1 LEU 1 N -0.0149 0.0275 -0.0268 2 LEU 1 CA -0.0128 0.0285 0.0013 3 LEU 1 C -0.0152 0.0328 0.0134 4 LEU 1 O -0.0067 0.0221 0.0062 5 LEU 1 CB 0.0049 0.0091 0.0092 6 LEU 1 CG 0.0063 0.0064 0.0010 7 LEU 1 CD1 0.0244 -0.0138 0.0060 8 LEU 1 CD2 -0.0057 0.0219 0.0146 9 PRO 2 N -0.0063 0.0241 0.0141 10 PRO 2 CA -0.0106 0.0244 0.0213 11 PRO 2 C -0.0239 0.0180 0.0182 12 PRO 2 O -0.0259 0.0137 0.0066 13 PRO 2 CB -0.0007 0.0272 0.0167 14 PRO 2 CG 0.0046 0.0252 0.0026 15 PRO 2 CD 0.0029 0.0245 0.0026 16 VAL 3 N -0.0324 0.0053 0.0336 17 VAL 3 CA -0.0303 0.0141 0.0250 18 VAL 3 C -0.0108 0.0149 0.0157 19 VAL 3 O 0.0010 0.0073 0.0172 20 VAL 3 CB -0.0351 0.0078 0.0326 21 VAL 3 CG1 -0.0342 0.0184 0.0228 22 VAL 3 CG2 -0.0544 0.0056 0.0430 23 GLU 4 N -0.0012 0.0327 -0.0214 24 GLU 4 CA -0.0100 0.0258 -0.0208 25 GLU 4 C -0.0054 0.0300 -0.0218 26 GLU 4 O 0.0040 0.0302 -0.0147 27 GLU 4 CB -0.0115 0.0146 -0.0100 28 GLU 4 CG -0.0196 0.0084 -0.0095 29 GLU 4 CD -0.0223 -0.0029 0.0006 30 GLU 4 OE1 -0.0330 -0.0094 -0.0007 31 GLU 4 OE2 -0.0136 -0.0051 0.0097 32 ASP 5 N -0.0013 0.0175 -0.0151 33 ASP 5 CA 0.0036 0.0142 -0.0119 34 ASP 5 C 0.0049 0.0103 -0.0029 35 ASP 5 O -0.0001 0.0101 0.0031 36 ASP 5 CB -0.0006 0.0162 -0.0124 37 ASP 5 CG -0.0004 0.0195 -0.0214 38 ASP 5 OD1 0.0065 0.0183 -0.0259 39 ASP 5 OD2 -0.0072 0.0232 -0.0239 40 ALA 6 N -0.0057 -0.0036 -0.0078 41 ALA 6 CA -0.0049 -0.0021 -0.0046 42 ALA 6 C 0.0009 -0.0086 0.0043 43 ALA 6 O 0.0024 -0.0118 0.0053 44 ALA 6 CB -0.0080 -0.0048 -0.0142 45 ASP 7 N 0.0030 -0.0098 0.0016 46 ASP 7 CA 0.0057 -0.0183 0.0132 47 ASP 7 C 0.0048 -0.0100 0.0265 48 ASP 7 O 0.0067 -0.0151 0.0374 49 ASP 7 CB 0.0076 -0.0274 0.0113 50 ASP 7 CG 0.0104 -0.0414 0.0063 51 ASP 7 OD1 0.0114 -0.0452 0.0077 52 ASP 7 OD2 0.0117 -0.0485 0.0012 53 SER 8 N 0.0155 0.0029 0.0139 54 SER 8 CA 0.0111 -0.0045 0.0051 55 SER 8 C 0.0126 -0.0201 -0.0068 56 SER 8 O 0.0140 -0.0292 -0.0133 57 SER 8 CB 0.0208 -0.0044 0.0113 58 SER 8 OG 0.0156 0.0100 0.0198 59 SER 9 N 0.0133 -0.0133 -0.0013 60 SER 9 CA 0.0130 -0.0148 0.0002 61 SER 9 C 0.0153 -0.0069 -0.0130 62 SER 9 O 0.0152 -0.0049 -0.0119 63 SER 9 CB 0.0112 -0.0085 0.0163 64 SER 9 OG 0.0117 0.0074 0.0190 65 VAL 10 N 0.0214 -0.0056 -0.0204 66 VAL 10 CA 0.0217 -0.0025 -0.0298 67 VAL 10 C 0.0130 -0.0118 -0.0461 68 VAL 10 O 0.0140 -0.0061 -0.0612 69 VAL 10 CB 0.0316 0.0147 -0.0355 70 VAL 10 CG1 0.0317 0.0168 -0.0432 71 VAL 10 CG2 0.0403 0.0238 -0.0188 72 GLY 11 N 0.0188 -0.0268 -0.0407 73 GLY 11 CA 0.0226 -0.0318 -0.0450 74 GLY 11 C 0.0332 -0.0401 -0.0402 75 GLY 11 O 0.0369 -0.0448 -0.0436 76 GLN 12 N 0.0216 -0.0519 -0.0447 77 GLN 12 CA 0.0140 -0.0672 -0.0410 78 GLN 12 C 0.0086 -0.0782 -0.0427 79 GLN 12 O 0.0087 -0.0774 -0.0339 80 GLN 12 CB 0.0126 -0.0688 -0.0241 81 GLN 12 CG 0.0098 -0.0748 -0.0265 82 GLN 12 CD 0.0088 -0.0757 -0.0103 83 GLN 12 OE1 0.0120 -0.0683 0.0022 84 GLN 12 NE2 0.0043 -0.0848 -0.0105 85 LEU 13 N 0.0070 -0.0440 -0.0266 86 LEU 13 CA -0.0021 -0.0412 -0.0182 87 LEU 13 C -0.0061 -0.0391 -0.0165 88 LEU 13 O -0.0068 -0.0350 -0.0243 89 LEU 13 CB -0.0102 -0.0337 -0.0216 90 LEU 13 CG -0.0081 -0.0349 -0.0224 91 LEU 13 CD1 -0.0132 -0.0273 -0.0308 92 LEU 13 CD2 -0.0113 -0.0378 -0.0110 93 GLN 14 N -0.0567 -0.0318 0.0223 94 GLN 14 CA -0.0446 -0.0296 0.0120 95 GLN 14 C -0.0386 -0.0151 0.0199 96 GLN 14 O -0.0445 -0.0139 0.0272 97 GLN 14 CB -0.0488 -0.0421 0.0040 98 GLN 14 CG -0.0359 -0.0437 -0.0108 99 GLN 14 CD -0.0408 -0.0578 -0.0195 100 GLN 14 OE1 -0.0531 -0.0652 -0.0141 101 GLN 14 NE2 -0.0311 -0.0620 -0.0337 102 GLY 15 N -0.0564 -0.0507 0.0096 103 GLY 15 CA -0.0557 -0.0461 0.0107 104 GLY 15 C -0.0554 -0.0317 0.0129 105 GLY 15 O -0.0632 -0.0243 0.0078 106 ARG 16 N -0.0076 -0.0047 0.0257 107 ARG 16 CA -0.0012 -0.0006 0.0217 108 ARG 16 C 0.0050 0.0005 0.0244 109 ARG 16 O 0.0054 -0.0020 0.0309 110 ARG 16 CB 0.0019 0.0001 0.0226 111 ARG 16 CG -0.0035 -0.0003 0.0186 112 ARG 16 CD 0.0001 0.0010 0.0187 113 ARG 16 NE -0.0050 0.0013 0.0133 114 ARG 16 CZ -0.0027 0.0034 0.0104 115 ARG 16 NH1 0.0044 0.0052 0.0123 116 ARG 16 NH2 -0.0074 0.0035 0.0056 117 GLY 17 N 0.0191 -0.0066 0.0211 118 GLY 17 CA 0.0382 -0.0144 0.0322 119 GLY 17 C 0.0375 -0.0115 0.0342 120 GLY 17 O 0.0342 0.0047 0.0460 121 ASN 18 N 0.0172 -0.0067 0.0449 122 ASN 18 CA 0.0019 -0.0002 0.0319 123 ASN 18 C 0.0035 0.0022 0.0283 124 ASN 18 O 0.0056 -0.0054 0.0409 125 ASN 18 CB -0.0195 -0.0059 0.0373 126 ASN 18 CG -0.0313 0.0017 0.0230 127 ASN 18 OD1 -0.0229 0.0097 0.0117 128 ASN 18 ND2 -0.0515 -0.0007 0.0233 129 PRO 19 N 0.0031 0.0019 0.0151 130 PRO 19 CA 0.0054 0.0025 0.0137 131 PRO 19 C 0.0042 0.0022 0.0146 132 PRO 19 O 0.0012 0.0012 0.0140 133 PRO 19 CB 0.0058 0.0022 0.0096 134 PRO 19 CG 0.0024 0.0010 0.0087 135 PRO 19 CD 0.0015 0.0011 0.0121 136 TYR 20 N 0.0038 -0.0017 0.0262 137 TYR 20 CA 0.0148 0.0007 0.0135 138 TYR 20 C 0.0145 0.0025 0.0112 139 TYR 20 O 0.0032 0.0091 0.0106 140 TYR 20 CB 0.0116 0.0107 0.0013 141 TYR 20 CG 0.0223 0.0139 -0.0123 142 TYR 20 CD1 0.0191 0.0214 -0.0209 143 TYR 20 CD2 0.0359 0.0091 -0.0164 144 TYR 20 CE1 0.0292 0.0241 -0.0333 145 TYR 20 