1 LEU 1 N 0.0101 0.0000 0.0175 2 LEU 1 CA 0.0063 -0.0034 -0.0018 3 LEU 1 C 0.0035 -0.0060 -0.0159 4 LEU 1 O -0.0014 0.0059 -0.0149 5 LEU 1 CB -0.0018 0.0128 -0.0055 6 LEU 1 CG 0.0012 0.0134 0.0065 7 LEU 1 CD1 -0.0068 0.0305 0.0047 8 LEU 1 CD2 0.0070 -0.0033 0.0009 9 PRO 2 N -0.0009 0.0042 -0.0120 10 PRO 2 CA -0.0013 0.0044 -0.0153 11 PRO 2 C 0.0115 0.0053 -0.0100 12 PRO 2 O 0.0143 0.0048 0.0023 13 PRO 2 CB -0.0142 0.0027 -0.0083 14 PRO 2 CG -0.0164 0.0018 0.0040 15 PRO 2 CD -0.0098 0.0027 -0.0003 16 VAL 3 N 0.0049 -0.0028 0.0071 17 VAL 3 CA -0.0009 -0.0060 0.0077 18 VAL 3 C 0.0030 -0.0037 0.0088 19 VAL 3 O 0.0032 -0.0026 0.0157 20 VAL 3 CB -0.0068 -0.0084 0.0149 21 VAL 3 CG1 -0.0132 -0.0121 0.0147 22 VAL 3 CG2 -0.0098 -0.0103 0.0139 23 GLU 4 N -0.0044 -0.0106 0.0106 24 GLU 4 CA 0.0001 -0.0064 0.0126 25 GLU 4 C 0.0013 -0.0086 0.0140 26 GLU 4 O -0.0019 -0.0084 0.0118 27 GLU 4 CB -0.0010 0.0005 0.0101 28 GLU 4 CG -0.0006 0.0039 0.0094 29 GLU 4 CD -0.0010 0.0109 0.0073 30 GLU 4 OE1 0.0030 0.0147 0.0091 31 GLU 4 OE2 -0.0052 0.0124 0.0040 32 ASP 5 N 0.0007 -0.0041 0.0025 33 ASP 5 CA 0.0051 0.0028 -0.0016 34 ASP 5 C 0.0062 0.0047 0.0029 35 ASP 5 O 0.0044 0.0017 0.0002 36 ASP 5 CB 0.0045 0.0015 -0.0122 37 ASP 5 CG 0.0044 0.0013 -0.0172 38 ASP 5 OD1 0.0081 0.0071 -0.0160 39 ASP 5 OD2 0.0007 -0.0047 -0.0221 40 ALA 6 N 0.0054 -0.0008 0.0043 41 ALA 6 CA 0.0049 0.0005 0.0022 42 ALA 6 C 0.0044 0.0004 0.0021 43 ALA 6 O 0.0030 0.0010 0.0007 44 ALA 6 CB 0.0026 0.0006 0.0011 45 ASP 7 N 0.0077 -0.0019 -0.0025 46 ASP 7 CA 0.0058 -0.0096 0.0076 47 ASP 7 C -0.0018 -0.0037 0.0193 48 ASP 7 O -0.0046 -0.0077 0.0285 49 ASP 7 CB 0.0080 -0.0113 0.0043 50 ASP 7 CG 0.0146 -0.0240 0.0003 51 ASP 7 OD1 0.0165 -0.0326 0.0029 52 ASP 7 OD2 0.0177 -0.0253 -0.0053 53 SER 8 N 0.0075 0.0040 0.0057 54 SER 8 CA 0.0108 0.0054 0.0067 55 SER 8 C 0.0111 0.0103 0.0074 56 SER 8 O 0.0128 0.0122 0.0080 57 SER 8 CB 0.0104 0.0038 0.0064 58 SER 8 OG 0.0115 -0.0008 0.0061 59 SER 9 N 0.0106 0.0056 0.0036 60 SER 9 CA 0.0140 0.0007 -0.0110 61 SER 9 C 0.0029 -0.0061 -0.0128 62 SER 9 O 0.0029 -0.0119 -0.0253 63 SER 9 CB 0.0157 -0.0048 -0.0247 64 SER 9 OG 0.0029 -0.0111 -0.0237 65 VAL 10 N -0.0130 -0.0087 -0.0021 66 VAL 10 CA -0.0126 -0.0090 -0.0005 67 VAL 10 C 0.0065 -0.0031 0.0173 68 VAL 10 O 0.0050 -0.0108 0.0378 69 VAL 10 CB -0.0329 -0.0235 0.0058 70 VAL 10 CG1 -0.0320 -0.0223 0.0039 71 VAL 10 CG2 -0.0520 -0.0295 -0.0115 72 GLY 11 N 0.0242 0.0045 0.0082 73 GLY 11 CA 0.0149 0.0067 0.0069 74 GLY 11 C 0.0144 0.0081 0.0063 75 GLY 11 O 0.0068 0.0099 0.0053 76 GLN 12 N 0.0593 0.0409 -0.0017 77 GLN 12 CA 0.0408 0.0320 -0.0019 78 GLN 12 C 0.0453 0.0469 0.0031 79 GLN 12 O 0.0418 0.0703 0.0126 80 GLN 12 CB 0.0099 0.0305 