209 -0.0282 -0.0343 99 GLY 14 C 0.0242 -0.0266 -0.0304 100 GLY 14 O 0.0296 -0.0285 -0.0318 101 ARG 15 N 0.0156 -0.0174 -0.0362 102 ARG 15 CA 0.0186 -0.0155 -0.0313 103 ARG 15 C 0.0179 -0.0119 -0.0240 104 ARG 15 O 0.0165 -0.0094 -0.0191 105 ARG 15 CB 0.0142 -0.0152 -0.0319 106 ARG 15 CG 0.0152 -0.0185 -0.0387 107 ARG 15 CD 0.0125 -0.0180 -0.0383 108 ARG 15 NE 0.0041 -0.0166 -0.0375 109 ARG 15 CZ 0.0003 -0.0146 -0.0343 110 ARG 15 NH1 0.0038 -0.0136 -0.0311 111 ARG 15 NH2 -0.0072 -0.0135 -0.0341 112 GLY 16 N 0.0153 -0.0121 -0.0101 113 GLY 16 CA 0.0144 -0.0089 -0.0024 114 GLY 16 C 0.0086 -0.0067 -0.0020 115 GLY 16 O 0.0094 -0.0051 0.0029 116 VAL 17 N 0.0049 -0.0133 -0.0067 117 VAL 17 CA 0.0061 -0.0122 -0.0060 118 VAL 17 C 0.0072 -0.0137 -0.0046 119 VAL 17 O 0.0066 -0.0157 -0.0046 120 VAL 17 CB 0.0052 -0.0112 -0.0071 121 VAL 17 CG1 0.0064 -0.0100 -0.0063 122 VAL 17 CG2 0.0042 -0.0094 -0.0085 123 SER 18 N 0.0054 -0.0139 0.0066 124 SER 18 CA 0.0050 -0.0137 0.0093 125 SER 18 C 0.0057 -0.0115 0.0109 126 SER 18 O 0.0063 -0.0105 0.0102 127 SER 18 CB 0.0037 -0.0160 0.0107 128 SER 18 OG 0.0033 -0.0159 0.0133 129 TYR 19 N 0.0048 -0.0176 0.0110 130 TYR 19 CA 0.0022 -0.0156 0.0125 131 TYR 19 C 0.0012 -0.0160 0.0144 132 TYR 19 O -0.0008 -0.0140 0.0152 133 TYR 19 CB 0.0015 -0.0124 0.0103 134 TYR 19 CG 0.0026 -0.0118 0.0082 135 TYR 19 CD1 0.0017 -0.0115 0.0090 136 TYR 19 CD2 0.0044 -0.0116 0.0053 137 TYR 19 CE1 0.0028 -0.0109 0.0069 138 TYR 19 CE2 0.0054 -0.0110 0.0032 139 TYR 19 CZ 0.0046 -0.0107 0.0040 140 TYR 19 OH 0.0057 -0.0101 0.0020 141 CYS 20 N -0.0018 -0.0173 0.0173 142 CYS 20 CA 0.0002 -0.0187 0.0188 143 CYS 20 C 0.0001 -0.0181 0.0186 144 CYS 20 O -0.0015 -0.0196 0.0183 145 CYS 20 CB -0.0002 -0.0220 0.0198 146 CYS 20 SG 0.0027 -0.0237 0.0218 147 ALA 21 N -0.0004 -0.0162 0.0159 148 ALA 21 CA 0.0006 -0.0140 0.0158 149 ALA 21 C 0.0022 -0.0143 0.0150 150 ALA 21 O 0.0024 -0.0129 0.0151 151 ALA 21 CB 0.0018 -0.0126 0.0154 152 THR 22 N 0.0026 -0.0208 0.0164 153 THR 22 CA 0.0045 -0.0210 0.0150 154 THR 22 C 0.0038 -0.0213 0.0154 155 THR 22 O 0.0052 -0.0204 0.0147 156 THR 22 CB 0.0059 -0.0232 0.0132 157 THR 22 OG1 0.0044 -0.0258 0.0133 158 THR 22 CG2 0.0072 -0.0225 0.0126 159 CYS 23 N 0.0058 -0.0248 0.0186 160 CYS 23 CA 0.0020 -0.0252 0.0212 161 CYS 23 C -0.0015 -0.0186 0.0234 162 CYS 23 O -0.0017 -0.0155 0.0235 163 CYS 23 CB -0.0019 -0.0315 0.0240 164 CYS 23 SG -0.0048 -0.0345 0.0260 165 ASP 24 N 0.0024 -0.0177 0.0233 166 ASP 24 CA -0.0009 -0.0145 0.0240 167 ASP 24 C 0.0005 -0.0099 0.0230 168 ASP 24 O -0.0019 -0.0070 0.0235 169 ASP 24 CB -0.0043 -0.0146 0.0252 170 ASP 24 CG -0.0062 -0.0190 0.0263 171 ASP 24 OD1 -0.0052 -0.0220 0.0264 172 ASP 24 OD2 -0.0088 -0.0194 0.0273 173 GLY 25 N 0.0012 -0.0070 0.0197 174 GLY 25 CA 0.0020 -0.0036 0.0179 175 GLY 25 C 0.0018 0.0019 0.0177 176 GLY 25 O 0.0012 0.0051 0.0184 177 ALA 26 N 0.0020 0.0037 0.0184 178 ALA 26 CA 0.0009 0.0086 0.0176 179 ALA 26 C -0.0005 0.0112 0.0214 180 ALA 26 O -0.0013 0.0148 0.0205 181 ALA 26 CB 0.0005 0.0101 0.0170 182 PHE 27 N -0.0045 0.0087 0.0202 183 PHE 27 CA -0.0052 0.0121 0.0277 184 PHE 27 C -0.0039 0.0088 0.0260 185 PHE 27 O -0.0050 0.0124 0.0301 186 PHE 27 CB -0.0028 0.0097 0.0378 187 PHE 27 CG -0.0041 0.0129 0.0395 188 PHE 27 CD1 -0.0018 0.0073 0.0369 189 PHE 27 CD2 -0.0074 0.0212 0.0439 190 PHE 27 CE1 -0.0028 0.0099 0.0385 191 PHE 27 CE2 -0.0084 0.0239 0.0456 192 PHE 27 CZ -0.0061 0.0182 0.0428 193 TYR 28 N 0.0031 0.0028 0.0187 194 TYR 28 CA 0.0031 0.0043 0.0178 195 TYR 28 C 0.0040 0.0061 0.0163 196 TYR 28 O 0.0047 0.0072 0.0152 197 TYR 28 CB 0.0043 0.0032 0.0177 198 TYR 28 CG 0.0032 0.0016 0.0193 199 TYR 28 CD1 0.0013 0.0023 0.0200 200 TYR 28 CD2 0.0039 -0.0006 0.0201 201 TYR 28 CE1 0.0002 0.0008 0.0216 202 TYR 28 CE2 0.0028 -0.0021 0.0216 203 TYR 28 CZ 0.0009 -0.0013 0.0223 204 TYR 28 OH -0.0002 -0.0028 0.0239 205 ARG 29 N 0.0025 0.0159 0.0205 206 ARG 29 CA 0.0026 0.0182 0.0181 207 ARG 29 C 0.0018 0.0200 0.0191 208 ARG 29 O 0.0008 0.0215 0.0214 209 ARG 29 CB 0.0023 0.0204 0.0170 210 