CE2 0.0461 0.0117 -0.0288 146 TYR 20 CZ 0.0427 0.0194 -0.0373 147 TYR 20 OH 0.0527 0.0222 -0.0499 148 CYS 21 N 0.0184 0.0092 0.0075 149 CYS 21 CA 0.0191 0.0082 0.0088 150 CYS 21 C 0.0216 0.0099 0.0072 151 CYS 21 O 0.0244 0.0106 0.0068 152 CYS 21 CB 0.0208 0.0060 0.0117 153 CYS 21 SG 0.0180 0.0036 0.0142 154 VAL 22 N 0.0319 0.0023 0.0077 155 VAL 22 CA 0.0317 0.0021 0.0067 156 VAL 22 C 0.0325 0.0031 0.0121 157 VAL 22 O 0.0344 0.0042 0.0121 158 VAL 22 CB 0.0267 -0.0009 0.0046 159 VAL 22 CG1 0.0265 -0.0012 0.0031 160 VAL 22 CG2 0.0258 -0.0020 -0.0006 161 PHE 23 N 0.0275 0.0071 0.0161 162 PHE 23 CA 0.0262 0.0087 0.0188 163 PHE 23 C 0.0308 0.0101 0.0216 164 PHE 23 O 0.0336 0.0109 0.0233 165 PHE 23 CB 0.0216 0.0106 0.0216 166 PHE 23 CG 0.0171 0.0091 0.0188 167 PHE 23 CD1 0.0144 0.0080 0.0166 168 PHE 23 CD2 0.0155 0.0089 0.0182 169 PHE 23 CE1 0.0103 0.0066 0.0139 170 PHE 23 CE2 0.0113 0.0075 0.0155 171 PHE 23 CZ 0.0087 0.0064 0.0133 172 PRO 24 N 0.0463 0.0156 0.0310 173 PRO 24 CA 0.0382 0.0142 0.0313 174 PRO 24 C 0.0433 0.0094 0.0184 175 PRO 24 O 0.0403 0.0089 0.0185 176 PRO 24 CB 0.0431 0.0212 0.0448 177 PRO 24 CG 0.0594 0.0248 0.0459 178 PRO 24 CD 0.0589 0.0222 0.0403 179 GLY 25 N 0.0534 0.0070 0.0149 180 GLY 25 CA 0.0563 -0.0072 0.0007 181 GLY 25 C 0.0357 -0.0210 -0.0063 182 GLY 25 O 0.0314 -0.0289 -0.0125 183 ARG 26 N 0.0224 -0.0141 0.0046 184 ARG 26 CA 0.0155 -0.0162 0.0031 185 ARG 26 C 0.0103 -0.0112 0.0062 186 ARG 26 O 0.0119 -0.0062 0.0095 187 ARG 26 CB 0.0150 -0.0192 0.0011 188 ARG 26 CG 0.0195 -0.0248 -0.0024 189 ARG 26 CD 0.0178 -0.0283 -0.0047 190 ARG 26 NE 0.0228 -0.0334 -0.0079 191 ARG 26 CZ 0.0226 -0.0374 -0.0106 192 ARG 26 NH1 0.0182 -0.0371 -0.0105 193 ARG 26 NH2 0.0271 -0.0419 -0.0134 194 ARG 27 N -0.0188 -0.0397 0.0207 195 ARG 27 CA -0.0171 -0.0194 -0.0041 196 ARG 27 C -0.0069 0.0147 0.0057 197 ARG 27 O -0.0015 0.0273 0.0207 198 ARG 27 CB -0.0220 -0.0205 -0.0366 199 ARG 27 CG -0.0326 -0.0532 -0.0517 200 ARG 27 CD -0.0379 -0.0556 -0.0843 201 ARG 27 NE -0.0361 -0.0354 -0.1084 202 ARG 27 CZ -0.0375 -0.0251 -0.1371 203 ARG 27 NH1 -0.0408 -0.0326 -0.1465 204 ARG 27 NH2 -0.0356 -0.0070 -0.1567 205 THR 28 N -0.0017 0.0148 0.0063 206 THR 28 CA -0.0018 0.0226 0.0074 207 THR 28 C -0.0023 0.0274 0.0014 208 THR 28 O -0.0026 0.0252 -0.0050 209 THR 28 CB -0.0017 0.0240 0.0083 210 THR 28 OG1 -0.0020 0.0202 0.0028 211 THR 28 CG2 -0.0012 0.0208 0.0157 212 SER 29 N 0.0051 0.0181 0.0069 213 SER 29 CA 0.0066 0.0143 0.0109 214 SER 29 C 0.0074 0.0127 0.0109 215 SER 29 O 0.0070 0.0145 0.0077 216 SER 29 CB 0.0091 0.0100 0.0100 217 SER 29 OG 0.0112 0.0074 0.0058 218 SER 30 N 0.0038 0.0102 0.0201 219 SER 30 CA 0.0045 0.0094 0.0197 220 SER 30 C 0.0093 0.0069 0.0147 221 SER 30 O 0.0101 0.0072 0.0129 222 SER 30 CB 0.0040 0.0054 0.0259 223 SER 30 OG 0.0065 0.0004 0.0279 224 THR 31 N 0.0083 0.0055 0.0148 225 THR 31 CA 0.0102 0.0046 0.0128 226 THR 31 C 0.0094 0.0056 0.0105 227 THR 31 O 0.0108 0.0052 0.0084 228 THR 31 CB 0.0120 0.0031 0.0140 229 THR 31 OG1 0.0110 0.0035 0.0155 230 THR 31 CG2 0.0131 0.0019 0.0160 231 SER 32 N 0.0076 0.0084 0.0099 232 SER 32 CA 0.0067 0.0093 0.0078 233 SER 32 C 0.0067 0.0094 0.0060 234 SER 32 O 0.0066 0.0094 0.0064 235 SER 32 CB 0.0046 0.0108 0.0083 236 SER 32 OG 0.0044 0.0109 0.0102 237 PHE 33 N 0.0068 0.0102 0.0042 238 PHE 33 CA 0.0066 0.0090 0.0023 239 PHE 33 C 0.0044 0.0087 0.0019 240 PHE 33 O 0.0031 0.0091 0.0026 241 PHE 33 CB 0.0075 0.0085 0.0015 242 PHE 33 CG 0.0072 0.0073 -0.0005 243 PHE 33 CD1 0.0058 0.0068 -0.0012 244 PHE 33 CD2 0.0083 0.0066 -0.0016 245 PHE 33 CE1 0.0055 0.0057 -0.0030 246 PHE 33 CE2 0.0080 0.0055 -0.0034 247 PHE 33 CZ 0.0066 0.0050 -0.0041 248 THR 34 N 0.0076 0.0088 0.0026 249 THR 34 CA 0.0059 0.0092 0.0018 250 THR 34 C 0.0059 0.0089 -0.0001 251 THR 34 O 0.0067 0.0087 -0.0006 252 THR 34 CB 0.0045 0.0098 0.0028 253 THR 34 OG1 0.0049 0.0097 0.0032 254 THR 34 CG2 0.0042 0.0102 0.0046 255 THR 35 N 0.0080 0.0093 -0.0001 256 THR 35 CA 0.0081 0.0086 0.0001 257 THR 35 C 0.0077 0.0089 -0.0003 258 THR 35 O 0.0072 0.0095 -0.0009 259 THR 35 CB 0.0077 0.0075 -0.0000 260 THR 35 OG1 0.0079 0.0068 0.0002 261 THR 35 CG2 0.0068 0.0074 -0.0008 262 SER 36 N 0.0095 0.0082 -0.0010 263 SER 36 CA 0.0086 0.0073 -0.0008 264 SER 36 C 0.0081 0.0058 -0.0007 265 SER 36 O 0.0088 0.0052 -0.0009 266 SER 36 CB 0.0094 0.0068 -0.0010 267 SER 36 OG 0.0107 0.0060 -0.0014 268 PHE 37 N 0.0059 0.0049 -0.0006 269 PHE 37 CA 0.0055 0.0039 -0.0008 270 PHE 37 C 0.0046 0.0034 -0.0007 271 PHE 37 O 0.0040 0.0039 -0.0004 272 PHE 37 CB 0.0052 0.0041 -0.0006 273 PHE 37 CG 0.0042 0.0048 -0.0003 274 PHE 37 CD1 0.0044 0.0059 0.0000 275 PHE 37 CD2 0.0031 0.0043 -0.0002 276 PHE 37 CE1 0.0035 0.0066 0.0004 277 PHE 37 CE2 0.0022 0.0050 0.0002 278 PHE 37 CZ 0.0024 0.0061 0.0005 279 SER 38 N 0.0028 0.0081 -0.0079 280 SER 38 CA 0.0017 0.0057 -0.0065 281 SER 38 C 0.0005 0.0061 -0.0047 282 SER 38 O 0.0009 0.0076 -0.0051 283 SER 38 CB 0.0024 0.0029 -0.0079 284 SER 38 OG 0.0036 0.0023 -0.0097 285 THR 39 N -0.0030 0.0047 -0.0019 286 THR 39 CA -0.0033 0.0051 -0.0007 287 THR 39 C -0.0034 0.0038 -0.0011 288 THR 39 O -0.0036 0.0023 -0.0012 289 THR 39 CB -0.0038 0.0050 0.0011 290 THR 39 OG1 -0.0037 0.0062 0.0015 291 THR 39 CG2 -0.0041 0.0053 0.0024 292 GLU 40 N -0.0084 0.0028 0.0043 293 GLU 40 CA -0.0087 0.0026 0.0034 294 GLU 40 C -0.0096 0.0027 0.0029 295 GLU 40 O -0.0097 0.0028 0.0031 296 GLU 40 CB -0.0080 0.0021 0.0027 297 GLU 40 CG -0.0072 0.0019 0.0031 298 GLU 40 CD -0.0065 0.0019 0.0038 299 GLU 40 OE1 -0.0058 0.0019 0.0042 300 GLU 40 OE2 -0.0065 0.0020 0.0040 301 PRO 41 N -0.0126 0.0013 -0.0020 302 PRO 41 CA -0.0140 0.0005 -0.0016 303 PRO 41 C -0.0126 0.0015 -0.0011 304 PRO 41 O -0.0107 0.0024 -0.0024 305 PRO 41 CB -0.0153 -0.0008 -0.0042 306 PRO 41 CG -0.0155 -0.0010 -0.0052 307 PRO 41 CD -0.0131 0.0005 -0.0045 308 LEU 42 N -0.0107 0.0011 0.0024 309 LEU 42 CA -0.0093 0.0013 0.0025 310 LEU 42 C -0.0089 0.0014 0.0005 311 LEU 42 O -0.0074 0.0017 0.0002 312 LEU 42 CB -0.0100 0.0012 0.0038 313 LEU 42 CG -0.0102 0.0011 0.0060 314 LEU 42 CD1 -0.0110 0.0010 0.0072 315 LEU 42 CD2 -0.0083 0.0015 0.0069 316 GLY 43 N -0.0155 0.0011 -0.0049 317 GLY 43 CA -0.0144 0.0040 -0.0107 318 GLY 43 C -0.0126 0.0049 -0.0126 319 GLY 43 O -0.0110 0.0071 -0.0173 320 TYR 44 N -0.0126 0.0057 -0.0092 321 TYR 44 CA -0.0103 0.0064 -0.0109 322 TYR 44 C -0.0061 0.0069 -0.0100 323 TYR 44 O -0.0050 0.0066 -0.0068 324 TYR 44 CB -0.0112 0.0060 -0.0097 325 TYR 44 CG -0.0150 0.0057 -0.0113 326 TYR 44 CD1 -0.0174 0.0056 -0.0137 327 TYR 44 CD2 -0.0160 0.0054 -0.0104 328 TYR 44 CE1 -0.0208 0.0053 -0.0150 329 TYR 44 CE2 -0.0194 0.0050 -0.0118 330 TYR 44 CZ -0.0218 0.0050 -0.0140 331 TYR 44 OH -0.0253 0.0046 -0.0154 332 ALA 45 N -0.0080 0.0042 -0.0127 333 ALA 45 CA -0.0040 0.0009 -0.0141 334 ALA 45 C -0.0059 -0.0055 -0.0111 335 ALA 45 O -0.0113 -0.0059 -0.0079 336 ALA 45 CB -0.0031 0.0058 -0.0160 337 ARG 46 N -0.0063 -0.0253 -0.0089 338 ARG 46 CA -0.0020 -0.0225 -0.0060 339 ARG 46 C -0.0029 -0.0255 -0.0075 340 ARG 46 O -0.0084 -0.0267 -0.0104 341 ARG 46 CB -0.0041 -0.0148 -0.0039 342 ARG 46 CG -0.0029 -0.0108 -0.0018 343 ARG 46 CD -0.0069 -0.0038 -0.0007 344 ARG 46 NE -0.0050 0.0005 0.0017 345 ARG 46 CZ -0.0095 0.0031 0.0008 346 ARG 46 NH1 -0.0136 -0.0006 -0.0024 347 ARG 46 NH2 -0.0096 0.0096 0.0034 348 MET 47 N -0.0091 -0.0379 -0.0141 349 MET 47 CA -0.0104 -0.0084 -0.0013 350 MET 47 C -0.0119 0.0149 0.0096 351 MET 47 O -0.0007 0.0273 -0.0071 352 MET 47 CB 0.0043 0.0075 -0.0234 353 MET 47 CG 0.0044 -0.0129 -0.0307 354 MET 47 SD 0.0181 0.0083 -0.0490 355 MET 47 CE 0.0369 0.0100 -0.0835 356 LEU 48 N -0.0178 0.0160 0.0019 357 LEU 48 CA -0.0190 0.0228 0.0054 358 LEU 48 C -0.0189 0.0351 0.0066 359 LEU 48 O -0.0208 0.0378 0.0109 360 LEU 48 CB -0.0240 0.0188 0.0158 361 LEU 48 CG -0.0246 0.0061 0.0159 362 LEU 48 CD1 -0.0297 0.0029 0.0267 363 LEU 48 CD2 -0.0211 0.0031 0.0078 364 HIS 49 N -0.0167 0.0311 0.0055 365 HIS 49 CA -0.0152 0.0315 0.0059 366 HIS 49 C -0.0134 0.0283 0.0078 367 HIS 49 O -0.0146 0.0253 0.0085 368 HIS 49 CB -0.0182 0.0320 0.0047 369 HIS 49 CG -0.0167 0.0334 0.0046 370 HIS 49 ND1 -0.0151 0.0368 0.0039 371 HIS 49 CD2 -0.0167 0.0318 0.0052 372 HIS 49 CE1 -0.0141 0.0373 0.0040 373 HIS 49 NE2 -0.0151 0.0344 0.0048 374 ARG 50 N -0.0181 0.0336 0.0149 375 ARG 50 CA -0.0181 0.0318 0.0084 376 ARG 50 C -0.0188 0.0293 0.0127 377 ARG 50 O -0.0181 0.0317 0.0092 378 ARG 50 CB -0.0192 0.0243 0.0015 379 ARG 50 CG -0.0185 0.0264 -0.0045 380 ARG 50 CD -0.0194 0.0192 -0.0120 381 ARG 50 NE -0.0192 0.0195 -0.0153 382 ARG 50 CZ -0.0203 0.0128 -0.0200 383 ARG 50 NH1 -0.0215 0.0056 -0.0226 384 ARG 50 NH2 -0.0201 0.0132 -0.0221 385 ASP 51 N -0.0138 0.0243 0.0152 386 ASP 51 CA -0.0144 0.0243 0.0138 387 ASP 51 C -0.0167 0.0240 0.0086 388 ASP 51 O -0.0163 0.0275 0.0059 389 ASP 51 CB -0.0120 0.0287 0.0151 390 ASP 51 CG -0.0122 0.0286 0.0147 391 ASP 51 OD1 -0.0133 0.0248 0.0160 392 ASP 51 OD2 -0.0112 0.0323 0.0133 393 PRO 52 N -0.0166 0.0184 0.0038 394 PRO 52 CA -0.0175 0.0181 0.0009 395 PRO 52 C -0.0173 0.0188 0.0002 396 PRO 52 O -0.0170 0.0185 0.0021 397 PRO 52 CB -0.0194 0.0154 0.0007 398 PRO 52 CG -0.0193 0.0146 0.0031 399 PRO 52 CD -0.0177 0.0161 0.0054 400 PRO 53 N -0.0102 0.0179 -0.0009 401 PRO 53 CA -0.0122 0.0185 -0.0041 402 PRO 53 C -0.0131 0.0134 -0.0055 403 PRO 53 O -0.0133 0.0096 -0.0058 404 PRO 53 CB -0.0147 0.0213 -0.0078 405 PRO 53 CG -0.0144 0.0200 -0.0074 406 PRO 53 CD -0.0113 0.0195 -0.0026 407 TYR 54 N -0.0102 0.0055 -0.0022 408 TYR 54 CA -0.0097 0.0043 -0.0047 409 TYR 54 C -0.0096 0.0042 -0.0079 410 TYR 54 O -0.0105 0.0062 -0.0087 411 TYR 54 CB -0.0105 0.0062 -0.0053 412 TYR 54 CG -0.0102 0.0055 -0.0029 413 TYR 54 CD1 -0.0092 0.0032 -0.0037 414 TYR 54 CD2 -0.0109 0.0069 0.0001 415 TYR 54 CE1 -0.0089 0.0026 -0.0015 416 TYR 54 CE2 -0.0106 0.0063 0.0023 417 TYR 54 CZ -0.0096 0.0041 0.0014 418 TYR 54 OH -0.0094 0.0035 0.0035 419 GLU 55 N 0.0020 0.0004 -0.0160 420 GLU 55 CA 0.0027 0.0001 -0.0181 421 GLU 55 C 0.0028 0.0012 -0.0142 422 GLU 55 O 0.0010 0.0013 -0.0102 423 GLU 55 CB -0.0010 -0.0024 -0.0212 424 GLU 55 CG -0.0010 -0.0035 -0.0256 425 GLU 55 CD -0.0043 -0.0059 -0.0289 426 GLU 55 OE1 -0.0045 -0.0069 -0.0326 427 GLU 55 OE2 -0.0067 -0.0067 -0.0278 428 ARG 56 N 0.0039 -0.0147 -0.0149 429 ARG 56 CA 0.0097 -0.0003 -0.0119 430 ARG 56 C 0.0019 -0.0129 -0.0117 431 ARG 56 O 0.0050 -0.0298 -0.0258 432 ARG 56 CB 0.0315 0.0108 -0.0275 433 ARG 56 CG 0.0390 0.0295 -0.0234 434 ARG 56 CD 0.0605 0.0427 -0.0374 435 ARG 56 NE 0.0691 0.0259 -0.0572 436 ARG 56 CZ 0.0877 0.0310 -0.0733 437 ARG 56 NH1 0.1000 0.0519 -0.0728 438 ARG 56 NH2 0.0943 0.0152 -0.0902 439 ALA 57 N 0.0053 -0.0005 -0.0036 440 ALA 57 CA 0.0031 -0.0003 -0.0027 441 ALA 57 C 0.0060 0.0012 -0.0025 442 ALA 57 O 0.0059 0.0039 -0.0003 443 ALA 57 CB -0.0002 0.0017 0.0000 444 GLY 58 N 0.0088 0.0000 -0.0086 445 GLY 58 CA 0.0112 0.0010 -0.0079 446 GLY 58 C 0.0158 0.0041 -0.0043 447 GLY 58 O 0.0203 0.0047 -0.0052 448 ASN 59 N 0.0171 0.0060 0.0000 449 ASN 59 CA 0.0204 0.0084 0.0031 450 ASN 59 C 0.0201 0.0095 0.0091 451 ASN 59 O 0.0220 0.0111 0.0124 452 ASN 59 CB 0.0192 0.0077 0.0031 453 ASN 59 CG 0.0201 0.0071 -0.0027 454 ASN 59 OD1 0.0231 0.0079 -0.0062 455 ASN 59 ND2 0.0176 0.0055 -0.0037 456 SER 60 N 0.0121 0.0052 0.0098 457 SER 60 CA 0.0107 0.0066 0.0103 458 SER 60 C 0.0121 0.0056 0.0103 459 SER 60 O 0.0114 0.0068 0.0110 460 SER 60 CB 0.0077 0.0070 0.0084 461 SER 60 OG 0.0076 0.0049 0.0059 462 GLY 61 N 0.0201 0.0110 0.0119 463 GLY 61 CA 0.0188 0.0084 0.0107 464 GLY 61 C 0.0137 0.0060 0.0071 465 GLY 61 O 0.0120 0.0040 0.0057 466 LEU 62 N 0.0055 0.0037 0.0051 467 LEU 62 CA 0.0052 0.0036 0.0056 468 LEU 62 C 0.0050 0.0032 0.0038 469 LEU 62 O 0.0047 0.0028 0.0022 470 LEU 62 CB 0.0037 0.0027 0.0069 471 LEU 62 CG 0.0037 0.0030 0.0089 472 LEU 62 CD1 0.0021 0.0021 0.0101 473 LEU 62 CD2 0.0050 0.0042 0.0100 474 ASN 63 N -0.0013 0.0034 -0.0003 475 ASN 63 CA -0.0018 0.0018 -0.0022 476 ASN 63 C -0.0043 0.0000 -0.0010 477 ASN 63 O -0.0053 0.0004 0.0016 478 ASN 63 CB -0.0004 0.0031 -0.0024 479 ASN 63 CG 0.0021 0.0046 -0.0040 480 ASN 63 OD1 0.0028 0.0044 -0.0058 481 ASN 63 ND2 0.0036 0.0064 -0.0035 482 HIS 64 N -0.0074 -0.0008 -0.0046 483 HIS 64 CA -0.0090 -0.0022 -0.0040 484 HIS 64 C -0.0095 -0.0041 -0.0043 485 HIS 64 O -0.0084 -0.0046 -0.0052 486 HIS 64 CB -0.0089 -0.0030 -0.0043 487 HIS 64 CG -0.0078 -0.0047 -0.0057 488 HIS 64 ND1 -0.0060 -0.0043 -0.0069 489 HIS 64 CD2 -0.0082 -0.0066 -0.0061 490 HIS 64 CE1 -0.0054 -0.0061 -0.0079 491 HIS 64 NE2 -0.0067 -0.0075 -0.0075 492 ARG 65 N -0.0149 -0.0018 -0.0054 493 ARG 65 CA -0.0148 -0.0022 -0.0047 494 ARG 65 C -0.0146 -0.0050 -0.0032 495 ARG 65 O -0.0144 -0.0059 -0.0015 496 ARG 65 CB -0.0148 0.0003 -0.0028 497 ARG 65 CG -0.0147 0.0009 0.0000 498 ARG 65 CD -0.0147 0.0034 0.0017 499 ARG 65 NE -0.0145 0.0038 0.0044 500 ARG 65 CZ -0.0145 0.0062 0.0060 501 ARG 65 NH1 -0.0147 0.0083 0.0053 502 ARG 65 NH2 -0.0144 0.0064 0.0083 503 ILE 66 N -0.0147 -0.0044 -0.0021 504 ILE 66 CA -0.0122 -0.0033 -0.0021 505 ILE 66 C -0.0124 -0.0037 0.0002 506 ILE 66 O -0.0129 -0.0042 0.0027 507 ILE 66 CB -0.0097 -0.0023 -0.0015 508 ILE 66 CG1 -0.0096 -0.0020 -0.0037 509 ILE 66 CG2 -0.0071 -0.0012 -0.0016 510 ILE 66 CD1 -0.0072 -0.0010 -0.0032 511 TYR 67 N -0.0179 -0.0021 0.0027 512 TYR 67 CA -0.0175 -0.0010 0.0039 513 TYR 67 C -0.0162 -0.0016 0.0049 514 TYR 67 O -0.0156 -0.0028 0.0048 515 TYR 67 CB -0.0180 0.0004 0.0043 516 TYR 67 CG -0.0175 0.0001 0.0046 517 TYR 67 CD1 -0.0179 -0.0006 0.0037 518 TYR 67 CD2 -0.0167 0.0007 0.0059 519 TYR 67 CE1 -0.0175 -0.0007 0.0041 520 TYR 67 CE2 -0.0163 0.0006 0.0063 521 TYR 67 CZ -0.0167 -0.0001 0.0054 522 TYR 67 OH -0.0162 -0.0003 0.0058 523 GLU 68 N -0.0167 0.0041 0.0048 524 GLU 68 CA -0.0151 0.0043 0.0051 525 GLU 68 C -0.0162 0.0043 0.0056 526 GLU 68 O -0.0179 0.0045 0.0066 527 GLU 68 CB -0.0136 0.0048 0.0069 528 GLU 68 CG -0.0121 0.0048 0.0065 529 GLU 68 CD -0.0106 0.0053 0.0083 530 GLU 68 OE1 -0.0094 0.0054 0.0084 531 GLU 68 OE2 -0.0107 0.0057 0.0098 532 ARG 69 N -0.0246 0.0018 0.0113 533 ARG 69 CA -0.0263 0.0021 0.0126 534 ARG 69 C -0.0205 0.0032 0.0146 535 ARG 69 O -0.0151 0.0028 0.0127 536 ARG 69 CB -0.0293 0.0001 0.0070 537 ARG 69 CG -0.0249 -0.0015 0.0014 538 ARG 69 CD -0.0283 -0.0034 -0.0038 539 ARG 69 NE -0.0239 -0.0050 -0.0093 540 ARG 69 CZ -0.0254 -0.0068 -0.0146 541 ARG 69 NH1 -0.0307 -0.0073 -0.0152 542 ARG 69 NH2 -0.0215 -0.0082 -0.0194 543 SER 70 N -0.0385 -0.0001 0.0212 544 SER 70 CA -0.0333 -0.0001 0.0251 545 SER 70 C -0.0334 0.0021 0.0129 546 SER 70 O -0.0429 0.0025 0.0038 547 SER 70 CB -0.0415 -0.0035 0.0375 548 SER 70 OG -0.0348 -0.0036 0.0427 549 ARG 71 N -0.0397 -0.0008 0.0174 550 ARG 71 CA -0.0347 -0.0000 -0.0010 551 ARG 71 C -0.0223 0.0044 0.0079 552 ARG 71 O -0.0124 0.0085 0.0248 553 ARG 71 CB -0.0213 0.0035 -0.0177 554 ARG 71 CG -0.0137 0.0050 -0.0386 555 ARG 71 CD 0.0012 0.0093 -0.0522 556 ARG 71 NE 0.0081 0.0106 -0.0716 557 ARG 71 CZ 0.0241 0.0152 -0.0845 558 ARG 71 NH1 0.0342 0.0185 -0.0824 559 ARG 71 NH2 0.0306 0.0166 -0.1000 560 VAL 72 N -0.0448 0.0012 -0.0101 561 VAL 72 CA -0.0246 0.0039 -0.0005 562 VAL 72 C 0.0256 0.0182 -0.0040 563 VAL 72 O 0.0416 0.0324 -0.0395 564 VAL 72 CB -0.0441 