1 GLY 5 N 0.0087 -0.0045 0.0137 2 GLY 5 CA 0.0077 -0.0032 0.0155 3 GLY 5 C 0.0066 -0.0019 0.0145 4 GLY 5 O 0.0060 -0.0012 0.0124 5 LEU 6 N 0.0063 -0.0015 0.0159 6 LEU 6 CA 0.0053 -0.0003 0.0152 7 LEU 6 C 0.0062 -0.0014 0.0153 8 LEU 6 O 0.0071 -0.0025 0.0170 9 LEU 6 CB 0.0039 0.0015 0.0168 10 LEU 6 CG 0.0025 0.0032 0.0158 11 LEU 6 CD1 0.0021 0.0036 0.0131 12 LEU 6 CD2 0.0010 0.0050 0.0174 13 TYR 7 N 0.0072 -0.0010 0.0100 14 TYR 7 CA 0.0078 -0.0021 0.0102 15 TYR 7 C 0.0072 -0.0010 0.0097 16 TYR 7 O 0.0064 0.0004 0.0086 17 TYR 7 CB 0.0085 -0.0039 0.0087 18 TYR 7 CG 0.0094 -0.0054 0.0094 19 TYR 7 CD1 0.0092 -0.0053 0.0091 20 TYR 7 CD2 0.0102 -0.0071 0.0103 21 TYR 7 CE1 0.0100 -0.0067 0.0098 22 TYR 7 CE2 0.0110 -0.0085 0.0109 23 TYR 7 CZ 0.0108 -0.0083 0.0107 24 TYR 7 OH 0.0116 -0.0097 0.0113 25 ARG 8 N 0.0076 -0.0016 0.0106 26 ARG 8 CA 0.0071 -0.0006 0.0103 27 ARG 8 C 0.0078 -0.0021 0.0096 28 ARG 8 O 0.0086 -0.0036 0.0106 29 ARG 8 CB 0.0068 0.0005 0.0122 30 ARG 8 CG 0.0063 0.0015 0.0120 31 ARG 8 CD 0.0061 0.0022 0.0141 32 ARG 8 NE 0.0055 0.0038 0.0150 33 ARG 8 CZ 0.0056 0.0040 0.0170 34 ARG 8 NH1 0.0064 0.0027 0.0183 35 ARG 8 NH2 0.0049 0.0055 0.0176 36 MET 9 N 0.0086 -0.0024 0.0084 37 MET 9 CA 0.0094 -0.0035 0.0072 38 MET 9 C 0.0086 -0.0032 0.0064 39 MET 9 O 0.0074 -0.0025 0.0057 40 MET 9 CB 0.0095 -0.0040 0.0059 41 MET 9 CG 0.0095 -0.0047 0.0042 42 MET 9 SD 0.0097 -0.0054 0.0027 43 MET 9 CE 0.0114 -0.0064 0.0035 44 THR 10 N 0.0094 -0.0037 0.0064 45 THR 10 CA 0.0088 -0.0036 0.0056 46 THR 10 C 0.0096 -0.0047 0.0044 47 THR 10 O 0.0109 -0.0056 0.0047 48 THR 10 CB 0.0088 -0.0031 0.0069 49 THR 10 CG2 0.0102 -0.0038 0.0079 50 THR 10 OG1 0.0083 -0.0031 0.0060 51 TYR 11 N 0.0093 -0.0050 0.0036 52 TYR 11 CA 0.0100 -0.0062 0.0022 53 TYR 11 C 0.0091 -0.0066 0.0009 54 TYR 11 O 0.0078 -0.0059 0.0010 55 TYR 11 CB 0.0098 -0.0066 0.0015 56 TYR 11 CG 0.0081 -0.0064 0.0004 57 TYR 11 CD1 0.0068 -0.0053 0.0011 58 TYR 11 CD2 0.0078 -0.0073 -0.0012 59 TYR 11 CE1 0.0052 -0.0051 0.0001 60 TYR 11 CE2 0.0062 -0.0071 -0.0022 61 TYR 11 CZ 0.0050 -0.0060 -0.0015 62 TYR 11 OH 0.0034 -0.0058 -0.0025 63 ILE 12 N 0.0098 -0.0078 -0.0003 64 ILE 12 CA 0.0092 -0.0083 -0.0016 65 ILE 12 C 0.0090 -0.0092 -0.0032 66 ILE 12 O 0.0096 -0.0096 -0.0033 67 ILE 12 CB 0.0103 -0.0089 -0.0016 68 ILE 12 CG1 0.0120 -0.0099 -0.0019 69 ILE 12 CG2 0.0105 -0.0080 -0.0001 70 ILE 12 CD1 0.0134 -0.0103 -0.0013 71 SER 13 N 0.0071 -0.0096 -0.0050 72 SER 13 CA 0.0070 -0.0106 -0.0075 73 SER 13 C 0.0063 -0.0110 -0.0093 74 SER 13 O 0.0053 -0.0102 -0.0087 75 SER 13 CB 0.0053 -0.0100 -0.0081 76 SER 13 OG 0.0031 -0.0094 -0.0094 77 ARG 14 N 0.0067 -0.0123 -0.0115 78 ARG 14 CA 0.0061 -0.0128 -0.0135 79 ARG 14 C 0.0041 -0.0126 -0.0154 80 ARG 14 O 0.0043 -0.0132 -0.0164 81 ARG 14 CB 0.0082 -0.0145 -0.0146 82 ARG 14 CG 0.0103 -0.0148 -0.0128 83 ARG 14 CD 0.0121 -0.0164 -0.0141 84 ARG 14 NE 0.0142 -0.0167 -0.0124 85 ARG 14 CZ 0.0144 -0.0164 -0.0115 86 ARG 14 NH1 0.0126 -0.0157 -0.0120 87 ARG 14 NH2 0.0163 -0.0168 -0.0099 88 ALA 15 N 0.0024 -0.0126 -0.0176 89 ALA 15 CA -0.0004 -0.0124 -0.0194 90 ALA 15 C -0.0001 -0.0140 -0.0229 91 ALA 15 O 0.0016 -0.0150 -0.0239 92 ALA 15 CB -0.0033 -0.0110 -0.0187 93 VAL 16 N -0.0018 -0.0141 -0.0247 94 VAL 16 CA -0.0020 -0.0155 -0.0280 95 VAL 16 C -0.0037 -0.0154 -0.0294 96 VAL 16 O -0.0058 -0.0141 -0.0280 97 VAL 16 CB -0.0035 -0.0155 -0.0294 98 VAL 16 CG1 -0.0012 -0.0161 -0.0287 99 VAL 16 CG2 -0.0066 -0.0138 -0.0281 100 PRO 17 N -0.0032 -0.0183 -0.0328 101 PRO 17 CA -0.0045 -0.0181 -0.0337 102 PRO 17 C -0.0078 -0.0169 -0.0347 103 PRO 17 O -0.0092 -0.0159 -0.0343 104 PRO 17 CB -0.0031 -0.0203 -0.0362 105 PRO 17 CG -0.0016 -0.0215 -0.0369 106 PRO 17 CD -0.0012 -0.0204 -0.0345 107 GLY 18 N -0.0090 -0.0170 -0.0360 108 GLY 18 CA -0.0121 -0.0160 -0.0373 109 GLY 18 C -0.0140 -0.0139 -0.0354 110 GLY 18 O -0.0165 -0.0131 -0.0364 111 LEU 19 N -0.0119 -0.0125 -0.0329 112 LEU 19 CA -0.0136 -0.0107 -0.0307 113 LEU 19 C -0.0164 -0.0092 -0.0308 114 LEU 19 O -0.0165 -0.0094 -0.0312 115 LEU 19 CB -0.0118 -0.0103 -0.0275 116 LEU 19 CG -0.0129 -0.0087 -0.0252 117 LEU 19 CD1 -0.0118 -0.0093 -0.0253 118 LEU 19 CD2 -0.0120 -0.0079 -0.0221 119 GLY 20 N -0.0187 -0.0079 -0.0305 120 GLY 20 CA -0.0215 -0.0064 -0.0305 121 GLY 20 C -0.0230 -0.0045 -0.0279 122 GLY 20 O -0.0216 -0.0043 -0.0258 123 TYR 21 N -0.0254 -0.0032 -0.0297 124 TYR 21 CA -0.0272 -0.0018 -0.0268 125 TYR 21 C -0.0277 -0.0015 -0.0263 126 TYR 21 O -0.0277 -0.0007 -0.0235 127 TYR 21 CB -0.0304 -0.0008 -0.0272 128 TYR 21 CG -0.0302 -0.0008 -0.0268 129 TYR 21 CD1 -0.0297 -0.0017 -0.0295 130 TYR 21 CD2 -0.0304 0.0001 -0.0238 131 TYR 21 CE1 -0.0295 -0.0017 -0.0292 132 TYR 21 CE2 -0.0302 0.0002 -0.0235 133 TYR 21 CZ -0.0298 -0.0007 -0.0262 134 TYR 21 OH -0.0295 -0.0007 -0.0258 135 ASN 22 N -0.0281 -0.0021 -0.0289 136 ASN 22 CA -0.0286 -0.0018 -0.0286 137 ASN 22 C -0.0257 -0.0023 -0.0268 138 ASN 22 O -0.0260 -0.0016 -0.0245 139 ASN 22 CB -0.0294 -0.0025 -0.0320 140 ASN 22 CG -0.0323 -0.0020 -0.0339 141 ASN 22 ND2 -0.0325 -0.0028 -0.0371 142 ASN 22 OD1 -0.0344 -0.0009 -0.0324 143 ASP 23 N -0.0234 -0.0041 -0.0268 144 ASP 23 CA -0.0211 -0.0044 -0.0254 145 ASP 23 C -0.0205 -0.0032 -0.0224 146 ASP 23 O -0.0199 -0.0027 -0.0207 147 ASP 23 CB -0.0186 -0.0061 -0.0267 148 ASP 23 CG -0.0188 -0.0074 -0.0294 149 ASP 23 OD1 -0.0185 -0.0076 -0.0296 150 ASP 23 OD2 -0.0193 -0.0081 -0.0315 151 LEU 24 N -0.0206 -0.0028 -0.0217 152 LEU 24 CA -0.0201 -0.0017 -0.0189 153 LEU 24 C -0.0221 -0.0000 -0.0173 154 LEU 24 O -0.0212 0.0007 -0.0151 155 LEU 24 CB -0.0202 -0.0015 -0.0187 156 LEU 24 CG -0.0176 -0.0029 -0.0192 157 LEU 24 CD1 -0.0181 -0.0027 -0.0192 158 LEU 24 CD2 -0.0152 -0.0029 -0.0171 159 ARG 25 N -0.0244 0.0005 -0.0192 160 ARG 25 CA -0.0266 0.0019 -0.0174 161 ARG 25 C -0.0259 0.0017 -0.0171 162 ARG 25 O -0.0264 0.0027 -0.0147 163 ARG 25 CB -0.0299 0.0026 -0.0188 164 ARG 25 CG -0.0308 0.0019 -0.0220 165 ARG 25 CD -0.0342 0.0028 -0.0228 166 ARG 25 NE -0.0350 0.0020 -0.0261 167 ARG 25 CZ -0.0366 0.0023 -0.0271 168 ARG 25 NH1 -0.0376 0.0033 -0.0251 169 ARG 25 NH2 -0.0372 0.0015 -0.0301 170 ASP 26 N -0.0248 0.0005 -0.0194 171 ASP 26 CA -0.0238 0.0003 -0.0191 172 ASP 26 C -0.0212 0.0002 -0.0165 173 ASP 26 O -0.0212 0.0008 -0.0146 174 ASP 26 CB -0.0228 -0.0011 -0.0222 175 ASP 26 CG -0.0221 -0.0013 -0.0221 176 ASP 26 OD1 -0.0240 -0.0003 -0.0212 177 ASP 26 OD2 -0.0196 -0.0025 -0.0230 178 ILE 27 N -0.0190 -0.0004 -0.0160 179 ILE 27 CA -0.0171 -0.0007 -0.0141 180 ILE 27 C -0.0178 0.0010 -0.0118 181 ILE 27 O -0.0172 0.0013 -0.0103 182 ILE 27 CB -0.0152 -0.0019 -0.0139 183 ILE 27 CG1 -0.0144 -0.0036 -0.0162 184 ILE 27 CG2 -0.0133 -0.0021 -0.0118 185 ILE 27 CD1 -0.0133 -0.0046 -0.0167 186 MET 28 N -0.0190 0.0021 -0.0114 187 MET 28 CA -0.0197 0.0037 -0.0091 188 MET 28 C -0.0211 0.0048 -0.0089 189 MET 28 O -0.0207 0.0055 -0.0070 190 MET 28 CB -0.0208 0.0045 -0.0090 191 MET 28 CG -0.0213 0.0060 -0.0067 192 MET 28 SD -0.0227 0.0078 -0.0052 193 MET 28 CE -0.0253 0.0085 -0.0073 194 GLY 29 N -0.0224 0.0038 -0.0112 195 GLY 29 CA -0.0239 0.0048 -0.0105 196 GLY 29 C -0.0222 0.0044 -0.0097 197 GLY 29 O -0.0225 0.0053 -0.0077 198 LYS 30 N -0.0204 0.0030 -0.0113 199 LYS 30 CA -0.0187 0.0025 -0.0107 200 LYS 30 C -0.0169 0.0028 -0.0080 201 LYS 30 O -0.0165 0.0033 -0.0064 202 LYS 30 CB -0.0169 0.0009 -0.0129 203 LYS 30 CG -0.0185 0.0005 -0.0155 204 LYS 30 CD -0.0167 -0.0011 -0.0177 205 LYS 30 CE -0.0182 -0.0015 -0.0203 206 LYS 30 NZ -0.0164 -0.0031 -0.0224 207 SER 31 N -0.0155 0.0033 -0.0080 208 SER 31 CA -0.0143 0.0033 -0.0056 209 SER 31 C -0.0156 0.0046 -0.0036 210 SER 31 O -0.0148 0.0046 -0.0020 211 SER 31 CB -0.0136 0.0030 -0.0053 212 SER 31 OG -0.0154 0.0040 -0.0053 213 GLU 32 N -0.0176 0.0057 -0.0038 214 GLU 32 CA -0.0190 0.0069 -0.0020 215 GLU 32 C -0.0192 0.0071 -0.0018 216 GLU 32 O -0.0188 0.0075 0.0001 217 GLU 32 CB -0.0212 0.0081 -0.0024 218 GLU 32 CG -0.0216 0.0089 -0.0005 219 GLU 32 CD -0.0235 0.0097 -0.0014 220 GLU 32 OE1 -0.0248 0.0100 -0.0031 221 GLU 32 OE2 -0.0237 0.0101 -0.0002 222 VAL 33 N -0.0191 0.0058 -0.0022 223 VAL 33 CA -0.0194 0.0060 -0.0016 224 VAL 33 C -0.0170 0.0055 -0.0003 225 VAL 33 O -0.0170 0.0061 0.0018 226 VAL 33 CB -0.0203 0.0057 -0.0041 227 VAL 33 CG1 -0.0198 0.0056 -0.0037 228 VAL 33 CG2 -0.0231 0.0064 -0.0048 229 ASN 34 N -0.0148 0.0045 -0.0015 230 ASN 34 CA -0.0125 0.0040 -0.0004 231 ASN 34 C -0.0116 0.0044 0.0023 232 ASN 34 O -0.0108 0.0046 0.0040 233 ASN 34 CB -0.0104 0.0028 -0.0023 234 ASN 34 CG -0.0109 0.0024 -0.0049 235 ASN 34 ND2 -0.0124 0.0024 -0.0067 236 ASN 34 OD1 -0.0100 0.0020 -0.0052 237 ASN 35 N -0.0115 0.0041 0.0012 238 ASN 35 CA -0.0102 0.0047 0.0034 239 ASN 35 C -0.0118 0.0062 0.0052 240 ASN 35 O -0.0109 0.0069 0.0071 241 ASN 35 CB -0.0092 0.0043 0.0034 242 ASN 35 CG -0.0073 0.0029 0.0020 243 ASN 35 ND2 -0.0053 0.0026 0.0030 244 ASN 35 OD1 -0.0075 0.0020 0.0001 245 SER 36 N -0.0140 0.0068 0.0045 246 SER 36 CA -0.0156 0.0082 0.0061 247 SER 36 C -0.0155 0.0084 0.0066 248 SER 36 O -0.0155 0.0094 0.0086 249 SER 36 CB -0.0181 0.0087 0.0051 250 SER 36 OG -0.0192 0.0085 0.0038 251 HIS 37 N -0.0150 0.0061 0.0038 252 HIS 37 CA -0.0144 0.0061 0.0045 253 HIS 37 C -0.0117 0.0058 0.0065 254 HIS 37 O -0.0117 0.0065 0.0085 255 HIS 37 CB -0.0143 0.0051 0.0018 256 HIS 37 CG -0.0129 0.0048 0.0023 257 HIS 37 CD2 -0.0108 0.0037 0.0010 258 HIS 37 ND1 -0.0137 0.0057 0.0042 259 HIS 37 CE1 -0.0121 0.0052 0.0042 260 HIS 37 NE2 -0.0104 0.0039 0.0023 261 VAL 38 N -0.0095 0.0049 0.0059 262 VAL 38 CA -0.0069 0.0045 0.0076 263 VAL 38 C -0.0066 0.0053 0.0103 264 VAL 38 O -0.0052 0.0055 0.0124 265 VAL 38 CB -0.0044 0.0030 0.0060 266 VAL 38 CG1 -0.0018 0.0026 0.0073 267 VAL 38 CG2 -0.0050 0.0023 0.0030 268 GLY 39 N -0.0081 0.0064 0.0074 269 GLY 39 CA -0.0080 0.0072 0.0101 270 GLY 39 C -0.0061 0.0064 0.0104 271 GLY 39 O -0.0047 0.0065 0.0127 272 LEU 40 N -0.0061 0.0057 0.0081 273 LEU 40 CA -0.0045 0.0050 0.0082 274 LEU 40 C -0.0064 0.0058 0.0078 275 LEU 40 O -0.0086 0.0063 0.0062 276 LEU 40 CB -0.0026 0.0034 0.0057 277 LEU 40 CG -0.0007 0.0025 0.0055 278 LEU 40 CD1 0.0001 0.0012 0.0026 279 LEU 40 CD2 0.0018 0.0020 0.0077 280 THR 41 N -0.0060 0.0066 0.0085 281 THR 41 CA -0.0070 0.0076 0.0087 282 THR 41 C -0.0057 0.0064 0.0083 283 THR 41 O -0.0040 0.0048 0.0080 284 THR 41 CB -0.0076 0.0090 0.0113 285 THR 41 