ARG 29 CG 0.0027 0.0224 0.0140 211 ARG 29 CD 0.0024 0.0248 0.0129 212 ARG 29 NE 0.0028 0.0232 0.0127 213 ARG 29 CZ 0.0039 0.0216 0.0103 214 ARG 29 NH1 0.0046 0.0213 0.0079 215 ARG 29 NH2 0.0042 0.0202 0.0105 216 ASN 30 N 0.0042 0.0194 0.0161 217 ASN 30 CA 0.0037 0.0207 0.0168 218 ASN 30 C 0.0026 0.0201 0.0184 219 ASN 30 O 0.0020 0.0213 0.0194 220 ASN 30 CB 0.0038 0.0227 0.0167 221 ASN 30 CG 0.0049 0.0233 0.0150 222 ASN 30 OD1 0.0054 0.0236 0.0142 223 ASN 30 ND2 0.0052 0.0236 0.0145 224 ARG 31 N 0.0018 0.0157 0.0137 225 ARG 31 CA 0.0009 0.0149 0.0151 226 ARG 31 C 0.0034 0.0140 0.0140 227 ARG 31 O 0.0059 0.0133 0.0127 228 ARG 31 CB -0.0001 0.0127 0.0180 229 ARG 31 CG -0.0027 0.0136 0.0193 230 ARG 31 CD -0.0041 0.0116 0.0223 231 ARG 31 NE -0.0064 0.0124 0.0233 232 ARG 31 CZ -0.0090 0.0144 0.0236 233 ARG 31 NH1 -0.0100 0.0156 0.0232 234 ARG 31 NH2 -0.0109 0.0151 0.0244 235 GLU 32 N 0.0054 0.0124 0.0132 236 GLU 32 CA 0.0053 0.0130 0.0134 237 GLU 32 C 0.0052 0.0135 0.0131 238 GLU 32 O 0.0052 0.0135 0.0126 239 GLU 32 CB 0.0053 0.0132 0.0130 240 GLU 32 CG 0.0054 0.0128 0.0133 241 GLU 32 CD 0.0053 0.0131 0.0138 242 GLU 32 OE1 0.0054 0.0128 0.0144 243 GLU 32 OE2 0.0052 0.0136 0.0137 244 VAL 33 N 0.0018 0.0103 0.0125 245 VAL 33 CA 0.0018 0.0099 0.0126 246 VAL 33 C 0.0021 0.0114 0.0126 247 VAL 33 O 0.0028 0.0126 0.0128 248 VAL 33 CB 0.0027 0.0086 0.0134 249 VAL 33 CG1 0.0024 0.0070 0.0134 250 VAL 33 CG2 0.0043 0.0092 0.0143 251 VAL 34 N 0.0006 0.0111 0.0100 252 VAL 34 CA 0.0011 0.0127 0.0099 253 VAL 34 C 0.0020 0.0122 0.0109 254 VAL 34 O 0.0017 0.0108 0.0110 255 VAL 34 CB -0.0003 0.0135 0.0086 256 VAL 34 CG1 0.0002 0.0152 0.0085 257 VAL 34 CG2 -0.0013 0.0140 0.0076 258 VAL 35 N -0.0069 -0.0006 0.0101 259 VAL 35 CA -0.0067 -0.0016 0.0096 260 VAL 35 C -0.0078 -0.0012 0.0098 261 VAL 35 O -0.0080 -0.0000 0.0104 262 VAL 35 CB -0.0050 -0.0016 0.0096 263 VAL 35 CG1 -0.0049 -0.0026 0.0092 264 VAL 35 CG2 -0.0039 -0.0021 0.0094 265 VAL 36 N -0.0065 -0.0020 0.0118 266 VAL 36 CA -0.0064 -0.0024 0.0119 267 VAL 36 C -0.0065 -0.0026 0.0117 268 VAL 36 O -0.0065 -0.0025 0.0117 269 VAL 36 CB -0.0063 -0.0024 0.0123 270 VAL 36 CG1 -0.0062 -0.0028 0.0125 271 VAL 36 CG2 -0.0062 -0.0021 0.0126 272 GLY 37 N -0.0100 -0.0127 0.0105 273 GLY 37 CA -0.0089 -0.0138 0.0104 274 GLY 37 C -0.0086 -0.0138 0.0086 275 GLY 37 O -0.0095 -0.0129 0.0076 276 LEU 38 N -0.0163 -0.0126 0.0101 277 LEU 38 CA -0.0126 -0.0117 0.0088 278 LEU 38 C -0.0096 -0.0145 0.0108 279 LEU 38 O -0.0077 -0.0154 0.0113 280 LEU 38 CB -0.0110 -0.0090 0.0064 281 LEU 38 CG -0.0070 -0.0078 0.0048 282 LEU 38 CD1 -0.0071 -0.0067 0.0039 283 LEU 38 CD2 -0.0060 -0.0051 0.0025 284 ASN 39 N -0.0131 -0.0218 0.0107 285 ASN 39 CA -0.0118 -0.0249 0.0088 286 ASN 39 C -0.0084 -0.0244 0.0075 287 ASN 39 O -0.0077 -0.0219 0.0083 288 ASN 39 CB -0.0141 -0.0282 0.0085 289 ASN 39 CG -0.0155 -0.0277 0.0094 290 ASN 39 OD1 -0.0136 -0.0273 0.0087 291 ASN 39 ND2 -0.0189 -0.0278 0.0108 292 PRO 40 N -0.0105 -0.0276 0.0074 293 PRO 40 CA -0.0117 -0.0256 0.0060 294 PRO 40 C -0.0115 -0.0230 0.0072 295 PRO 40 O -0.0122 -0.0217 0.0064 296 PRO 40 CB -0.0125 -0.0257 0.0047 297 PRO 40 CG -0.0120 -0.0284 0.0046 298 PRO 40 CD -0.0106 -0.0291 0.0068 299 GLU 41 N -0.0131 -0.0248 0.0050 300 GLU 41 CA -0.0105 -0.0238 0.0044 301 GLU 41 C -0.0089 -0.0216 0.0083 302 GLU 41 O -0.0053 -0.0199 0.0083 303 GLU 41 CB -0.0130 -0.0256 0.0029 304 GLU 41 CG -0.0106 -0.0250 0.0013 305 GLU 41 CD -0.0133 -0.0267 0.0003 306 GLU 41 OE1 -0.0170 -0.0281 0.0013 307 GLU 41 OE2 -0.0117 -0.0266 -0.0016 308 ALA 42 N -0.0089 -0.0184 0.0106 309 ALA 42 CA -0.0095 -0.0166 0.0114 310 ALA 42 C -0.0082 -0.0149 0.0109 311 ALA 42 O -0.0082 -0.0135 0.0112 312 ALA 42 CB -0.0107 -0.0164 0.0123 313 VAL 43 N -0.0110 -0.0150 0.0098 314 VAL 43 CA -0.0115 -0.0152 0.0094 315 VAL 43 C -0.0115 -0.0139 0.0088 316 VAL 43 O -0.0112 -0.0136 0.0089 317 VAL 43 CB -0.0127 -0.0160 0.0087 318 VAL 43 CG1 -0.0134 -0.0160 0.0082 319 VAL 43 CG2 -0.0127 -0.0174 0.0094 320 GLU 44 N -0.0110 -0.0184 0.0079 321 GLU 44 