1 MET 1 N 0.0102 -0.0044 0.0157 2 MET 1 CA 0.0108 -0.0023 0.0092 3 MET 1 C 0.0093 -0.0032 0.0123 4 MET 1 O 0.0049 -0.0047 0.0178 5 MET 1 CB 0.0053 0.0003 0.0031 6 MET 1 CG -0.0030 0.0005 0.0044 7 MET 1 SD -0.0090 0.0036 -0.0031 8 MET 1 CE -0.0185 0.0034 -0.0002 9 GLN 2 N 0.0204 -0.0130 0.0091 10 GLN 2 CA 0.0207 -0.0145 0.0118 11 GLN 2 C 0.0165 -0.0138 0.0092 12 GLN 2 O 0.0155 -0.0114 0.0047 13 GLN 2 CB 0.0265 -0.0136 0.0121 14 GLN 2 CG 0.0275 -0.0143 0.0135 15 GLN 2 CD 0.0337 -0.0133 0.0138 16 GLN 2 OE1 0.0363 -0.0151 0.0177 17 GLN 2 NE2 0.0357 -0.0106 0.0095 18 ILE 3 N 0.0108 -0.0144 0.0102 19 ILE 3 CA 0.0093 -0.0138 0.0092 20 ILE 3 C 0.0105 -0.0148 0.0107 21 ILE 3 O 0.0119 -0.0161 0.0125 22 ILE 3 CB 0.0059 -0.0143 0.0092 23 ILE 3 CG1 0.0049 -0.0164 0.0115 24 ILE 3 CG2 0.0048 -0.0130 0.0074 25 ILE 3 CD1 0.0016 -0.0170 0.0116 26 PHE 4 N 0.0172 -0.0188 0.0128 27 PHE 4 CA 0.0113 -0.0169 0.0143 28 PHE 4 C 0.0117 -0.0170 0.0142 29 PHE 4 O 0.0144 -0.0214 0.0136 30 PHE 4 CB 0.0066 -0.0213 0.0157 31 PHE 4 CG 0.0060 -0.0214 0.0159 32 PHE 4 CD1 0.0088 -0.0259 0.0152 33 PHE 4 CD2 0.0026 -0.0166 0.0167 34 PHE 4 CE1 0.0084 -0.0257 0.0153 35 PHE 4 CE2 0.0023 -0.0163 0.0168 36 PHE 4 CZ 0.0050 -0.0211 0.0162 37 VAL 5 N 0.0087 0.0051 0.0079 38 VAL 5 CA 0.0094 0.0065 0.0077 39 VAL 5 C 0.0070 0.0067 0.0069 40 VAL 5 O 0.0055 0.0080 0.0061 41 VAL 5 CB 0.0108 0.0090 0.0073 42 VAL 5 CG1 0.0115 0.0102 0.0071 43 VAL 5 CG2 0.0131 0.0088 0.0080 44 LYS 6 N 0.0133 0.0066 0.0116 45 LYS 6 CA 0.0129 0.0080 0.0063 46 LYS 6 C 0.0101 0.0122 0.0076 47 LYS 6 O 0.0075 0.0158 0.0095 48 LYS 6 CB 0.0127 0.0091 0.0017 49 LYS 6 CG 0.0125 0.0103 -0.0042 50 LYS 6 CD 0.0125 0.0109 -0.0083 51 LYS 6 CE 0.0127 0.0115 -0.0144 52 LYS 6 NZ 0.0124 0.0126 -0.0178 53 THR 7 N 0.0161 0.0180 0.0087 54 THR 7 CA 0.0188 0.0199 0.0066 55 THR 7 C 0.0178 0.0184 0.0082 56 THR 7 O 0.0144 0.0164 0.0105 57 THR 7 CB 0.0172 0.0238 0.0026 58 THR 7 OG1 0.0124 0.0239 0.0028 59 THR 7 CG2 0.0165 0.0253 0.0011 60 LEU 8 N -0.0108 0.0368 0.0118 61 LEU 8 CA -0.0478 0.0226 0.0075 62 LEU 8 C -0.1103 0.0377 -0.0107 63 LEU 8 O -0.1478 0.0219 -0.0148 64 LEU 8 CB -0.0187 0.0495 0.0066 65 LEU 8 CG 0.0377 0.0247 0.0261 66 LEU 8 CD1 0.0540 0.0442 0.0244 67 LEU 8 CD2 0.0336 -0.0407 0.0432 68 THR 9 N 0.0580 -0.0201 0.0211 69 THR 9 CA 0.0220 -0.0010 0.0448 70 THR 9 C -0.0182 0.0195 0.0725 71 THR 9 O -0.0530 0.0458 0.0842 72 THR 9 CB 0.0196 0.0297 0.0042 73 THR 9 OG1 0.0045 0.0633 -0.0225 74 THR 9 CG2 0.0620 0.0106 -0.0285 75 GLY 10 N 0.0406 0.0148 0.0132 76 GLY 10 CA 0.0464 0.0313 0.0135 77 GLY 10 C 0.0419 0.0289 0.0122 78 GLY 10 O 0.0502 0.0398 0.0140 79 LYS 11 N 0.0295 0.0208 0.0170 80 LYS 11 CA 0.0033 0.0232 0.0016 81 LYS 11 C -0.0030 0.0249 