0.0074 -0.0316 565 VAL 72 CG1 -0.0238 0.0092 -0.0190 566 VAL 72 CG2 -0.0949 -0.0069 -0.0292 567 GLY 73 N 0.0501 0.0276 0.0307 568 GLY 73 CA 0.0844 0.0295 0.0307 569 GLY 73 C 0.0572 0.0294 0.0327 570 GLY 73 O 0.0841 0.0310 0.0329 571 GLY 74 N 0.0269 0.0206 0.0234 572 GLY 74 CA 0.0224 0.0217 0.0279 573 GLY 74 C 0.0060 0.0170 0.0268 574 GLY 74 O -0.0036 0.0140 0.0256 575 LEU 75 N -0.0049 0.0078 0.0150 576 LEU 75 CA -0.0076 0.0090 0.0127 577 LEU 75 C -0.0067 0.0098 0.0075 578 LEU 75 O -0.0029 0.0091 0.0058 579 LEU 75 CB -0.0063 0.0084 0.0140 580 LEU 75 CG -0.0074 0.0076 0.0192 581 LEU 75 CD1 -0.0055 0.0069 0.0204 582 LEU 75 CD2 -0.0126 0.0089 0.0203 583 ARG 76 N -0.0073 0.0076 0.0030 584 ARG 76 CA -0.0076 0.0056 -0.0016 585 ARG 76 C -0.0123 0.0029 0.0026 586 ARG 76 O -0.0174 -0.0012 0.0046 587 ARG 76 CB -0.0092 0.0013 -0.0089 588 ARG 76 CG -0.0082 -0.0001 -0.0149 589 ARG 76 CD -0.0090 -0.0037 -0.0224 590 ARG 76 NE -0.0080 -0.0049 -0.0277 591 ARG 76 CZ -0.0077 -0.0074 -0.0350 592 ARG 76 NH1 -0.0090 -0.0098 -0.0382 593 ARG 76 NH2 -0.0063 -0.0077 -0.0392 594 THR 77 N -0.0075 0.0032 0.0004 595 THR 77 CA -0.0089 0.0025 0.0009 596 THR 77 C -0.0104 0.0010 -0.0015 597 THR 77 O -0.0095 0.0010 -0.0040 598 THR 77 CB -0.0073 0.0036 0.0014 599 THR 77 OG1 -0.0057 0.0050 0.0036 600 THR 77 CG2 -0.0089 0.0029 0.0023 601 VAL 78 N -0.0133 -0.0025 0.0001 602 VAL 78 CA -0.0138 -0.0033 -0.0006 603 VAL 78 C -0.0139 -0.0036 0.0004 604 VAL 78 O -0.0140 -0.0040 0.0017 605 VAL 78 CB -0.0147 -0.0045 -0.0011 606 VAL 78 CG1 -0.0152 -0.0053 -0.0020 607 VAL 78 CG2 -0.0146 -0.0042 -0.0021 608 ILE 79 N -0.0113 -0.0055 -0.0004 609 ILE 79 CA -0.0109 -0.0056 0.0001 610 ILE 79 C -0.0125 -0.0059 -0.0014 611 ILE 79 O -0.0129 -0.0048 -0.0031 612 ILE 79 CB -0.0092 -0.0039 -0.0001 613 ILE 79 CG1 -0.0075 -0.0035 0.0013 614 ILE 79 CG2 -0.0089 -0.0040 0.0005 615 ILE 79 CD1 -0.0056 -0.0019 0.0015 616 ASP 80 N -0.0119 -0.0059 0.0010 617 ASP 80 CA -0.0117 -0.0058 0.0012 618 ASP 80 C -0.0121 -0.0058 0.0007 619 ASP 80 O -0.0125 -0.0056 0.0002 620 ASP 80 CB -0.0115 -0.0050 0.0013 621 ASP 80 CG -0.0110 -0.0048 0.0018 622 ASP 80 OD1 -0.0108 -0.0053 0.0022 623 ASP 80 OD2 -0.0109 -0.0042 0.0018 624 VAL 81 N -0.0083 -0.0083 0.0025 625 VAL 81 CA -0.0060 -0.0074 0.0037 626 VAL 81 C -0.0058 -0.0070 0.0039 627 VAL 81 O -0.0075 -0.0057 0.0038 628 VAL 81 CB -0.0057 -0.0050 0.0047 629 VAL 81 CG1 -0.0033 -0.0041 0.0059 630 VAL 81 CG2 -0.0060 -0.0054 0.0044 631 ALA 82 N -0.0060 -0.0056 0.0029 632 ALA 82 CA -0.0057 -0.0047 0.0032 633 ALA 82 C -0.0045 -0.0042 0.0030 634 ALA 82 O -0.0038 -0.0047 0.0024 635 ALA 82 CB -0.0060 -0.0052 0.0031 636 PRO 83 N -0.0008 -0.0082 0.0033 637 PRO 83 CA -0.0003 -0.0067 0.0018 638 PRO 83 C -0.0005 -0.0065 0.0021 639 PRO 83 O -0.0015 -0.0070 0.0037 640 PRO 83 CB -0.0011 -0.0045 0.0018 641 PRO 83 CG -0.0016 -0.0050 0.0029 642 PRO 83 CD -0.0019 -0.0071 0.0044 643 PRO 84 N 0.0100 -0.0104 0.0001 644 PRO 84 CA 0.0136 -0.0206 -0.0018 645 PRO 84 C 0.0078 -0.0152 -0.0001 646 PRO 84 O 0.0053 -0.0016 0.0020 647 PRO 84 CB 0.0311 -0.0210 -0.0048 648 PRO 84 CG 0.0360 -0.0053 -0.0037 649 PRO 84 CD 0.0233 -0.0014 -0.0011 650 ASP 85 N -0.0005 -0.0457 0.0083 651 ASP 85 CA -0.0107 -0.0353 0.0104 652 ASP 85 C -0.0413 -0.0101 0.0171 653 ASP 85 O -0.0460 0.0094 0.0169 654 ASP 85 CB 0.0207 -0.0223 0.0004 655 ASP 85 CG 0.0481 -0.0510 -0.0051 656 ASP 85 OD1 0.0388 -0.0824 0.0001 657 ASP 85 OD2 0.0784 -0.0418 -0.0144 658 GLY 86 N -0.0264 0.0004 0.0184 659 GLY 86 CA -0.0373 0.0105 0.0290 660 GLY 86 C -0.0353 0.0229 0.0205 661 GLY 86 O -0.0439 0.0334 0.0276 662 HIS 87 N -0.0219 0.0245 0.0105 663 HIS 87 CA -0.0180 0.0332 -0.0029 664 HIS 87 C -0.0176 0.0241 0.0033 665 HIS 87 O -0.0174 0.0075 0.0151 666 HIS 87 CB -0.0049 0.0314 -0.0245 667 HIS 87 CG -0.0056 0.0451 -0.0333 668 HIS 87 ND1 0.0051 0.0466 -0.0532 669 HIS 87 CD2 -0.0152 0.0569 -0.0252 670 HIS 87 CE1 0.0020 0.0591 -0.0568 671 HIS 87 NE2 -0.0102 0.0658 -0.0404 672 GLN 88 N -0.0121 0.0014 0.0036 673 GLN 88 CA -0.0074 -0.0037 0.0024 674 GLN 88 C -0.0054 -0.0077 -0.0024 675 GLN 88 O -0.0084 -0.0066 -0.0068 676 GLN 88 CB -0.0085 -0.0038 -0.0003 677 GLN 88 CG -0.0094 -0.0005 0.0051 678 GLN 88 CD -0.0109 -0.0002 0.0025 679 GLN 88 OE1 -0.0129 -0.0009 -0.0035 680 GLN 88 NE2 -0.0100 0.0009 0.0072 681 ALA 89 N -0.0039 -0.0135 0.0011 682 ALA 89 CA -0.0051 -0.0158 -0.0003 683 ALA 89 C -0.0073 -0.0202 -0.0029 684 ALA 89 O -0.0053 -0.0231 -0.0039 685 ALA 89 CB -0.0005 -0.0166 0.0002 686 ILE 90 N -0.0139 -0.0231 0.0027 687 ILE 90 CA -0.0156 -0.0240 -0.0014 688 ILE 90 C -0.0117 -0.0247 -0.0046 689 ILE 90 O -0.0124 -0.0256 -0.0085 690 ILE 90 CB -0.0186 -0.0239 -0.0006 691 ILE 90 CG1 -0.0161 -0.0233 0.0021 692 ILE 90 CG2 -0.0229 -0.0234 0.0019 693 ILE 90 CD1 -0.0188 -0.0232 0.0024 694 ALA 91 N -0.0060 -0.0245 0.0018 695 ALA 91 CA -0.0015 -0.0223 -0.0007 696 ALA 91 C 0.0030 -0.0195 -0.0013 697 ALA 91 O 0.0026 -0.0191 0.0010 698 ALA 91 CB -0.0005 -0.0205 0.0033 699 ASN 92 N 0.0045 -0.0165 0.0015 700 ASN 92 CA 0.0079 -0.0135 0.0004 701 ASN 92 C 0.0089 -0.0102 0.0041 702 ASN 92 O 