CA -0.0090 -0.0177 0.0060 322 GLU 44 C -0.0077 -0.0166 0.0066 323 GLU 44 O -0.0057 -0.0152 0.0065 324 GLU 44 CB -0.0096 -0.0191 0.0034 325 GLU 44 CG -0.0103 -0.0198 0.0026 326 GLU 44 CD -0.0113 -0.0214 0.0003 327 GLU 44 OE1 -0.0102 -0.0213 -0.0017 328 GLU 44 OE2 -0.0131 -0.0226 0.0004 329 GLU 45 N -0.0010 -0.0145 0.0089 330 GLU 45 CA -0.0015 -0.0132 0.0103 331 GLU 45 C -0.0015 -0.0111 0.0114 332 GLU 45 O -0.0012 -0.0094 0.0117 333 GLU 45 CB -0.0029 -0.0146 0.0118 334 GLU 45 CG -0.0029 -0.0165 0.0109 335 GLU 45 CD -0.0023 -0.0156 0.0104 336 GLU 45 OE1 -0.0031 -0.0157 0.0116 337 GLU 45 OE2 -0.0011 -0.0147 0.0090 338 ALA 46 N -0.0056 -0.0097 0.0113 339 ALA 46 CA -0.0058 -0.0061 0.0115 340 ALA 46 C -0.0034 -0.0043 0.0100 341 ALA 46 O -0.0038 -0.0019 0.0103 342 ALA 46 CB -0.0061 -0.0051 0.0116 343 GLN 47 N -0.0056 -0.0065 0.0073 344 GLN 47 CA -0.0057 -0.0051 0.0055 345 GLN 47 C -0.0027 -0.0010 0.0032 346 GLN 47 O -0.0017 0.0005 0.0023 347 GLN 47 CB -0.0103 -0.0060 0.0024 348 GLN 47 CG -0.0139 -0.0101 0.0042 349 GLN 47 CD -0.0176 -0.0107 0.0015 350 GLN 47 OE1 -0.0173 -0.0107 0.0018 351 GLN 47 NE2 -0.0212 -0.0111 -0.0012 352 VAL 48 N 0.0042 -0.0057 0.0061 353 VAL 48 CA 0.0046 -0.0049 0.0061 354 VAL 48 C 0.0034 -0.0011 0.0089 355 VAL 48 O 0.0050 0.0017 0.0086 356 VAL 48 CB 0.0030 -0.0088 0.0059 357 VAL 48 CG1 0.0031 -0.0079 0.0062 358 VAL 48 CG2 0.0048 -0.0122 0.0027 359 LEU 49 N 0.0044 -0.0002 0.0111 360 LEU 49 CA 0.0034 0.0017 0.0128 361 LEU 49 C 0.0038 0.0040 0.0120 362 LEU 49 O 0.0033 0.0060 0.0129 363 LEU 49 CB 0.0023 0.0005 0.0148 364 LEU 49 CG 0.0016 -0.0014 0.0160 365 LEU 49 CD1 0.0007 -0.0030 0.0176 366 LEU 49 CD2 0.0010 -0.0002 0.0172 367 THR 50 N -0.0001 0.0068 0.0101 368 THR 50 CA 0.0011 0.0085 0.0109 369 THR 50 C 0.0034 0.0110 0.0092 370 THR 50 O 0.0046 0.0128 0.0099 371 THR 50 CB 0.0002 0.0071 0.0099 372 THR 50 OG1 0.0001 0.0060 0.0066 373 THR 50 CG2 -0.0020 0.0049 0.0120 374 LYS 51 N 0.0049 0.0099 0.0077 375 LYS 51 CA 0.0076 0.0121 0.0059 376 LYS 51 C 0.0078 0.0142 0.0080 377 LYS 51 O 0.0099 0.0163 0.0070 378 LYS 51 CB 0.0082 0.0098 0.0024 379 LYS 51 CG 0.0082 0.0076 0.0001 380 LYS 51 CD 0.0082 0.0048 -0.0031 381 LYS 51 CE 0.0083 0.0028 -0.0055 382 LYS 51 NZ 0.0058 -0.0007 -0.0053 383 PHE 52 N 0.0071 0.0113 0.0099 384 PHE 52 CA 0.0060 0.0129 0.0120 385 PHE 52 C 0.0049 0.0141 0.0140 386 PHE 52 O 0.0046 0.0166 0.0148 387 PHE 52 CB 0.0051 0.0109 0.0133 388 PHE 52 CG 0.0060 0.0096 0.0114 389 PHE 52 CD1 0.0068 0.0114 0.0103 390 PHE 52 CD2 0.0062 0.0065 0.0109 391 PHE 52 CE1 0.0077 0.0101 0.0086 392 PHE 52 CE2 0.0070 0.0053 0.0092 393 PHE 52 CZ 0.0078 0.0071 0.0080 394 ALA 53 N 0.0049 0.0118 0.0139 395 ALA 53 CA 0.0042 0.0122 0.0150 396 ALA 53 C 0.0044 0.0136 0.0149 397 ALA 53 O 0.0052 0.0139 0.0139 398 ALA 53 CB 0.0037 0.0107 0.0154 399 SER 54 N 0.0047 0.0144 0.0153 400 SER 54 CA 0.0048 0.0147 0.0158 401 SER 54 C 0.0044 0.0134 0.0158 402 SER 54 O 0.0044 0.0133 0.0152 403 SER 54 CB 0.0050 0.0153 0.0174 404 SER 54 OG 0.0054 0.0167 0.0174 405 THR 55 N 0.0028 0.0119 0.0139 406 THR 55 CA 0.0019 0.0118 0.0143 407 THR 55 C 0.0012 0.0117 0.0135 408 THR 55 O 0.0013 0.0117 0.0130 409 THR 55 CB 0.0016 0.0117 0.0152 410 THR 55 OG1 0.0022 0.0118 0.0160 411 THR 55 CG2 0.0005 0.0116 0.0155 412 VAL 56 N -0.0036 0.0099 0.0115 413 VAL 56 CA -0.0040 0.0088 0.0115 414 VAL 56 C -0.0045 0.0092 0.0117 415 VAL 56 O -0.0039 0.0097 0.0116 416 VAL 56 CB -0.0030 0.0080 0.0110 417 VAL 56 CG1 -0.0034 0.0069 0.0109 418 VAL 56 CG2 -0.0024 0.0076 0.0107 419 HIS 57 N -0.0019 0.0157 0.0066 420 HIS 57 CA -0.0033 0.0159 0.0074 421 HIS 57 C -0.0043 0.0151 0.0065 422 HIS 57 O -0.0047 0.0144 0.0056 423 HIS 57 CB -0.0042 0.0161 0.0079 424 HIS 57 CG -0.0034 0.0169 0.0088 425 HIS 57 ND1 -0.0033 0.0177 0.0100 426 HIS 57 CD2 -0.0026 0.0169 0.0086 427 HIS 57 CE1 -0.0025 0.0182 0.0105 428 HIS 57 NE2 -0.0021 0.0178 0.0097 429 TRP 58 N -0.0139 0.0029 0.0048 430 TRP 58 CA -0.0132 0.0019 0.0050 431 TRP 58 C -0.0123 0.0007 0.0053 432 TRP 58 O -0.0121 0.0002 0.0044 433 TRP 58 CB -0.0132 