CG2 -0.0090 0.0102 0.0116 286 THR 41 OG1 -0.0058 0.0082 0.0132 287 GLY 42 N -0.0066 0.0070 0.0083 288 GLY 42 CA -0.0054 0.0060 0.0080 289 GLY 42 C -0.0067 0.0066 0.0066 290 GLY 42 O -0.0086 0.0080 0.0065 291 LEU 43 N -0.0066 0.0058 0.0061 292 LEU 43 CA -0.0075 0.0058 0.0049 293 LEU 43 C -0.0063 0.0040 0.0031 294 LEU 43 O -0.0043 0.0028 0.0036 295 LEU 43 CB -0.0076 0.0069 0.0067 296 LEU 43 CG -0.0086 0.0071 0.0058 297 LEU 43 CD1 -0.0110 0.0082 0.0045 298 LEU 43 CD2 -0.0084 0.0081 0.0079 299 LEU 44 N -0.0075 0.0037 0.0011 300 LEU 44 CA -0.0066 0.0020 -0.0008 301 LEU 44 C -0.0072 0.0022 -0.0014 302 LEU 44 O -0.0091 0.0034 -0.0017 303 LEU 44 CB -0.0074 0.0015 -0.0030 304 LEU 44 CG -0.0071 -0.0001 -0.0054 305 LEU 44 CD1 -0.0047 -0.0017 -0.0052 306 LEU 44 CD2 -0.0083 -0.0003 -0.0074 307 CYS 45 N -0.0063 0.0011 -0.0016 308 CYS 45 CA -0.0066 0.0008 -0.0025 309 CYS 45 C -0.0059 -0.0011 -0.0050 310 CYS 45 O -0.0040 -0.0024 -0.0054 311 CYS 45 CB -0.0051 0.0010 -0.0005 312 CYS 45 SG -0.0049 0.0002 -0.0017 313 PHE 46 N -0.0072 -0.0013 -0.0068 314 PHE 46 CA -0.0068 -0.0030 -0.0093 315 PHE 46 C -0.0064 -0.0034 -0.0097 316 PHE 46 O -0.0077 -0.0022 -0.0089 317 PHE 46 CB -0.0090 -0.0029 -0.0114 318 PHE 46 CG -0.0086 -0.0046 -0.0141 319 PHE 46 CD1 -0.0063 -0.0063 -0.0146 320 PHE 46 CD2 -0.0105 -0.0046 -0.0160 321 PHE 46 CE1 -0.0060 -0.0079 -0.0171 322 PHE 46 CE2 -0.0102 -0.0062 -0.0184 323 PHE 46 CZ -0.0080 -0.0078 -0.0190 324 GLY 47 N -0.0051 -0.0053 -0.0113 325 GLY 47 CA -0.0045 -0.0061 -0.0120 326 GLY 47 C -0.0022 -0.0081 -0.0131 327 GLY 47 O -0.0002 -0.0087 -0.0124 328 ASN 48 N -0.0023 -0.0092 -0.0149 329 ASN 48 CA -0.0002 -0.0112 -0.0162 330 ASN 48 C 0.0004 -0.0124 -0.0174 331 ASN 48 O 0.0028 -0.0137 -0.0174 332 ASN 48 CB 0.0024 -0.0114 -0.0144 333 ASN 48 CG 0.0041 -0.0133 -0.0158 334 ASN 48 ND2 0.0067 -0.0141 -0.0149 335 ASN 48 OD1 0.0030 -0.0140 -0.0178 336 SER 49 N -0.0015 -0.0115 -0.0174 337 SER 49 CA -0.0010 -0.0123 -0.0185 338 SER 49 C 0.0010 -0.0122 -0.0165 339 SER 49 O 0.0026 -0.0134 -0.0172 340 SER 49 CB 0.0000 -0.0141 -0.0210 341 SER 49 OG -0.0021 -0.0142 -0.0232 342 ILE 50 N 0.0008 -0.0108 -0.0141 343 ILE 50 CA 0.0024 -0.0105 -0.0120 344 ILE 50 C 0.0007 -0.0088 -0.0102 345 ILE 50 O -0.0008 -0.0076 -0.0094 346 ILE 50 CB 0.0047 -0.0109 -0.0105 347 ILE 50 CG1 0.0071 -0.0127 -0.0118 348 ILE 50 CG2 0.0055 -0.0098 -0.0077 349 ILE 50 CD1 0.0093 -0.0131 -0.0106 350 PHE 51 N 0.0015 -0.0084 -0.0094 351 PHE 51 CA 0.0003 -0.0068 -0.0078 352 PHE 51 C 0.0021 -0.0064 -0.0055 353 PHE 51 O 0.0042 -0.0075 -0.0054 354 PHE 51 CB -0.0006 -0.0068 -0.0087 355 PHE 51 CG -0.0028 -0.0068 -0.0107 356 PHE 51 CD1 -0.0049 -0.0053 -0.0104 357 PHE 51 CD2 -0.0026 -0.0082 -0.0129 358 PHE 51 CE1 -0.0069 -0.0053 -0.0122 359 PHE 51 CE2 -0.0046 -0.0081 -0.0148 360 PHE 51 CZ -0.0068 -0.0067 -0.0144 361 LEU 52 N 0.0013 -0.0048 -0.0036 362 LEU 52 CA 0.0027 -0.0042 -0.0013 363 LEU 52 C 0.0011 -0.0026 -0.0000 364 LEU 52 O -0.0007 -0.0014 0.0003 365 LEU 52 CB 0.0037 -0.0040 0.0001 366 LEU 52 CG 0.0044 -0.0028 0.0027 367 LEU 52 CD1 0.0068 -0.0037 0.0035 368 LEU 52 CD2 0.0045 -0.0023 0.0038 369 GLN 53 N 0.0026 -0.0033 0.0004 370 GLN 53 CA 0.0014 -0.0021 0.0011 371 GLN 53 C 0.0026 -0.0017 0.0031 372 GLN 53 O 0.0043 -0.0026 0.0033 373 GLN 53 CB 0.0006 -0.0024 -0.0003 374 GLN 53 CG -0.0006 -0.0012 0.0004 375 GLN 53 CD -0.0018 -0.0013 -0.0012 376 GLN 53 NE2 -0.0034 -0.0001 -0.0009 377 GLN 53 OE1 -0.0013 -0.0026 -0.0027 378 ILE 54 N 0.0017 -0.0002 0.0045 379 ILE 54 CA 0.0025 0.0003 0.0064 380 ILE 54 C 0.0012 0.0013 0.0066 381 ILE 54 O -0.0006 0.0023 0.0063 382 ILE 54 CB 0.0028 0.0012 0.0081 383 ILE 54 CG1 0.0033 0.0021 0.0101 384 ILE 54 CG2 0.0010 0.0022 0.0079 385 ILE 54 CD1 0.0038 0.0028 0.0119 386 LEU 55 N 0.0026 0.0003 0.0065 387 LEU 55 CA 0.0020 0.0009 0.0064 388 LEU 55 C 0.0026 0.0011 0.0084 389 LEU 55 O 0.0040 0.0003 0.0094 390 LEU 55 CB 0.0024 -0.0002 0.0048 391 LEU 55 CG 0.0017 -0.0004 0.0026 392 LEU 55 CD1 0.0029 -0.0021 0.0014 393 LEU 55 CD2 0.0004 0.0003 0.0017 394 GLU 56 N 0.0016 0.0023 0.0089 395 GLU 56 CA 0.0021 0.0027 0.0108 396 GLU 56 C 0.0014 0.0031 0.0104 397 GLU 56 O 0.0000 0.0039 0.0094 398 GLU 56 CB 0.0014 0.0039 0.0124 399 GLU 56 CG 0.0019 0.0036 0.0128 400 GLU 56 CD 0.0017 0.0046 0.0148 401 GLU 56 OE1 0.0006 0.0059 0.0154 402 GLU 56 OE2 0.0027 0.0041 0.0157 403 GLY 57 N 0.0024 0.0011 0.0102 404 GLY 57 CA 0.0023 0.0011 0.0100 405 GLY 57 C 0.0044 -0.0003 0.0108 406 GLY 57 O 0.0056 -0.0012 0.0121 407 SER 58 N 0.0046 -0.0006 0.0100 408 SER 58 CA 0.0065 -0.0020 0.0106 409 SER 58 C 0.0082 -0.0034 0.0090 410 SER 58 O 0.0078 -0.0032 0.0070 411 SER 58 CB 0.0063 -0.0018 0.0101 412 SER 58 OG 0.0060 -0.0018 0.0075 413 ARG 59 N 0.0120 -0.0077 0.0039 414 ARG 59 CA 0.0125 -0.0077 0.0036 415 ARG 59 C 0.0126 -0.0077 0.0031 416 ARG 59 O 0.0126 -0.0076 0.0026 417 ARG 59 CB 0.0130 -0.0078 0.0039 418 ARG 59 CG 0.0134 -0.0078 0.0036 419 ARG 59 CD 0.0139 -0.0080 0.0040 420 ARG 59 NE 0.0142 -0.0081 0.0042 421 ARG 59 CZ 0.0146 -0.0082 0.0046 422 ARG 59 NH1 0.0146 -0.0082 0.0049 423 ARG 59 NH2 0.0148 -0.0082 0.0048 424 GLN 60 N 0.0127 -0.0077 0.0033 425 GLN 60 CA 0.0129 -0.0077 0.0029 426 GLN 60 C 0.0124 -0.0075 0.0025 427 GLN 60 O 0.0126 -0.0075 0.0020 428 GLN 60 CB 0.0130 -0.0077 0.0033 429 GLN 60 CG 0.0133 -0.0077 0.0029 430 GLN 60 CD 0.0128 -0.0076 0.0028 431 GLN 60 NE2 0.0127 -0.0077 0.0031 432 GLN 60 OE1 0.0126 -0.0075 0.0023 433 ALA 61 N 0.0096 -0.0042 0.0052 434 ALA 61 CA 0.0085 -0.0035 0.0043 435 ALA 61 C 0.0084 -0.0035 0.0036 436 ALA 61 O 0.0082 -0.0033 0.0023 437 ALA 61 CB 0.0072 -0.0029 0.0051 438 ILE 62 N 0.0086 -0.0036 0.0045 439 ILE 62 CA 0.0087 -0.0036 0.0039 440 ILE 62 C 0.0097 -0.0041 0.0028 441 ILE 62 O 0.0096 -0.0040 0.0016 442 ILE 62 CB 0.0088 -0.0037 0.0052 443 ILE 62 CG1 0.0076 -0.0031 0.0062 444 ILE 62 CG2 0.0089 -0.0038 0.0045 445 ILE 62 CD1 0.0079 -0.0034 0.0077 446 SER 63 N 0.0112 -0.0055 0.0040 447 SER 63 CA 0.0115 -0.0061 0.0035 448 SER 63 C 0.0112 -0.0061 0.0027 449 SER 63 O 0.0113 -0.0065 0.0022 450 SER 63 CB 0.0120 -0.0064 0.0038 451 SER 63 OG 0.0124 -0.0064 0.0046 452 HIS 64 N 0.0107 -0.0057 0.0025 453 HIS 64 CA 0.0103 -0.0058 0.0018 454 HIS 64 C 0.0099 -0.0056 0.0014 455 HIS 64 O 0.0098 -0.0058 0.0007 456 HIS 64 CB 0.0099 -0.0054 0.0018 457 HIS 64 CG 0.0093 -0.0052 0.0011 458 HIS 64 CD2 0.0087 -0.0046 0.0010 459 HIS 64 ND1 0.0094 -0.0056 0.0003 460 HIS 64 CE1 0.0088 -0.0052 -0.0002 461 HIS 64 NE2 0.0084 -0.0047 0.0002 462 THR 65 N 0.0078 -0.0036 0.0017 463 THR 65 CA 0.0073 -0.0033 0.0013 464 THR 65 C 0.0078 -0.0039 0.0010 465 THR 65 O 0.0075 -0.0040 0.0002 466 THR 65 CB 0.0068 -0.0026 0.0021 467 THR 65 CG2 0.0066 -0.0024 0.0019 468 THR 65 OG1 0.0061 -0.0019 0.0019 469 TYR 66 N 0.0085 -0.0044 0.0017 470 TYR 66 CA 0.0091 -0.0050 0.0014 471 TYR 66 C 0.0093 -0.0057 0.0004 472 TYR 66 O 0.0094 -0.0060 -0.0002 473 TYR 66 CB 0.0099 -0.0054 0.0024 474 TYR 66 CG 0.0104 -0.0060 0.0022 475 TYR 66 CD1 0.0102 -0.0058 0.0020 476 TYR 66 CD2 0.0113 -0.0067 0.0023 477 TYR 66 CE1 0.0107 -0.0063 0.0019 478 TYR 66 CE2 0.0118 -0.0073 0.0022 479 TYR 66 CZ 0.0115 -0.0071 0.0020 480 TYR 66 OH 0.0120 -0.0076 0.0019 481 HIS 67 N 0.0104 -0.0055 0.0026 482 HIS 67 CA 0.0108 -0.0060 0.0015 483 HIS 67 C 0.0099 -0.0058 0.0003 484 HIS 67 O 0.0101 -0.0062 -0.0009 485 HIS 67 CB 0.0113 -0.0061 0.0019 486 HIS 67 CG 0.0115 -0.0065 0.0008 487 HIS 67 CD2 0.0120 -0.0071 -0.0003 488 HIS 67 ND1 0.0111 -0.0064 0.0007 489 HIS 67 CE1 0.0115 -0.0068 -0.0004 490 HIS 67 NE2 0.0120 -0.0073 -0.0010 491 ARG 68 N 0.0087 -0.0051 0.0005 492 ARG 68 CA 0.0078 -0.0048 -0.0006 493 ARG 68 C 0.0075 -0.0048 -0.0012 494 ARG 68 O 0.0072 -0.0050 -0.0024 495 ARG 68 CB 0.0066 -0.0041 -0.0001 496 ARG 68 CG 0.0065 -0.0041 -0.0003 497 ARG 68 CD 0.0055 -0.0033 0.0004 498 ARG 68 NE 0.0045 -0.0028 0.0003 499 ARG 68 CZ 0.0039 -0.0022 0.0013 500 ARG 68 NH1 0.0041 -0.0020 0.0024 501 ARG 68 NH2 0.0030 -0.0017 0.0011 502 ILE 69 N 0.0072 -0.0049 0.0013 503 ILE 69 CA 0.0068 -0.0048 0.0006 504 ILE 69 C 0.0077 -0.0053 -0.0004 505 ILE 69 O 0.0074 -0.0053 -0.0015 506 ILE 69 CB 0.0065 -0.0046 0.0017 507 ILE 69 CG1 0.0051 -0.0040 0.0022 508 ILE 69 CG2 0.0067 -0.0047 0.0012 509 ILE 69 CD1 0.0048 -0.0038 0.0032 510 LEU 70 N 0.0090 -0.0057 -0.0000 511 LEU 70 CA 0.0100 -0.0062 -0.0009 512 LEU 70 C 0.0099 -0.0064 -0.0023 513 LEU 70 O 0.0104 -0.0066 -0.0033 514 LEU 70 CB 0.0113 -0.0067 -0.0002 515 LEU 70 CG 0.0118 -0.0068 0.0008 516 LEU 70 CD1 0.0130 -0.0072 0.0015 517 LEU 70 CD2 0.0119 -0.0069 0.0000 518 GLN 71 N 0.0105 -0.0050 -0.0037 519 GLN 71 CA 0.0100 -0.0055 -0.0054 520 GLN 71 C 0.0067 -0.0069 -0.0077 521 GLN 71 O 0.0061 -0.0074 -0.0094 522 GLN 71 CB 0.0097 -0.0049 -0.0024 523 GLN 71 CG 0.0131 -0.0035 -0.0003 524 GLN 71 CD 0.0125 -0.0030 0.0031 525 GLN 71 NE2 0.0129 -0.0030 0.0025 526 GLN 71 OE1 0.0117 -0.0025 0.0062 527 ASP 72 N 0.0046 -0.0075 -0.0079 528 ASP 72 CA 0.0014 -0.0088 -0.0102 529 ASP 72 C 0.0028 -0.0093 -0.0143 530 ASP 72 O 0.0052 -0.0089 -0.0154 531 ASP 72 CB -0.0009 -0.0092 -0.0094 532 ASP 72 CG -0.0049 -0.0104 -0.0098 533 ASP 72 OD1 -0.0060 -0.0113 -0.0129 534 ASP 72 OD2 -0.0070 -0.0104 -0.0070 535 PRO 73 N -0.0012 -0.0114 -0.0216 536 PRO 73 CA -0.0000 -0.0128 -0.0244 537 PRO 73 C -0.0014 -0.0125 -0.0250 538 PRO 73 O -0.0009 -0.0135 -0.0275 539 PRO 73 CB -0.0012 -0.0133 -0.0272 540 PRO 73 CG -0.0037 -0.0120 -0.0260 541 PRO 73 CD -0.0040 -0.0107 -0.0225 542 ARG 74 N -0.0031 -0.0111 -0.0229 543 ARG 74 CA -0.0046 -0.0107 -0.0233 544 ARG 74 C -0.0024 -0.0110 -0.0218 545 ARG 74 O -0.0034 -0.0107 -0.0220 546 ARG 74 CB -0.0078 -0.0090 -0.0219 547 ARG 74 CG -0.0104 -0.0087 -0.0239 548 ARG 74 CD -0.0137 -0.0071 -0.0229 549 ARG 74 NE -0.0145 -0.0059 -0.0203 550 ARG 74 CZ -0.0156 -0.0056 -0.0206 551 ARG 74 NH1 -0.0161 -0.0063 -0.0235 552 ARG 74 NH2 -0.0163 -0.0044 -0.0180 553 HIS 75 N 0.0009 -0.0110 -0.0182 554 HIS 75 CA 0.0027 -0.0112 -0.0170 555 HIS 75 C 0.0055 -0.0123 -0.0170 556 HIS 75 O 0.0059 -0.0126 -0.0174 557 HIS 75 CB 0.0020 -0.0101 -0.0143 558 HIS 75 CG 0.0023 -0.0095 -0.0123 559 HIS 75 CD2 0.0027 -0.0098 -0.0126 560 HIS 75 ND1 0.0020 -0.0085 -0.0097 561 HIS 75 CE1 0.0023 -0.0082 -0.0085 562 HIS 75 NE2 0.0028 -0.0090 -0.0102 563 HIS 76 N 0.0073 -0.0128 -0.0164 564 HIS 76 CA 0.0100 -0.0138 -0.0164 565 HIS 76 C 0.0116 -0.0138 -0.0147 566 HIS 76 O 0.0106 -0.0131 -0.0137 