0.0082 -0.0098 0.0059 703 ASN 92 CB 0.0105 -0.0131 -0.0033 704 ASN 92 CG 0.0098 -0.0162 -0.0072 705 ASN 92 OD1 0.0097 -0.0170 -0.0084 706 ASN 92 ND2 0.0093 -0.0180 -0.0093 707 TYR 93 N 0.0094 -0.0055 0.0056 708 TYR 93 CA 0.0106 -0.0050 0.0072 709 TYR 93 C 0.0116 -0.0041 0.0068 710 TYR 93 O 0.0111 -0.0043 0.0061 711 TYR 93 CB 0.0099 -0.0060 0.0090 712 TYR 93 CG 0.0089 -0.0070 0.0096 713 TYR 93 CD1 0.0095 -0.0069 0.0110 714 TYR 93 CD2 0.0074 -0.0079 0.0087 715 TYR 93 CE1 0.0086 -0.0079 0.0116 716 TYR 93 CE2 0.0065 -0.0088 0.0093 717 TYR 93 CZ 0.0070 -0.0088 0.0108 718 TYR 93 OH 0.0061 -0.0097 0.0114 719 GLU 94 N 0.0109 -0.0012 0.0091 720 GLU 94 CA 0.0105 -0.0001 0.0084 721 GLU 94 C 0.0107 -0.0006 0.0088 722 GLU 94 O 0.0113 -0.0011 0.0100 723 GLU 94 CB 0.0108 0.0017 0.0090 724 GLU 94 CG 0.0104 0.0030 0.0083 725 GLU 94 CD 0.0096 0.0033 0.0067 726 GLU 94 OE1 0.0094 0.0046 0.0063 727 GLU 94 OE2 0.0092 0.0021 0.0058 728 ILE 95 N 0.0062 0.0005 0.0060 729 ILE 95 CA 0.0065 0.0002 0.0073 730 ILE 95 C 0.0074 0.0018 0.0069 731 ILE 95 O 0.0072 0.0023 0.0053 732 ILE 95 CB 0.0053 -0.0014 0.0069 733 ILE 95 CG1 0.0042 -0.0030 0.0074 734 ILE 95 CG2 0.0055 -0.0015 0.0082 735 ILE 95 CD1 0.0029 -0.0045 0.0063 736 GLU 96 N 0.0121 0.0014 0.0113 737 GLU 96 CA 0.0123 0.0025 0.0110 738 GLU 96 C 0.0124 0.0024 0.0115 739 GLU 96 O 0.0127 0.0019 0.0124 740 GLU 96 CB 0.0128 0.0035 0.0116 741 GLU 96 CG 0.0127 0.0037 0.0112 742 GLU 96 CD 0.0131 0.0048 0.0117 743 GLU 96 OE1 0.0131 0.0051 0.0114 744 GLU 96 OE2 0.0135 0.0053 0.0124 745 VAL 97 N 0.0063 0.0052 0.0059 746 VAL 97 CA 0.0063 0.0054 0.0058 747 VAL 97 C 0.0061 0.0066 0.0058 748 VAL 97 O 0.0057 0.0071 0.0051 749 VAL 97 CB 0.0061 0.0048 0.0048 750 VAL 97 CG1 0.0060 0.0050 0.0048 751 VAL 97 CG2 0.0063 0.0036 0.0049 752 ARG 98 N 0.0102 0.0055 0.0058 753 ARG 98 CA 0.0096 0.0054 0.0058 754 ARG 98 C 0.0093 0.0035 0.0052 755 ARG 98 O 0.0101 0.0023 0.0049 756 ARG 98 CB 0.0111 0.0061 0.0060 757 ARG 98 CG 0.0114 0.0081 0.0066 758 ARG 98 CD 0.0128 0.0090 0.0068 759 ARG 98 NE 0.0120 0.0089 0.0068 760 ARG 98 CZ 0.0127 0.0081 0.0065 761 ARG 98 NH1 0.0143 0.0072 0.0062 762 ARG 98 NH2 0.0118 0.0082 0.0066 763 ARG 99 N 0.0038 0.0062 0.0028 764 ARG 99 CA 0.0031 0.0049 0.0014 765 ARG 99 C 0.0023 0.0051 0.0014 766 ARG 99 O 0.0012 0.0062 0.0023 767 ARG 99 CB 0.0017 0.0042 0.0005 768 ARG 99 CG -0.0004 0.0051 0.0010 769 ARG 99 CD -0.0017 0.0044 0.0001 770 ARG 99 NE -0.0037 0.0054 0.0007 771 ARG 99 CZ -0.0052 0.0050 0.0001 772 ARG 99 NH1 -0.0050 0.0039 -0.0010 773 ARG 99 NH2 -0.0069 0.0059 0.0006 774 ILE 100 N 0.0038 0.0026 0.0006 775 ILE 100 CA 0.0023 0.0008 -0.0005 776 ILE 100 C 0.0010 -0.0014 -0.0024 777 ILE 100 O 0.0025 -0.0016 -0.0043 778 ILE 100 CB 0.0040 0.0010 -0.0022 779 ILE 100 CG1 0.0056 0.0033 -0.0004 780 ILE 100 CG2 0.0021 -0.0010 -0.0030 781 ILE 100 CD1 0.0071 0.0036 -0.0017 782 PRO 101 N -0.0026 -0.0057 -0.0030 783 PRO 101 CA -0.0039 -0.0091 -0.0044 784 PRO 101 C -0.0011 -0.0111 -0.0062 785 PRO 101 O 0.0005 -0.0106 -0.0064 786 PRO 101 CB -0.0068 -0.0093 -0.0037 787 PRO 101 CG -0.0080 -0.0060 -0.0017 788 PRO 101 CD -0.0048 -0.0038 -0.0014 789 VAL 102 N 0.0007 -0.0142 -0.0089 790 VAL 102 CA 0.0049 -0.0169 -0.0147 791 VAL 102 C 0.0054 -0.0236 -0.0180 792 VAL 102 O 0.0096 -0.0247 -0.0232 793 VAL 102 CB 0.0046 -0.0182 -0.0150 794 VAL 102 CG1 0.0053 -0.0110 -0.0129 795 VAL 102 CG2 -0.0004 -0.0237 -0.0114 796 ALA 103 N -0.0037 -0.0370 -0.0256 797 ALA 103 CA -0.0064 -0.0370 -0.0267 798 ALA 103 C -0.0075 -0.0026 -0.0117 799 ALA 103 O -0.0142 0.0027 -0.0120 800 ALA 103 CB -0.0383 -0.0516 -0.0457 801 THR 104 N -0.0026 -0.0070 -0.0040 802 THR 104 CA -0.0031 -0.0050 -0.0027 803 THR 104 C -0.0032 -0.0066 0.0008 804 THR 104 O -0.0028 -0.0088 0.0007 805 THR 104 CB -0.0028 -0.0049 -0.0054 806 THR 104 OG1 -0.0027 -0.0037 -0.0088 807 THR 104 CG2 -0.0034 -0.0023 -0.0044 808 PRO 105 N -0.0058 0.0096 0.0317 809 PRO 105 CA -0.0210 -0.0022 0.0407 810 PRO 105 C -0.0172 -0.0032 0.0126 811 PRO 105 O -0.0347 -0.0188 0.0110 812 PRO 105 CB -0.0102 0.0126 0.0754 813 PRO 105 CG -0.0023 0.0222 0.0932 814 PRO 105 CD 0.0085 0.0267 0.0617 815 ASN 106 N -0.0047 -0.0045 0.0141 816 ASN 106 CA 0.0018 -0.0153 -0.0109 817 ASN 106 C 0.0028 -0.0204 -0.0230 818 ASN 106 O 0.0119 -0.0293 -0.0430 819 ASN 106 CB 0.0289 -0.0181 -0.0134 820 ASN 106 CG 0.0287 -0.0139 -0.0032 821 ASN 106 OD1 0.0091 -0.0127 -0.0034 822 ASN 106 ND2 0.0513 -0.0115 0.0061 823 ALA 107 N -0.0051 -0.0162 -0.0106 824 ALA 107 CA -0.0044 -0.0161 -0.0096 825 ALA 107 C -0.0056 -0.0158 -0.0111 826 ALA 107 O -0.0072 -0.0143 -0.0120 827 ALA 107 CB -0.0041 -0.0142 -0.0074 828 ALA 108 N -0.0075 -0.0028 0.0002 829 ALA 108 CA -0.0016 0.0097 0.0045 830 ALA 108 C -0.0008 0.0087 0.0041 831 ALA 108 O 0.0095 0.0140 0.0053 832 ALA 108 CB -0.0110 0.0218 0.0100 833 GLY 109 N -0.0013 0.0079 0.0043 834 GLY 109 CA 0.0004 0.0076 0.0037 835 GLY 109 C -0.0003 0.0098 0.0063 836 GLY 109 O 0.0001 0.0121 0.0090 837 ASP 110 N -0.0004 0.0084 0.0048 838 ASP 110 CA -0.0011 0.0096 0.0062 839 ASP 110 C 0.0017 0.0099 0.0070 840 ASP 110 O 0.0037 0.0086 