0.0017 0.0035 434 TRP 58 CG -0.0127 0.0009 0.0037 435 TRP 58 CD1 -0.0123 0.0006 0.0050 436 TRP 58 CD2 -0.0124 0.0002 0.0024 437 TRP 58 NE1 -0.0118 -0.0002 0.0046 438 TRP 58 CE2 -0.0119 -0.0004 0.0031 439 TRP 58 CE3 -0.0126 0.0002 0.0009 440 TRP 58 CZ2 -0.0115 -0.0012 0.0022 441 TRP 58 CZ3 -0.0122 -0.0006 -0.0000 442 TRP 58 CH2 -0.0117 -0.0012 0.0006 443 ILE 59 N -0.0106 0.0125 -0.0004 444 ILE 59 CA -0.0102 0.0125 -0.0005 445 ILE 59 C -0.0109 0.0131 -0.0005 446 ILE 59 O -0.0110 0.0141 -0.0007 447 ILE 59 CB -0.0092 0.0128 -0.0008 448 ILE 59 CG1 -0.0085 0.0120 -0.0009 449 ILE 59 CG2 -0.0088 0.0128 -0.0010 450 ILE 59 CD1 -0.0074 0.0124 -0.0012 451 THR 60 N -0.0131 0.0036 -0.0039 452 THR 60 CA -0.0102 0.0045 -0.0025 453 THR 60 C -0.0076 0.0056 -0.0044 454 THR 60 O -0.0078 0.0057 -0.0074 455 THR 60 CB -0.0098 0.0046 -0.0022 456 THR 60 OG1 -0.0098 0.0049 -0.0053 457 THR 60 CG2 -0.0125 0.0035 -0.0004 458 PRO 61 N -0.0035 0.0043 -0.0082 459 PRO 61 CA 0.0014 0.0048 -0.0109 460 PRO 61 C 0.0038 0.0047 -0.0139 461 PRO 61 O 0.0078 0.0051 -0.0165 462 PRO 61 CB 0.0049 0.0063 -0.0065 463 PRO 61 CG 0.0029 0.0067 -0.0019 464 PRO 61 CD -0.0029 0.0055 -0.0025 465 LYS 62 N 0.0032 -0.0006 -0.0130 466 LYS 62 CA 0.0060 -0.0007 -0.0169 467 LYS 62 C 0.0017 -0.0004 -0.0183 468 LYS 62 O -0.0028 -0.0001 -0.0159 469 LYS 62 CB 0.0115 -0.0011 -0.0143 470 LYS 62 CG 0.0105 -0.0011 -0.0095 471 LYS 62 CD 0.0159 -0.0015 -0.0066 472 LYS 62 CE 0.0183 -0.0017 -0.0022 473 LYS 62 NZ 0.0232 -0.0021 0.0006 474 ASP 63 N 0.0009 -0.0039 -0.0207 475 ASP 63 CA -0.0044 -0.0041 -0.0223 476 ASP 63 C -0.0067 -0.0033 -0.0158 477 ASP 63 O -0.0020 -0.0028 -0.0116 478 ASP 63 CB -0.0014 -0.0049 -0.0286 479 ASP 63 CG -0.0055 -0.0050 -0.0302 480 ASP 63 OD1 -0.0045 -0.0045 -0.0258 481 ASP 63 OD2 -0.0094 -0.0057 -0.0356 482 PRO 64 N -0.0112 -0.0058 -0.0101 483 PRO 64 CA -0.0117 -0.0062 -0.0074 484 PRO 64 C -0.0099 -0.0065 -0.0086 485 PRO 64 O -0.0098 -0.0070 -0.0063 486 PRO 64 CB -0.0159 -0.0051 -0.0069 487 PRO 64 CG -0.0176 -0.0042 -0.0089 488 PRO 64 CD -0.0146 -0.0045 -0.0119 489 HIS 65 N -0.0100 -0.0099 -0.0131 490 HIS 65 CA -0.0094 -0.0093 -0.0115 491 HIS 65 C -0.0054 -0.0071 -0.0093 492 HIS 65 O -0.0047 -0.0064 -0.0069 493 HIS 65 CB -0.0095 -0.0100 -0.0151 494 HIS 65 CG -0.0136 -0.0122 -0.0170 495 HIS 65 ND1 -0.0141 -0.0132 -0.0211 496 HIS 65 CD2 -0.0172 -0.0134 -0.0154 497 HIS 65 CE1 -0.0179 -0.0150 -0.0219 498 HIS 65 NE2 -0.0199 -0.0152 -0.0186 499 THR 66 N -0.0009 -0.0066 -0.0122 500 THR 66 CA 0.0036 -0.0064 -0.0081 501 THR 66 C 0.0024 -0.0067 -0.0021 502 THR 66 O 0.0064 -0.0065 0.0010 503 THR 66 CB 0.0054 -0.0062 -0.0077 504 THR 66 OG1 0.0008 -0.0067 -0.0064 505 THR 66 CG2 0.0080 -0.0057 -0.0132 506 LEU 67 N -0.0034 -0.0122 -0.0001 507 LEU 67 CA -0.0043 -0.0132 0.0044 508 LEU 67 C -0.0048 -0.0136 0.0060 509 LEU 67 O -0.0065 -0.0149 0.0093 510 LEU 67 CB -0.0079 -0.0153 0.0054 511 LEU 67 CG -0.0075 -0.0151 0.0057 512 LEU 67 CD1 -0.0112 -0.0173 0.0073 513 LEU 67 CD2 -0.0042 -0.0136 0.0087 514 ASP 68 N -0.0043 -0.0124 0.0045 515 ASP 68 CA -0.0009 -0.0118 0.0026 516 ASP 68 C -0.0097 -0.0130 0.0057 517 ASP 68 O -0.0084 -0.0145 0.0136 518 ASP 68 CB 0.0112 -0.0120 0.0077 519 ASP 68 CG 0.0169 -0.0105 0.0019 520 ASP 68 OD1 0.0181 -0.0115 0.0074 521 ASP 68 OD2 0.0201 -0.0083 -0.0081 522 GLY 69 N -0.0144 -0.0154 0.0020 523 GLY 69 CA -0.0183 -0.0176 0.0036 524 GLY 69 C -0.0207 -0.0187 0.0058 525 GLY 69 O -0.0242 -0.0208 0.0063 526 HIS 70 N -0.0162 -0.0187 0.0079 527 HIS 70 CA -0.0172 -0.0198 0.0084 528 HIS 70 C -0.0186 -0.0192 0.0082 529 HIS 70 O -0.0192 -0.0197 0.0084 530 HIS 70 CB -0.0175 -0.0209 0.0089 531 HIS 70 CG -0.0178 -0.0223 0.0096 532 HIS 70 ND1 -0.0193 -0.0227 0.0098 533 HIS 70 CD2 -0.0168 -0.0234 0.0101 534 HIS 70 CE1 -0.0192 -0.0240 0.0105 535 HIS 70 NE2 -0.0177 -0.0245 0.0107 536 ALA 71 N -0.0204 -0.0149 0.0051 537 ALA 71 CA -0.0224 -0.0150 0.0039 538 ALA 71 C -0.0238 -0.0149 0.0018 539 ALA 71 O -0.0255 -0.0150 0.0007 540 ALA 71 CB -0.0213 -0.0147 0.0027 541 ASP 72 N -0.0267 -0.0163 0.0004 