567 HIS 76 CB 0.0109 -0.0150 -0.0192 568 HIS 76 CG 0.0106 -0.0154 -0.0206 569 HIS 76 CD2 0.0123 -0.0164 -0.0218 570 HIS 76 ND1 0.0083 -0.0146 -0.0208 571 HIS 76 CE1 0.0086 -0.0151 -0.0221 572 HIS 76 NE2 0.0110 -0.0162 -0.0227 573 SER 77 N 0.0112 -0.0140 -0.0093 574 SER 77 CA 0.0133 -0.0138 -0.0083 575 SER 77 C 0.0129 -0.0124 -0.0062 576 SER 77 O 0.0135 -0.0121 -0.0056 577 SER 77 CB 0.0139 -0.0148 -0.0096 578 SER 77 OG 0.0144 -0.0162 -0.0115 579 ALA 78 N 0.0120 -0.0114 -0.0051 580 ALA 78 CA 0.0116 -0.0100 -0.0030 581 ALA 78 C 0.0139 -0.0098 -0.0017 582 ALA 78 O 0.0156 -0.0104 -0.0019 583 ALA 78 CB 0.0101 -0.0091 -0.0022 584 GLU 79 N 0.0127 -0.0101 -0.0007 585 GLU 79 CA 0.0137 -0.0099 -0.0002 586 GLU 79 C 0.0135 -0.0089 0.0007 587 GLU 79 O 0.0128 -0.0086 0.0008 588 GLU 79 CB 0.0145 -0.0103 -0.0003 589 GLU 79 CG 0.0151 -0.0112 -0.0010 590 GLU 79 CD 0.0158 -0.0116 -0.0013 591 GLU 79 OE1 0.0157 -0.0123 -0.0020 592 GLU 79 OE2 0.0165 -0.0113 -0.0007 593 ILE 80 N 0.0141 -0.0085 0.0013 594 ILE 80 CA 0.0140 -0.0076 0.0021 595 ILE 80 C 0.0148 -0.0075 0.0025 596 ILE 80 O 0.0158 -0.0078 0.0025 597 ILE 80 CB 0.0141 -0.0072 0.0026 598 ILE 80 CG1 0.0133 -0.0074 0.0021 599 ILE 80 CG2 0.0138 -0.0063 0.0034 600 ILE 80 CD1 0.0136 -0.0072 0.0024 601 ILE 81 N 0.0134 -0.0082 0.0029 602 ILE 81 CA 0.0140 -0.0080 0.0036 603 ILE 81 C 0.0143 -0.0075 0.0041 604 ILE 81 O 0.0149 -0.0077 0.0045 605 ILE 81 CB 0.0138 -0.0076 0.0037 606 ILE 81 CG1 0.0139 -0.0082 0.0033 607 ILE 81 CG2 0.0143 -0.0071 0.0045 608 ILE 81 CD1 0.0136 -0.0078 0.0034 609 ALA 82 N 0.0138 -0.0068 0.0042 610 ALA 82 CA 0.0140 -0.0063 0.0047 611 ALA 82 C 0.0133 -0.0058 0.0045 612 ALA 82 O 0.0127 -0.0057 0.0041 613 ALA 82 CB 0.0143 -0.0057 0.0053 614 PHE 83 N 0.0125 -0.0065 0.0057 615 PHE 83 CA 0.0122 -0.0062 0.0059 616 PHE 83 C 0.0127 -0.0062 0.0079 617 PHE 83 O 0.0142 -0.0072 0.0084 618 PHE 83 CB 0.0129 -0.0070 0.0044 619 PHE 83 CG 0.0126 -0.0067 0.0045 620 PHE 83 CD1 0.0135 -0.0071 0.0057 621 PHE 83 CD2 0.0114 -0.0060 0.0033 622 PHE 83 CE1 0.0131 -0.0069 0.0058 623 PHE 83 CE2 0.0111 -0.0058 0.0033 624 PHE 83 CZ 0.0119 -0.0062 0.0046 625 ASP 84 N 0.0117 -0.0052 0.0091 626 ASP 84 CA 0.0122 -0.0052 0.0111 627 ASP 84 C 0.0111 -0.0042 0.0119 628 ASP 84 O 0.0097 -0.0033 0.0112 629 ASP 84 CB 0.0122 -0.0050 0.0123 630 ASP 84 CG 0.0109 -0.0041 0.0117 631 ASP 84 OD1 0.0108 -0.0044 0.0101 632 ASP 84 OD2 0.0098 -0.0032 0.0128 633 PRO 85 N 0.0118 -0.0044 0.0160 634 PRO 85 CA 0.0108 -0.0034 0.0168 635 PRO 85 C 0.0096 -0.0022 0.0182 636 PRO 85 O 0.0100 -0.0024 0.0192 637 PRO 85 CB 0.0120 -0.0043 0.0181 638 PRO 85 CG 0.0136 -0.0056 0.0182 639 PRO 85 CD 0.0134 -0.0056 0.0171 640 VAL 86 N 0.0082 -0.0011 0.0183 641 VAL 86 CA 0.0069 0.0002 0.0194 642 VAL 86 C 0.0062 0.0009 0.0207 643 VAL 86 O 0.0064 0.0007 0.0203 644 VAL 86 CB 0.0056 0.0011 0.0179 645 VAL 86 CG1 0.0061 0.0006 0.0174 646 VAL 86 CG2 0.0053 0.0011 0.0159 647 LEU 87 N 0.0048 0.0025 0.0266 648 LEU 87 CA 0.0040 0.0044 0.0275 649 LEU 87 C 0.0021 0.0067 0.0260 650 LEU 87 O 0.0013 0.0076 0.0250 651 LEU 87 CB 0.0047 0.0053 0.0307 652 LEU 87 CG 0.0046 0.0064 0.0326 653 LEU 87 CD1 0.0053 0.0071 0.0356 654 LEU 87 CD2 0.0029 0.0088 0.0316 655 GLN 88 N 0.0014 0.0077 0.0258 656 GLN 88 CA -0.0004 0.0099 0.0244 657 GLN 88 C -0.0007 0.0095 0.0227 658 GLN 88 O 0.0003 0.0080 0.0232 659 GLN 88 CB -0.0011 0.0124 0.0265 660 GLN 88 CG -0.0002 0.0123 0.0288 661 GLN 88 CD -0.0009 0.0148 0.0309 662 GLN 88 NE2 -0.0005 0.0151 0.0326 663 GLN 88 OE1 -0.0019 0.0164 0.0309 664 ARG 89 N -0.0015 0.0102 0.0230 665 ARG 89 CA -0.0020 0.0099 0.0213 666 ARG 89 C -0.0025 0.0109 0.0222 667 ARG 89 O -0.0029 0.0121 0.0239 668 ARG 89 CB -0.0033 0.0106 0.0194 669 ARG 89 CG -0.0033 0.0104 0.0189 670 ARG 89 CD -0.0049 0.0114 0.0172 671 ARG 89 NE -0.0048 0.0103 0.0150 672 ARG 89 CZ -0.0047 0.0098 0.0139 673 ARG 89 NH1 -0.0046 0.0101 0.0149 674 ARG 89 NH2 -0.0046 0.0088 0.0119 675 GLU 90 N -0.0025 0.0104 0.0210 676 GLU 90 CA -0.0031 0.0113 0.0215 677 GLU 90 C -0.0044 0.0120 0.0195 678 GLU 90 O -0.0051 0.0129 0.0198 679 GLU 90 CB -0.0017 0.0100 0.0222 680 GLU 90 CG -0.0004 0.0094 0.0242 681 GLU 90 CD 0.0005 0.0090 0.0255 682 GLU 90 OE1 0.0014 0.0076 0.0247 683 GLU 90 OE2 0.0003 0.0100 0.0273 684 PHE 91 N -0.0055 0.0116 0.0181 685 PHE 91 CA -0.0072 0.0119 0.0160 686 PHE 91 C -0.0087 0.0128 0.0155 687 PHE 91 O -0.0093 0.0124 0.0135 688 PHE 91 CB -0.0064 0.0102 0.0137 689 PHE 91 CG -0.0050 0.0093 0.0139 690 PHE 91 CD1 -0.0059 0.0096 0.0132 691 PHE 91 CD2 -0.0029 0.0081 0.0150 692 PHE 91 CE1 -0.0047 0.0088 0.0134 693 PHE 91 CE2 -0.0016 0.0072 0.0152 694 PHE 91 CZ -0.0025 0.0076 0.0144 695 VAL 92 N -0.0092 0.0142 0.0175 696 VAL 92 CA -0.0104 0.0151 0.0174 697 VAL 92 C -0.0126 0.0159 0.0156 698 VAL 92 O -0.0134 0.0160 0.0144 699 VAL 92 CB -0.0106 0.0164 0.0200 700 VAL 92 CG1 -0.0113 0.0175 0.0212 701 VAL 92 CG2 -0.0122 0.0175 0.0199 702 GLN 93 N -0.0148 0.0165 0.0162 703 GLN 93 CA -0.0170 0.0177 0.0146 704 GLN 93 C -0.0173 0.0166 0.0118 705 GLN 93 O -0.0189 0.0174 0.0105 706 GLN 93 CB -0.0179 0.0186 0.0151 707 GLN 93 CG -0.0169 0.0190 0.0178 708 GLN 93 CD -0.0148 0.0173 0.0179 709 GLN 93 NE2 -0.0132 0.0169 0.0201 710 GLN 93 OE1 -0.0147 0.0163 0.0162 711 TRP 94 N -0.0158 0.0149 0.0107 712 TRP 94 CA -0.0161 0.0139 0.0080 713 TRP 94 C -0.0148 0.0124 0.0071 714 TRP 94 O -0.0129 0.0112 0.0081 715 TRP 94 CB -0.0154 0.0129 0.0072 716 TRP 94 CG -0.0164 0.0142 0.0083 717 TRP 94 CD1 -0.0153 0.0142 0.0103 718 TRP 94 CD2 -0.0185 0.0157 0.0075 719 TRP 94 CE2 -0.0187 0.0166 0.0091 720 TRP 94 CE3 -0.0204 0.0164 0.0056 721 TRP 94 NE1 -0.0167 0.0157 0.0108 722 TRP 94 CZ2 -0.0206 0.0181 0.0088 723 TRP 94 CZ3 -0.0223 0.0179 0.0053 724 TRP 94 CH2 -0.0224 0.0188 0.0069 725 SER 95 N -0.0165 0.0108 0.0071 726 SER 95 CA -0.0151 0.0095 0.0059 727 SER 95 C -0.0138 0.0082 0.0041 728 SER 95 O -0.0118 0.0070 0.0040 729 SER 95 CB -0.0165 0.0099 0.0046 730 SER 95 OG -0.0167 0.0106 0.0062 731 MET 96 N -0.0151 0.0085 0.0026 732 MET 96 CA -0.0141 0.0075 0.0011 733 MET 96 C -0.0160 0.0082 0.0001 734 MET 96 O -0.0179 0.0090 -0.0009 735 MET 96 CB -0.0131 0.0062 -0.0011 736 MET 96 CG -0.0109 0.0048 -0.0014 737 MET 96 SD -0.0086 0.0042 0.0010 738 MET 96 CE -0.0083 0.0037 0.0001 739 LYS 97 N -0.0160 0.0083 0.0005 740 LYS 97 CA -0.0173 0.0088 -0.0003 741 LYS 97 C -0.0159 0.0072 -0.0016 742 LYS 97 O -0.0138 0.0061 -0.0010 743 LYS 97 CB -0.0178 0.0102 0.0019 744 LYS 97 CG -0.0197 0.0111 0.0012 745 LYS 97 CD -0.0216 0.0114 -0.0009 746 LYS 97 CE -0.0237 0.0127 -0.0010 747 LYS 97 NZ -0.0256 0.0129 -0.0032 748 LEU 98 N -0.0171 0.0071 -0.0034 749 LEU 98 CA -0.0161 0.0057 -0.0047 750 LEU 98 C -0.0164 0.0063 -0.0039 751 LEU 98 O -0.0182 0.0077 -0.0036 752 LEU 98 CB -0.0171 0.0050 -0.0075 753 LEU 98 CG -0.0158 0.0031 -0.0093 754 LEU 98 CD1 -0.0157 0.0030 -0.0095 755 LEU 98 CD2 -0.0134 0.0019 -0.0087 756 VAL 99 N -0.0156 0.0058 -0.0034 757 VAL 99 CA -0.0158 0.0061 -0.0028 758 VAL 99 C -0.0144 0.0044 -0.0047 759 VAL 99 O -0.0121 0.0030 -0.0047 760 VAL 99 CB -0.0145 0.0068 0.0002 761 VAL 99 CG1 -0.0140 0.0067 0.0005 762 VAL 99 CG2 -0.0162 0.0087 0.0021 763 GLN 100 N -0.0159 0.0045 -0.0064 764 GLN 100 CA -0.0148 0.0029 -0.0082 765 GLN 100 C -0.0142 0.0031 -0.0071 766 GLN 100 O -0.0155 0.0046 -0.0056 767 GLN 100 CB -0.0167 0.0027 -0.0111 768 GLN 100 CG -0.0159 0.0013 -0.0131 769 GLN 100 CD -0.0161 0.0000 -0.0159 770 GLN 100 NE2 -0.0148 -0.0016 -0.0174 771 GLN 100 OE1 -0.0173 0.0004 -0.0166 772 ILE 101 N -0.0131 0.0016 -0.0083 773 ILE 101 CA -0.0123 0.0016 -0.0073 774 ILE 101 C -0.0129 0.0008 -0.0105 775 ILE 101 O -0.0112 -0.0001 -0.0106 776 ILE 101 CB -0.0087 0.0005 -0.0054 777 ILE 101 CG1 -0.0062 -0.0015 -0.0076 778 ILE 101 CG2 -0.0083 0.0016 -0.0018 779 ILE 101 CD1 -0.0044 -0.0031 -0.0096 780 ASP 102 N -0.0154 0.0011 -0.0130 781 ASP 102 CA -0.0162 0.0003 -0.0163 782 ASP 102 C -0.0167 0.0008 -0.0155 783 ASP 102 O -0.0147 -0.0004 -0.0164 784 ASP 102 CB -0.0194 0.0011 -0.0184 785 ASP 102 CG -0.0221 0.0032 -0.0162 786 ASP 102 OD1 -0.0216 0.0041 -0.0130 787 ASP 102 OD2 -0.0247 0.0040 -0.0177 788 SER 105 N -0.0230 0.0045 -0.0134 789 SER 105 CA -0.0223 0.0060 -0.0096 790 SER 105 C -0.0223 0.0071 -0.0072 791 SER 105 O -0.0211 0.0061 -0.0082 792 SER 105 CB -0.0188 0.0048 -0.0086 793 SER 105 OG -0.0158 0.0037 -0.0079 794 PRO 106 N -0.0236 0.0091 -0.0043 795 PRO 106 CA -0.0234 0.0103 -0.0017 796 PRO 106 C -0.0195 0.0091 -0.0003 797 PRO 106 O -0.0171 0.0081 -0.0000 798 PRO 106 CB -0.0252 0.0126 0.0012 799 PRO 106 CG -0.0253 0.0124 0.0007 800 PRO 106 CD -0.0255 0.0106 -0.0032 801 GLU 107 N -0.0190 0.0096 0.0000 802 GLU 107 CA -0.0154 0.0083 0.0014 803 GLU 107 C -0.0136 0.0090 0.0049 804 GLU 107 O -0.0104 0.0077 0.0060 805 GLU 107 CB -0.0154 0.0086 0.0020 806 GLU 107 CG -0.0175 0.0112 0.0047 807 GLU 107 CD -0.0153 0.0118 0.0086 808 GLU 107 OE1 -0.0123 0.0103 0.0091 809 GLU 107 OE2 -0.0166 0.0139 0.0111 810 LYS 108 N -0.0157 0.0111 0.0067 811 LYS 108 CA -0.0141 0.0118 0.0100 812 LYS 108 C -0.0119 0.0102 0.0092 813 LYS 108 O -0.0093 0.0098 0.0114 814 LYS 108 CB -0.0169 0.0145 0.0120 815 LYS 108 CG -0.0184 0.0163 0.0138 816 LYS 108 CD -0.0156 0.0163 0.0169 817 LYS 108 CE -0.0136 0.0164 0.0194 818 LYS 108 NZ -0.0158 0.0187 0.0215 819 MET 109 N -0.0126 0.0086 0.0065 820 MET 109 CA -0.0103 0.0071 0.0056 821 MET 109 C -0.0070 0.0052 0.0050 822 MET 109 O -0.0043 0.0043 0.0063 823 MET 109 CB -0.0120 0.0066 0.0024 824 MET 109 CG -0.0137 0.0078 0.0032 825 MET 109 SD -0.0161 0.0076 -0.0006 826 MET 109 CE -0.0183 0.0095 0.0014 827 ARG 110 N -0.0071 0.0045 0.0032 828 ARG 110 CA -0.0040 0.0027 0.0027 829 ARG 110 C -0.0022 0.0031 0.0062 830 ARG 110 O 0.0009 0.0018 0.0067 831 ARG 110 CB -0.0047 0.0019 -0.0001 832 ARG 110 CG -0.0068 0.0017 -0.0034 833 ARG 110 CD -0.0075 0.0009 -0.0061 834 ARG 110 NE -0.0111 0.0024 -0.0071 835 ARG 110 CZ -0.0125 0.0034 -0.0063 836 ARG 110 NH1 -0.0107 0.0031 -0.0046 837 ARG 110 NH2 -0.0158 0.0047 -0.0073 838 ARG 111 N -0.0034 0.0055 0.0086 839 ARG 111 CA -0.0017 0.0061 0.0120 840 ARG 111 C -0.0001 0.0058 0.0136 841 ARG 111 O 0.0026 0.0048 0.0152 842 ARG 111 CB -0.0039 0.0086 0.0139 843 ARG 111 CG -0.0024 0.0093 0.0174 844 ARG 111 CD -0.0006 0.0079 0.0172 845 ARG 111 NE -0.0023 0.0092 0.0174 846 ARG 111 CZ -0.0028 0.0109 0.0201 847 ARG 111 NH1 -0.0017 0.0116 0.0230 848 ARG 111 NH2 -0.0043 0.0118 