0.0137 82 LYS 11 O 0.0179 0.0223 0.0163 83 LYS 11 CB 0.0067 0.0206 -0.0315 84 LYS 11 CG -0.0221 0.0234 -0.0465 85 LYS 11 CD -0.0172 0.0205 -0.0796 86 LYS 11 CE -0.0439 0.0228 -0.0980 87 LYS 11 NZ -0.0698 0.0268 -0.0890 88 THR 12 N -0.0145 0.0118 0.0059 89 THR 12 CA -0.0121 0.0101 0.0094 90 THR 12 C -0.0158 0.0131 0.0032 91 THR 12 O -0.0239 0.0144 0.0011 92 THR 12 CB -0.0163 0.0061 0.0185 93 THR 12 OG1 -0.0120 0.0034 0.0239 94 THR 12 CG2 -0.0140 0.0046 0.0214 95 ILE 13 N -0.0071 0.0073 0.0017 96 ILE 13 CA -0.0091 0.0084 -0.0011 97 ILE 13 C -0.0096 0.0064 0.0024 98 ILE 13 O -0.0063 0.0051 0.0062 99 ILE 13 CB -0.0055 0.0114 -0.0054 100 ILE 13 CG1 -0.0030 0.0119 -0.0054 101 ILE 13 CG2 -0.0011 0.0127 -0.0062 102 ILE 13 CD1 0.0008 0.0149 -0.0096 103 THR 14 N -0.0008 0.0009 0.0066 104 THR 14 CA 0.0014 0.0000 0.0056 105 THR 14 C 0.0055 0.0035 0.0002 106 THR 14 O 0.0042 0.0086 -0.0026 107 THR 14 CB -0.0041 0.0023 0.0080 108 THR 14 OG1 -0.0061 0.0087 0.0049 109 THR 14 CG2 -0.0089 -0.0002 0.0133 110 LEU 15 N 0.0122 0.0039 -0.0102 111 LEU 15 CA 0.0142 0.0052 -0.0096 112 LEU 15 C 0.0175 0.0047 -0.0112 113 LEU 15 O 0.0175 0.0028 -0.0132 114 LEU 15 CB 0.0128 0.0042 -0.0101 115 LEU 15 CG 0.0115 0.0053 -0.0085 116 LEU 15 CD1 0.0100 0.0073 -0.0059 117 LEU 15 CD2 0.0092 0.0034 -0.0096 118 GLU 16 N 0.0291 0.0101 -0.0254 119 GLU 16 CA 0.0201 0.0044 -0.0118 120 GLU 16 C 0.0224 0.0108 -0.0024 121 GLU 16 O 0.0244 0.0110 -0.0082 122 GLU 16 CB 0.0100 -0.0092 -0.0154 123 GLU 16 CG 0.0065 -0.0160 -0.0220 124 GLU 16 CD -0.0043 -0.0295 -0.0232 125 GLU 16 OE1 -0.0095 -0.0348 -0.0203 126 GLU 16 OE2 -0.0070 -0.0345 -0.0278 127 VAL 17 N 0.0163 0.0137 0.0008 128 VAL 17 CA 0.0155 0.0148 0.0025 129 VAL 17 C 0.0160 0.0141 0.0030 130 VAL 17 O 0.0168 0.0128 0.0018 131 VAL 17 CB 0.0142 0.0169 0.0017 132 VAL 17 CG1 0.0136 0.0178 0.0013 133 VAL 17 CG2 0.0142 0.0169 -0.0004 134 GLU 18 N 0.0099 0.0260 0.0066 135 GLU 18 CA -0.0001 0.0326 0.0131 136 GLU 18 C -0.0003 0.0437 0.0157 137 GLU 18 O 0.0023 0.0428 0.0142 138 GLU 18 CB -0.0115 0.0243 0.0168 139 GLU 18 CG -0.0139 0.0139 0.0156 140 GLU 18 CD -0.0134 0.0176 0.0162 141 GLU 18 OE1 -0.0140 0.0278 0.0188 142 GLU 18 OE2 -0.0124 0.0081 0.0135 143 PRO 19 N -0.0062 0.0477 0.0149 144 PRO 19 CA -0.0028 0.0448 0.0160 145 PRO 19 C 0.0064 0.0528 0.0189 146 PRO 19 O 0.0082 0.0543 0.0194 147 PRO 19 CB 0.0013 0.0320 0.0175 148 PRO 19 CG -0.0055 0.0273 0.0153 149 PRO 19 CD -0.0053 0.0374 0.0153 150 SER 20 N 0.0041 0.0512 0.0132 151 SER 20 CA 0.0071 0.0513 0.0103 152 SER 20 C 0.0071 0.0523 0.0097 153 SER 20 O 0.0095 0.0524 0.0074 154 SER 20 CB 0.0079 0.0542 0.0078 155 SER 20 OG 0.0052 0.0573 0.0085 156 ASP 21 N -0.0037 0.0421 0.0100 157 ASP 21 CA -0.0006 0.0380 