542 ASP 72 CA -0.0291 -0.0182 -0.0024 543 ASP 72 C -0.0325 -0.0172 -0.0023 544 ASP 72 O -0.0334 -0.0186 -0.0041 545 ASP 72 CB -0.0305 -0.0191 -0.0038 546 ASP 72 CG -0.0273 -0.0208 -0.0048 547 ASP 72 OD1 -0.0239 -0.0211 -0.0041 548 ASP 72 OD2 -0.0282 -0.0218 -0.0062 549 GLU 73 N -0.0308 -0.0128 -0.0015 550 GLU 73 CA -0.0312 -0.0118 -0.0015 551 GLU 73 C -0.0290 -0.0116 -0.0009 552 GLU 73 O -0.0289 -0.0122 -0.0009 553 GLU 73 CB -0.0323 -0.0094 -0.0015 554 GLU 73 CG -0.0330 -0.0082 -0.0016 555 GLU 73 CD -0.0341 -0.0059 -0.0017 556 GLU 73 OE1 -0.0343 -0.0051 -0.0016 557 GLU 73 OE2 -0.0347 -0.0048 -0.0017 558 LEU 74 N -0.0213 -0.0082 0.0015 559 LEU 74 CA -0.0184 -0.0074 0.0042 560 LEU 74 C -0.0173 -0.0100 0.0062 561 LEU 74 O -0.0155 -0.0089 0.0077 562 LEU 74 CB -0.0173 -0.0075 0.0054 563 LEU 74 CG -0.0141 -0.0068 0.0084 564 LEU 74 CD1 -0.0126 -0.0029 0.0085 565 LEU 74 CD2 -0.0133 -0.0074 0.0093 566 LEU 75 N -0.0240 -0.0094 0.0012 567 LEU 75 CA -0.0237 -0.0104 0.0019 568 LEU 75 C -0.0234 -0.0120 0.0035 569 LEU 75 O -0.0228 -0.0131 0.0040 570 LEU 75 CB -0.0251 -0.0093 0.0024 571 LEU 75 CG -0.0251 -0.0078 0.0008 572 LEU 75 CD1 -0.0267 -0.0066 0.0014 573 LEU 75 CD2 -0.0238 -0.0085 -0.0002 574 ALA 76 N -0.0277 -0.0151 0.0047 575 ALA 76 CA -0.0297 -0.0153 0.0033 576 ALA 76 C -0.0253 -0.0088 0.0046 577 ALA 76 O -0.0257 -0.0089 0.0043 578 ALA 76 CB -0.0372 -0.0140 -0.0026 579 HIS 77 N -0.0132 0.0001 0.0112 580 HIS 77 CA -0.0092 0.0031 0.0114 581 HIS 77 C -0.0074 0.0039 0.0165 582 HIS 77 O -0.0093 0.0023 0.0194 583 HIS 77 CB -0.0090 0.0035 0.0083 584 HIS 77 CG -0.0049 0.0066 0.0068 585 HIS 77 ND1 -0.0022 0.0083 0.0102 586 HIS 77 CD2 -0.0032 0.0083 0.0025 587 HIS 77 CE1 0.0012 0.0109 0.0080 588 HIS 77 NE2 0.0007 0.0110 0.0033 589 PRO 78 N -0.0038 0.0085 0.0169 590 PRO 78 CA -0.0012 0.0090 0.0240 591 PRO 78 C -0.0001 0.0092 0.0228 592 PRO 78 O 0.0005 0.0093 0.0285 593 PRO 78 CB 0.0066 0.0105 0.0263 594 PRO 78 CG 0.0064 0.0105 0.0223 595 PRO 78 CD 0.0018 0.0096 0.0147 596 SER 79 N -0.0008 0.0090 0.0181 597 SER 79 CA 0.0004 0.0094 0.0172 598 SER 79 C -0.0023 0.0091 0.0172 599 SER 79 O -0.0016 0.0093 0.0170 600 SER 79 CB 0.0018 0.0106 0.0138 601 SER 79 OG 0.0044 0.0110 0.0135 602 VAL 80 N -0.0073 0.0059 0.0134 603 VAL 80 CA -0.0087 0.0045 0.0138 604 VAL 80 C -0.0094 0.0044 0.0157 605 VAL 80 O -0.0093 0.0046 0.0161 606 VAL 80 CB -0.0093 0.0033 0.0122 607 VAL 80 CG1 -0.0109 0.0018 0.0128 608 VAL 80 CG2 -0.0088 0.0034 0.0105 609 LYS 81 N -0.0043 0.0112 0.0075 610 LYS 81 CA -0.0061 0.0121 0.0090 611 LYS 81 C -0.0086 0.0123 0.0079 612 LYS 81 O -0.0093 0.0117 0.0059 613 LYS 81 CB -0.0057 0.0122 0.0094 614 LYS 81 CG -0.0034 0.0123 0.0110 615 LYS 81 CD -0.0034 0.0125 0.0117 616 LYS 81 CE -0.0013 0.0127 0.0135 617 LYS 81 NZ 0.0011 0.0118 0.0123 618 LEU 82 N -0.0122 0.0115 -0.0052 619 LEU 82 CA -0.0130 0.0089 -0.0051 620 LEU 82 C -0.0130 0.0074 -0.0023 621 LEU 82 O -0.0131 0.0068 -0.0014 622 LEU 82 CB -0.0139 0.0071 -0.0075 623 LEU 82 CG -0.0147 0.0041 -0.0075 624 LEU 82 CD1 -0.0148 0.0041 -0.0081 625 LEU 82 CD2 -0.0156 0.0025 -0.0096 626 TRP 83 N -0.0076 0.0173 -0.0113 627 TRP 83 CA -0.0109 0.0168 -0.0085 628 TRP 83 C -0.0130 0.0135 -0.0095 629 TRP 83 O -0.0149 0.0109 -0.0102 630 TRP 83 CB -0.0122 0.0168 -0.0072 631 TRP 83 CG -0.0100 0.0201 -0.0063 632 TRP 83 CD1 -0.0075 0.0208 -0.0081 633 TRP 83 CD2 -0.0102 0.0231 -0.0032 634 TRP 83 NE1 -0.0061 0.0241 -0.0063 635 TRP 83 CE2 -0.0077 0.0256 -0.0034 636 TRP 83 CE3 -0.0123 0.0239 -0.0005 637 TRP 83 CZ2 -0.0072 0.0288 -0.0008 638 TRP 83 CZ3 -0.0118 0.0272 0.0021 639 TRP 83 CH2 -0.0093 0.0296 0.0020 640 GLU 84 N -0.0177 0.0055 -0.0180 641 GLU 84 CA -0.0120 0.0040 -0.0172 642 GLU 84 C -0.0063 0.0024 -0.0172 643 GLU 84 O -0.0061 0.0013 -0.0204 644 GLU 84 CB -0.0117 0.0024 -0.0221 645 GLU 84 CG -0.0111 0.0002 -0.0288 646 GLU 84 CD -0.0088 -0.0018 -0.0331 647 GLU 84 OE1 -0.0088 -0.0012 -0.0314 648 GLU 84 OE2 -0.0065 -0.0039 -0.0379 649 LYS 85 N -0.0118 0.0051 -0.0227 650 LYS 85 CA -0.0015 0.0046 -0.0238 651 LYS 85 C -0.0043 