0.0199 849 LEU 112 N -0.0017 0.0066 0.0130 850 LEU 112 CA -0.0002 0.0062 0.0143 851 LEU 112 C 0.0023 0.0037 0.0127 852 LEU 112 O 0.0046 0.0029 0.0142 853 LEU 112 CB -0.0026 0.0076 0.0137 854 LEU 112 CG -0.0051 0.0102 0.0155 855 LEU 112 CD1 -0.0078 0.0113 0.0141 856 LEU 112 CD2 -0.0039 0.0112 0.0192 857 TYR 113 N 0.0021 0.0025 0.0096 858 TYR 113 CA 0.0044 0.0002 0.0080 859 TYR 113 C 0.0071 -0.0008 0.0095 860 TYR 113 O 0.0095 -0.0020 0.0101 861 TYR 113 CB 0.0033 -0.0009 0.0047 862 TYR 113 CG 0.0020 -0.0012 0.0028 863 TYR 113 CD1 0.0033 -0.0018 0.0032 864 TYR 113 CD2 -0.0005 -0.0008 0.0006 865 TYR 113 CE1 0.0021 -0.0020 0.0015 866 TYR 113 CE2 -0.0017 -0.0010 -0.0012 867 TYR 113 CZ -0.0004 -0.0016 -0.0007 868 TYR 113 OH -0.0015 -0.0018 -0.0025 869 LEU 114 N 0.0067 -0.0002 0.0101 870 LEU 114 CA 0.0091 -0.0010 0.0114 871 LEU 114 C 0.0106 -0.0003 0.0146 872 LEU 114 O 0.0133 -0.0015 0.0155 873 LEU 114 CB 0.0081 -0.0003 0.0115 874 LEU 114 CG 0.0102 -0.0018 0.0113 875 LEU 114 CD1 0.0103 -0.0036 0.0081 876 LEU 114 CD2 0.0092 -0.0005 0.0125 877 LYS 115 N 0.0085 0.0023 0.0159 878 LYS 115 CA 0.0097 0.0030 0.0191 879 LYS 115 C 0.0119 0.0014 0.0193 880 LYS 115 O 0.0140 0.0008 0.0214 881 LYS 115 CB 0.0075 0.0054 0.0205 882 LYS 115 CG 0.0086 0.0061 0.0237 883 LYS 115 CD 0.0075 0.0081 0.0261 884 LYS 115 CE 0.0044 0.0101 0.0254 885 LYS 115 NZ 0.0034 0.0104 0.0244 886 TYR 116 N 0.0114 0.0007 0.0171 887 TYR 116 CA 0.0132 -0.0006 0.0173 888 TYR 116 C 0.0148 -0.0030 0.0149 889 TYR 116 O 0.0159 -0.0041 0.0144 890 TYR 116 CB 0.0115 0.0005 0.0170 891 TYR 116 CG 0.0101 0.0029 0.0195 892 TYR 116 CD1 0.0115 0.0032 0.0225 893 TYR 116 CD2 0.0072 0.0047 0.0188 894 TYR 116 CE1 0.0102 0.0054 0.0247 895 TYR 116 CE2 0.0059 0.0068 0.0211 896 TYR 116 CZ 0.0074 0.0072 0.0240 897 TYR 116 OH 0.0061 0.0093 0.0263 898 SER 117 N 0.0157 -0.0031 0.0136 899 SER 117 CA 0.0174 -0.0055 0.0114 900 SER 117 C 0.0186 -0.0066 0.0108 901 SER 117 O 0.0175 -0.0056 0.0114 902 SER 117 CB 0.0154 -0.0061 0.0085 903 SER 117 OG 0.0126 -0.0049 0.0076 904 GLY 118 N 0.0209 -0.0088 0.0096 905 GLY 118 CA 0.0222 -0.0101 0.0089 906 GLY 118 C 0.0212 -0.0115 0.0056 907 GLY 118 O 0.0222 -0.0126 0.0048 908 GLU 119 N 0.0198 -0.0109 0.0037 909 GLU 119 CA 0.0187 -0.0123 0.0005 910 GLU 119 C 0.0154 -0.0109 -0.0002 911 GLU 119 O 0.0136 -0.0090 0.0010 912 GLU 119 CB 0.0189 -0.0136 -0.0012 913 GLU 119 CG 0.0218 -0.0160 -0.0022 914 GLU 119 CD 0.0243 -0.0161 -0.0001 915 GLU 119 OE1 0.0238 -0.0143 0.0022 916 GLU 119 OE2 0.0268 -0.0179 -0.0007 917 VAL 120 N 0.0147 -0.0118 -0.0023 918 VAL 120 CA 0.0116 -0.0106 -0.0031 919 VAL 120 C 0.0093 -0.0102 -0.0047 920 VAL 120 O 0.0068 -0.0085 -0.0043 921 VAL 120 CB 0.0116 -0.0117 -0.0050 922 VAL 120 CG1 0.0127 -0.0111 -0.0030 923 VAL 120 CG2 0.0135 -0.0143 -0.0071 924 ALA 121 N 0.0104 -0.0116 -0.0063 925 ALA 121 CA 0.0086 -0.0115 -0.0078 926 ALA 121 C 0.0087 -0.0105 -0.0062 927 ALA 121 O 0.0104 -0.0101 -0.0041 928 ALA 121 CB 0.0093 -0.0136 -0.0104 929 PHE 122 N 0.0068 -0.0101 -0.0072 930 PHE 122 CA 0.0066 -0.0092 -0.0058 931 PHE 122 C 0.0087 -0.0107 -0.0064 932 PHE 122 O 0.0082 -0.0117 -0.0084 933 PHE 122 CB 0.0037 -0.0081 -0.0068 934 PHE 122 CG 0.0033 -0.0069 -0.0053 935 PHE 122 CD1 0.0044 -0.0058 -0.0026 936 PHE 122 CD2 0.0017 -0.0068 -0.0065 937 PHE 122 CE1 0.0040 -0.0047 -0.0012 938 PHE 122 CE2 0.0012 -0.0057 -0.0052 939 PHE 122 CZ 0.0024 -0.0047 -0.0025 940 MET 123 N 0.0110 -0.0110 -0.0043 941 MET 123 CA 0.0131 -0.0123 -0.0044 942 MET 123 C 0.0139 -0.0111 -0.0020 943 MET 123 O 0.0158 -0.0109 -0.0002 944 MET 123 CB 0.0155 -0.0141 -0.0049 945 MET 123 CG 0.0148 -0.0152 -0.0070 946 MET 123 SD 0.0175 -0.0178 -0.0084 947 MET 123 CE 0.0159 -0.0188 -0.0112 948 PRO 124 N 0.0124 -0.0101 -0.0018 949 PRO 124 CA 0.0130 -0.0088 0.0006 950 PRO 124 C 0.0155 -0.0099 0.0010 951 PRO 124 O 0.0163 -0.0089 0.0031 952 PRO 124 CB 0.0105 -0.0074 0.0003 953 PRO 124 CG 0.0087 -0.0083 -0.0024 954 PRO 124 CD 0.0102 -0.0102 -0.0038 955 GLU 125 N 0.0160 -0.0115 -0.0008 956 GLU 125 CA 0.0182 -0.0125 -0.0004 957 GLU 125 C 0.0206 -0.0128 0.0011 958 GLU 125 O 0.0225 -0.0134 0.0018 959 GLU 125 CB 0.0184 -0.0145 -0.0027 960 GLU 125 CG 0.0195 -0.0161 -0.0039 961 GLU 125 CD 0.0174 -0.0161 -0.0054 962 GLU 125 OE1 0.0152 -0.0152 -0.0061 963 GLU 125 OE2 0.0181 -0.0169 -0.0060 964 THR 126 N 0.0207 -0.0125 0.0016 965 THR 126 CA 0.0229 -0.0127 0.0031 966 THR 126 C 0.0230 -0.0108 0.0056 967 THR 126 O 0.0247 -0.0108 0.0069 968 THR 126 CB 0.0232 -0.0137 0.0021 969 THR 126 CG2 0.0235 -0.0157 -0.0003 970 THR 126 OG1 0.0210 -0.0125 0.0019 971 MET 127 N 0.0203 -0.0101 0.0068 972 MET 127 CA 0.0201 -0.0084 0.0091 973 MET 127 C 0.0204 -0.0077 0.0105 974 MET 127 O 0.0200 -0.0082 0.0094 975 MET 127 CB 0.0176 -0.0070 0.0090 976 MET 127 CG 0.0155 -0.0063 0.0081 977 MET 127 SD 0.0128 -0.0054 0.0068 978 MET 127 CE 0.0119 -0.0032 0.0093 979 THR 128 N 0.0213 -0.0067 0.0128 980 THR 128 CA 0.0220 -0.0061 0.0143 981 THR 128 C 0.0198 -0.0046 0.0145 982 THR 128 O 0.0178 -0.0037 0.0140 983 THR 128 CB 0.0235 -0.0054 0.0167 984 THR 128 CG2 0.0253 -0.0067 0.0165 985 THR 128 OG1 0.0220 -0.0036 0.0180 986 PRO 129 N 0.0191 -0.0050 0.0137 987 PRO 129 CA 0.0169 -0.0032 0.0136 988 PRO 129 C 0.0157 -0.0007 0.0156 989 PRO 129 O 0.0133 0.0008 0.0149 990 PRO 129 CB 0.0180 -0.0036 0.0143 991 PRO 129 CG 0.0208 -0.0056 0.0149 992 PRO 129 CD 0.0213 -0.0068 0.0137 993 ALA 130 N 0.0172 -0.0003 0.0181 994 ALA 130 CA 0.0161 0.0020 0.0201 995 ALA 130 C 0.0145 0.0026 0.0190 996 ALA 130 O 0.0124 0.0045 0.0193 997 ALA 130 CB 0.0183 0.0022 0.0228 998 GLN 131 N 0.0164 -0.0004 0.0196 999 GLN 131 CA 0.0148 -0.0001 0.0182 1000 GLN 131 C 0.0124 0.0002 0.0161 1001 GLN 131 O 0.0102 0.0015 0.0157 1002 GLN 131 CB 0.0164 -0.0020 0.0169 1003 GLN 131 CG 0.0181 -0.0020 0.0188 1004 GLN 131 CD 0.0202 -0.0041 0.0177 1005 GLN 131 NE2 0.0226 -0.0047 0.0194 1006 GLN 131 OE1 0.0197 -0.0052 0.0153 1007 CYS 132 N 0.0127 -0.0009 0.0146 1008 CYS 132 CA 0.0105 -0.0006 0.0127 1009 CYS 132 C 0.0085 0.0016 0.0140 1010 CYS 132 O 0.0061 0.0025 0.0129 1011 CYS 132 CB 0.0115 -0.0021 0.0113 1012 CYS 132 SG 0.0131 -0.0046 0.0087 1013 LEU 133 N 0.0085 0.0011 0.0166 1014 LEU 133 CA 0.0069 0.0031 0.0176 1015 LEU 133 C 0.0057 0.0048 0.0187 1016 LEU 133 O 0.0036 0.0063 0.0183 1017 LEU 133 CB 0.0082 0.0032 0.0197 1018 LEU 133 CG 0.0067 0.0053 0.0212 1019 LEU 133 CD1 0.0047 0.0060 0.0193 1020 LEU 133 CD2 0.0081 0.0053 0.0232 1021 GLN 134 N 0.0069 0.0046 0.0201 1022 GLN 134 CA 0.0057 0.0061 0.0212 1023 GLN 134 C 0.0040 0.0064 0.0191 1024 GLN 134 O 0.0021 0.0081 0.0192 1025 GLN 134 CB 0.0075 0.0057 0.0230 1026 GLN 134 CG 0.0086 0.0062 0.0256 1027 GLN 134 CD 0.0070 0.0084 0.0272 1028 GLN 134 NE2 0.0075 0.0090 0.0289 1029 GLN 134 OE1 0.0053 0.0096 0.0268 1030 PHE 135 N 0.0048 0.0044 0.0172 1031 PHE 135 CA 0.0030 0.0044 0.0149 1032 PHE 135 C 0.0009 0.0052 0.0137 1033 PHE 135 O -0.0012 0.0063 0.0129 1034 PHE 135 CB 0.0044 0.0023 0.0128 1035 PHE 135 CG 0.0028 0.0020 0.0101 1036 PHE 135 CD1 0.0007 0.0033 0.0097 1037 PHE 135 CD2 0.0034 0.0004 0.0079 1038 PHE 135 CE1 -0.0008 0.0030 0.0072 1039 PHE 135 CE2 0.0019 0.0001 0.0054 1040 PHE 135 CZ -0.0002 0.0014 0.0050 1041 MET 136 N 0.0015 0.0048 0.0137 1042 MET 136 CA -0.0004 0.0056 0.0126 1043 MET 136 C -0.0023 0.0077 0.0142 1044 MET 136 O -0.0045 0.0087 0.0131 1045 MET 136 CB 0.0008 0.0047 0.0126 1046 MET 136 CG 0.0014 0.0029 0.0100 1047 MET 136 SD -0.0003 0.0025 0.0069 1048 MET 136 CE -0.0034 0.0046 0.0068 1049 ILE 137 N -0.0017 0.0084 0.0169 1050 ILE 137 CA -0.0033 0.0106 0.0186 1051 ILE 137 C -0.0049 0.0117 0.0184 1052 ILE 137 O -0.0071 0.0133 0.0180 1053 ILE 137 CB -0.0019 0.0110 0.0217 1054 ILE 137 CG1 -0.0009 0.0104 0.0220 1055 ILE 137 CG2 -0.0034 0.0132 0.0236 1056 ILE 137 CD1 0.0007 0.0105 0.0249 1057 ASP 138 N -0.0038 0.0109 0.0186 1058 ASP 138 CA -0.0051 0.0121 0.0188 1059 ASP 138 C -0.0072 0.0125 0.0163 1060 ASP 138 O -0.0087 0.0139 0.0165 1061 ASP 138 CB -0.0033 0.0110 0.0194 1062 ASP 138 CG -0.0015 0.0110 0.0223 1063 ASP 138 OD1 -0.0014 0.0116 0.0237 1064 ASP 138 OD2 -0.0002 0.0103 0.0231 1065 ILE 139 N -0.0079 0.0108 0.0144 1066 ILE 139 CA -0.0098 0.0113 0.0119 1067 ILE 139 C -0.0114 0.0122 0.0112 1068 ILE 139 O -0.0129 0.0123 0.0089 1069 ILE 139 CB -0.0089 0.0094 0.0094 1070 ILE 139 CG1 -0.0078 0.0080 0.0081 1071 ILE 139 CG2 -0.0070 0.0083 0.0103 1072 ILE 139 CD1 -0.0075 0.0064 0.0053 1073 ASP 140 N -0.0112 0.0128 0.0131 1074 ASP 140 CA -0.0126 0.0137 0.0125 1075 ASP 140 C -0.0152 0.0157 0.0122 1076 ASP 140 O -0.0158 0.0170 0.0140 1077 ASP 140 CB -0.0118 0.0141 0.0149 1078 ASP 140 CG -0.0126 0.0145 0.0142 1079 ASP 140 OD1 -0.0136 0.0142 0.0117 1080 ASP 140 OD2 -0.0123 0.0151 0.0161 1081 PRO 141 N -0.0171 0.0155 0.0105 1082 PRO 141 CA -0.0196 0.0175 0.0101 1083 PRO 141 C -0.0207 0.0195 0.0124 1084 PRO 141 O -0.0223 0.0213 0.0131 1085 PRO 141 CB -0.0209 0.0172 0.0071 1086 PRO 141 CG -0.0190 0.0148 0.0056 1087 PRO 141 CD -0.0167 0.0138 0.0078 1088 ALA 142 N -0.0198 0.0194 0.0137 1089 ALA 142 CA -0.0207 0.0212 0.0159 1090 ALA 142 C -0.0197 0.0217 0.0189 1091 ALA 142 O -0.0201 0.0231 0.0210 1092 ALA 142 CB -0.0202 0.0208 0.0161 1093 ARG 143 N -0.0184 0.0212 0.0185 1094 ARG 143 CA -0.0175 0.0215 0.0211 1095 ARG 143 C -0.0185 0.0223 0.0210 1096 ARG 143 O -0.0180 0.0228 0.0231 1097 ARG 143 CB -0.0147 0.0196 0.0218 1098 ARG 143 CG -0.0134 0.0193 0.0236 1099 ARG 143 CD -0.0108 0.0179 0.0251 1100 ARG 143 NE -0.0094 0.0174 0.0264 1101 ARG 143 CZ -0.0088 0.0163 0.0250 1102 ARG 143 NH1 -0.0094 0.0156 0.0222 1103 ARG 143 NH2 -0.0075 0.0159 0.0265 1104 SER 144 N -0.0199 0.0224 0.0185 1105 SER 144 CA -0.0210 0.0231 0.0181 1106 SER 144 C -0.0191 0.0220 0.0191 1107 SER 144 O -0.0196 0.0230 0.0206 1108 SER 144 CB -0.0231 0.0253 0.0196 1109 SER 144 OG -0.0225 0.0260 0.0224 1110 GLY 5 N 0.0118 -0.0054 0.0030 1111 GLY 5 CA 0.0106 -0.0046 0.0013 1112 GLY 5 C 0.0092 -0.0037 0.0012 1113 GLY 5 O 0.0085 -0.0034 0.0029 1114 LEU 6 N 0.0089 -0.0034 -0.0006 1115 LEU 6 CA 0.0076 -0.0026 -0.0010 1116 LEU 6 C 0.0086 -0.0031 -0.0018 1117 LEU 6 O 0.0099 -0.0038 -0.0030 1118 LEU 6 CB 0.0062 -0.0016 -0.0025 1119 LEU 6 CG 0.0044 -0.0006 -0.0023 1120 LEU 6 CD1 0.0036 -0.0003 -0.0001 1121 LEU 6 CD2 0.0030 0.0003 -0.0038 1122 TYR 7 N 0.0075 -0.0028 0.0005 1123 TYR 7 CA 0.0089 -0.0036 -0.0003 1124 TYR 7 C 0.0077 -0.0030 -0.0004 1125 TYR 7 