0.0077 158 ASP 21 C 0.0022 0.0401 0.0082 159 ASP 21 O 0.0042 0.0447 0.0098 160 ASP 21 CB 0.0040 0.0363 0.0062 161 ASP 21 CG 0.0016 0.0325 0.0050 162 ASP 21 OD1 -0.0030 0.0301 0.0047 163 ASP 21 OD2 0.0040 0.0323 0.0045 164 THR 22 N 0.0137 0.0112 0.0072 165 THR 22 CA 0.0177 0.0083 0.0078 166 THR 22 C 0.0185 0.0076 0.0103 167 THR 22 O 0.0162 0.0093 0.0102 168 THR 22 CB 0.0198 0.0070 0.0030 169 THR 22 OG1 0.0184 0.0082 0.0005 170 THR 22 CG2 0.0190 0.0078 0.0004 171 ILE 23 N 0.0180 -0.0010 0.0076 172 ILE 23 CA 0.0216 -0.0018 0.0085 173 ILE 23 C 0.0224 -0.0058 0.0086 174 ILE 23 O 0.0254 -0.0069 0.0093 175 ILE 23 CB 0.0220 -0.0008 0.0086 176 ILE 23 CG1 0.0213 0.0034 0.0086 177 ILE 23 CG2 0.0257 -0.0020 0.0096 178 ILE 23 CD1 0.0235 0.0057 0.0093 179 GLU 24 N 0.0219 -0.0229 0.0031 180 GLU 24 CA 0.0193 0.0009 -0.0045 181 GLU 24 C 0.0064 0.0020 -0.0099 182 GLU 24 O -0.0071 0.0160 -0.0191 183 GLU 24 CB 0.0418 0.0131 0.0009 184 GLU 24 CG 0.0450 0.0384 -0.0048 185 GLU 24 CD 0.0684 0.0464 0.0021 186 GLU 24 OE1 0.0774 0.0441 0.0063 187 GLU 24 OE2 0.0776 0.0550 0.0034 188 ASN 25 N 0.0174 0.0013 -0.0073 189 ASN 25 CA 0.0143 0.0011 -0.0084 190 ASN 25 C 0.0094 -0.0003 -0.0094 191 ASN 25 O 0.0063 0.0015 -0.0115 192 ASN 25 CB 0.0156 -0.0016 -0.0065 193 ASN 25 CG 0.0120 -0.0016 -0.0077 194 ASN 25 OD1 0.0111 0.0019 -0.0099 195 ASN 25 ND2 0.0100 -0.0054 -0.0065 196 VAL 26 N 0.0021 0.0025 -0.0044 197 VAL 26 CA 0.0021 0.0024 -0.0050 198 VAL 26 C 0.0050 0.0028 -0.0093 199 VAL 26 O 0.0039 0.0017 -0.0121 200 VAL 26 CB 0.0035 0.0040 -0.0006 201 VAL 26 CG1 0.0044 0.0042 -0.0016 202 VAL 26 CG2 0.0001 0.0033 0.0035 203 LYS 27 N -0.0175 -0.0005 -0.0018 204 LYS 27 CA -0.0135 -0.0022 -0.0044 205 LYS 27 C -0.0161 -0.0025 -0.0101 206 LYS 27 O -0.0149 -0.0030 -0.0114 207 LYS 27 CB -0.0077 -0.0041 -0.0055 208 LYS 27 CG -0.0044 -0.0039 0.0007 209 LYS 27 CD 0.0016 -0.0058 -0.0005 210 LYS 27 CE 0.0050 -0.0057 0.0054 211 LYS 27 NZ 0.0108 -0.0077 0.0038 212 ALA 28 N -0.0055 -0.0043 -0.0215 213 ALA 28 CA -0.0071 -0.0048 -0.0245 214 ALA 28 C -0.0095 -0.0037 -0.0237 215 ALA 28 O -0.0097 -0.0042 -0.0254 216 ALA 28 CB -0.0089 -0.0049 -0.0267 217 LYS 29 N 0.0029 -0.0021 -0.0190 218 LYS 29 CA 0.0051 -0.0034 -0.0201 219 LYS 29 C 0.0015 -0.0031 -0.0215 220 LYS 29 O 0.0020 -0.0027 -0.0205 221 LYS 29 CB 0.0079 -0.0061 -0.0237 222 LYS 29 CG 0.0117 -0.0066 -0.0226 223 LYS 29 CD 0.0138 -0.0093 -0.0265 224 LYS 29 CE 0.0188 -0.0102 -0.0255 225 LYS 29 NZ 0.0216 -0.0111 -0.0257 226 ILE 30 N -0.0151 -0.0063 -0.0201 227 ILE 30 CA -0.0121 -0.0073 -0.0166 228 ILE 30 C -0.0106 -0.0104 -0.0186 229 ILE 30 O -0.0093 -0.0105 -0.0167 230 ILE 30 CB -0.0093 -0.0085 -0.0140 231 ILE 30 CG1 -0.0106 -0.0051 -0.0113 232 ILE 30 CG2 -0.0058 -0.0104 -0.0111 233 ILE 30 CD1 -0.0082 -0.0066 -0.0096 234 GLN 31 N -0.0187 -0.0093 -0.0149 235 GLN 31 CA -0.0166 -0.0227 -0.0091 236 GLN 31 C -0.0107 -0.0227 -0.0052 237 GLN 31 O -0.0021 -0.0278 0.0021 238 GLN 31 CB -0.0277 -0.0326 -0.0130 239 GLN 31 CG -0.0249 -0.0461 -0.0066 240 GLN 31 CD -0.0357 -0.0562 -0.0103 241 GLN 31 OE1 -0.0447 -0.0526 -0.0174 242 GLN 31 NE2 -0.0348 -0.0678 -0.0058 243 ASP 32 N -0.0218 -0.0073 -0.0177 244 ASP 32 CA -0.0024 -0.0028 -0.0064 245 ASP 32 C -0.0083 -0.0095 -0.0166 246 ASP 32 O -0.0078 -0.0005 -0.0050 247 ASP 32 CB 0.0276 -0.0101 -0.0070 248 ASP 32 CG 0.0450 0.0026 0.0141 249 ASP 32 OD1 0.0388 0.0184 0.0323 250 ASP 32 OD2 0.0615 -0.0044 0.0099 251 LYS 33 N -0.0030 -0.0093 -0.0248 252 LYS 33 CA -0.0023 -0.0054 -0.0188 253 LYS 33 C -0.0045 -0.0095 -0.0118 254 LYS 33 O -0.0039 -0.0058 -0.0056 255 LYS 33 CB -0.0004 -0.0012 -0.0221 256 LYS 33 CG -0.0014 -0.0048 -0.0247 257 LYS 33 CD 0.0001 0.0000 -0.0222 258 LYS 33 CE 0.0031 0.0073 -0.0258 259 LYS 33 NZ 0.0044 0.0123 -0.0215 260 GLU 34 N -0.0203 -0.0089 -0.0130 261 GLU 34 CA -0.0230 -0.0116 -0.0087 262 GLU 34 C -0.0313 -0.0180 -0.0014 263 GLU 34 O -0.0340 -0.0208 0.0030 264 GLU 34 CB -0.0269 -0.0102 -0.0180 265 GLU 34 CG -0.0190 -0.0038 -0.0257 266 GLU 34 CD -0.0107 -0.0017 -0.0207 267 GLU 34 OE1 -0.0126 -0.0046 -0.0149 268 GLU 34 OE2 -0.0019 0.0033 -0.0233 269 GLY 35 N -0.0270 -0.0181 -0.0013 270 GLY 35 CA -0.0203 -0.0335 -0.0101 271 GLY 35 C -0.0107 -0.0518 -0.0100 272 GLY 35 O -0.0046 -0.0656 -0.0171 273 ILE 36 N -0.0168 -0.0349 -0.0114 274 ILE 36 CA -0.0160 -0.0317 -0.0107 275 ILE 36 C -0.0194 -0.0317 -0.0088 276 ILE 36 O -0.0226 -0.0312 -0.0069 277 ILE 36 CB -0.0148 -0.0274 -0.0097 278 ILE 36 CG1 -0.0115 -0.0276 -0.0115 279 ILE 36 CG2 -0.0138 -0.0239 -0.0088 280 ILE 36 CD1 -0.0113 -0.0241 -0.0103 281 PRO 37 N -0.0194 -0.0367 -0.0111 282 PRO 37 CA -0.0245 -0.0366 -0.0083 283 PRO 37 C -0.0271 -0.0287 -0.0013 284 PRO 37 O -0.0214 -0.0221 0.0003 285 PRO 37 CB -0.0173 -0.0368 -0.0123 286 PRO 37 CG -0.0118 -0.0416 -0.0186 287 PRO 37 CD -0.0105 -0.0379 -0.0166 288 PRO 38 N -0.0205 -0.0225 0.0043 289 PRO 38 CA -0.0217 -0.0182 0.0103 290 PRO 38 C -0.0152 -0.0159 0.0120 291 PRO 38 O -0.0136 -0.0117 0.0174 292 PRO 38 CB -0.0288 -0.0194 0.0100 293 PRO 38 CG -0.0329 -0.0235 0.0054 294 PRO 38 CD -0.0266 -0.0262 0.0005 295 ASP 39 N -0.0063 -0.0074 0.0211 296 ASP 39 CA 0.0048 0.0042 0.0237 297 ASP 39 C 0.0010 0.0044 0.0173 298 ASP 39 O 0.0087 0.0102 0.0220 299 ASP 39 CB 0.0128 0.0186 0.0175 300 ASP 39 CG 0.0168 0.0309 0.0077 301 ASP 39 OD1 0.0081 0.0298 -0.0048 302 ASP 39 OD2 0.0284 0.0415 0.0123 303 GLN 40 N -0.0057 0.0022 0.0093 304 GLN 40 CA -0.0073 0.0030 0.0037 305 GLN 40 C -0.0086 -0.0029 0.0055 306 GLN 40 O -0.0095 -0.0021 0.0021 307 GLN 40 CB -0.0104 0.0016 -0.0042 308 GLN 40 CG -0.0093 0.0076 -0.0065 309 GLN 40 CD -0.0122 0.0067 -0.0143 310 GLN 40 OE1 -0.0117 0.0101 -0.0162 311 GLN 40 NE2 -0.0150 0.0023 -0.0185 312 GLN 41 N -0.0058 -0.0029 0.0018 313 GLN 41 CA -0.0076 -0.0042 0.0049 314 GLN 41 C -0.0059 -0.0025 0.0092 315 GLN 41 O -0.0053 -0.0018 0.0117 316 GLN 41 CB -0.0111 -0.0072 0.0059 317 GLN 41 CG -0.0131 -0.0091 0.0018 318 GLN 41 CD -0.0165 -0.0120 0.0030 319 GLN 41 OE1 -0.0178 -0.0128 0.0066 320 GLN 41 NE2 -0.0181 -0.0135 0.0004 321 ARG 42 N -0.0028 0.0099 0.0079 322 ARG 42 CA -0.0004 0.0032 0.0062 323 ARG 42 C -0.0017 0.0045 0.0076 324 ARG 42 O -0.0063 0.0053 0.0130 325 ARG 42 CB -0.0017 -0.0038 0.0090 326 ARG 42 CG -0.0009 -0.0109 0.0094 327 ARG 42 CD -0.0018 -0.0174 0.0117 328 ARG 42 NE -0.0016 -0.0242 0.0126 329 ARG 42 CZ -0.0054 -0.0274 0.0177 330 ARG 42 NH1 -0.0098 -0.0251 0.0227 331 ARG 42 NH2 -0.0049 -0.0327 0.0180 332 LEU 43 N 0.0042 0.0058 0.0038 333 LEU 43 CA 0.0051 0.0059 0.0031 334 LEU 43 C 0.0047 0.0059 0.0020 335 LEU 43 O 0.0042 0.0059 0.0018 336 LEU 43 CB 0.0060 0.0059 0.0033 337 LEU 43 CG 0.0066 0.0059 0.0043 338 LEU 43 CD1 0.0072 0.0059 0.0046 339 LEU 43 CD2 0.0073 0.0059 0.0042 340 ILE 44 N 0.0062 0.0043 -0.0000 341 ILE 44 CA 0.0055 0.0014 -0.0032 342 ILE 44 C 0.0081 0.0019 -0.0052 343 ILE 44 O 0.0088 0.0035 -0.0037 344 ILE 44 CB 0.0015 -0.0007 -0.0020 345 ILE 44 CG1 -0.0013 -0.0009 0.0006 346 ILE 44 CG2 0.0006 -0.0039 -0.0053 347 ILE 44 CD1 -0.0014 -0.0023 -0.0011 348 PHE 45 N 0.0089 -0.0006 -0.0206 349 PHE 45 CA 0.0059 -0.0033 -0.0175 350 PHE 45 C 0.0069 0.0023 -0.0122 351 PHE 45 O 0.0074 0.0061 -0.0082 352 PHE 45 CB 0.0012 -0.0088 -0.0139 353 PHE 45 CG -0.0020 -0.0117 -0.0104 354 PHE 45 CD1 -0.0028 -0.0160 -0.0143 355 PHE 45 CD2 -0.0041 -0.0100 -0.0032 356 PHE 45 CE1 -0.0057 -0.0186 -0.0111 357 PHE 45 CE2 -0.0070 -0.0126 0.0001 358 PHE 45 CZ -0.0079 -0.0170 -0.0038 359 ALA 46 N 0.0144 0.0114 -0.0199 360 ALA 46 CA 0.0117 0.0196 -0.0232 361 ALA 46 C 0.0077 0.0122 -0.0241 362 ALA 46 O -0.0004 0.0142 -0.0297 363 ALA 46 CB 0.0039 0.0276 -0.0297 364 GLY 47 N 0.0183 0.0040 -0.0102 365 GLY 47 CA 0.0030 -0.0279 -0.0058 366 GLY 47 C -0.0015 -0.0417 -0.0253 367 GLY 47 O -0.0144 -0.0704 -0.0296 368 LYS 48 N 0.0113 0.0011 -0.0171 369 LYS 48 CA 0.0106 0.0005 -0.0176 370 LYS 48 C 0.0107 -0.0016 -0.0200 371 LYS 48 O 0.0098 -0.0025 -0.0207 372 LYS 48 CB 0.0079 0.0005 -0.0165 373 LYS 48 CG 0.0074 0.0024 -0.0141 374 LYS 48 CD 0.0045 0.0021 -0.0134 375 LYS 48 CE 0.0031 0.0026 -0.0123 376 LYS 48 NZ 0.0045 0.0046 -0.0105 377 GLN 49 N 0.0099 -0.0050 -0.0126 378 GLN 49 CA 0.0104 -0.0052 -0.0093 379 GLN 49 C 0.0107 -0.0025 -0.0141 380 GLN 49 O 0.0091 -0.0041 -0.0195 381 GLN 49 CB 0.0081 -0.0114 -0.0074 382 GLN 49 CG 0.0089 -0.0114 -0.0033 383 GLN 49 CD 0.0066 -0.0176 -0.0011 384 GLN 49 OE1 0.0055 -0.0196 -0.0025 385 GLN 49 NE2 0.0061 -0.0202 0.0023 386 LEU 50 N 0.0204 0.0016 -0.0067 387 LEU 50 CA 0.0197 0.0026 -0.0085 388 LEU 50 C 0.0207 0.0023 -0.0108 389 LEU 50 O 0.0211 0.0021 -0.0113 390 LEU 50 CB 0.0176 0.0043 -0.0082 391 LEU 50 CG 0.0166 0.0046 -0.0058 392 LEU 50 CD1 0.0145 0.0064 -0.0059 393 LEU 50 CD2 0.0169 0.0041 -0.0048 394 GLU 51 N 0.0396 0.0114 -0.0008 395 GLU 51 CA 0.0242 -0.0052 0.0045 396 GLU 51 C 0.0249 -0.0137 0.0096 397 GLU 51 O 0.0272 -0.0036 0.0044 398 GLU 51 CB 0.0034 0.0008 -0.0047 399 GLU 51 CG -0.0159 -0.0135 -0.0018 400 GLU 51 CD -0.0317 -0.0116 -0.0073 401 GLU 51 OE1 -0.0491 -0.0196 -0.0075 402 GLU 51 OE2 -0.0235 -0.0001 -0.0116 403 ASP 52 N 0.0255 -0.0308 0.0083 404 ASP 52 CA 0.0253 -0.0287 0.0072 405 ASP 52 C 0.0259 -0.0275 0.0052 406 ASP 52 O 0.0254 -0.0253 0.0049 407 ASP 52 CB 0.0256 -0.0289 0.0067 408 ASP 52 CG 0.0247 -0.0288 0.0087 409 ASP 52 OD1 0.0249 -0.0290 0.0086 410 ASP 52 OD2 0.0239 -0.0284 0.0105 411 GLY 53 N 0.0206 -0.0245 -0.0038 412 GLY 53 CA 0.0047 -0.0217 -0.0068 413 GLY 53 C -0.0017 -0.0076 -0.0013 414 GLY 53 O -0.0151 -0.0046 -0.0034 415 ARG 54 N -0.0126 -0.0181 0.0083 416 ARG 54 CA -0.0125 0.0129 0.0022 417 ARG 54 C 0.0086 0.0056 0.0033 418 ARG 54 O 0.0296 -0.0187 0.0077 419 ARG 54 CB 0.0035 0.0432 -0.0040 420 ARG 54 CG -0.0138 0.0516 -0.0054 421 ARG 54 CD -0.0497 0.0671 -0.0078 422 ARG 54 NE -0.0746 0.0428 -0.0027 423 ARG 54 CZ -0.1011 0.0267 0.0009 424 ARG 54 NH1 -0.1130 0.0294 0.0006 425 ARG 54 NH2 -0.1171 0.0038 0.0057 426 THR 55 N 0.0083 0.0339 0.0004 427 THR 55 CA 0.0107 0.0386 0.0022 428 THR 55 C 0.0095 0.0376 0.0035 429 THR 55 O 0.0075 0.0336 0.0019 430 THR 55 CB 0.0144 0.0417 -0.0022 431 THR 55 OG1 0.0142 0.0386 -0.0067 432 THR 55 CG2 0.0159 0.0429 -0.0041 433 LEU 56 N -0.0068 0.0324 0.0095 434 LEU 56 CA -0.0083 0.0314 0.0110 435 LEU 56 C -0.0073 0.0297 0.0097 436 LEU 56 O -0.0081 0.0275 0.0103 437 LEU 56 CB -0.0092 0.0340 0.0122 438 LEU 56 CG -0.0103 0.0359 0.0136 439 LEU 56 CD1 -0.0112 0.0383 0.0147 440 LEU 56 CD2 -0.0121 0.0342 0.0153 441 SER 57 N -0.0069 0.0322 0.0067 442 SER 57 CA -0.0010 0.0199 0.0076 443 SER 57 C 0.0082 0.0029 0.0081 444 SER 57 O 0.0084 -0.0110 0.0136 445 SER 57 CB 0.0086 0.0278 -0.0023 446 SER 57 OG 0.0210 0.0324 -0.0129 447 ASP 58 N 0.0035 0.0283 -0.0041 448 ASP 58 CA 0.0118 0.0039 -0.0067 449 ASP 58 C 0.0062 -0.0100 0.0144 450 ASP 58 O 0.0112 -0.0280 0.0152 451 ASP 58 CB 0.0187 -0.0049 -0.0161 452 ASP 58 CG 0.0273 0.0021 -0.0395 453 ASP 58 OD1 0.0305 0.0017 -0.0464 454 ASP 58 OD2 0.0307 