0.0047 -0.0234 652 LYS 85 O 0.0010 0.0035 -0.0294 653 LYS 85 CB 0.0058 0.0024 -0.0347 654 LYS 85 CG 0.0093 0.0021 -0.0363 655 LYS 85 CD 0.0196 0.0003 -0.0446 656 LYS 85 CE 0.0184 -0.0011 -0.0529 657 LYS 85 NZ 0.0119 -0.0028 -0.0634 658 THR 86 N -0.0082 0.0140 -0.0210 659 THR 86 CA -0.0071 0.0146 -0.0200 660 THR 86 C -0.0062 0.0167 -0.0177 661 THR 86 O -0.0073 0.0180 -0.0169 662 THR 86 CB -0.0088 0.0147 -0.0206 663 THR 86 OG1 -0.0110 0.0167 -0.0198 664 THR 86 CG2 -0.0099 0.0127 -0.0229 665 ARG 87 N 0.0018 0.0214 -0.0209 666 ARG 87 CA 0.0045 0.0282 -0.0253 667 ARG 87 C 0.0098 0.0235 -0.0299 668 ARG 87 O 0.0141 0.0174 -0.0330 669 ARG 87 CB 0.0073 0.0350 -0.0299 670 ARG 87 CG 0.0069 0.0447 -0.0318 671 ARG 87 CD 0.0127 0.0496 -0.0390 672 ARG 87 NE 0.0123 0.0523 -0.0392 673 ARG 87 CZ 0.0103 0.0609 -0.0391 674 ARG 87 NH1 0.0079 0.0678 -0.0383 675 ARG 87 NH2 0.0106 0.0627 -0.0399 676 LEU 88 N 0.0202 0.0311 -0.0251 677 LEU 88 CA 0.0168 0.0271 -0.0266 678 LEU 88 C 0.0166 0.0283 -0.0299 679 LEU 88 O 0.0184 0.0300 -0.0281 680 LEU 88 CB 0.0160 0.0235 -0.0217 681 LEU 88 CG 0.0126 0.0191 -0.0224 682 LEU 88 CD1 0.0096 0.0169 -0.0265 683 LEU 88 CD2 0.0120 0.0158 -0.0172 684 ILE 89 N 0.0174 0.0362 -0.0291 685 ILE 89 CA 0.0154 0.0358 -0.0291 686 ILE 89 C 0.0138 0.0340 -0.0286 687 ILE 89 O 0.0127 0.0327 -0.0282 688 ILE 89 CB 0.0139 0.0380 -0.0298 689 ILE 89 CG1 0.0154 0.0400 -0.0303 690 ILE 89 CG2 0.0117 0.0376 -0.0297 691 ILE 89 CD1 0.0165 0.0395 -0.0301 692 ARG 90 N 0.0105 0.0324 -0.0242 693 ARG 90 CA 0.0061 0.0278 -0.0243 694 ARG 90 C 0.0069 0.0252 -0.0229 695 ARG 90 O 0.0091 0.0281 -0.0231 696 ARG 90 CB 0.0005 0.0303 -0.0276 697 ARG 90 CG -0.0050 0.0262 -0.0283 698 ARG 90 CD -0.0100 0.0292 -0.0316 699 ARG 90 NE -0.0092 0.0307 -0.0318 700 ARG 90 CZ -0.0081 0.0359 -0.0335 701 ARG 90 NH1 -0.0081 0.0406 -0.0353 702 ARG 90 NH2 -0.0071 0.0365 -0.0333 703 ILE 91 N 0.0026 0.0164 -0.0203 704 ILE 91 CA 0.0027 0.0147 -0.0197 705 ILE 91 C -0.0024 0.0141 -0.0206 706 ILE 91 O -0.0054 0.0124 -0.0206 707 ILE 91 CB 0.0052 0.0102 -0.0179 708 ILE 91 CG1 0.0103 0.0111 -0.0171 709 ILE 91 CG2 0.0050 0.0082 -0.0173 710 ILE 91 CD1 0.0128 0.0068 -0.0153 711 LYS 92 N 0.0032 0.0192 -0.0173 712 LYS 92 CA -0.0015 0.0185 -0.0199 713 LYS 92 C -0.0021 0.0141 -0.0190 714 LYS 92 O 0.0011 0.0131 -0.0166 715 LYS 92 CB -0.0026 0.0234 -0.0221 716 LYS 92 CG -0.0026 0.0283 -0.0236 717 LYS 92 CD -0.0033 0.0329 -0.0255 718 LYS 92 CE -0.0069 0.0361 -0.0287 719 LYS 92 NZ -0.0053 0.0392 -0.0287 720 GLY 93 N -0.0059 0.0089 -0.0123 721 GLY 93 CA 0.0006 0.0112 -0.0148 722 GLY 93 C -0.0007 0.0127 -0.0119 723 GLY 93 O -0.0063 0.0133 -0.0068 724 GLU 94 N 0.0090 0.0072 -0.0075 725 GLU 94 CA 0.0098 0.0106 -0.0039 726 GLU 94 C 0.0123 0.0036 -0.0158 727 GLU 94 O 0.0128 -0.0038 -0.0260 728 GLU 94 CB 0.0206 0.0231 0.0010 729 GLU 94 CG 0.0194 0.0311 0.0128 730 GLU 94 CD 0.0307 0.0431 0.0166 731 GLU 94 OE1 0.0286 0.0503 0.0283 732 GLU 94 OE2 0.0415 0.0450 0.0077 733 GLU 95 N 0.0379 -0.0112 -0.0296 734 GLU 95 CA 0.0339 0.0070 -0.0176 735 GLU 95 C 0.0149 0.0159 -0.0272 736 GLU 95 O 0.0128 0.0224 -0.0234 737 GLU 95 CB 0.0347 0.0211 -0.0046 738 GLU 95 CG 0.0327 0.0401 0.0101 739 GLU 95 CD 0.0510 0.0385 0.0254 740 GLU 95 OE1 0.0640 0.0346 0.0339 741 GLU 95 OE2 0.0522 0.0408 0.0285 742 ALA 96 N 0.0236 0.0140 -0.0207 743 ALA 96 CA 0.0294 0.0146 -0.0244 744 ALA 96 C 0.0260 0.0123 -0.0270 745 ALA 96 O 0.0285 0.0106 -0.0333 746 ALA 96 CB 0.0355 0.0192 -0.0188 747 GLY 97 N 0.0163 0.0030 -0.0257 748 GLY 97 CA 0.0135 0.0022 -0.0265 749 GLY 97 C 0.0109 0.0032 -0.0222 750 GLY 97 O 0.0101 0.0043 -0.0188 751 VAL 98 N 0.0075 0.0020 -0.0154 752 VAL 98 CA 0.0069 0.0053 -0.0134 753 VAL 98 C 0.0085 0.0073 -0.0115 754 VAL 98 O 0.0114 0.0063 -0.0109 755 VAL 98 CB 0.0083 0.0057 -0.0126 756 VAL 98 CG1 0.0077 0.0092 -0.0105 757 VAL 98 CG2 0.0066 0.0040 -0.0145 758 THR 99 N 0.0077 0.0124 -0.0170 759 THR 99 CA 0.0085 0.0134 -0.0157 760 THR 99 C 0.0083 0.0155 -0.0144 761 THR 99 O 0.0094 0.0164 -0.0130 762 THR 99 CB 0.0074 0.0136 -0.0164 763 THR 