O 0.0063 -0.0021 0.0007 1126 TYR 7 CB 0.0108 -0.0042 0.0013 1127 TYR 7 CG 0.0124 -0.0051 0.0010 1128 TYR 7 CD1 0.0139 -0.0061 -0.0006 1129 TYR 7 CD2 0.0125 -0.0049 0.0022 1130 TYR 7 CE1 0.0153 -0.0069 -0.0009 1131 TYR 7 CE2 0.0140 -0.0057 0.0019 1132 TYR 7 CZ 0.0154 -0.0067 0.0004 1133 TYR 7 OH 0.0168 -0.0075 0.0001 1134 ARG 8 N 0.0084 -0.0036 -0.0018 1135 ARG 8 CA 0.0075 -0.0032 -0.0021 1136 ARG 8 C 0.0093 -0.0041 -0.0020 1137 ARG 8 O 0.0107 -0.0050 -0.0032 1138 ARG 8 CB 0.0062 -0.0030 -0.0044 1139 ARG 8 CG 0.0052 -0.0026 -0.0047 1140 ARG 8 CD 0.0042 -0.0025 -0.0071 1141 ARG 8 NE 0.0025 -0.0017 -0.0075 1142 ARG 8 CZ 0.0020 -0.0019 -0.0094 1143 ARG 8 NH1 0.0032 -0.0028 -0.0111 1144 ARG 8 NH2 0.0004 -0.0011 -0.0096 1145 MET 9 N 0.0089 -0.0046 -0.0002 1146 MET 9 CA 0.0099 -0.0051 0.0002 1147 MET 9 C 0.0095 -0.0049 0.0001 1148 MET 9 O 0.0088 -0.0041 0.0008 1149 MET 9 CB 0.0106 -0.0051 0.0016 1150 MET 9 CG 0.0116 -0.0056 0.0021 1151 MET 9 SD 0.0125 -0.0058 0.0036 1152 MET 9 CE 0.0139 -0.0068 0.0034 1153 THR 10 N 0.0100 -0.0055 -0.0006 1154 THR 10 CA 0.0097 -0.0053 -0.0007 1155 THR 10 C 0.0108 -0.0059 -0.0002 1156 THR 10 O 0.0117 -0.0067 -0.0006 1157 THR 10 CB 0.0091 -0.0054 -0.0022 1158 THR 10 CG2 0.0099 -0.0063 -0.0031 1159 THR 10 OG1 0.0090 -0.0054 -0.0022 1160 TYR 11 N 0.0103 -0.0064 0.0005 1161 TYR 11 CA 0.0117 -0.0069 0.0012 1162 TYR 11 C 0.0117 -0.0067 0.0015 1163 TYR 11 O 0.0106 -0.0060 0.0013 1164 TYR 11 CB 0.0125 -0.0064 0.0025 1165 TYR 11 CG 0.0123 -0.0053 0.0038 1166 TYR 11 CD1 0.0132 -0.0053 0.0046 1167 TYR 11 CD2 0.0111 -0.0042 0.0041 1168 TYR 11 CE1 0.0130 -0.0044 0.0058 1169 TYR 11 CE2 0.0110 -0.0033 0.0053 1170 TYR 11 CZ 0.0119 -0.0033 0.0061 1171 TYR 11 OH 0.0117 -0.0023 0.0072 1172 ILE 12 N 0.0129 -0.0073 0.0018 1173 ILE 12 CA 0.0131 -0.0072 0.0021 1174 ILE 12 C 0.0143 -0.0070 0.0034 1175 ILE 12 O 0.0151 -0.0072 0.0039 1176 ILE 12 CB 0.0133 -0.0082 0.0009 1177 ILE 12 CG1 0.0147 -0.0093 0.0008 1178 ILE 12 CG2 0.0121 -0.0084 -0.0004 1179 ILE 12 CD1 0.0149 -0.0103 -0.0004 1180 SER 13 N 0.0138 -0.0065 0.0036 1181 SER 13 CA 0.0153 -0.0063 0.0056 1182 SER 13 C 0.0154 -0.0063 0.0058 1183 SER 13 O 0.0142 -0.0060 0.0048 1184 SER 13 CB 0.0148 -0.0047 0.0073 1185 SER 13 OG 0.0158 -0.0042 0.0091 1186 ARG 14 N 0.0170 -0.0066 0.0073 1187 ARG 14 CA 0.0174 -0.0067 0.0077 1188 ARG 14 C 0.0175 -0.0052 0.0098 1189 ARG 14 O 0.0183 -0.0048 0.0112 1190 ARG 14 CB 0.0193 -0.0084 0.0076 1191 ARG 14 CG 0.0193 -0.0099 0.0055 1192 ARG 14 CD 0.0211 -0.0115 0.0054 1193 ARG 14 NE 0.0210 -0.0130 0.0033 1194 ARG 14 CZ 0.0203 -0.0133 0.0021 1195 ARG 14 NH1 0.0196 -0.0123 0.0027 1196 ARG 14 NH2 0.0203 -0.0146 0.0002 1197 ALA 15 N 0.0169 -0.0044 0.0106 1198 ALA 15 CA 0.0168 -0.0023 0.0126 1199 ALA 15 C 0.0188 -0.0028 0.0145 1200 ALA 15 O 0.0201 -0.0046 0.0140 1201 ALA 15 CB 0.0149 -0.0008 0.0121 1202 VAL 16 N 0.0191 -0.0011 0.0166 1203 VAL 16 CA 0.0208 -0.0012 0.0185 1204 VAL 16 C 0.0200 -0.0005 0.0184 1205 VAL 16 O 0.0181 0.0007 0.0175 1206 VAL 16 CB 0.0214 0.0004 0.0209 1207 VAL 16 CG1 0.0226 -0.0006 0.0212 1208 VAL 16 CG2 0.0193 0.0027 0.0210 1209 PRO 17 N 0.0224 -0.0016 0.0191 1210 PRO 17 CA 0.0214 -0.0013 0.0186 1211 PRO 17 C 0.0199 0.0010 0.0201 1212 PRO 17 O 0.0184 0.0015 0.0194 1213 PRO 17 CB 0.0239 -0.0027 0.0191 1214 PRO 17 CG 0.0261 -0.0033 0.0204 1215 PRO 17 CD 0.0252 -0.0029 0.0201 1216 GLY 18 N 0.0201 0.0026 0.0222 1217 GLY 18 CA 0.0190 0.0048 0.0239 1218 GLY 18 C 0.0164 0.0065 0.0236 1219 GLY 18 O 0.0156 0.0085 0.0254 1220 LEU 19 N 0.0145 0.0055 0.0210 1221 LEU 19 CA 0.0121 0.0070 0.0206 1222 LEU 19 C 0.0095 0.0087 0.0205 1223 LEU 19 O 0.0091 0.0081 0.0191 1224 LEU 19 CB 0.0116 0.0058 0.0179 1225 LEU 19 CG 0.0131 0.0052 0.0188 1226 LEU 19 CD1 0.0119 0.0048 0.0166 1227 LEU 19 CD2 0.0131 0.0070 0.0218 1228 GLY 20 N 0.0078 0.0107 0.0219 1229 GLY 20 CA 0.0053 0.0124 0.0219 1230 GLY 20 C 0.0028 0.0138 0.0213 1231 GLY 20 O 0.0028 0.0132 0.0204 1232 TYR 21 N 0.0001 0.0149 0.0228 1233 TYR 21 CA -0.0022 0.0165 0.0216 1234 TYR 21 C -0.0022 0.0175 0.0235 1235 TYR 21 O -0.0032 0.0179 0.0223 1236 TYR 21 CB -0.0042 0.0184 0.0214 1237 TYR 21 CG -0.0048 0.0176 0.0190 1238 TYR 21 CD1 -0.0037 0.0168 0.0196 1239 TYR 21 CD2 -0.0064 0.0176 0.0162 1240 TYR 21 CE1 -0.0042 0.0161 0.0174 1241 TYR 21 CE2 -0.0069 0.0169 0.0141 1242 TYR 21 CZ -0.0058 0.0161 0.0146 1243 TYR 21 OH -0.0063 0.0153 0.0125 1244 ASN 22 N -0.0011 0.0181 0.0264 1245 ASN 22 CA -0.0010 0.0191 0.0283 1246 ASN 22 C 0.0003 0.0174 0.0276 1247 ASN 22 O -0.0005 0.0182 0.0275 1248 ASN 22 CB 0.0001 0.0198 0.0315 1249 ASN 22 CG -0.0014 0.0219 0.0324 1250 ASN 22 ND2 -0.0002 0.0220 0.0346 1251 ASN 22 OD1 -0.0035 0.0233 0.0310 1252 ASP 23 N 0.0033 0.0154 0.0259 1253 ASP 23 CA 0.0045 0.0142 0.0254 1254 ASP 23 C 0.0029 0.0139 0.0232 1255 ASP 23 O 0.0028 0.0140 0.0232 1256 ASP 23 CB 0.0068 0.0122 0.0251 1257 ASP 23 CG 0.0087 0.0124 0.0275 1258 ASP 23 OD1 0.0097 0.0125 0.0289 1259 ASP 23 OD2 0.0092 0.0123 0.0279 1260 LEU 24 N 0.0017 0.0136 0.0212 1261 LEU 24 CA 0.0001 0.0134 0.0190 1262 LEU 24 C -0.0019 0.0152 0.0196 1263 LEU 24 O -0.0025 0.0151 0.0186 1264 LEU 24 CB -0.0008 0.0128 0.0170 1265 LEU 24 CG 0.0009 0.0107 0.0157 1266 LEU 24 CD1 -0.0002 0.0102 0.0137 1267 LEU 24 CD2 0.0019 0.0092 0.0147 1268 ARG 25 N -0.0031 0.0171 0.0214 1269 ARG 25 CA -0.0048 0.0188 0.0218 1270 ARG 25 C -0.0037 0.0184 0.0235 1271 ARG 25 O -0.0045 0.0189 0.0229 1272 ARG 25 CB -0.0064 0.0209 0.0234 1273 ARG 25 CG -0.0084 0.0220 0.0213 1274 ARG 25 CD -0.0098 0.0238 0.0229 1275 ARG 25 NE -0.0110 0.0243 0.0211 1276 ARG 25 CZ -0.0107 0.0242 0.0215 1277 ARG 25 NH1 -0.0093 0.0237 0.0238 1278 ARG 25 NH2 -0.0119 0.0247 0.0197 1279 ASP 26 N -0.0018 0.0175 0.0256 1280 ASP 26 CA -0.0006 0.0169 0.0272 1281 ASP 26 C 0.0003 0.0153 0.0251 1282 ASP 26 O 0.0002 0.0154 0.0252 1283 ASP 26 CB 0.0013 0.0160 0.0296 1284 ASP 26 CG 0.0023 0.0157 0.0316 1285 ASP 26 OD1 0.0011 0.0172 0.0326 1286 ASP 26 OD2 0.0044 0.0140 0.0322 1287 ILE 27 N 0.0009 0.0134 0.0223 1288 ILE 27 CA 0.0016 0.0122 0.0205 1289 ILE 27 C -0.0004 0.0130 0.0190 1290 ILE 27 O -0.0003 0.0128 0.0187 1291 ILE 27 CB 0.0027 0.0105 0.0186 1292 ILE 27 CG1 0.0051 0.0095 0.0200 1293 ILE 27 CG2 0.0030 0.0094 0.0164 1294 ILE 27 CD1 0.0060 0.0081 0.0184 1295 MET 28 N -0.0023 0.0139 0.0181 1296 MET 28 CA -0.0044 0.0149 0.0167 1297 MET 28 C -0.0051 0.0160 0.0184 1298 MET 28 O -0.0054 0.0159 0.0176 1299 MET 28 CB -0.0064 0.0159 0.0160 1300 MET 28 CG -0.0081 0.0161 0.0136 1301 MET 28 SD -0.0075 0.0144 0.0108 1302 MET 28 CE -0.0095 0.0156 0.0101 1303 GLY 29 N -0.0043 0.0172 0.0198 1304 GLY 29 CA -0.0050 0.0188 0.0205 1305 GLY 29 C -0.0040 0.0173 0.0205 1306 GLY 29 O -0.0049 0.0177 0.0193 1307 LYS 30 N -0.0022 0.0153 0.0218 1308 LYS 30 CA -0.0011 0.0137 0.0220 1309 LYS 30 C -0.0015 0.0122 0.0191 1310 LYS 30 O -0.0018 0.0122 0.0184 1311 LYS 30 CB 0.0010 0.0119 0.0239 1312 LYS 30 CG 0.0016 0.0132 0.0270 1313 LYS 30 CD 0.0036 0.0113 0.0288 1314 LYS 30 CE 0.0042 0.0126 0.0319 1315 LYS 30 NZ 0.0062 0.0107 0.0337 1316 SER 31 N -0.0016 0.0116 0.0180 1317 SER 31 CA -0.0014 0.0107 0.0158 1318 SER 31 C -0.0029 0.0118 0.0148 1319 SER 31 O -0.0026 0.0113 0.0140 1320 SER 31 CB -0.0012 0.0099 0.0142 1321 SER 31 OG -0.0024 0.0112 0.0141 1322 GLU 32 N -0.0045 0.0134 0.0148 1323 GLU 32 CA -0.0060 0.0145 0.0138 1324 GLU 32 C -0.0059 0.0149 0.0151 1325 GLU 32 O -0.0062 0.0148 0.0140 1326 GLU 32 CB -0.0076 0.0162 0.0139 1327 GLU 32 CG -0.0085 0.0163 0.0115 1328 GLU 32 CD -0.0097 0.0176 0.0117 1329 GLU 32 OE1 -0.0103 0.0187 0.0135 1330 GLU 32 OE2 -0.0101 0.0174 0.0101 1331 VAL 33 N -0.0048 0.0144 0.0153 1332 VAL 33 CA -0.0047 0.0145 0.0160 1333 VAL 33 C -0.0038 0.0129 0.0154 1334 VAL 33 O -0.0039 0.0129 0.0145 1335 VAL 33 CB -0.0047 0.0149 0.0182 1336 VAL 33 CG1 -0.0042 0.0145 0.0190 1337 VAL 33 CG2 -0.0058 0.0167 0.0187 1338 ASN 34 N -0.0028 0.0115 0.0157 1339 ASN 34 CA -0.0018 0.0099 0.0153 1340 ASN 34 C -0.0019 0.0096 0.0131 1341 ASN 34 O -0.0017 0.0090 0.0126 1342 ASN 34 CB -0.0008 0.0086 0.0161 1343 ASN 34 CG -0.0005 0.0086 0.0183 1344 ASN 34 ND2 -0.0010 0.0096 0.0192 1345 ASN 34 OD1 0.0002 0.0077 0.0191 1346 ASN 35 N -0.0018 0.0094 0.0130 1347 ASN 35 CA -0.0023 0.0087 0.0109 1348 ASN 35 C -0.0041 0.0099 0.0105 1349 ASN 35 O -0.0044 0.0096 0.0094 1350 ASN 35 CB -0.0023 0.0079 0.0092 1351 ASN 35 CG -0.0005 0.0064 0.0094 1352 ASN 35 ND2 0.0000 0.0051 0.0076 1353 ASN 35 OD1 0.0006 0.0064 0.0110 1354 SER 36 N -0.0053 0.0114 0.0113 1355 SER 36 CA -0.0070 0.0127 0.0112 1356 SER 36 C -0.0065 0.0129 0.0123 1357 SER 36 O -0.0073 0.0131 0.0116 1358 SER 36 CB -0.0083 0.0142 0.0120 1359 SER 36 OG -0.0101 0.0152 0.0111 1360 HIS 37 N -0.0051 0.0122 0.0142 1361 HIS 37 CA -0.0043 0.0121 0.0156 1362 HIS 37 C -0.0031 0.0103 0.0141 1363 HIS 37 O -0.0033 0.0104 0.0139 1364 HIS 37 CB -0.0029 0.0121 0.0184 1365 HIS 37 CG -0.0022 0.0121 0.0200 1366 HIS 37 CD2 -0.0005 0.0106 0.0200 1367 HIS 37 ND1 -0.0031 0.0137 0.0219 1368 HIS 37 CE1 -0.0021 0.0133 0.0230 1369 HIS 37 NE2 -0.0005 0.0114 0.0219 1370 VAL 38 N -0.0018 0.0087 0.0128 1371 VAL 38 CA -0.0003 0.0068 0.0116 1372 VAL 38 C -0.0014 0.0065 0.0087 1373 VAL 38 O -0.0009 0.0057 0.0078 1374 VAL 38 CB 0.0017 0.0051 0.0118 1375 VAL 38 CG1 0.0027 0.0032 0.0096 1376 VAL 38 CG2 0.0033 0.0048 0.0145 1377 GLY 39 N -0.0023 0.0076 0.0102 1378 GLY 39 CA -0.0032 0.0072 0.0078 1379 GLY 39 C -0.0024 0.0057 0.0060 1380 GLY 39 O -0.0020 0.0047 0.0044 1381 LEU 40 N -0.0021 0.0056 0.0063 1382 LEU 40 CA -0.0013 0.0043 0.0047 1383 LEU 40 C -0.0029 0.0051 0.0035 1384 LEU 40 O -0.0042 0.0065 0.0046 1385 LEU 40 CB 0.0006 0.0034 0.0060 1386 LEU 40 CG 0.0026 0.0019 0.0062 1387 LEU 40 CD1 0.0043 0.0013 0.0077 1388 LEU 40 CD2 0.0031 0.0006 0.0039 1389 THR 41 N -0.0032 0.0050 0.0049 1390 THR 41 CA -0.0046 0.0057 0.0036 1391 THR 41 C -0.0035 0.0047 0.0026 1392 THR 41 O -0.0016 0.0035 0.0028 1393 THR 41 CB -0.0060 0.0061 0.0016 1394 THR 41 CG2 -0.0072 0.0072 0.0026 1395 THR 41 OG1 -0.0047 0.0049 0.0000 1396 GLY 42 N -0.0046 0.0052 0.0015 1397 GLY 42 CA -0.0036 0.0043 0.0003 1398 GLY 42 C -0.0048 0.0051 0.0004 1399 GLY 42 O -0.0066 0.0063 0.0008 1400 LEU 43 N -0.0045 0.0046 0.0007 1401 LEU 43 CA -0.0053 0.0050 0.0005 1402 LEU 43 C -0.0031 0.0039 0.0011 1403 LEU 43 O -0.0011 0.0026 0.0009 1404 LEU 43 CB -0.0069 0.0049 -0.0022 1405 LEU 43 CG -0.0082 0.0054 -0.0028 1406 