0.0030 81 GLN 12 CG -0.0026 0.0020 -0.0057 82 GLN 12 CD -0.0324 -0.0007 -0.0015 83 GLN 12 OE1 -0.0425 0.0156 0.0065 84 GLN 12 NE2 -0.0474 -0.0224 -0.0071 85 LEU 13 N 0.0027 0.0103 -0.0118 86 LEU 13 CA 0.0011 0.0099 -0.0110 87 LEU 13 C -0.0028 0.0098 -0.0075 88 LEU 13 O -0.0058 0.0083 -0.0073 89 LEU 13 CB -0.0003 0.0071 -0.0150 90 LEU 13 CG 0.0034 0.0069 -0.0189 91 LEU 13 CD1 0.0017 0.0040 -0.0229 92 LEU 13 CD2 0.0058 0.0082 -0.0188 93 GLN 14 N -0.0076 0.0158 -0.0010 94 GLN 14 CA -0.0030 0.0059 0.0007 95 GLN 14 C -0.0084 0.0079 -0.0007 96 GLN 14 O -0.0194 0.0048 -0.0032 97 GLN 14 CB -0.0065 -0.0077 0.0006 98 GLN 14 CG 0.0024 -0.0181 0.0034 99 GLN 14 CD 0.0002 -0.0308 0.0036 100 GLN 14 OE1 -0.0091 -0.0327 0.0015 101 GLN 14 NE2 0.0090 -0.0399 0.0062 102 GLY 15 N -0.0294 -0.0068 -0.0138 103 GLY 15 CA -0.0401 -0.0118 -0.0185 104 GLY 15 C -0.0476 -0.0084 -0.0087 105 GLY 15 O -0.0560 -0.0063 -0.0012 106 ARG 16 N -0.0227 -0.0088 -0.0152 107 ARG 16 CA -0.0264 -0.0019 -0.0101 108 ARG 16 C -0.0348 -0.0025 -0.0141 109 ARG 16 O -0.0352 -0.0087 -0.0202 110 ARG 16 CB -0.0184 0.0001 -0.0049 111 ARG 16 CG -0.0106 0.0023 0.0003 112 ARG 16 CD -0.0035 0.0051 0.0059 113 ARG 16 NE 0.0024 0.0086 0.0117 114 ARG 16 CZ 0.0074 0.0134 0.0183 115 ARG 16 NH1 0.0074 0.0154 0.0202 116 ARG 16 NH2 0.0124 0.0164 0.0231 117 GLY 17 N -0.0323 0.0103 -0.0320 118 GLY 17 CA -0.0375 0.0102 -0.0340 119 GLY 17 C -0.0175 -0.0041 -0.0224 120 GLY 17 O -0.0190 -0.0303 -0.0160 121 ASN 18 N 0.1218 -0.0453 -0.0099 122 ASN 18 CA 0.0714 -0.0039 -0.0214 123 ASN 18 C 0.0467 -0.0090 -0.0104 124 ASN 18 O 0.0403 -0.0532 0.0204 125 ASN 18 CB 0.0215 -0.0049 -0.0054 126 ASN 18 CG 0.0022 0.0492 -0.0347 127 ASN 18 OD1 0.0348 0.0830 -0.0668 128 ASN 18 ND2 -0.0522 0.0585 -0.0240 129 PRO 19 N 0.0236 -0.0184 0.0098 130 PRO 19 CA 0.0201 -0.0195 0.0122 131 PRO 19 C 0.0192 -0.0197 0.0130 132 PRO 19 O 0.0209 -0.0173 0.0138 133 PRO 19 CB 0.0196 -0.0172 0.0153 134 PRO 19 CG 0.0229 -0.0141 0.0151 135 PRO 19 CD 0.0253 -0.0153 0.0113 136 TYR 20 N 0.0148 -0.0235 0.0262 137 TYR 20 CA 0.0202 -0.0258 0.0117 138 TYR 20 C 0.0126 -0.0211 0.0087 139 TYR 20 O 0.0003 -0.0138 0.0080 140 TYR 20 CB 0.0185 -0.0239 -0.0019 141 TYR 20 CG 0.0233 -0.0257 -0.0175 142 TYR 20 CD1 0.0141 -0.0196 -0.0274 143 TYR 20 CD2 0.0371 -0.0335 -0.0221 144 TYR 20 CE1 0.0185 -0.0213 -0.0417 145 TYR 20 CE2 0.0416 -0.0352 -0.0364 146 TYR 20 CZ 0.0322 -0.0291 -0.0463 147 TYR 20 OH 0.0366 -0.0307 -0.0608 148 CYS 21 N 0.0074 -0.0218 0.0119 149 CYS 21 CA 0.0032 -0.0182 0.0085 150 CYS 21 C -0.0006 -0.0225 0.0049 151 CYS 21 O -0.0013 -0.0268 0.0039 152 CYS 21 CB 0.0019 -0.0149 0.0077 153 CYS 21 SG 0.0053 -0.0086 0.0112 154 VAL 22 N 0.0025 -0.0185 -0.0053 155 VAL 22 CA 0.0017 -0.0193 -0.0100 156 VAL 22 C 0.0015 -0.0196 -0.0113 157 VAL 22 O 0.0021 -0.0216 -0.0147 158 VAL 22 CB -0.0015 -0.0166 -0.0121 159 VAL 22 CG1 -0.0023 -0.0176 -0.0172 160 VAL 22 CG2 -0.0013 -0.0162 -0.0105 161 PHE 23 N -0.0026 -0.0131 -0.0042 162 PHE 23 CA -0.0028 -0.0144 -0.0100 163 PHE 23 C -0.0058 -0.0190 -0.0112 164 PHE 23 O -0.0069 -0.0199 -0.0085 165 PHE 23 CB 0.0003 -0.0106 -0.0132 166 PHE 23 CG 0.0032 -0.0062 -0.0123 167 PHE 23 CD1 0.0040 -0.0056 -0.0152 168 PHE 23 CD2 0.0052 -0.0027 -0.0087 169 PHE 23 CE1 0.0067 -0.0016 -0.0143 170 PHE 23 CE2 0.0080 0.0014 -0.0078 171 PHE 23 CZ 0.0087 0.0019 -0.0106 172 PRO 24 N -0.0201 -0.0312 -0.0314 173 PRO 24 CA -0.0192 -0.0295 -0.0463 174 PRO 24 C -0.0280 -0.0388 -0.0339 175 PRO 24 O -0.0319 -0.0419 -0.0461 176 PRO 24 CB -0.0294 -0.0382 -0.0697 177 PRO 24 CG -0.0435 -0.0524 -0.0611 178 PRO 24 CD -0.0341 -0.0444 -0.0402 179 GLY 25 N -0.0258 -0.0453 -0.0317 180 GLY 25 CA -0.0281 -0.0351 -0.0212 181 GLY 25 C -0.0104 -0.0193 -0.0193 182 GLY 25 O -0.0063 -0.0144 -0.0177 183 ARG 26 N 0.0117 -0.0045 -0.0255 184 ARG 26 CA 0.0145 -0.0056 -0.0229 185 ARG 26 C 0.0162 -0.0062 -0.0254 186 ARG 26 O 0.0163 -0.0062 -0.0294 187 ARG 26 CB 0.0181 -0.0069 -0.0215 188 ARG 26 CG 0.0169 -0.0064 -0.0185 189 ARG 26 CD 0.0205 -0.0078 -0.0164 190 ARG 26 NE 0.0190 -0.0072 -0.0137 191 ARG 26 CZ 0.0214 -0.0081 -0.0114 192 ARG 26 NH1 0.0254 -0.0095 -0.0114 193 ARG 26 NH2 0.0198 -0.0075 -0.0091 194 ARG 27 N 0.1297 -0.0033 -0.0682 195 ARG 27 CA 0.0826 0.0095 -0.0214 196 ARG 27 C 0.0315 0.0005 -0.0184 197 ARG 27 O 0.0111 -0.0241 -0.0617 198 ARG 27 CB 0.0522 0.0012 -0.0258 199 ARG 27 CG 0.0987 0.0142 -0.0182 200 ARG 27 CD 0.0710 0.0073 -0.0211 201 ARG 27 NE 0.0263 0.0231 0.0313 202 ARG 27 CZ -0.0180 0.0170 0.0373 203 ARG 27 NH1 -0.0250 -0.0040 -0.0041 204 ARG 27 NH2 -0.0560 0.0321 0.0851 205 THR 28 N 0.0040 -0.0032 -0.0069 206 THR 28 CA 0.0014 -0.0075 -0.0069 207 THR 28 C -0.0037 -0.0126 -0.0039 208 THR 28 O -0.0060 -0.0116 0.0001 209 THR 28 CB 0.0014 -0.0040 -0.0039 210 THR 28 OG1 0.0003 0.0008 0.0016 211 THR 28 CG2 0.0065 -0.0003 -0.0080 212 SER 29 N 0.0025 -0.0028 -0.0002 213 SER 29 CA -0.0021 -0.0029 -0.0020 214 SER 29 C -0.0054 0.0045 -0.0034 215 SER 29 O -0.0039 0.0096 -0.0028 216 SER 29 CB 0.0015 -0.0049 -0.0006 217 SER 29 OG 0.0053 0.0009 0.0010 218 SER 30 N -0.0123 -0.0031 0.0158 219 SER 30 CA -0.0178 0.0061 0.0154 220 SER 30 C 0.0053 0.0056 0.0010 221 SER 30 O 0.0038 0.0182 -0.0034 222 SER 30 CB -0.0335 -0.0120 0.0329 223 SER 30 OG -0.0225 -0.0400 0.0380 224 THR 31 N 0.0118 0.0089 0.0081 225 THR 31 CA 0.0173 0.0106 0.0070 226 THR 31 C 0.0144 0.0100 0.0056 227 THR 31 O 0.0180 0.0113 0.0035 228 THR 31 CB 0.0224 0.0114 0.0134 229 THR 31 OG1 