0.0056 841 ASP 110 CB -0.0033 0.0087 0.0048 842 ASP 110 CG -0.0062 0.0082 0.0038 843 ASP 110 OD1 -0.0074 0.0094 0.0052 844 ASP 110 OD2 -0.0070 0.0067 0.0017 845 CYS 111 N 0.0034 0.0064 0.0068 846 CYS 111 CA 0.0055 0.0049 0.0069 847 CYS 111 C 0.0040 0.0034 0.0037 848 CYS 111 O 0.0010 0.0048 0.0027 849 CYS 111 CB 0.0057 0.0070 0.0098 850 CYS 111 SG 0.0088 0.0051 0.0103 851 PHE 112 N 0.0015 0.0083 0.0052 852 PHE 112 CA 0.0011 0.0078 0.0038 853 PHE 112 C 0.0018 0.0074 0.0038 854 PHE 112 O 0.0011 0.0076 0.0033 855 PHE 112 CB 0.0015 0.0070 0.0026 856 PHE 112 CG 0.0010 0.0064 0.0011 857 PHE 112 CD1 0.0019 0.0054 0.0001 858 PHE 112 CD2 -0.0003 0.0069 0.0006 859 PHE 112 CE1 0.0015 0.0048 -0.0014 860 PHE 112 CE2 -0.0007 0.0063 -0.0009 861 PHE 112 CZ 0.0002 0.0053 -0.0019 862 HIS 113 N 0.0036 0.0079 0.0041 863 HIS 113 CA 0.0039 0.0062 0.0031 864 HIS 113 C 0.0056 0.0053 0.0056 865 HIS 113 O 0.0068 0.0051 0.0077 866 HIS 113 CB 0.0043 0.0033 0.0012 867 HIS 113 CG 0.0027 0.0036 -0.0017 868 HIS 113 ND1 0.0013 0.0045 -0.0034 869 HIS 113 CD2 0.0022 0.0032 -0.0029 870 HIS 113 CE1 0.0001 0.0046 -0.0057 871 HIS 113 NE2 0.0006 0.0038 -0.0055 872 THR 114 N 0.0036 -0.0016 0.0066 873 THR 114 CA 0.0043 -0.0023 0.0080 874 THR 114 C 0.0027 -0.0051 0.0062 875 THR 114 O 0.0010 -0.0054 0.0035 876 THR 114 CB 0.0050 0.0009 0.0080 877 THR 114 OG1 0.0035 0.0029 0.0050 878 THR 114 CG2 0.0068 0.0035 0.0101 879 ALA 115 N 0.0023 -0.0047 0.0027 880 ALA 115 CA -0.0017 -0.0077 0.0007 881 ALA 115 C 0.0005 -0.0066 0.0020 882 ALA 115 O 0.0053 -0.0054 0.0054 883 ALA 115 CB -0.0036 -0.0149 0.0019 884 ARG 116 N 0.0029 -0.0133 -0.0011 885 ARG 116 CA 0.0047 -0.0123 -0.0001 886 ARG 116 C 0.0045 -0.0154 -0.0001 887 ARG 116 O 0.0019 -0.0171 -0.0016 888 ARG 116 CB 0.0033 -0.0087 -0.0011 889 ARG 116 CG 0.0042 -0.0050 -0.0007 890 ARG 116 CD 0.0076 -0.0035 0.0013 891 ARG 116 NE 0.0083 -0.0001 0.0015 892 ARG 116 CZ 0.0105 0.0025 0.0027 893 ARG 116 NH1 0.0119 0.0028 0.0035 894 ARG 116 NH2 0.0119 0.0046 0.0035 895 LEU 117 N 0.0076 -0.0111 0.0025 896 LEU 117 CA 0.0059 -0.0116 0.0027 897 LEU 117 C 0.0051 -0.0126 0.0012 898 LEU 117 O 0.0046 -0.0129 0.0011 899 LEU 117 CB 0.0047 -0.0112 0.0043 900 LEU 117 CG 0.0029 -0.0116 0.0046 901 LEU 117 CD1 0.0032 -0.0113 0.0051 902 LEU 117 CD2 0.0017 -0.0114 0.0060 903 SER 118 N 0.0096 -0.0173 -0.0016 904 SER 118 CA 0.0091 -0.0199 -0.0026 905 SER 118 C 0.0071 -0.0216 -0.0022 906 SER 118 O 0.0067 -0.0211 -0.0017 907 SER 118 CB 0.0112 -0.0210 -0.0046 908 SER 118 OG 0.0133 -0.0194 -0.0051 909 THR 119 N 0.0079 -0.0258 -0.0061 910 THR 119 CA 0.0028 -0.0283 -0.0065 911 THR 119 C 0.0028 -0.0294 -0.0075 912 THR 119 O 0.0063 -0.0308 -0.0104 913 THR 119 CB 0.0009 -0.0324 -0.0098 914 THR 119 OG1 0.0007 -0.0317 -0.0090 915 THR 119 CG2 -0.0048 -0.0348 -0.0098 916 GLY 120 N -0.0011 -0.0274 -0.0059 917 GLY 120 CA -0.0011 -0.0250 -0.0038 918 GLY 120 C 0.0028 -0.0206 0.0015 919 GLY 120 O 0.0023 -0.0175 0.0039 920 SER 121 N 0.0036 -0.0196 0.0037 921 SER 121 CA 0.0058 -0.0168 0.0064 922 SER 121 C 0.0034 -0.0125 0.0065 923 SER 121 O 0.0000 -0.0121 0.0045 924 SER 121 CB 0.0084 -0.0187 0.0074 925 SER 121 OG 0.0064 -0.0185 0.0061 926 ARG 122 N 0.0035 -0.0087 0.0141 927 ARG 122 CA 0.0015 -0.0048 0.0147 928 ARG 122 C 0.0039 -0.0077 0.0173 929 ARG 122 O 0.0026 -0.0051 0.0179 930 ARG 122 CB -0.0001 0.0009 0.0196 931 ARG 122 CG -0.0033 0.0050 0.0168 932 ARG 122 CD -0.0053 0.0110 0.0212 933 ARG 122 NE -0.0083 0.0146 0.0180 934 ARG 122 CZ -0.0087 0.0167 0.0205 935 ARG 122 NH1 -0.0062 0.0153 0.0261 936 ARG 122 NH2 -0.0116 0.0202 0.0173 937 GLY 123 N 0.0013 -0.0104 0.0117 938 GLY 123 CA -0.0020 -0.0115 0.0086 939 GLY 123 C -0.0007 -0.0106 0.0063 940 GLY 123 O 0.0028 -0.0093 0.0075 941 PRO 124 N -0.0064 -0.0113 0.0013 942 PRO 124 CA -0.0074 -0.0112 0.0013 943 PRO 124 C -0.0061 -0.0127 0.0011 944 PRO 124 O -0.0039 -0.0131 0.0010 945 PRO 124 CB -0.0071 -0.0085 0.0018 946 PRO 124 CG -0.0049 -0.0077 0.0020 947 PRO 124 CD -0.0049 -0.0093 0.0017 948 ALA 125 N -0.0050 -0.0165 0.0027 949 ALA 125 CA -0.0048 -0.0170 0.0028 950 ALA 125 C -0.0049 -0.0156 0.0026 951 ALA 125 O -0.0061 -0.0148 0.0025 952 ALA 125 CB -0.0061 -0.0182 0.0030 953 THR 126 N -0.0086 -0.0122 -0.0020 954 THR 126 CA -0.0083 -0.0115 -0.0017 955 THR 126 C -0.0078 -0.0112 -0.0018 956 THR 126 O -0.0072 -0.0115 -0.0022 957 THR 126 CB -0.0079 -0.0113 -0.0018 958 THR 126 OG1 -0.0083 -0.0116 -0.0018 959 THR 126 CG2 -0.0076 -0.0105 -0.0015 960 ILE 127 N -0.0066 -0.0108 -0.0014 961 ILE 127 CA -0.0059 -0.0078 -0.0019 962 ILE 127 C -0.0060 -0.0082 -0.0019 963 ILE 127 O -0.0057 -0.0098 0.0001 964 ILE 127 CB -0.0045 -0.0057 0.0003 965 ILE 127 CG1 -0.0044 -0.0052 0.0003 966 ILE 127 CG2 -0.0039 -0.0027 -0.0004 967 ILE 127 CD1 -0.0030 -0.0032 0.0027 968 SER 128 N -0.0084 -0.0053 -0.0102 969 SER 128 CA -0.0075 -0.0036 -0.0084 970 SER 128 C -0.0045 -0.0002 -0.0102 971 SER 128 O -0.0035 0.0001 -0.0141 972 SER 128 CB -0.0093 -0.0061 -0.0090 973 SER 128 OG -0.0094 -0.0076 -0.0133 974 TRP 129 N -0.0023 0.0024 -0.0083 975 TRP 129 CA -0.0017 0.0049 -0.0092 976 TRP 129 