LEU 43 CD1 -0.0101 0.0073 -0.0012 1407 LEU 43 CD2 -0.0093 0.0050 -0.0057 1408 LEU 44 N -0.0035 0.0045 0.0019 1409 LEU 44 CA -0.0016 0.0036 0.0026 1410 LEU 44 C -0.0025 0.0036 0.0014 1411 LEU 44 O -0.0045 0.0049 0.0015 1412 LEU 44 CB -0.0009 0.0043 0.0056 1413 LEU 44 CG 0.0007 0.0038 0.0067 1414 LEU 44 CD1 0.0033 0.0020 0.0061 1415 LEU 44 CD2 0.0008 0.0049 0.0096 1416 CYS 45 N -0.0016 0.0026 0.0009 1417 CYS 45 CA -0.0020 0.0022 -0.0003 1418 CYS 45 C 0.0002 0.0015 0.0010 1419 CYS 45 O 0.0024 0.0002 0.0011 1420 CYS 45 CB -0.0023 0.0009 -0.0033 1421 CYS 45 SG -0.0022 0.0000 -0.0049 1422 PHE 46 N -0.0004 0.0024 0.0020 1423 PHE 46 CA 0.0015 0.0018 0.0032 1424 PHE 46 C 0.0012 0.0012 0.0016 1425 PHE 46 O -0.0009 0.0020 0.0006 1426 PHE 46 CB 0.0013 0.0034 0.0061 1427 PHE 46 CG 0.0031 0.0030 0.0074 1428 PHE 46 CD1 0.0056 0.0013 0.0073 1429 PHE 46 CD2 0.0023 0.0042 0.0088 1430 PHE 46 CE1 0.0073 0.0009 0.0085 1431 PHE 46 CE2 0.0040 0.0038 0.0101 1432 PHE 46 CZ 0.0065 0.0021 0.0099 1433 GLY 47 N 0.0033 -0.0003 0.0014 1434 GLY 47 CA 0.0033 -0.0010 0.0001 1435 GLY 47 C 0.0058 -0.0029 0.0000 1436 GLY 47 O 0.0074 -0.0042 -0.0004 1437 ASN 48 N 0.0064 -0.0031 0.0004 1438 ASN 48 CA 0.0088 -0.0048 0.0003 1439 ASN 48 C 0.0110 -0.0053 0.0024 1440 ASN 48 O 0.0129 -0.0070 0.0017 1441 ASN 48 CB 0.0091 -0.0066 -0.0025 1442 ASN 48 CG 0.0114 -0.0084 -0.0027 1443 ASN 48 ND2 0.0123 -0.0102 -0.0048 1444 ASN 48 OD1 0.0123 -0.0081 -0.0011 1445 SER 49 N 0.0111 -0.0038 0.0046 1446 SER 49 CA 0.0127 -0.0039 0.0064 1447 SER 49 C 0.0132 -0.0048 0.0055 1448 SER 49 O 0.0151 -0.0057 0.0062 1449 SER 49 CB 0.0150 -0.0048 0.0074 1450 SER 49 OG 0.0166 -0.0067 0.0062 1451 ILE 50 N 0.0114 -0.0045 0.0040 1452 ILE 50 CA 0.0115 -0.0051 0.0031 1453 ILE 50 C 0.0095 -0.0036 0.0032 1454 ILE 50 O 0.0075 -0.0026 0.0025 1455 ILE 50 CB 0.0115 -0.0068 0.0005 1456 ILE 50 CG1 0.0134 -0.0083 0.0002 1457 ILE 50 CG2 0.0119 -0.0076 -0.0003 1458 ILE 50 CD1 0.0157 -0.0098 0.0005 1459 PHE 51 N 0.0100 -0.0033 0.0042 1460 PHE 51 CA 0.0085 -0.0022 0.0042 1461 PHE 51 C 0.0084 -0.0032 0.0025 1462 PHE 51 O 0.0101 -0.0044 0.0023 1463 PHE 51 CB 0.0089 -0.0012 0.0064 1464 PHE 51 CG 0.0089 -0.0001 0.0082 1465 PHE 51 CD1 0.0106 -0.0006 0.0093 1466 PHE 51 CD2 0.0071 0.0015 0.0088 1467 PHE 51 CE1 0.0106 0.0004 0.0109 1468 PHE 51 CE2 0.0070 0.0025 0.0104 1469 PHE 51 CZ 0.0088 0.0020 0.0115 1470 LEU 52 N 0.0066 -0.0027 0.0012 1471 LEU 52 CA 0.0063 -0.0034 -0.0002 1472 LEU 52 C 0.0047 -0.0020 0.0003 1473 LEU 52 O 0.0030 -0.0009 0.0002 1474 LEU 52 CB 0.0054 -0.0042 -0.0026 1475 LEU 52 CG 0.0044 -0.0045 -0.0043 1476 LEU 52 CD1 0.0060 -0.0056 -0.0043 1477 LEU 52 CD2 0.0036 -0.0053 -0.0064 1478 GLN 53 N 0.0063 -0.0025 0.0010 1479 GLN 53 CA 0.0053 -0.0015 0.0017 1480 GLN 53 C 0.0052 -0.0020 0.0005 1481 GLN 53 O 0.0065 -0.0031 0.0002 1482 GLN 53 CB 0.0061 -0.0009 0.0038 1483 GLN 53 CG 0.0051 0.0002 0.0045 1484 GLN 53 CD 0.0053 0.0012 0.0066 1485 GLN 53 NE2 0.0041 0.0024 0.0072 1486 GLN 53 OE1 0.0066 0.0008 0.0077 1487 ILE 54 N 0.0036 -0.0012 -0.0001 1488 ILE 54 CA 0.0033 -0.0015 -0.0011 1489 ILE 54 C 0.0026 -0.0003 0.0001 1490 ILE 54 O 0.0013 0.0009 0.0007 1491 ILE 54 CB 0.0020 -0.0016 -0.0031 1492 ILE 54 CG1 0.0027 -0.0028 -0.0044 1493 ILE 54 CG2 0.0015 -0.0017 -0.0040 1494 ILE 54 CD1 0.0020 -0.0034 -0.0065 1495 LEU 55 N 0.0048 -0.0013 -0.0001 1496 LEU 55 CA 0.0044 -0.0005 0.0012 1497 LEU 55 C 0.0041 -0.0008 0.0002 1498 LEU 55 O 0.0050 -0.0018 -0.0010 1499 LEU 55 CB 0.0059 -0.0007 0.0029 1500 LEU 55 CG 0.0060 -0.0001 0.0046 1501 LEU 55 CD1 0.0079 -0.0009 0.0055 1502 LEU 55 CD2 0.0050 0.0011 0.0060 1503 GLU 56 N 0.0029 0.0002 0.0006 1504 GLU 56 CA 0.0025 0.0001 -0.0003 1505 GLU 56 C 0.0022 0.0008 0.0013 1506 GLU 56 O 0.0013 0.0019 0.0024 1507 GLU 56 CB 0.0008 0.0004 -0.0018 1508 GLU 56 CG 0.0012 -0.0006 -0.0037 1509 GLU 56 CD -0.0004 -0.0002 -0.0051 1510 GLU 56 OE1 -0.0018 0.0009 -0.0044 1511 GLU 56 OE2 -0.0004 -0.0009 -0.0068 1512 GLY 57 N 0.0057 -0.0009 0.0002 1513 GLY 57 CA 0.0058 -0.0011 0.0012 1514 GLY 57 C 0.0071 -0.0022 0.0011 1515 GLY 57 O 0.0079 -0.0028 0.0001 1516 SER 58 N 0.0074 -0.0025 0.0023 1517 SER 58 CA 0.0086 -0.0035 0.0025 1518 SER 58 C 0.0096 -0.0044 0.0030 1519 SER 58 O 0.0092 -0.0041 0.0037 1520 SER 58 CB 0.0086 -0.0036 0.0037 1521 SER 58 OG 0.0083 -0.0035 0.0053 1522 ARG 59 N 0.0156 -0.0049 0.0011 1523 ARG 59 CA 0.0148 -0.0052 0.0016 1524 ARG 59 C 0.0141 -0.0059 0.0020 1525 ARG 59 O 0.0134 -0.0057 0.0026 1526 ARG 59 CB 0.0150 -0.0058 0.0013 1527 ARG 59 CG 0.0144 -0.0058 0.0018 1528 ARG 59 CD 0.0147 -0.0064 0.0013 1529 ARG 59 NE 0.0147 -0.0075 0.0010 1530 ARG 59 CZ 0.0149 -0.0081 0.0005 1531 ARG 59 NH1 0.0152 -0.0078 0.0004 1532 ARG 59 NH2 0.0149 -0.0091 0.0002 1533 GLN 60 N 0.0143 -0.0066 0.0016 1534 GLN 60 CA 0.0136 -0.0073 0.0019 1535 GLN 60 C 0.0132 -0.0067 0.0024 1536 GLN 60 O 0.0125 -0.0069 0.0030 1537 GLN 60 CB 0.0140 -0.0082 0.0013 1538 GLN 60 CG 0.0134 -0.0088 0.0015 1539 GLN 60 CD 0.0126 -0.0094 0.0020 1540 GLN 60 NE2 0.0119 -0.0099 0.0023 1541 GLN 60 OE1 0.0125 -0.0095 0.0020 1542 ALA 61 N 0.0107 -0.0033 0.0050 1543 ALA 61 CA 0.0102 -0.0028 0.0054 1544 ALA 61 C 0.0104 -0.0030 0.0051 1545 ALA 61 O 0.0104 -0.0029 0.0057 1546 ALA 61 CB 0.0095 -0.0023 0.0051 1547 ILE 62 N 0.0105 -0.0032 0.0044 1548 ILE 62 CA 0.0106 -0.0034 0.0041 1549 ILE 62 C 0.0112 -0.0038 0.0046 1550 ILE 62 O 0.0112 -0.0038 0.0049 1551 ILE 62 CB 0.0106 -0.0036 0.0031 1552 ILE 62 CG1 0.0100 -0.0031 0.0026 1553 ILE 62 CG2 0.0110 -0.0040 0.0029 1554 ILE 62 CD1 0.0100 -0.0033 0.0017 1555 SER 63 N 0.0122 -0.0045 0.0020 1556 SER 63 CA 0.0127 -0.0050 0.0025 1557 SER 63 C 0.0127 -0.0047 0.0034 1558 SER 63 O 0.0129 -0.0049 0.0038 1559 SER 63 CB 0.0131 -0.0056 0.0023 1560 SER 63 OG 0.0131 -0.0058 0.0015 1561 HIS 64 N 0.0124 -0.0043 0.0037 1562 HIS 64 CA 0.0123 -0.0041 0.0045 1563 HIS 64 C 0.0120 -0.0036 0.0048 1564 HIS 64 O 0.0122 -0.0036 0.0054 1565 HIS 64 CB 0.0121 -0.0037 0.0047 1566 HIS 64 CG 0.0122 -0.0036 0.0056 1567 HIS 64 CD2 0.0126 -0.0040 0.0062 1568 HIS 64 ND1 0.0117 -0.0029 0.0060 1569 HIS 64 CE1 0.0119 -0.0030 0.0068 1570 HIS 64 NE2 0.0125 -0.0036 0.0069 1571 THR 65 N 0.0103 -0.0017 0.0062 1572 THR 65 CA 0.0101 -0.0016 0.0062 1573 THR 65 C 0.0108 -0.0022 0.0059 1574 THR 65 O 0.0110 -0.0022 0.0062 1575 THR 65 CB 0.0091 -0.0015 0.0056 1576 THR 65 CG2 0.0089 -0.0015 0.0054 1577 THR 65 OG1 0.0085 -0.0008 0.0059 1578 TYR 66 N 0.0111 -0.0029 0.0053 1579 TYR 66 CA 0.0118 -0.0035 0.0050 1580 TYR 66 C 0.0127 -0.0035 0.0058 1581 TYR 66 O 0.0131 -0.0037 0.0059 1582 TYR 66 CB 0.0120 -0.0041 0.0042 1583 TYR 66 CG 0.0126 -0.0048 0.0039 1584 TYR 66 CD1 0.0124 -0.0049 0.0034 1585 TYR 66 CD2 0.0135 -0.0052 0.0040 1586 TYR 66 CE1 0.0130 -0.0055 0.0031 1587 TYR 66 CE2 0.0141 -0.0058 0.0036 1588 TYR 66 CZ 0.0138 -0.0059 0.0032 1589 TYR 66 OH 0.0144 -0.0065 0.0028 1590 HIS 67 N 0.0121 -0.0043 0.0039 1591 HIS 67 CA 0.0129 -0.0045 0.0049 1592 HIS 67 C 0.0128 -0.0037 0.0059 1593 HIS 67 O 0.0135 -0.0039 0.0066 1594 HIS 67 CB 0.0131 -0.0045 0.0052 1595 HIS 67 CG 0.0138 -0.0044 0.0063 1596 HIS 67 CD2 0.0147 -0.0049 0.0069 1597 HIS 67 ND1 0.0137 -0.0039 0.0070 1598 HIS 67 CE1 0.0145 -0.0040 0.0079 1599 HIS 67 NE2 0.0151 -0.0046 0.0078 1600 ARG 68 N 0.0120 -0.0028 0.0060 1601 ARG 68 CA 0.0119 -0.0021 0.0068 1602 ARG 68 C 0.0119 -0.0022 0.0067 1603 ARG 68 O 0.0122 -0.0020 0.0075 1604 ARG 68 CB 0.0109 -0.0011 0.0069 1605 ARG 68 CG 0.0107 -0.0003 0.0078 1606 ARG 68 CD 0.0098 0.0007 0.0078 1607 ARG 68 NE 0.0093 0.0006 0.0070 1608 ARG 68 CZ 0.0084 0.0012 0.0065 1609 ARG 68 NH1 0.0078 0.0018 0.0067 1610 ARG 68 NH2 0.0080 0.0010 0.0059 1611 ILE 69 N 0.0118 -0.0017 0.0053 1612 ILE 69 CA 0.0118 -0.0017 0.0053 1613 ILE 69 C 0.0125 -0.0025 0.0057 1614 ILE 69 O 0.0127 -0.0024 0.0063 1615 ILE 69 CB 0.0114 -0.0018 0.0043 1616 ILE 69 CG1 0.0107 -0.0009 0.0041 1617 ILE 69 CG2 0.0116 -0.0023 0.0043 1618 ILE 69 CD1 0.0103 -0.0010 0.0032 1619 LEU 70 N 0.0129 -0.0032 0.0055 1620 LEU 70 CA 0.0135 -0.0040 0.0059 1621 LEU 70 C 0.0139 -0.0039 0.0069 1622 LEU 70 O 0.0144 -0.0043 0.0073 1623 LEU 70 CB 0.0138 -0.0048 0.0054 1624 LEU 70 CG 0.0137 -0.0055 0.0046 1625 LEU 70 CD1 0.0140 -0.0062 0.0042 1626 LEU 70 CD2 0.0140 -0.0058 0.0048 1627 GLN 71 N 0.0119 -0.0040 0.0076 1628 GLN 71 CA 0.0128 -0.0036 0.0092 1629 GLN 71 C 0.0144 -0.0020 0.0114 1630 GLN 71 O 0.0153 -0.0020 0.0132 1631 GLN 71 CB 0.0125 -0.0022 0.0075 1632 GLN 71 CG 0.0109 -0.0033 0.0050 1633 GLN 71 CD 0.0100 -0.0063 0.0054 1634 GLN 71 NE2 0.0096 -0.0068 0.0050 1635 GLN 71 OE1 0.0097 -0.0080 0.0062 1636 ASP 72 N 0.0149 -0.0007 0.0112 1637 ASP 72 CA 0.0165 0.0012 0.0130 1638 ASP 72 C 0.0171 -0.0003 0.0157 1639 ASP 72 O 0.0167 -0.0019 0.0160 1640 ASP 72 CB 0.0167 0.0031 0.0120 1641 ASP 72 CG 0.0182 0.0058 0.0128 1642 ASP 72 OD1 0.0194 0.0060 0.0152 1643 ASP 72 OD2 0.0181 0.0078 0.0111 1644 PRO 73 N 0.0210 0.0019 0.0237 1645 PRO 73 CA 0.0220 0.0010 0.0242 1646 PRO 73 C 0.0209 0.0016 0.0231 1647 PRO 73 O 0.0217 0.0007 0.0234 1648 PRO 73 CB 0.0228 0.0021 0.0269 1649 PRO 73 CG 0.0222 0.0025 0.0265 1650 PRO 73 CD 0.0215 0.0029 0.0260 1651 ARG 74 N 0.0191 0.0031 0.0222 1652 ARG 74 CA 0.0179 0.0038 0.0211 1653 ARG 74 C 0.0180 0.0021 0.0189 1654 ARG 74 O 0.0175 0.0022 0.0182 1655 ARG 74 CB 0.0160 0.0059 0.0206 1656 ARG 74 CG 0.0145 0.0066 0.0193 1657 ARG 74 CD 0.0129 0.0091 0.0198 1658 ARG 74 NE 0.0122 0.0101 0.0200 1659 ARG 74 CZ 0.0128 0.0109 0.0220 1660 ARG 74 NH1 0.0141 0.0107 0.0240 1661 ARG 74 NH2 0.0121 0.0117 0.0220 1662 HIS 75 N 0.0180 -0.0003 0.0161 1663 HIS 75 CA 0.0181 -0.0020 0.0145 1664 HIS 75 C 0.0194 -0.0038 0.0145 1665 HIS 75 O 0.0201 -0.0037 0.0156 1666 HIS 75 CB 0.0164 -0.0016 0.0125 1667 HIS 75 CG 0.0159 -0.0013 0.0120 1668 HIS 75 CD2 0.0146 0.0001 0.0116 1669 HIS 75 ND1 0.0168 -0.0027 0.0119 1670 HIS 75 CE1 0.0161 -0.0021 0.0114 1671 HIS 75 NE2 0.0147 -0.0004 0.0112 1672 HIS 76 N 0.0197 -0.0054 0.0132 1673 HIS 76 CA 0.0210 -0.0073 0.0132 1674 HIS 76 C 0.0206 -0.0087 0.0111 1675 HIS 76 O 0.0196 -0.0084 0.0099 1676 HIS 76 CB 0.0226 -0.0080 0.0147 1677 HIS 76 CG 0.0227 -0.0085 0.0143 1678 HIS 76 CD2 0.0239 -0.0102 0.0143 1679 HIS 76 ND1 0.0216 -0.0074 0.0139 1680 HIS 76 CE1 0.0220 -0.0083 0.0136 1681 HIS 76 NE2 0.0234 -0.0100 0.0138 1682 SER 77 N 0.0204 -0.0081 0.0086 1683 SER 77 CA 0.0200 -0.0096 0.0074 1684 SER 77 C 0.0184 -0.0092 0.0063 1685 