99 OG1 0.0053 0.0145 -0.0172 764 THR 99 CG2 0.0077 0.0115 -0.0176 765 ALA 100 N 0.0082 0.0199 -0.0168 766 ALA 100 CA 0.0096 0.0244 -0.0161 767 ALA 100 C 0.0098 0.0246 -0.0159 768 ALA 100 O 0.0083 0.0216 -0.0167 769 ALA 100 CB 0.0065 0.0283 -0.0174 770 VAL 101 N 0.0099 0.0268 -0.0165 771 VAL 101 CA 0.0104 0.0287 -0.0164 772 VAL 101 C 0.0097 0.0325 -0.0177 773 VAL 101 O 0.0098 0.0341 -0.0179 774 VAL 101 CB 0.0136 0.0288 -0.0141 775 VAL 101 CG1 0.0142 0.0250 -0.0129 776 VAL 101 CG2 0.0157 0.0306 -0.0127 777 GLU 102 N 0.0148 0.0426 -0.0208 778 GLU 102 CA 0.0149 0.0428 -0.0210 779 GLU 102 C 0.0163 0.0420 -0.0216 780 GLU 102 O 0.0167 0.0406 -0.0212 781 GLU 102 CB 0.0139 0.0423 -0.0197 782 GLU 102 CG 0.0137 0.0426 -0.0198 783 GLU 102 CD 0.0128 0.0419 -0.0185 784 GLU 102 OE1 0.0120 0.0416 -0.0176 785 GLU 102 OE2 0.0129 0.0416 -0.0185 786 VAL 103 N 0.0150 0.0374 -0.0194 787 VAL 103 CA 0.0147 0.0378 -0.0190 788 VAL 103 C 0.0148 0.0378 -0.0191 789 VAL 103 O 0.0150 0.0373 -0.0194 790 VAL 103 CB 0.0142 0.0376 -0.0184 791 VAL 103 CG1 0.0141 0.0376 -0.0182 792 VAL 103 CG2 0.0141 0.0369 -0.0183 793 ARG 104 N 0.0158 0.0284 -0.0262 794 ARG 104 CA 0.0154 0.0222 -0.0235 795 ARG 104 C 0.0130 0.0166 -0.0290 796 ARG 104 O 0.0119 0.0151 -0.0326 797 ARG 104 CB 0.0165 0.0190 -0.0167 798 ARG 104 CG 0.0161 0.0122 -0.0134 799 ARG 104 CD 0.0167 0.0082 -0.0079 800 ARG 104 NE 0.0191 0.0126 -0.0014 801 ARG 104 CZ 0.0202 0.0110 0.0042 802 ARG 104 NH1 0.0192 0.0057 0.0043 803 ARG 104 NH2 0.0223 0.0149 0.0100 804 HIS 105 N 0.0066 0.0098 -0.0280 805 HIS 105 CA 0.0052 0.0032 -0.0326 806 HIS 105 C 0.0045 -0.0041 -0.0289 807 HIS 105 O 0.0050 -0.0052 -0.0221 808 HIS 105 CB 0.0050 0.0026 -0.0340 809 HIS 105 CG 0.0039 0.0001 -0.0417 810 HIS 105 ND1 0.0041 0.0054 -0.0475 811 HIS 105 CD2 0.0026 -0.0069 -0.0443 812 HIS 105 CE1 0.0030 0.0015 -0.0535 813 HIS 105 NE2 0.0020 -0.0060 -0.0519 814 PRO 106 N -0.0034 -0.0068 -0.0262 815 PRO 106 CA -0.0015 -0.0136 -0.0221 816 PRO 106 C 0.0002 -0.0281 -0.0154 817 PRO 106 O -0.0067 -0.0369 -0.0184 818 PRO 106 CB -0.0117 -0.0133 -0.0312 819 PRO 106 CG -0.0156 -0.0008 -0.0392 820 PRO 106 CD -0.0130 -0.0010 -0.0369 821 GLY 107 N -0.0120 -0.0407 -0.0085 822 GLY 107 CA -0.0126 -0.0527 0.0033 823 GLY 107 C -0.0075 -0.0451 0.0147 824 GLY 107 O -0.0065 -0.0532 0.0280 825 GLU 108 N -0.0078 -0.0350 0.0067 826 GLU 108 CA 0.0007 -0.0285 0.0201 827 GLU 108 C 0.0062 -0.0252 0.0335 828 GLU 108 O 0.0078 -0.0266 0.0485 829 GLU 108 CB 0.0106 -0.0162 0.0125 830 GLU 108 CG 0.0069 -0.0188 0.0055 831 GLU 108 CD 0.0056 -0.0230 0.0191 832 GLU 108 OE1 0.0093 -0.0220 0.0343 833 GLU 108 OE2 0.0009 -0.0270 0.0141 834 SER 109 N 0.0075 -0.0269 0.0253 835 SER 109 CA 0.0079 -0.0244 0.0409 836 SER 109 C 0.0221 -0.0059 0.0462 837 SER 109 O 0.0253 -0.0013 0.0500 838 SER 109 CB -0.0021 -0.0342 0.0619 839 SER 109 OG -0.0036 -0.0347 0.0725 840 ASP 110 N 0.0142 -0.0078 0.0398 841 ASP 110 CA 0.0292 0.0098 0.0426 842 ASP 110 C 0.0310 0.0240 0.0217 843 ASP 110 O 0.0209 0.0202 0.0059 844 ASP 110 CB 0.0337 0.0080 0.0557 845 ASP 110 CG 0.0367 -0.0012 0.0785 846 ASP 110 OD1 0.0475 0.0072 0.0880 847 ASP 110 OD2 0.0284 -0.0163 0.0866 848 SER 111 N 0.0196 0.0354 0.0109 849 SER 111 CA 0.0206 0.0419 0.0024 850 SER 111 C 0.0237 0.0500 0.0002 851 SER 111 O 0.0264 0.0527 0.0069 852 SER 111 CB 0.0231 0.0466 0.0042 853 SER 111 OG 0.0205 0.0399 0.0059 854 GLN 112 N 0.0227 0.0535 -0.0195 855 GLN 112 CA 0.0196 0.0508 -0.0190 856 GLN 112 C 0.0190 0.0541 -0.0182 857 GLN 112 O 0.0181 0.0586 -0.0172 858 GLN 112 CB 0.0145 0.0493 -0.0177 859 GLN 112 CG 0.0120 0.0446 -0.0178 860 GLN 112 CD 0.0065 0.0446 -0.0161 861 GLN 112 OE1 0.0040 0.0472 -0.0149 862 GLN 112 NE2 0.0044 0.0415 -0.0160 863 GLU 113 N 0.0130 0.0545 -0.0192 864 GLU 113 CA 0.0118 0.0490 -0.0181 865 GLU 113 C 0.0137 0.0463 -0.0145 866 GLU 113 O 0.0137 0.0469 -0.0148 867 GLU 113 CB 0.0076 0.0465 -0.0220 868 GLU 113 CG 0.0062 0.0409 -0.0211 869 GLU 113 CD 0.0023 0.0390 -0.0251 870 GLU 113 OE1 0.0014 0.0410 -0.0271 871 GLU 113 OE2 0.0001 0.0354 -0.0260 