C -0.0016 0.0052 -0.0089 977 TRP 129 O -0.0019 0.0038 -0.0073 978 TRP 129 CB -0.0011 0.0071 -0.0076 979 TRP 129 CG -0.0009 0.0070 -0.0045 980 TRP 129 CD1 -0.0005 0.0083 -0.0031 981 TRP 129 CD2 -0.0012 0.0056 -0.0025 982 TRP 129 NE1 -0.0005 0.0079 -0.0003 983 TRP 129 CE2 -0.0009 0.0062 0.0000 984 TRP 129 CE3 -0.0016 0.0040 -0.0027 985 TRP 129 CZ2 -0.0010 0.0052 0.0024 986 TRP 129 CZ3 -0.0017 0.0030 -0.0003 987 TRP 129 CH2 -0.0015 0.0036 0.0022 988 ASP 130 N 0.0035 0.0062 -0.0177 989 ASP 130 CA 0.0061 0.0147 -0.0115 990 ASP 130 C 0.0029 0.0209 -0.0010 991 ASP 130 O 0.0044 0.0231 -0.0003 992 ASP 130 CB 0.0168 0.0208 -0.0174 993 ASP 130 CG 0.0194 0.0148 -0.0270 994 ASP 130 OD1 0.0140 0.0094 -0.0266 995 ASP 130 OD2 0.0268 0.0152 -0.0351 996 ALA 131 N -0.0008 0.0087 0.0029 997 ALA 131 CA -0.0007 0.0089 0.0036 998 ALA 131 C 0.0010 0.0089 0.0041 999 ALA 131 O 0.0018 0.0091 0.0051 1000 ALA 131 CB -0.0020 0.0091 0.0050 1001 ASP 132 N -0.0023 0.0054 0.0000 1002 ASP 132 CA -0.0024 0.0038 -0.0004 1003 ASP 132 C -0.0025 0.0036 -0.0022 1004 ASP 132 O -0.0025 0.0042 -0.0031 1005 ASP 132 CB -0.0025 0.0027 0.0003 1006 ASP 132 CG -0.0026 0.0009 0.0001 1007 ASP 132 OD1 -0.0026 0.0005 -0.0006 1008 ASP 132 OD2 -0.0026 -0.0001 0.0007 1009 ALA 133 N -0.0047 0.0006 0.0000 1010 ALA 133 CA -0.0045 0.0002 -0.0018 1011 ALA 133 C -0.0032 -0.0022 -0.0034 1012 ALA 133 O -0.0029 -0.0028 -0.0051 1013 ALA 133 CB -0.0046 0.0002 -0.0001 1014 SER 134 N -0.0042 -0.0074 -0.0027 1015 SER 134 CA -0.0043 -0.0099 -0.0037 1016 SER 134 C -0.0033 -0.0083 -0.0050 1017 SER 134 O -0.0032 -0.0100 -0.0062 1018 SER 134 CB -0.0061 -0.0121 -0.0011 1019 SER 134 OG -0.0068 -0.0104 0.0013 1020 TYR 135 N -0.0016 -0.0027 -0.0034 1021 TYR 135 CA -0.0008 -0.0012 -0.0038 1022 TYR 135 C 0.0007 -0.0001 -0.0050 1023 TYR 135 O 0.0008 0.0003 -0.0050 1024 TYR 135 CB -0.0014 0.0005 -0.0023 1025 TYR 135 CG -0.0028 -0.0003 -0.0010 1026 TYR 135 CD1 -0.0029 -0.0003 -0.0009 1027 TYR 135 CD2 -0.0041 -0.0011 0.0002 1028 TYR 135 CE1 -0.0042 -0.0010 0.0003 1029 TYR 135 CE2 -0.0054 -0.0018 0.0014 1030 TYR 135 CZ -0.0055 -0.0018 0.0014 1031 TYR 135 OH -0.0068 -0.0026 0.0027 1032 THR 136 N 0.0029 0.0012 -0.0055 1033 THR 136 CA 0.0054 0.0023 -0.0060 1034 THR 136 C 0.0058 0.0042 -0.0039 1035 THR 136 O 0.0047 0.0047 -0.0025 1036 THR 136 CB 0.0064 0.0021 -0.0070 1037 THR 136 OG1 0.0060 0.0003 -0.0089 1038 THR 136 CG2 0.0090 0.0032 -0.0074 1039 TYR 137 N 0.0044 0.0061 -0.0012 1040 TYR 137 CA 0.0045 0.0072 -0.0005 1041 TYR 137 C 0.0058 0.0078 -0.0005 1042 TYR 137 O 0.0068 0.0074 -0.0010 1043 TYR 137 CB 0.0042 0.0072 -0.0005 1044 TYR 137 CG 0.0029 0.0065 -0.0005 1045 TYR 137 CD1 0.0018 0.0071 0.0001 1046 TYR 137 CD2 0.0028 0.0054 -0.0012 1047 TYR 137 CE1 0.0006 0.0065 0.0001 1048 TYR 137 CE2 0.0016 0.0048 -0.0013 1049 TYR 137 CZ 0.0005 0.0053 -0.0006 1050 TYR 137 OH -0.0007 0.0047 -0.0007 1051 TYR 138 N 0.0075 0.0072 0.0015 1052 TYR 138 CA 0.0090 0.0083 0.0011 1053 TYR 138 C 0.0089 0.0100 0.0019 1054 TYR 138 O 0.0079 0.0107 0.0028 1055 TYR 138 CB 0.0093 0.0085 0.0010 1056 TYR 138 CG 0.0095 0.0069 0.0002 1057 TYR 138 CD1 0.0110 0.0066 -0.0008 1058 TYR 138 CD2 0.0082 0.0057 0.0005 1059 TYR 138 CE1 0.0111 0.0051 -0.0015 1060 TYR 138 CE2 0.0084 0.0042 -0.0003 1061 TYR 138 CZ 0.0098 0.0039 -0.0013 1062 TYR 138 OH 0.0100 0.0024 -0.0020 1063 LEU 139 N 0.0069 0.0081 0.0025 1064 LEU 139 CA 0.0062 0.0078 0.0019 1065 LEU 139 C 0.0067 0.0082 0.0022 1066 LEU 139 O 0.0073 0.0078 0.0031 1067 LEU 139 CB 0.0054 0.0064 0.0021 1068 LEU 139 CG 0.0046 0.0060 0.0015 1069 LEU 139 CD1 0.0039 0.0066 0.0003 1070 LEU 139 CD2 0.0041 0.0046 0.0019 1071 THR 140 N 0.0092 0.0052 0.0099 1072 THR 140 CA 0.0102 0.0054 0.0117 1073 THR 140 C 0.0102 0.0042 0.0110 1074 THR 140 O 0.0092 0.0047 0.0095 1075 THR 140 CB 0.0100 0.0078 0.0126 1076 THR 140 OG1 0.0101 0.0090 0.0134 1077 THR 140 CG2 0.0110 0.0079 0.0146 1078 ILE 141 N 0.0061 0.0074 0.0072 1079 ILE 141 CA 0.0057 0.0067 0.0067 1080 ILE 141 C 0.0066 0.0073 0.0079 1081 ILE 141 O 0.0076 0.0069 0.0093 1082 ILE 141 CB 0.0057 0.0045 0.0066 1083 ILE 141 CG1 0.0049 0.0038 0.0055 1084 ILE 141 CG2 0.0052 0.0038 0.0060 1085 ILE 141 CD1 0.0049 0.0016 0.0055 1086 SER 142 N 0.0105 0.0053 0.0106 1087 SER 142 CA 0.0104 0.0049 0.0124 1088 SER 142 C 0.0107 0.0034 0.0117 1089 SER 142 O 0.0108 0.0036 0.0100 1090 SER 142 CB 0.0099 0.0069 0.0133 1091 SER 142 OG 0.0098 0.0065 0.0153 1092 GLU 143 N 0.0136 -0.0000 0.0140 1093 GLU 143 CA 0.0136 -0.0012 0.0132 1094 GLU 143 C 0.0137 0.0009 0.0129 1095 GLU 143 O 0.0137 0.0029 0.0142 1096 GLU 143 CB 0.0136 -0.0033 0.0152 1097 GLU 143 CG 0.0135 -0.0052 0.0144 1098 GLU 143 CD 0.0135 -0.0073 0.0164 1099 GLU 143 OE1 0.0134 -0.0088 0.0161 1100 GLU 143 OE2 0.0135 -0.0076 0.0182 1101 ASP 144 N 0.0133 -0.0012 0.0121 1102 ASP 144 CA 0.0144 0.0016 0.0100 1103 ASP 144 C 0.0152 0.0024 0.0111 1104 ASP 144 O 0.0148 0.0007 0.0134 1105 ASP 144 CB 0.0130 0.0011 0.0060 1106 ASP 144 CG 0.0129 0.0018 0.0041 1107 ASP 144 OD1 0.0145 0.0041 0.0045 1108 ASP 144 OD2 0.0112 0.0001 0.0018 1109 ASP 144 OXT 0.0164 0.0049 0.0094