0.0191 0.0095 0.0199 230 THR 31 CG2 0.0263 0.0125 0.0139 231 SER 32 N 0.0065 0.0109 0.0033 232 SER 32 CA 0.0068 0.0120 0.0021 233 SER 32 C 0.0066 0.0143 -0.0001 234 SER 32 O 0.0050 0.0151 -0.0008 235 SER 32 CB 0.0046 0.0117 0.0027 236 SER 32 OG 0.0045 0.0096 0.0047 237 PHE 33 N 0.0078 0.0179 0.0005 238 PHE 33 CA 0.0076 0.0178 -0.0011 239 PHE 33 C 0.0060 0.0195 -0.0023 240 PHE 33 O 0.0053 0.0201 -0.0032 241 PHE 33 CB 0.0087 0.0160 -0.0029 242 PHE 33 CG 0.0085 0.0158 -0.0048 243 PHE 33 CD1 0.0078 0.0161 -0.0071 244 PHE 33 CD2 0.0090 0.0154 -0.0042 245 PHE 33 CE1 0.0076 0.0160 -0.0088 246 PHE 33 CE2 0.0088 0.0152 -0.0059 247 PHE 33 CZ 0.0081 0.0155 -0.0082 248 THR 34 N 0.0034 0.0220 -0.0034 249 THR 34 CA 0.0026 0.0237 -0.0043 250 THR 34 C 0.0025 0.0261 -0.0061 251 THR 34 O 0.0015 0.0268 -0.0062 252 THR 34 CB -0.0001 0.0236 -0.0032 253 THR 34 OG1 -0.0022 0.0237 -0.0024 254 THR 34 CG2 0.0001 0.0213 -0.0016 255 THR 35 N 0.0009 0.0271 -0.0102 256 THR 35 CA 0.0007 0.0276 -0.0120 257 THR 35 C -0.0004 0.0277 -0.0125 258 THR 35 O -0.0005 0.0274 -0.0116 259 THR 35 CB 0.0024 0.0280 -0.0130 260 THR 35 OG1 0.0021 0.0285 -0.0148 261 THR 35 CG2 0.0034 0.0280 -0.0127 262 SER 36 N 0.0000 0.0273 -0.0161 263 SER 36 CA -0.0015 0.0243 -0.0147 264 SER 36 C -0.0011 0.0251 -0.0153 265 SER 36 O -0.0000 0.0270 -0.0182 266 SER 36 CB -0.0033 0.0206 -0.0168 267 SER 36 OG -0.0031 0.0207 -0.0212 268 PHE 37 N -0.0015 0.0179 -0.0097 269 PHE 37 CA -0.0016 0.0182 -0.0087 270 PHE 37 C -0.0011 0.0172 -0.0078 271 PHE 37 O -0.0008 0.0165 -0.0076 272 PHE 37 CB -0.0021 0.0194 -0.0080 273 PHE 37 CG -0.0021 0.0194 -0.0073 274 PHE 37 CD1 -0.0022 0.0196 -0.0079 275 PHE 37 CD2 -0.0019 0.0192 -0.0060 276 PHE 37 CE1 -0.0022 0.0196 -0.0073 277 PHE 37 CE2 -0.0019 0.0192 -0.0053 278 PHE 37 CZ -0.0020 0.0194 -0.0059 279 SER 38 N 0.0010 0.0082 -0.0030 280 SER 38 CA -0.0013 0.0054 -0.0020 281 SER 38 C -0.0036 0.0048 -0.0006 282 SER 38 O -0.0027 0.0054 -0.0011 283 SER 38 CB 0.0000 0.0017 -0.0033 284 SER 38 OG 0.0023 0.0021 -0.0047 285 THR 39 N -0.0045 -0.0017 0.0022 286 THR 39 CA -0.0059 -0.0023 0.0032 287 THR 39 C -0.0056 -0.0042 0.0038 288 THR 39 O -0.0049 -0.0050 0.0038 289 THR 39 CB -0.0073 -0.0018 0.0038 290 THR 39 OG1 -0.0077 -0.0000 0.0033 291 THR 39 CG2 -0.0088 -0.0024 0.0049 292 GLU 40 N -0.0119 -0.0115 0.0100 293 GLU 40 CA -0.0112 -0.0114 0.0118 294 GLU 40 C -0.0100 -0.0113 0.0120 295 GLU 40 O -0.0102 -0.0113 0.0111 296 GLU 40 CB -0.0126 -0.0114 0.0132 297 GLU 40 CG -0.0137 -0.0115 0.0133 298 GLU 40 CD -0.0150 -0.0117 0.0119 299 GLU 40 OE1 -0.0158 -0.0117 0.0117 300 GLU 40 OE2 -0.0153 -0.0117 0.0109 301 PRO 41 N -0.0122 -0.0179 0.0117 302 PRO 41 CA -0.0109 -0.0178 0.0128 303 PRO 41 C -0.0086 -0.0162 0.0138 