SER 77 O 0.0178 -0.0100 0.0053 1686 SER 77 CB 0.0207 -0.0108 0.0073 1687 SER 77 OG 0.0222 -0.0112 0.0082 1688 ALA 78 N 0.0176 -0.0080 0.0063 1689 ALA 78 CA 0.0161 -0.0077 0.0053 1690 ALA 78 C 0.0157 -0.0091 0.0042 1691 ALA 78 O 0.0166 -0.0100 0.0044 1692 ALA 78 CB 0.0155 -0.0061 0.0056 1693 GLU 79 N 0.0164 -0.0082 0.0030 1694 GLU 79 CA 0.0161 -0.0087 0.0027 1695 GLU 79 C 0.0153 -0.0085 0.0027 1696 GLU 79 O 0.0149 -0.0084 0.0027 1697 GLU 79 CB 0.0162 -0.0094 0.0024 1698 GLU 79 CG 0.0165 -0.0099 0.0022 1699 GLU 79 CD 0.0166 -0.0106 0.0019 1700 GLU 79 OE1 0.0172 -0.0107 0.0020 1701 GLU 79 OE2 0.0162 -0.0111 0.0017 1702 ILE 80 N 0.0150 -0.0085 0.0027 1703 ILE 80 CA 0.0142 -0.0084 0.0026 1704 ILE 80 C 0.0139 -0.0091 0.0023 1705 ILE 80 O 0.0141 -0.0095 0.0021 1706 ILE 80 CB 0.0141 -0.0079 0.0028 1707 ILE 80 CG1 0.0146 -0.0073 0.0031 1708 ILE 80 CG2 0.0133 -0.0078 0.0028 1709 ILE 80 CD1 0.0147 -0.0070 0.0033 1710 ILE 81 N 0.0147 -0.0085 0.0015 1711 ILE 81 CA 0.0144 -0.0088 0.0008 1712 ILE 81 C 0.0143 -0.0087 0.0010 1713 ILE 81 O 0.0147 -0.0088 0.0006 1714 ILE 81 CB 0.0136 -0.0090 0.0004 1715 ILE 81 CG1 0.0138 -0.0093 -0.0002 1716 ILE 81 CG2 0.0131 -0.0093 -0.0001 1717 ILE 81 CD1 0.0130 -0.0095 -0.0005 1718 ALA 82 N 0.0138 -0.0085 0.0017 1719 ALA 82 CA 0.0137 -0.0084 0.0020 1720 ALA 82 C 0.0134 -0.0080 0.0029 1721 ALA 82 O 0.0131 -0.0079 0.0033 1722 ALA 82 CB 0.0130 -0.0087 0.0014 1723 PHE 83 N 0.0139 -0.0073 0.0007 1724 PHE 83 CA 0.0136 -0.0068 0.0009 1725 PHE 83 C 0.0134 -0.0072 -0.0007 1726 PHE 83 O 0.0140 -0.0084 -0.0011 1727 PHE 83 CB 0.0143 -0.0075 0.0022 1728 PHE 83 CG 0.0141 -0.0069 0.0024 1729 PHE 83 CD1 0.0142 -0.0075 0.0015 1730 PHE 83 CD2 0.0139 -0.0059 0.0036 1731 PHE 83 CE1 0.0140 -0.0070 0.0017 1732 PHE 83 CE2 0.0137 -0.0054 0.0039 1733 PHE 83 CZ 0.0137 -0.0060 0.0029 1734 ASP 84 N 0.0126 -0.0061 -0.0016 1735 ASP 84 CA 0.0123 -0.0065 -0.0032 1736 ASP 84 C 0.0116 -0.0053 -0.0036 1737 ASP 84 O 0.0111 -0.0041 -0.0029 1738 ASP 84 CB 0.0121 -0.0066 -0.0044 1739 ASP 84 CG 0.0113 -0.0052 -0.0044 1740 ASP 84 OD1 0.0114 -0.0048 -0.0032 1741 ASP 84 OD2 0.0107 -0.0045 -0.0055 1742 PRO 85 N 0.0120 -0.0058 -0.0057 1743 PRO 85 CA 0.0110 -0.0052 -0.0055 1744 PRO 85 C 0.0098 -0.0044 -0.0070 1745 PRO 85 O 0.0100 -0.0045 -0.0086 1746 PRO 85 CB 0.0122 -0.0060 -0.0057 1747 PRO 85 CG 0.0137 -0.0070 -0.0063 1748 PRO 85 CD 0.0135 -0.0068 -0.0065 1749 VAL 86 N 0.0085 -0.0036 -0.0065 1750 VAL 86 CA 0.0071 -0.0027 -0.0078 1751 VAL 86 C 0.0065 -0.0023 -0.0079 1752 VAL 86 O 0.0068 -0.0025 -0.0066 1753 VAL 86 CB 0.0058 -0.0018 -0.0072 1754 VAL 86 CG1 0.0061 -0.0020 -0.0079 1755 VAL 86 CG2 0.0056 -0.0018 -0.0051 1756 LEU 87 N 0.0062 -0.0011 -0.0122 1757 LEU 87 CA 0.0048 -0.0006 -0.0117 1758 LEU 87 C 0.0022 0.0002 -0.0098 1759 LEU 87 O 0.0017 0.0004 -0.0076 1760 LEU 87 CB 0.0040 -0.0004 -0.0148 1761 LEU 87 CG 0.0025 0.0000 -0.0147 1762 LEU 87 CD1 0.0038 -0.0003 -0.0123 1763 LEU 87 CD2 0.0026 -0.0001 -0.0178 1764 GLN 88 N 0.0003 0.0008 -0.0104 1765 GLN 88 CA -0.0023 0.0016 -0.0087 1766 GLN 88 C -0.0030 0.0018 -0.0085 1767 GLN 88 O -0.0021 0.0015 -0.0105 1768 GLN 88 CB -0.0048 0.0023 -0.0100 1769 GLN 88 CG -0.0051 0.0024 -0.0134 1770 GLN 88 CD -0.0077 0.0031 -0.0147 1771 GLN 88 NE2 -0.0103 0.0039 -0.0138 1772 GLN 88 OE1 -0.0074 0.0030 -0.0165 1773 ARG 89 N -0.0052 0.0024 -0.0079 1774 ARG 89 CA -0.0055 0.0026 -0.0075 1775 ARG 89 C -0.0072 0.0029 -0.0093 1776 ARG 89 O -0.0083 0.0031 -0.0106 1777 ARG 89 CB -0.0064 0.0032 -0.0052 1778 ARG 89 CG -0.0051 0.0031 -0.0032 1779 ARG 89 CD -0.0055 0.0036 -0.0010 1780 ARG 89 NE -0.0049 0.0036 0.0010 1781 ARG 89 CZ -0.0042 0.0037 0.0030 1782 ARG 89 NH1 -0.0041 0.0037 0.0034 1783 ARG 89 NH2 -0.0037 0.0038 0.0046 1784 GLU 90 N -0.0072 0.0029 -0.0095 1785 GLU 90 CA -0.0088 0.0032 -0.0110 1786 GLU 90 C -0.0101 0.0038 -0.0098 1787 GLU 90 O -0.0117 0.0042 -0.0108 1788 GLU 90 CB -0.0077 0.0025 -0.0130 1789 GLU 90 CG -0.0066 0.0019 -0.0146 1790 GLU 90 CD -0.0076 0.0019 -0.0169 1791 GLU 90 OE1 -0.0096 0.0025 -0.0172 1792 GLU 90 OE2 -0.0064 0.0013 -0.0186 1793 PHE 91 N -0.0101 0.0048 -0.0072 1794 PHE 91 CA -0.0109 0.0058 -0.0054 1795 PHE 91 C -0.0117 0.0069 -0.0035 1796 PHE 91 O -0.0112 0.0073 -0.0014 1797 PHE 91 CB -0.0092 0.0051 -0.0043 1798 PHE 91 CG -0.0081 0.0038 -0.0060 1799 PHE 91 CD1 -0.0090 0.0040 -0.0071 1800 PHE 91 CD2 -0.0062 0.0024 -0.0066 1801 PHE 91 CE1 -0.0080 0.0029 -0.0087 1802 PHE 91 CE2 -0.0053 0.0012 -0.0082 1803 PHE 91 CZ -0.0061 0.0015 -0.0093 1804 VAL 92 N -0.0129 0.0075 -0.0043 1805 VAL 92 CA -0.0136 0.0084 -0.0026 1806 VAL 92 C -0.0149 0.0099 -0.0010 1807 VAL 92 O -0.0147 0.0104 0.0011 1808 VAL 92 CB -0.0147 0.0087 -0.0041 1809 VAL 92 CG1 -0.0163 0.0091 -0.0061 1810 VAL 92 CG2 -0.0157 0.0099 -0.0025 1811 GLN 93 N -0.0175 0.0116 -0.0021 1812 GLN 93 CA -0.0194 0.0131 -0.0005 1813 GLN 93 C -0.0181 0.0132 0.0020 1814 GLN 93 O -0.0189 0.0143 0.0042 1815 GLN 93 CB -0.0212 0.0135 -0.0023 1816 GLN 93 CG -0.0217 0.0128 -0.0053 1817 GLN 93 CD -0.0201 0.0114 -0.0070 1818 GLN 93 NE2 -0.0203 0.0107 -0.0096 1819 GLN 93 OE1 -0.0188 0.0110 -0.0060 1820 TRP 94 N -0.0162 0.0120 0.0017 1821 TRP 94 CA -0.0151 0.0121 0.0038 1822 TRP 94 C -0.0127 0.0113 0.0053 1823 TRP 94 O -0.0110 0.0100 0.0041 1824 TRP 94 CB -0.0146 0.0114 0.0026 1825 TRP 94 CG -0.0167 0.0120 0.0007 1826 TRP 94 CD1 -0.0169 0.0113 -0.0020 1827 TRP 94 CD2 -0.0190 0.0135 0.0015 1828 TRP 94 CE2 -0.0205 0.0136 -0.0009 1829 TRP 94 CE3 -0.0199 0.0148 0.0040 1830 TRP 94 NE1 -0.0192 0.0122 -0.0030 1831 TRP 94 CZ2 -0.0228 0.0148 -0.0009 1832 TRP 94 CZ3 -0.0222 0.0161 0.0040 1833 TRP 94 CH2 -0.0237 0.0161 0.0016 1834 SER 95 N -0.0104 0.0128 0.0054 1835 SER 95 CA -0.0086 0.0117 0.0068 1836 SER 95 C -0.0072 0.0106 0.0071 1837 SER 95 O -0.0056 0.0091 0.0070 1838 SER 95 CB -0.0089 0.0127 0.0092 1839 SER 95 OG -0.0094 0.0131 0.0091 1840 MET 96 N -0.0079 0.0114 0.0076 1841 MET 96 CA -0.0070 0.0105 0.0074 1842 MET 96 C -0.0084 0.0117 0.0071 1843 MET 96 O -0.0097 0.0131 0.0083 1844 MET 96 CB -0.0054 0.0098 0.0096 1845 MET 96 CG -0.0037 0.0081 0.0089 1846 MET 96 SD -0.0023 0.0064 0.0072 1847 MET 96 CE -0.0018 0.0065 0.0092 1848 LYS 97 N -0.0094 0.0105 0.0059 1849 LYS 97 CA -0.0107 0.0112 0.0054 1850 LYS 97 C -0.0091 0.0099 0.0050 1851 LYS 97 O -0.0076 0.0084 0.0040 1852 LYS 97 CB -0.0125 0.0117 0.0030 1853 LYS 97 CG -0.0144 0.0130 0.0029 1854 LYS 97 CD -0.0150 0.0145 0.0054 1855 LYS 97 CE -0.0173 0.0161 0.0052 1856 LYS 97 NZ -0.0178 0.0175 0.0077 1857 LEU 98 N -0.0096 0.0106 0.0058 1858 LEU 98 CA -0.0083 0.0095 0.0055 1859 LEU 98 C -0.0097 0.0098 0.0037 1860 LEU 98 O -0.0116 0.0113 0.0037 1861 LEU 98 CB -0.0075 0.0100 0.0081 1862 LEU 98 CG -0.0059 0.0089 0.0083 1863 LEU 98 CD1 -0.0042 0.0070 0.0067 1864 LEU 98 CD2 -0.0048 0.0091 0.0111 1865 VAL 99 N -0.0099 0.0088 0.0020 1866 VAL 99 CA -0.0110 0.0087 0.0000 1867 VAL 99 C -0.0093 0.0076 0.0001 1868 VAL 99 O -0.0073 0.0060 -0.0004 1869 VAL 99 CB -0.0117 0.0079 -0.0028 1870 VAL 99 CG1 -0.0095 0.0061 -0.0035 1871 VAL 99 CG2 -0.0127 0.0077 -0.0049 1872 GLN 100 N -0.0101 0.0085 0.0010 1873 GLN 100 CA -0.0086 0.0075 0.0011 1874 GLN 100 C -0.0093 0.0068 -0.0016 1875 GLN 100 O -0.0113 0.0075 -0.0032 1876 GLN 100 CB -0.0090 0.0088 0.0034 1877 GLN 100 CG -0.0075 0.0089 0.0061 1878 GLN 100 CD -0.0089 0.0108 0.0083 1879 GLN 100 NE2 -0.0076 0.0110 0.0107 1880 GLN 100 OE1 -0.0111 0.0121 0.0079 1881 ILE 101 N -0.0083 0.0060 -0.0019 1882 ILE 101 CA -0.0087 0.0049 -0.0049 1883 ILE 101 C -0.0086 0.0051 -0.0044 1884 ILE 101 O -0.0078 0.0037 -0.0062 1885 ILE 101 CB -0.0065 0.0026 -0.0069 1886 ILE 101 CG1 -0.0033 0.0014 -0.0051 1887 ILE 101 CG2 -0.0068 0.0025 -0.0075 1888 ILE 101 CD1 -0.0012 -0.0009 -0.0073 1889 ASP 102 N -0.0095 0.0068 -0.0018 1890 ASP 102 CA -0.0094 0.0071 -0.0010 1891 ASP 102 C -0.0111 0.0070 -0.0037 1892 ASP 102 O -0.0098 0.0055 -0.0052 1893 ASP 102 CB -0.0107 0.0093 0.0020 1894 ASP 102 CG -0.0135 0.0110 0.0019 1895 ASP 102 OD1 -0.0152 0.0109 -0.0007 1896 ASP 102 OD2 -0.0141 0.0126 0.0045 1897 SER 105 N -0.0197 0.0085 -0.0089 1898 SER 105 CA -0.0208 0.0083 -0.0104 1899 SER 105 C -0.0226 0.0074 -0.0141 1900 SER 105 O -0.0218 0.0062 -0.0159 1901 SER 105 CB -0.0176 0.0070 -0.0103 1902 SER 105 OG -0.0161 0.0049 -0.0132 1903 PRO 106 N -0.0252 0.0081 -0.0151 1904 PRO 106 CA -0.0271 0.0073 -0.0186 1905 PRO 106 C -0.0247 0.0051 -0.0212 1906 PRO 106 O -0.0221 0.0043 -0.0204 1907 PRO 106 CB -0.0299 0.0085 -0.0187 1908 PRO 106 CG -0.0288 0.0094 -0.0157 1909 PRO 106 CD -0.0267 0.0097 -0.0130 1910 GLU 107 N -0.0258 0.0046 -0.0238 1911 GLU 107 CA -0.0237 0.0027 -0.0264 1912 GLU 107 C -0.0235 0.0022 -0.0276 1913 GLU 107 O -0.0214 0.0006 -0.0294 1914 GLU 107 CB -0.0249 0.0023 -0.0293 1915 GLU 107 CG -0.0282 0.0032 -0.0312 1916 GLU 107 CD -0.0280 0.0021 -0.0343 1917 GLU 107 OE1 -0.0258 0.0005 -0.0361 1918 GLU 107 OE2 -0.0299 0.0028 -0.0349 1919 LYS 108 N -0.0255 0.0035 -0.0267 1920 LYS 108 CA -0.0252 0.0030 -0.0276 1921 LYS 108 C -0.0220 0.0021 -0.0260 1922 LYS 108 O -0.0206 0.0009 -0.0276 1923 LYS 108 CB -0.0281 0.0047 -0.0267 1924 LYS 108 CG -0.0280 0.0044 -0.0275 1925 LYS 108 CD -0.0281 0.0055 -0.0243 1926 LYS 108 CE -0.0284 0.0053 -0.0252 1927 LYS 108 NZ -0.0296 0.0067 -0.0225 1928 MET 109 N -0.0205 0.0025 -0.0226 1929 MET 109 CA -0.0176 0.0018 -0.0211 1930 MET 109 C -0.0150 -0.0001 -0.0228 1931 MET 109 O -0.0129 -0.0012 -0.0231 1932 MET 109 CB -0.0169 0.0029 -0.0176 1933 MET 109 CG -0.0178 0.0042 -0.0154 1934 MET 109 SD -0.0167 0.0054 -0.0114 1935 MET 109 CE -0.0200 0.0075 -0.0098 1936 ARG 110 N -0.0150 -0.0005 -0.0238 1937 ARG 110 CA -0.0127 -0.0023 -0.0256 1938 ARG 110 C -0.0131 -0.0035 -0.0288 1939 ARG 110 O -0.0109 -0.0050 -0.0300 1940 ARG 110 CB -0.0129 -0.0024 -0.0261 1941 ARG 110 CG -0.0119 -0.0017 -0.0231 1942 ARG 110 CD -0.0130 -0.0013 -0.0235 1943 ARG 110 NE -0.0150 0.0005 -0.0213 1944 ARG 110 CZ -0.0175 0.0014 -0.0219 1945 ARG 110 NH1 -0.0183 0.0006 -0.0247 1946 ARG 110 NH2 -0.0191 0.0031 -0.0197 1947 ARG 111 N -0.0164 -0.0025 -0.0301 1948 ARG 111 CA -0.0167 -0.0034 -0.0333 1949 ARG 111 C -0.0151 -0.0040 -0.0327 1950 ARG 111 O -0.0134 -0.0055 -0.0349 1951 ARG 111 CB -0.0204 -0.0022 -0.0346 1952 ARG 111 CG -0.0211 -0.0031 -0.0382 1953 ARG 111 CD -0.0204 -0.0044 -0.0410 1954 ARG 111 NE -0.0233 -0.0035 -0.0424 1955 ARG 111 CZ -0.0258 -0.0032 -0.0446 1956 ARG 111 NH1 -0.0257 -0.0036 -0.0458 1957 ARG 111 NH2 -0.0283 -0.0024 -0.0458 1958 LEU 112 N -0.0154 -0.0029 -0.0298 1959 LEU 112 CA -0.0138 -0.0034 -0.0290 1960 LEU 112 C -0.0100 -0.0049 -0.0284 1961 LEU 112 O -0.0081 -0.0061 -0.0295 1962 LEU 112 CB -0.0150 -0.0017 -0.0259 1963 LEU 112 CG -0.0187 -0.0002 -0.0264 1964 LEU 112 CD1 -0.0195 0.0010 -0.0239 1965 LEU 112 CD2 -0.0199 -0.0009 -0.0301 1966 TYR 113 N -0.0096 -0.0050 -0.0263 1967 TYR 113 CA -0.0063 -0.0066 -0.0258 1968 TYR 113 C -0.0052 -0.0084 -0.0290 1969 TYR 113 O -0.0030 -0.0098 -0.0296 1970 TYR 113 CB -0.0056 -0.0062 -0.0239 1971 TYR 113 CG -0.0049 -0.0051 -0.0204 1972 TYR 113 CD1 -0.0029 -0.0056 -0.0190 1973 TYR 113 CD2 -0.0062 -0.0036 -0.0183 1974 TYR 113 CE1 -0.0022 -0.0047 -0.0157 1975 TYR 113 CE2 -0.0056 -0.0026 -0.0150 1976 TYR 113 CZ -0.0036 -0.0031 -0.0138 1977 TYR 113 OH -0.0029 -0.0022 -0.0105 1978 LEU 114 N -0.0068 -0.0085 -0.0312 1979 LEU 114 CA -0.0059 -0.0102 -0.0343 1980 LEU 114 C -0.0063 -0.0108 -0.0362 1981 LEU 114 O -0.0045 -0.0125 -0.0382 1982 LEU 114 CB -0.0079 -0.0099 -0.0362 1983 LEU 114 CG -0.0066 -0.0117 -0.0388 1984 LEU 114 CD1 -0.0042 -0.0124 -0.0374 1985 LEU 114 CD2 -0.0091 -0.0113 -0.0411 1986 LYS 115 N -0.0092 -0.0082 -0.0344 1987 LYS 115 CA -0.0092 -0.0087 -0.0360 1988 LYS 115 C -0.0064 -0.0097 -0.0349 1989 LYS 115 O -0.0050 -0.0109 -0.0369 1990 LYS 115 CB -0.0121 -0.0071 -0.0354 1991 LYS 115 CG -0.0130 -0.0073 -0.0380 1992 LYS 115 CD -0.0148 -0.0061 -0.0366 1993 LYS 115 CE -0.0182 -0.0048 -0.0379 1994 LYS 115 NZ -0.0198 -0.0038 -0.0371 1995 TYR 116 N -0.0054 -0.0094 -0.0317 1996 TYR 116 CA -0.0029 -0.0103 -0.0304 1997 TYR 116 C 0.0000 -0.0113 -0.0292 1998 TYR 116 O 0.0017 -0.0116 -0.0268 1999 TYR 116 CB -0.0038 -0.0091 -0.0276 2000 TYR 116 CG -0.0065 -0.0080 -0.0285 2001 TYR 116 CD1 -0.0062 -0.0087 -0.0305 2002 TYR 116 CD2 -0.0094 -0.0064 -0.0275 2003 TYR 116 CE1 -0.0086 -0.0078 -0.0314 2004 TYR 116 CE2 -0.0118 -0.0055 -0.0283 2005 TYR 116 CZ -0.0114 -0.0061 -0.0303 2006 TYR 116 OH -0.0139 -0.0052 -0.0312 2007 SER 117 N -0.0010 -0.0133 -0.0307 2008 SER 117 CA 0.0020 -0.0145 -0.0296 2009 SER 117 C 0.0028 -0.0160 -0.0320 2010 SER 117 O 0.0008 -0.0160 -0.0340 2011 SER 117 CB 0.0025 -0.0131 -0.0265 2012 SER 117 OG 0.0010 -0.0125 -0.0268 2013 GLY 118 N 0.0056 -0.0175 -0.0317 2014 GLY 118 CA 0.0067 -0.0190 -0.0336 2015 GLY 118 C 0.0077 -0.0188 -0.0320 2016 GLY 118 O 0.0089 -0.0202 -0.0334 2017 GLU 119 N 0.0066 -0.0182 -0.0292 2018 GLU 119 CA 0.0076 -0.0179 -0.0274 2019 GLU 119 C 0.0053 -0.0158 -0.0264 2020 GLU 119 O 0.0034 -0.0143 -0.0260 2021 GLU 119 CB 0.0100 -0.0180 -0.0248 2022 GLU 119 CG 0.0120 -0.0198 -0.0255 2023 GLU 119 CD 0.0148 -0.0216 -0.0255 2024 GLU 119 OE1 0.0147 -0.0219 -0.0262 2025 GLU 119 OE2 0.0169 -0.0226 -0.0248 2026 VAL 120 N 0.0055 -0.0157 -0.0260 2027 VAL 120 CA 0.0033 -0.0138 -0.0252 2028 VAL 120 C 0.0032 -0.0120 -0.0221 2029 VAL 120 O 0.0010 -0.0103 -0.0215 2030 VAL 120 CB 0.0037 -0.0143 -0.0256 2031 VAL 120 CG1 0.0026 -0.0153 -0.0288 2032 VAL 120 CG2 0.0067 -0.0157 -0.0245 2033 ALA 121 N 0.0058 -0.0127 -0.0191 2034 ALA 121 CA 0.0059 -0.0113 -0.0160 2035 ALA 121 C 0.0060 -0.0110 -0.0153 2036 ALA 121 O 0.0066 -0.0121 -0.0169 2037 ALA 121 CB 0.0084 -0.0119 -0.0142 2038 PHE 122 N 0.0054 -0.0095 -0.0127 2039 PHE 122 CA 0.0054 -0.0090 -0.0117 2040 PHE 122 C 0.0084 -0.0104 -0.0110 2041 PHE 122 O 0.0101 -0.0104 -0.0089 2042 PHE 122 CB 0.0041 -0.0070 -0.0091 2043 PHE 122 CG 0.0038 -0.0064 -0.0081 2044 PHE 122 CD1 0.0036 -0.0072 -0.0100 2045 PHE 122 CD2 0.0038 -0.0051 -0.0052 2046 PHE 122 CE1 0.0034 -0.0066 -0.0091 2047 PHE 122 CE2 0.0036 -0.0045 -0.0043 2048 PHE 122 CZ 0.0034 -0.0053 -0.0062 2049 MET 123 N 0.0087 -0.0124 -0.0118 2050 MET 123 CA 0.0112 -0.0129 -0.0115 2051 MET 123 C 0.0105 -0.0127 -0.0114 2052 MET 123 O 0.0103 -0.0138 -0.0132 2053 MET 123 CB 0.0128 -0.0146 -0.0134 2054 MET 123 CG 0.0157 -0.0147 -0.0126 2055 MET 123 SD 0.0176 -0.0168 -0.0149 2056 MET 123 CE 0.0157 -0.0174 -0.0164 2057 PRO 124 N 0.0103 -0.0112 -0.0095 2058 PRO 124 CA 0.0093 -0.0109 -0.0094 2059 PRO 124 C 0.0115 -0.0114 -0.0093 2060 PRO 124 O 0.0108 -0.0115 -0.0097 2061 PRO 124 CB 0.0081 -0.0091 -0.0072 2062 PRO 124 CG 0.0090 -0.0084 -0.0060 2063 PRO 124 CD 0.0107 -0.0098 -0.0073 2064 GLU 125 N 0.0124 -0.0131 -0.0070 2065 GLU 125 CA 0.0153 -0.0138 -0.0070 2066 GLU 125 C 0.0160 -0.0152 -0.0101 2067 GLU 125 O 0.0181 -0.0159 -0.0103 2068 GLU 125 CB 0.0180 -0.0140 -0.0056 2069 GLU 125 CG 0.0191 -0.0151 -0.0075 2070 GLU 125 CD 0.0177 -0.0144 -0.0069 2071 GLU 125 OE1 0.0164 -0.0132 -0.0046 2072 GLU 125 OE2 0.0178 -0.0152 -0.0088 2073 THR 126 N 0.0142 -0.0157 -0.0124 2074 THR 126 CA 0.0145 -0.0169 -0.0155 2075 THR 126 C 0.0121 -0.0167 -0.0164 2076 THR 126 O 0.0119 -0.0177 -0.0190 2077 THR 126 CB 0.0141 -0.0177 -0.0176 2078 THR 126 CG2 0.0165 -0.0180 -0.0168 2079 THR 126 OG1 0.0110 -0.0169 -0.0176 2080 MET 127 N 0.0110 -0.0133 -0.0165 2081 MET 127 CA 0.0092 -0.0130 -0.0172 2082 MET 127 C 0.0096 -0.0130 -0.0169 2083 MET 127 O 0.0108 -0.0126 -0.0155 2084 MET 127 CB 0.0075 -0.0117 -0.0162 2085 MET 127 CG 0.0062 -0.0117 -0.0171 2086 MET 127 SD 0.0043 -0.0101 -0.0157 2087 MET 127 CE 0.0034 -0.0103 -0.0167 2088 THR 128 N 0.0086 -0.0133 -0.0183 2089 THR 128 CA 0.0086 -0.0132 -0.0180 2090 THR 128 C 0.0072 -0.0119 -0.0167 2091 THR 128 O 0.0059 -0.0112 -0.0165 2092 THR 128 CB 0.0080 -0.0141 -0.0199 2093 THR 128 CG2 0.0090 -0.0153 -0.0214 2094 THR 128 OG1 0.0059 -0.0135 -0.0205 2095 PRO 129 N 0.0093 -0.0109 -0.0142 2096 PRO 129 CA 0.0074 -0.0091 -0.0125 2097 PRO 129 C 0.0044 -0.0081 -0.0142 2098 PRO 129 O 0.0024 -0.0064 -0.0128 2099 PRO 129 CB 0.0088 -0.0095 -0.0118 2100 PRO 129 CG 0.0112 -0.0116 -0.0134 2101 PRO 129 CD 0.0119 -0.0124 -0.0141 2102 ALA 130 N 0.0039 -0.0091 -0.0171 2103 ALA 130 CA 0.0010 -0.0082 -0.0188 2104 ALA 130 C -0.0006 -0.0073 -0.0188 2105 ALA 130 O -0.0031 -0.0057 -0.0184 2106 ALA 130 CB 0.0010 -0.0097 -0.0219 2107 GLN 131 N 0.0023 -0.0103 -0.0225 2108 GLN 131 CA 0.0010 -0.0095 -0.0225 2109 GLN 131 C 0.0004 -0.0081 -0.0197 2110 GLN 131 O -0.0016 -0.0068 -0.0195 2111 GLN 131 CB 0.0025 -0.0107 -0.0234 2112 GLN 131 CG 0.0026 -0.0120 -0.0263 2113 GLN 131 CD 0.0045 -0.0134 -0.0270 2114 GLN 131 NE2 0.0046 -0.0145 -0.0296 2115 GLN 131 OE1 0.0059 -0.0135 -0.0252 2116 CYS 132 N 0.0021 -0.0083 -0.0176 2117 CYS 132 CA 0.0017 -0.0069 -0.0149 2118 CYS 132 C -0.0005 -0.0054 -0.0144 2119 CYS 132 O -0.0022 -0.0040 -0.0133 2120 CYS 132 CB 0.0040 -0.0075 -0.0128 2121 CYS 132 SG 0.0064 -0.0088 -0.0124 2122 LEU 133 N 0.0009 -0.0051 -0.0161 2123 LEU 133 CA -0.0012 -0.0040 -0.0154 2124 LEU 133 C -0.0039 -0.0034 -0.0171 2125 LEU 133 O -0.0059 -0.0021 -0.0159 2126 LEU 133 CB -0.0006 -0.0045 -0.0160 2127 LEU 133 CG -0.0027 -0.0034 -0.0157 2128 LEU 133 CD1 -0.0034 -0.0021 -0.0128 2129 LEU 133 CD2 -0.0018 -0.0040 -0.0164 2130 GLN 134 N -0.0039 -0.0043 -0.0197 2131 GLN 134 CA -0.0064 -0.0038 -0.0214 2132 GLN 134 C -0.0075 -0.0029 -0.0204 2133 GLN 134 O -0.0099 -0.0018 -0.0202 2134 GLN 134 CB -0.0060 -0.0050 -0.0244 2135 GLN 134 CG -0.0062 -0.0054 -0.0260 2136 GLN 134 CD -0.0088 -0.0042 -0.0259 2137 GLN 134 NE2 -0.0088 -0.0043 -0.0260 2138 GLN 134 OE1 -0.0109 -0.0033 -0.0259 2139 PHE 135 N -0.0058 -0.0041 -0.0201 2140 PHE 135 CA -0.0065 -0.0033 -0.0190 2141 PHE 135 C -0.0075 -0.0018 -0.0165 2142 PHE 135 O -0.0093 -0.0006 -0.0161 2143 PHE 135 CB -0.0043 -0.0043 -0.0185 2144 PHE 135 CG -0.0047 -0.0035 -0.0170 2145 PHE 135 CD1 -0.0067 -0.0027 -0.0177 2146 PHE 135 CD2 -0.0030 -0.0036 -0.0148 2147 PHE 135 CE1 -0.0071 -0.0020 -0.0164 2148 PHE 135 CE2 -0.0033 -0.0029 -0.0135 2149 PHE 135 CZ -0.0054 -0.0020 -0.0142 2150 MET 136 N -0.0063 -0.0018 -0.0149 2151 MET 136 CA -0.0070 -0.0004 -0.0124 2152 MET 136 C -0.0094 0.0007 -0.0127 2153 MET 136 O -0.0106 0.0021 -0.0110 2154 MET 136 CB -0.0049 -0.0009 -0.0107 2155 MET 136 CG -0.0029 -0.0016 -0.0096 2156 MET 136 SD -0.0033 -0.0002 -0.0067 2157 MET 136 CE -0.0043 0.0010 -0.0050 2158 ILE 137 N -0.0095 0.0007 -0.0152 2159 ILE 137 CA -0.0121 0.0018 -0.0157 2160 ILE 137 C -0.0146 0.0025 -0.0169 2161 ILE 137 O -0.0168 0.0039 -0.0159 2162 ILE 137 CB -0.0118 0.0009 -0.0178 2163 ILE 137 CG1 -0.0104 0.0009 -0.0161 2164 ILE 137 CG2 -0.0147 0.0017 -0.0194 2165 ILE 137 CD1 -0.0096 -0.0002 -0.0180 2166 ASP 138 N -0.0142 0.0016 -0.0191 2167 ASP 138 CA -0.0165 0.0021 -0.0207 2168 ASP 138 C -0.0175 0.0032 -0.0188 2169 ASP 138 O -0.0198 0.0040 -0.0196 2170 ASP 138 CB -0.0156 0.0008 -0.0234 2171 ASP 138 CG -0.0152 -0.0002 -0.0257 2172 ASP 138 OD1 -0.0157 0.0002 -0.0252 2173 ASP 138 OD2 -0.0145 -0.0014 -0.0281 2174 ILE 139 N -0.0154 0.0037 -0.0164 2175 ILE 139 CA -0.0161 0.0050 -0.0143 2176 ILE 139 C -0.0167 0.0062 -0.0119 2177 ILE 139 O -0.0169 0.0070 -0.0098 2178 ILE 139 CB -0.0143 0.0040 -0.0133 2179 ILE 139 CG1 -0.0122 0.0030 -0.0115 2180 ILE 139 CG2 -0.0136 0.0027 -0.0156 2181 ILE 139 CD1 -0.0107 0.0026 -0.0097 2182 ASP 140 N -0.0170 0.0063 -0.0123 2183 ASP 140 CA -0.0176 0.0074 -0.0102 2184 ASP 140 C -0.0200 0.0093 -0.0098 2185 ASP 140 O -0.0216 0.0098 -0.0117 2186 ASP 140 CB -0.0175 0.0071 -0.0110 2187 ASP 140 CG -0.0173 0.0078 -0.0086 2188 ASP 140 OD1 -0.0176 0.0087 -0.0063 2189 ASP 140 OD2 -0.0169 0.0074 -0.0089 2190 PRO 141 N -0.0198 0.0107 -0.0078 2191 PRO 141 CA -0.0223 0.0126 -0.0074 2192 PRO 141 C -0.0244 0.0137 -0.0082 2193 PRO 141 O -0.0267 0.0149 -0.0089 2194 PRO 141 CB -0.0218 0.0135 -0.0042 2195 PRO 141 CG -0.0190 0.0120 -0.0032 2196 PRO 141 CD -0.0177 0.0102 -0.0055 2197 ALA 142 N -0.0238 0.0133 -0.0081 2198 ALA 142 CA -0.0257 0.0142 -0.0089 2199 ALA 142 C -0.0266 0.0135 -0.0122 2200 ALA 142 O -0.0279 0.0140 -0.0131 2201 ALA 142 CB -0.0248 0.0141 -0.0076 2202 ARG 143 N -0.0271 0.0122 -0.0132 2203 ARG 143 CA -0.0278 0.0116 -0.0166 2204 ARG 143 C -0.0298 0.0121 -0.0183 2205 ARG 143 O -0.0307 0.0118 -0.0211 2206 ARG 143 CB -0.0249 0.0096 -0.0182 2207 ARG 143 CG -0.0236 0.0090 -0.0180 2208 ARG 143 CD -0.0208 0.0071 -0.0196 2209 ARG 143 NE -0.0197 0.0065 -0.0197 2210 ARG 143 CZ -0.0180 0.0063 -0.0174 2211 ARG 143 NH1 -0.0171 0.0066 -0.0146 2212 ARG 143 NH2 -0.0171 0.0058 -0.0177 2213 SER 144 N -0.0304 0.0129 -0.0166 2214 SER 144 CA -0.0323 0.0135 -0.0179 2215 SER 144 C -0.0314 0.0121 -0.0211 2216 SER 144 O -0.0333 0.0124 -0.0235 2217 SER 144 CB -0.0355 0.0150 -0.0183 2218 SER 144 OG -0.0360 0.0149 -0.0198