0.0076 -0.0507 455 TYR 59 N 0.0000 -0.0054 0.0137 456 TYR 59 CA -0.0062 -0.0105 0.0175 457 TYR 59 C -0.0174 -0.0190 0.0236 458 TYR 59 O -0.0238 -0.0234 0.0267 459 TYR 59 CB -0.0118 -0.0027 0.0085 460 TYR 59 CG -0.0009 0.0054 0.0027 461 TYR 59 CD1 0.0011 0.0149 -0.0063 462 TYR 59 CD2 0.0069 0.0037 0.0061 463 TYR 59 CE1 0.0112 0.0223 -0.0115 464 TYR 59 CE2 0.0169 0.0110 0.0009 465 TYR 59 CZ 0.0189 0.0203 -0.0079 466 TYR 59 OH 0.0285 0.0274 -0.0130 467 ASN 60 N -0.0150 -0.0216 0.0252 468 ASN 60 CA -0.0460 -0.0477 0.0409 469 ASN 60 C -0.0817 -0.0453 0.0204 470 ASN 60 O -0.1020 -0.0630 0.0314 471 ASN 60 CB -0.0348 -0.0703 0.0733 472 ASN 60 CG -0.0590 -0.0988 0.0952 473 ASN 60 OD1 -0.0678 -0.1187 0.1146 474 ASN 60 ND2 -0.0705 -0.1023 0.0937 475 ILE 61 N -0.0586 -0.0182 0.0139 476 ILE 61 CA -0.0636 -0.0190 0.0079 477 ILE 61 C -0.0717 -0.0233 0.0087 478 ILE 61 O -0.0729 -0.0235 0.0072 479 ILE 61 CB -0.0614 -0.0155 -0.0008 480 ILE 61 CG1 -0.0535 -0.0114 -0.0017 481 ILE 61 CG2 -0.0672 -0.0165 -0.0078 482 ILE 61 CD1 -0.0511 -0.0078 -0.0101 483 GLN 62 N -0.0645 -0.0186 -0.0009 484 GLN 62 CA -0.0613 -0.0359 -0.0002 485 GLN 62 C -0.0542 -0.0480 -0.0124 486 GLN 62 O -0.0517 -0.0420 -0.0225 487 GLN 62 CB -0.0607 -0.0329 -0.0034 488 GLN 62 CG -0.0671 -0.0271 0.0107 489 GLN 62 CD -0.0647 -0.0308 0.0063 490 GLN 62 OE1 -0.0680 -0.0219 0.0104 491 GLN 62 NE2 -0.0584 -0.0446 -0.0031 492 LYS 63 N -0.0508 -0.0358 -0.0354 493 LYS 63 CA -0.0147 -0.0385 -0.0044 494 LYS 63 C 0.0081 -0.0329 0.0082 495 LYS 63 O 0.0075 -0.0127 -0.0114 496 LYS 63 CB 0.0111 -0.0129 -0.0083 497 LYS 63 CG 0.0176 0.0264 -0.0404 498 LYS 63 CD 0.0515 0.0504 -0.0364 499 LYS 63 CE 0.0513 0.0856 -0.0699 500 LYS 63 NZ 0.0621 0.1104 -0.0848 501 GLU 64 N 0.0109 -0.0306 -0.0123 502 GLU 64 CA 0.0201 -0.0314 -0.0016 503 GLU 64 C 0.0023 -0.0406 -0.0047 504 GLU 64 O 0.0093 -0.0393 0.0003 505 GLU 64 CB 0.0436 -0.0122 -0.0090 506 GLU 64 CG 0.0652 -0.0075 0.0052 507 GLU 64 CD 0.0775 0.0106 -0.0118 508 GLU 64 OE1 0.0803 0.0237 -0.0301 509 GLU 64 OE2 0.0840 0.0104 -0.0049 510 SER 65 N 0.0124 -0.0354 -0.0039 511 SER 65 CA 0.0088 -0.0366 -0.0044 512 SER 65 C 0.0115 -0.0423 0.0006 513 SER 65 O 0.0138 -0.0462 0.0042 514 SER 65 CB 0.0004 -0.0387 -0.0058 515 SER 65 OG -0.0026 -0.0333 -0.0107 516 THR 66 N 0.0151 -0.0251 0.0016 517 THR 66 CA 0.0125 -0.0215 0.0006 518 THR 66 C 0.0146 -0.0193 0.0010 519 THR 66 O 0.0156 -0.0218 0.0015 520 THR 66 CB 0.0077 -0.0230 -0.0005 521 THR 66 OG1 0.0060 -0.0249 -0.0009 522 THR 66 CG2 0.0052 -0.0191 -0.0016 523 LEU 67 N 0.0089 -0.0042 0.0013 524 LEU 67 CA 0.0076 -0.0031 0.0020 525 LEU 67 C 0.0089 -0.0030 0.0008 526 LEU 67 O 0.0105 -0.0045 0.0000 527 LEU 67 CB 0.0063 -0.0046 0.0038 528 LEU 67 CG 