304 PRO 41 O -0.0082 -0.0141 0.0130 305 PRO 41 CB -0.0121 -0.0171 0.0113 306 PRO 41 CG -0.0144 -0.0179 0.0099 307 PRO 41 CD -0.0142 -0.0175 0.0098 308 LEU 42 N -0.0028 -0.0130 0.0117 309 LEU 42 CA -0.0042 -0.0125 0.0125 310 LEU 42 C -0.0046 -0.0122 0.0149 311 LEU 42 O -0.0062 -0.0116 0.0157 312 LEU 42 CB -0.0033 -0.0128 0.0121 313 LEU 42 CG -0.0032 -0.0130 0.0097 314 LEU 42 CD1 -0.0022 -0.0134 0.0095 315 LEU 42 CD2 -0.0052 -0.0123 0.0085 316 GLY 43 N -0.0065 -0.0139 0.0179 317 GLY 43 CA -0.0056 -0.0102 0.0140 318 GLY 43 C -0.0050 -0.0066 0.0098 319 GLY 43 O -0.0038 -0.0032 0.0066 320 TYR 44 N -0.0071 -0.0057 0.0072 321 TYR 44 CA -0.0065 -0.0069 0.0081 322 TYR 44 C -0.0010 -0.0107 0.0075 323 TYR 44 O 0.0011 -0.0143 0.0098 324 TYR 44 CB -0.0104 -0.0082 0.0134 325 TYR 44 CG -0.0160 -0.0043 0.0139 326 TYR 44 CD1 -0.0177 0.0003 0.0100 327 TYR 44 CD2 -0.0197 -0.0052 0.0185 328 TYR 44 CE1 -0.0229 0.0037 0.0108 329 TYR 44 CE2 -0.0250 -0.0017 0.0193 330 TYR 44 CZ -0.0266 0.0027 0.0154 331 TYR 44 OH -0.0319 0.0063 0.0161 332 ALA 45 N 0.0044 -0.0121 0.0045 333 ALA 45 CA 0.0066 -0.0065 0.0067 334 ALA 45 C 0.0143 0.0025 0.0071 335 ALA 45 O 0.0208 0.0030 0.0023 336 ALA 45 CB 0.0085 -0.0119 0.0014 337 ARG 46 N 0.0121 0.0308 0.0066 338 ARG 46 CA 0.0108 0.0284 0.0067 339 ARG 46 C 0.0176 0.0335 0.0091 340 ARG 46 O 0.0244 0.0349 0.0128 341 ARG 46 CB 0.0110 0.0186 0.0106 342 ARG 46 CG 0.0040 0.0123 0.0085 343 ARG 46 CD 0.0060 0.0032 0.0132 344 ARG 46 NE -0.0011 -0.0031 0.0111 345 ARG 46 CZ -0.0011 -0.0077 0.0129 346 ARG 46 NH1 0.0017 -0.0039 0.0131 347 ARG 46 NH2 -0.0040 -0.0162 0.0142 348 MET 47 N 0.0535 -0.0078 0.0154 349 MET 47 CA 0.0461 -0.0079 0.0147 350 MET 47 C 0.0453 -0.0207 0.0010 351 MET 47 O 0.0357 -0.0275 -0.0070 352 MET 47 CB 0.0279 -0.0017 0.0201 353 MET 47 CG 0.0286 0.0117 0.0346 354 MET 47 SD 0.0088 0.0202 0.0423 355 MET 47 CE -0.0043 0.0152 0.0359 356 LEU 48 N 0.0188 0.0036 -0.0124 357 LEU 48 CA 0.0188 0.0040 -0.0116 358 LEU 48 C 0.0187 0.0073 -0.0113 359 LEU 48 O 0.0187 0.0091 -0.0099 360 LEU 48 CB 0.0190 0.0024 -0.0086 361 LEU 48 CG 0.0192 -0.0011 -0.0085 362 LEU 48 CD1 0.0194 -0.0024 -0.0054 363 LEU 48 CD2 0.0191 -0.0029 -0.0111 364 HIS 49 N 0.0140 0.0284 -0.0247 365 HIS 49 CA 0.0084 0.0240 -0.0262 366 HIS 49 C 0.0111 0.0171 -0.0332 367 HIS 49 O 0.0138 0.0146 -0.0365 368 HIS 49 CB -0.0011 0.0225 -0.0235 369 HIS 49 CG -0.0072 0.0197 -0.0233 370 HIS 49 ND1 -0.0078 0.0239 -0.0194 371 HIS 49 CD2 -0.0127 0.0133 -0.0265 372 HIS 49 CE1 -0.0138 0.0200 -0.0203 373 HIS 49 NE2 -0.0169 0.0135 -0.0246 374 ARG 50 N 0.0147 0.0080 -0.0280 375 ARG 50 CA 0.0125 0.0070 -0.0449 376 ARG 50 C 0.0068 0.0062 -0.0645 377 ARG 50 O 0.0133 0.0040 -0.0804 378 ARG 50 CB -0.0030 0.0094 -0.0405 379 ARG 50 CG 0.0023 0.0101 -0.0228 380 ARG 50 CD -0.0122 0.0122 -0.0216 381 ARG 50 NE -0.0117 0.0138 -0.0007 382 ARG 50 CZ -0.0259 0.0163 0.0067 383 ARG 50 NH1 -0.0409 0.0175 -0.0046 384 ARG 50 NH2 -0.0252 0.0177 0.0258 385 ASP 51 N -0.0002 -0.0068 -0.0584 386 ASP 51 CA -0.0093 -0.0187 -0.0560 387 ASP 51 C -0.0161 -0.0130 -0.0344 388 ASP 51 O -0.0283 -0.0226 -0.0226 389 ASP 51 CB -0.0200 -0.0390 -0.0618 390 ASP 51 CG -0.0282 -0.0529 -0.0641 391 ASP 51 OD1 -0.0218 -0.0491 -0.0719 392 ASP 51 OD2 -0.0407 -0.0675 -0.0584 393 PRO 52 N -0.0052 -0.0005 -0.0335 394 PRO 52 CA -0.0098 0.0025 -0.0245 395 PRO 52 C -0.0158 -0.0047 -0.0216 396 PRO 52 O -0.0150 -0.0102 -0.0271 397 PRO 52 CB -0.0055 0.0111 -0.0239 398 PRO 52 CG 0.0016 0.0144 -0.0315 399 PRO 52 CD 0.0015 0.0055 -0.0384 400 PRO 53 N -0.0170 -0.0110 -0.0120 401 PRO 53 CA -0.0237 -0.0175 -0.0107 402 PRO 53 C -0.0201 -0.0158 -0.0152 403 PRO 53 O -0.0131 -0.0081 -0.0144 404 PRO 53 CB -0.0285 -0.0166 0.0023 405 PRO 53 CG -0.0217 -0.0069 0.0079 406 PRO 53 CD -0.0163 -0.0053 -0.0009 407 TYR 54 N -0.0097 -0.0113 -0.0208 408 TYR 54 CA -0.0104 -0.0102 -0.0183 409 TYR 54 C -0.0099 -0.0103 -0.0168 410 TYR 54 O -0.0083 -0.0116 -0.0169 411 TYR 54 CB -0.0092 -0.0108 -0.0168 412 TYR 54 CG -0.0102 -0.0102 -0.0175 413 TYR 54 CD1 -0.0117 -0.0087 -0.0161 414 TYR 54 CD2 -0.0096 -0.0111 -0.0195 415 TYR 54 CE1 -0.0126 -0.0081 -0.0167 416 TYR 54 CE2 -0.0105 -0.0106 -0.0201 417 TYR 54 CZ -0.0120 -0.0090 -0.0186 418 TYR 54 OH -0.0128 -0.0085 -0.0191 419 GLU 55 N -0.0031 -0.0131 -0.0223 420 GLU 55 CA 0.0002 -0.0129 -0.0198 421 GLU 55 C 0.0012 -0.0091 -0.0164 422 GLU 55 O -0.0014 -0.0063 -0.0162 423 GLU 55 CB -0.0009 -0.0125 -0.0203 424 GLU 55 CG -0.0015 -0.0165 -0.0235 425 GLU 55 CD -0.0022 -0.0163 -0.0239 426 GLU 55 OE1 -0.0027 -0.0194 -0.0265 427 GLU 55 OE2 -0.0023 -0.0132 -0.0218 428 ARG 56 N 0.0042 -0.0165 -0.0092 429 ARG 56 CA 0.0056 -0.0128 -0.0066 430 ARG 56 C 0.0077 -0.0016 -0.0052 431 ARG 56 O 0.0101 0.0023 0.0008 432 ARG 56 CB 0.0076 -0.0184 0.0028 433 ARG 56 CG 0.0086 -0.0162 0.0051 434 ARG 56 CD 0.0103 -0.0224 0.0137 435 ARG 56 NE 0.0134 -0.0196 0.0226 436 ARG 56 CZ 0.0154 -0.0238 0.0314 437 ARG 56 NH1 0.0147 -0.0313 0.0328 438 ARG 56 NH2 0.0182 -0.0206 0.0390 439 ALA 57 N 0.0044 -0.0022 -0.0036 440 ALA 57 CA 0.0044 0.0013 -0.0033 441 ALA 57 C 0.0093 0.0040 -0.0015 442 ALA 57 O 0.0096 0.0086 -0.0009 443 ALA 57 CB 0.0000 0.0050 -0.0042 444 GLY 58 N 0.0174 0.0009 0.0020 445 GLY 58 CA 0.0221 0.0030 0.0045 446 GLY 58 C 0.0235 0.0047 0.0052 447 GLY 58 O 0.0233 0.0016 0.0051 448 ASN 59 N 0.0324 -0.0002 -0.0068 449 ASN 59 CA 0.0367 0.0158 -0.0096 450 ASN 59 C 0.0300 0.0243 0.0035 451 ASN 59 O 0.0327 0.0362 0.0021 452 ASN 59 