872 LEU 114 N 0.0113 0.0303 -0.0117 873 LEU 114 CA 0.0110 0.0290 -0.0099 874 LEU 114 C 0.0124 0.0285 -0.0116 875 LEU 114 O 0.0124 0.0304 -0.0133 876 LEU 114 CB 0.0087 0.0307 -0.0082 877 LEU 114 CG 0.0071 0.0311 -0.0061 878 LEU 114 CD1 0.0049 0.0333 -0.0050 879 LEU 114 CD2 0.0072 0.0285 -0.0038 880 LEU 115 N 0.0115 0.0245 -0.0094 881 LEU 115 CA 0.0100 0.0204 -0.0087 882 LEU 115 C 0.0109 0.0193 -0.0039 883 LEU 115 O 0.0122 0.0200 -0.0008 884 LEU 115 CB 0.0080 0.0169 -0.0101 885 LEU 115 CG 0.0069 0.0178 -0.0150 886 LEU 115 CD1 0.0057 0.0154 -0.0156 887 LEU 115 CD2 0.0054 0.0166 -0.0183 888 ALA 116 N 0.0070 0.0140 0.0006 889 ALA 116 CA 0.0073 0.0136 0.0037 890 ALA 116 C 0.0069 0.0115 0.0024 891 ALA 116 O 0.0066 0.0117 -0.0008 892 ALA 116 CB 0.0079 0.0174 0.0053 893 GLU 117 N 0.0089 0.0088 0.0075 894 GLU 117 CA 0.0077 0.0067 0.0085 895 GLU 117 C 0.0092 0.0051 0.0098 896 GLU 117 O 0.0083 0.0034 0.0107 897 GLU 117 CB 0.0070 0.0060 0.0088 898 GLU 117 CG 0.0050 0.0072 0.0076 899 GLU 117 CD 0.0049 0.0072 0.0075 900 GLU 117 OE1 0.0064 0.0084 0.0071 901 GLU 117 OE2 0.0033 0.0060 0.0079 902 GLY 118 N 0.0073 0.0056 0.0120 903 GLY 118 CA 0.0077 0.0029 0.0104 904 GLY 118 C 0.0059 0.0039 0.0110 905 GLY 118 O 0.0066 0.0067 0.0126 906 VAL 119 N 0.0033 -0.0003 0.0081 907 VAL 119 CA 0.0052 0.0016 0.0079 908 VAL 119 C 0.0071 0.0003 0.0101 909 VAL 119 O 0.0063 -0.0016 0.0109 910 VAL 119 CB 0.0040 0.0027 0.0063 911 VAL 119 CG1 0.0062 0.0048 0.0061 912 VAL 119 CG2 0.0019 0.0038 0.0041 913 PHE 120 N -0.0011 -0.0057 0.0143 914 PHE 120 CA 0.0002 -0.0072 0.0142 915 PHE 120 C 0.0001 -0.0070 0.0142 916 PHE 120 O 0.0007 -0.0055 0.0143 917 PHE 120 CB 0.0023 -0.0070 0.0142 918 PHE 120 CG 0.0024 -0.0075 0.0141 919 PHE 120 CD1 0.0020 -0.0061 0.0142 920 PHE 120 CD2 0.0030 -0.0094 0.0140 921 PHE 120 CE1 0.0021 -0.0065 0.0142 922 PHE 120 CE2 0.0032 -0.0098 0.0139 923 PHE 120 CZ 0.0028 -0.0084 0.0140 924 VAL 121 N -0.0035 -0.0133 0.0097 925 VAL 121 CA -0.0007 -0.0147 0.0097 926 VAL 121 C -0.0006 -0.0143 0.0104 927 VAL 121 O -0.0008 -0.0126 0.0124 928 VAL 121 CB 0.0017 -0.0145 0.0116 929 VAL 121 CG1 0.0046 -0.0161 0.0114 930 VAL 121 CG2 0.0016 -0.0149 0.0110 931 TYR 122 N -0.0077 -0.0202 0.0163 932 TYR 122 CA -0.0081 -0.0219 0.0136 933 TYR 122 C -0.0099 -0.0244 0.0143 934 TYR 122 O -0.0102 -0.0250 0.0140 935 TYR 122 CB -0.0067 -0.0208 0.0115 936 TYR 122 CG -0.0049 -0.0184 0.0109 937 TYR 122 CD1 -0.0044 -0.0183 0.0092 938 TYR 122 CD2 -0.0038 -0.0161 0.0121 939 TYR 122 CE1 -0.0027 -0.0160 0.0088 940 TYR 122 CE2 -0.0021 -0.0138 0.0117 941 TYR 122 CZ -0.0016 -0.0137 0.0101 942 TYR 122 OH 0.0001 -0.0114 0.0097 943 LEU 123 N -0.0121 -0.0327 0.0126 944 LEU 123 CA -0.0109 -0.0359 0.0131 945 LEU 123 C -0.0103 -0.0371 0.0137 946 LEU 123 O -0.0103 -0.0359 0.0157 947 LEU 123 CB -0.0100 -0.0366 0.0158 948 LEU 123 CG -0.0105 -0.0355 0.0155 949 LEU 123 CD1 -0.0097 -0.0358 0.0185 950 LEU 123 CD2 -0.0105 -0.0371 0.0128 951 GLN 124 N -0.0310 -0.0574 0.0131 952 GLN 124 CA -0.0387 -0.0525 0.0047 953 GLN 124 C -0.0303 -0.0562 0.0132 954 GLN 124 O -0.0232 -0.0692 0.0246 955 GLN 124 CB -0.0568 -0.0632 -0.0057 956 GLN 124 CG -0.0656 -0.0569 -0.0157 957 GLN 124 CD -0.0828 -0.0696 -0.0243 958 GLN 124 OE1 -0.0855 -0.0872 -0.0191 959 GLN 124 NE2 -0.0946 -0.0603 -0.0381 960 GLY 125 N -0.0246 -0.0394 0.0334 961 GLY 125 CA -0.0124 -0.0290 0.0263 962 GLY 125 C -0.0135 -0.0124 0.0319 963 GLY 125 O -0.0238 -0.0084 0.0416 964 SER 126 N -0.0120 0.0055 0.0255 965 SER 126 CA -0.0139 0.0204 0.0245 966 SER 126 C -0.0114 0.0155 0.0148 967 SER 126 O -0.0118 0.0275 0.0073 968 SER 126 CB -0.0144 0.0372 0.0139 969 SER 126 OG -0.0103 0.0333 -0.0047 970 LYS 127 N -0.0178 -0.0017 0.0143 971 LYS 127 CA -0.0103 -0.0071 -0.0022 972 LYS 127 C -0.0019 -0.0157 0.0007 973 LYS 127 O -0.0020 -0.0174 0.0163 974 LYS 127 CB -0.0011 -0.0154 -0.0090 975 LYS 127 CG -0.0082 -0.0081 -0.0115 976 LYS 127 CD -0.0152 0.0006 -0.0293 977 LYS 127 CE -0.0276 0.0125 -0.0273 978 LYS 127 NZ -0.0393 0.0239 -0.0272 979 LYS 127 OXT 0.0057 -0.0217 -0.0124