0.0054 -0.0058 0.0051 529 LEU 67 CD1 0.0039 -0.0069 0.0070 530 LEU 67 CD2 0.0045 -0.0040 0.0052 531 HIS 68 N 0.0113 0.0060 0.0011 532 HIS 68 CA 0.0085 0.0078 0.0004 533 HIS 68 C 0.0062 0.0096 0.0062 534 HIS 68 O 0.0041 0.0112 0.0089 535 HIS 68 CB 0.0042 0.0102 -0.0042 536 HIS 68 CG 0.0065 0.0083 -0.0100 537 HIS 68 ND1 0.0074 0.0075 -0.0136 538 HIS 68 CD2 0.0079 0.0072 -0.0127 539 HIS 68 CE1 0.0095 0.0058 -0.0183 540 HIS 68 NE2 0.0099 0.0056 -0.0178 541 LEU 69 N -0.0021 0.0170 0.0101 542 LEU 69 CA -0.0024 0.0144 0.0096 543 LEU 69 C -0.0006 0.0133 0.0101 544 LEU 69 O 0.0015 0.0134 0.0108 545 LEU 69 CB -0.0024 0.0132 0.0094 546 LEU 69 CG -0.0025 0.0104 0.0090 547 LEU 69 CD1 -0.0047 0.0097 0.0081 548 LEU 69 CD2 -0.0022 0.0093 0.0089 549 VAL 70 N -0.0111 0.0115 0.0132 550 VAL 70 CA -0.0124 0.0069 0.0167 551 VAL 70 C -0.0127 0.0058 0.0163 552 VAL 70 O -0.0124 0.0062 0.0119 553 VAL 70 CB -0.0134 0.0024 0.0150 554 VAL 70 CG1 -0.0148 -0.0025 0.0184 555 VAL 70 CG2 -0.0131 0.0038 0.0148 556 LEU 71 N -0.0092 0.0034 -0.0021 557 LEU 71 CA -0.0097 0.0026 -0.0012 558 LEU 71 C -0.0097 0.0066 -0.0009 559 LEU 71 O -0.0085 0.0094 -0.0032 560 LEU 71 CB -0.0082 -0.0003 -0.0043 561 LEU 71 CG -0.0091 -0.0046 -0.0027 562 LEU 71 CD1 -0.0103 -0.0056 -0.0002 563 LEU 71 CD2 -0.0077 -0.0077 -0.0058 564 ARG 72 N -0.0116 0.0078 -0.0028 565 ARG 72 CA -0.0112 0.0133 -0.0021 566 ARG 72 C -0.0115 0.0172 -0.0024 567 ARG 72 O -0.0092 0.0175 0.0013 568 ARG 72 CB -0.0082 0.0138 0.0028 569 ARG 72 CG -0.0068 0.0190 0.0053 570 ARG 72 CD -0.0036 0.0183 0.0104 571 ARG 72 NE -0.0029 0.0125 0.0115 572 ARG 72 CZ -0.0004 0.0107 0.0155 573 ARG 72 NH1 0.0009 0.0141 0.0178 574 ARG 72 NH2 0.0006 0.0059 0.0170 575 LEU 73 N -0.0086 -0.0022 -0.0045 576 LEU 73 CA -0.0097 0.0153 -0.0056 577 LEU 73 C -0.0011 0.0142 -0.0087 578 LEU 73 O -0.0002 0.0002 -0.0078 579 LEU 73 CB -0.0279 0.0217 0.0004 580 LEU 73 CG -0.0344 0.0333 0.0018 581 LEU 73 CD1 -0.0270 0.0280 -0.0005 582 LEU 73 CD2 -0.0533 0.0318 0.0088 583 ARG 74 N 0.0135 -0.0114 -0.0395 584 ARG 74 CA -0.0277 -0.0164 -0.0223 585 ARG 74 C -0.0684 -0.0123 0.0242 586 ARG 74 O -0.0559 0.0060 0.0735 587 ARG 74 CB 0.0015 -0.0034 -0.0038 588 ARG 74 CG -0.0280 -0.0147 -0.0165 589 ARG 74 CD 0.0105 -0.0057 -0.0187 590 ARG 74 NE 0.0105 0.0108 0.0350 591 ARG 74 CZ 0.0491 0.0318 0.0716 592 ARG 74 NH1 0.0925 0.0387 0.0587 593 ARG 74 NH2 0.0429 0.0459 0.1224 594 GLY 75 N 0.0948 -0.0476 -0.0309 595 GLY 75 CA 0.0490 -0.0439 0.0037 596 GLY 75 C 0.0054 -0.0609 0.0266 597 GLY 75 O 0.0039 -0.0404 0.0378 598 GLY 76 N -0.0166 -0.0253 -0.0438 599 GLY 76 CA -0.0050 -0.0215 -0.0355 600 GLY 76 C 0.0091 -0.0226 -0.0322 601 GLY 76 O 0.0152 -0.0151 -0.0215 602 GLY 76 OXT 0.0130 -0.0309 -0.0403