CB 0.0440 0.0139 -0.0218 453 ASN 59 CG 0.0516 0.0078 -0.0357 454 ASN 59 OD1 0.0535 0.0102 -0.0381 455 ASN 59 ND2 0.0565 -0.0002 -0.0456 456 SER 60 N 0.0145 0.0113 0.0052 457 SER 60 CA 0.0117 0.0140 0.0059 458 SER 60 C 0.0124 0.0139 0.0060 459 SER 60 O 0.0106 0.0163 0.0069 460 SER 60 CB 0.0072 0.0136 0.0044 461 SER 60 OG 0.0062 0.0103 0.0022 462 GLY 61 N 0.0109 0.0127 0.0019 463 GLY 61 CA 0.0022 0.0094 -0.0005 464 GLY 61 C -0.0042 0.0066 -0.0018 465 GLY 61 O -0.0118 0.0040 -0.0041 466 LEU 62 N 0.0003 0.0047 -0.0040 467 LEU 62 CA -0.0022 0.0035 -0.0014 468 LEU 62 C -0.0023 0.0002 -0.0028 469 LEU 62 O -0.0006 -0.0017 -0.0056 470 LEU 62 CB -0.0048 0.0019 0.0010 471 LEU 62 CG -0.0051 0.0049 0.0027 472 LEU 62 CD1 -0.0076 0.0029 0.0048 473 LEU 62 CD2 -0.0055 0.0086 0.0048 474 ASN 63 N -0.0075 -0.0033 -0.0091 475 ASN 63 CA -0.0082 -0.0053 -0.0114 476 ASN 63 C -0.0113 -0.0049 -0.0123 477 ASN 63 O -0.0130 -0.0035 -0.0116 478 ASN 63 CB -0.0072 -0.0072 -0.0128 479 ASN 63 CG -0.0039 -0.0079 -0.0123 480 ASN 63 OD1 -0.0024 -0.0078 -0.0115 481 ASN 63 ND2 -0.0028 -0.0089 -0.0128 482 HIS 64 N -0.0088 -0.0009 -0.0140 483 HIS 64 CA -0.0108 0.0003 -0.0156 484 HIS 64 C -0.0114 -0.0022 -0.0169 485 HIS 64 O -0.0100 -0.0046 -0.0163 486 HIS 64 CB -0.0105 0.0031 -0.0145 487 HIS 64 CG -0.0090 0.0026 -0.0132 488 HIS 64 ND1 -0.0068 0.0009 -0.0116 489 HIS 64 CD2 -0.0094 0.0034 -0.0134 490 HIS 64 CE1 -0.0059 0.0006 -0.0108 491 HIS 64 NE2 -0.0074 0.0021 -0.0118 492 ARG 65 N -0.0123 -0.0001 -0.0188 493 ARG 65 CA -0.0121 0.0018 -0.0193 494 ARG 65 C -0.0113 0.0057 -0.0213 495 ARG 65 O -0.0107 0.0060 -0.0237 496 ARG 65 CB -0.0115 -0.0007 -0.0216 497 ARG 65 CG -0.0105 -0.0022 -0.0255 498 ARG 65 CD -0.0101 -0.0047 -0.0275 499 ARG 65 NE -0.0091 -0.0060 -0.0313 500 ARG 65 CZ -0.0086 -0.0089 -0.0333 501 ARG 65 NH1 -0.0090 -0.0108 -0.0321 502 ARG 65 NH2 -0.0078 -0.0099 -0.0366 503 ILE 66 N -0.0066 0.0065 -0.0190 504 ILE 66 CA -0.0064 0.0090 -0.0200 505 ILE 66 C -0.0064 0.0090 -0.0210 506 ILE 66 O -0.0065 0.0086 -0.0196 507 ILE 66 CB -0.0065 0.0110 -0.0181 508 ILE 66 CG1 -0.0066 0.0107 -0.0170 509 ILE 66 CG2 -0.0063 0.0136 -0.0194 510 ILE 66 CD1 -0.0067 0.0126 -0.0150 511 TYR 67 N 0.0007 0.0124 -0.0274 512 TYR 67 CA 0.0010 0.0139 -0.0250 513 TYR 67 C 0.0041 0.0141 -0.0248 514 TYR 67 O 0.0059 0.0130 -0.0266 515 TYR 67 CB -0.0014 0.0141 -0.0247 516 TYR 67 CG -0.0011 0.0129 -0.0265 517 TYR 67 CD1 -0.0022 0.0113 -0.0290 518 TYR 67 CD2 -0.0000 0.0135 -0.0256 519 TYR 67 CE1 -0.0021 0.0102 -0.0306 520 TYR 67 CE2 -0.0000 0.0124 -0.0272 521 TYR 67 CZ -0.0010 0.0108 -0.0297 522 TYR 67 OH -0.0010 0.0098 -0.0313 523 GLU 68 N 0.0047 -0.0016 -0.0060 524 GLU 68 CA 0.0056 -0.0027 -0.0039 525 GLU 68 C 0.0059 -0.0009 -0.0020 526 GLU 68 O 0.0055 0.0012 -0.0022 527 GLU 68 CB 0.0059 -0.0037 -0.0038 528 GLU 68 CG 0.0057 -0.0058 -0.0055 529 GLU 68 CD 0.0060 -0.0068 -0.0052 530 GLU 68 OE1 0.0059 -0.0085 -0.0065 531 GLU 68 OE2 0.0063 -0.0059 -0.0037 532 ARG 69 N 0.0076 -0.0009 -0.0080 533 ARG 69 CA 0.0067 0.0016 -0.0037 534 ARG 69 C 0.0064 -0.0019 0.0003 535 ARG 69 O 0.0068 -0.0058 0.0005 536 ARG 69 CB 0.0060 0.0053 -0.0022 537 ARG 69 CG 0.0061 0.0031 -0.0009 538 ARG 69 CD 0.0054 0.0070 0.0004 539 ARG 69 NE 0.0056 0.0047 0.0011 540 ARG 69 CZ 0.0051 0.0070 0.0025 541 ARG 69 NH1 0.0044 0.0116 0.0036 542 ARG 69 NH2 0.0053 0.0048 0.0027 543 SER 70 N 0.0042 -0.0103 0.0105 544 SER 70 CA 0.0039 -0.0134 0.0152 545 SER 70 C 0.0021 -0.0116 0.0149 546 SER 70 O -0.0012 -0.0074 0.0129 547 SER 70 CB 0.0004 -0.0144 0.0209 548 SER 70 OG 0.0008 -0.0180 0.0255 549 ARG 71 N 0.0146 -0.0181 0.0185 550 ARG 71 CA 0.0109 -0.0160 0.0209 551 ARG 71 C 0.0071 -0.0193 0.0206 552 ARG 71 O 0.0073 -0.0228 0.0189 553 ARG 71 CB 0.0109 -0.0134 0.0221 554 ARG 71 CG 0.0071 -0.0110 0.0246 555 ARG 71 CD 0.0072 -0.0090 0.0255 556 ARG 71 NE 0.0034 -0.0068 0.0279 557 ARG 71 CZ 0.0021 -0.0054 0.0291 558 ARG 71 NH1 0.0043 -0.0055 0.0282 559 ARG 71 NH2 -0.0016 -0.0040 0.0311 560 VAL 72 N 0.0151 -0.0381 -0.0094 561 VAL 72 CA 0.0008 -0.0304 -0.0266 562 VAL 72 C 0.0066 -0.0019 -0.0196 563 VAL 72 O 0.0075 0.0228 -0.0185 564 VAL 72 CB -0.0191 -0.0256 -0.0507 565 VAL 72 CG1 -0.0342 -0.0192 -0.0688 566 VAL 72 CG2 -0.0250 -0.0540 -0.0577 567 GLY 73 N 0.0196 -0.0023 0.0096 568 GLY 73 CA 0.0261 0.0016 0.0107 569 GLY 73 C 0.0177 0.0022 0.0150 570 GLY 73 O 0.0226 0.0054 0.0162 571 GLY 74 N 0.0148 -0.0087 0.0186 572 GLY 74 CA 0.0127 -0.0081 0.0209 573 GLY 74 C 0.0085 -0.0105 0.0216 574 GLY 74 O 0.0067 -0.0123 0.0209 575 LEU 75 N 0.0070 -0.0115 0.0132 576 LEU 75 CA 0.0066 -0.0101 0.0118 577 LEU 75 C 0.0069 -0.0098 0.0102 578 LEU 75 O 0.0078 -0.0108 0.0098 579 LEU 75 CB 0.0073 -0.0106 0.0109 580 LEU 75 CG 0.0069 -0.0109 0.0123 581 LEU 75 CD1 0.0078 -0.0115 0.0114 582 LEU 75 CD2 0.0056 -0.0093 0.0129 583 ARG 76 N 0.0066 -0.0085 0.0060 584 ARG 76 CA 0.0069 -0.0073 0.0042 585 ARG 76 C 0.0079 -0.0050 -0.0005 586 ARG 76 O 0.0075 -0.0013 -0.0011 587 ARG 76 CB 0.0055 -0.0039 0.0074 588 ARG 76 CG 0.0057 -0.0033 0.0065 589 ARG 76 CD 0.0043 -0.0004 0.0101 590 ARG 76 NE 0.0046 -0.0001 0.0088 591 ARG 76 CZ 0.0036 0.0018 0.0113 592 ARG 76 NH1 0.0022 0.0040 0.0151 593 ARG 76 NH2 0.0041 0.0014 0.0098 594 THR 77 N 0.0037 -0.0002 -0.0036 595 THR 77 CA 0.0032 0.0002 -0.0052 596 THR 77 C 0.0027 0.0008 -0.0058 597 THR 77 O 0.0031 0.0003 -0.0056 598 THR 77 CB 0.0037 -0.0009 -0.0063 599 THR 77 OG1 0.0042 -0.0015 -0.0057 600 THR 77 CG2 0.0032 -0.0005 -0.0078 601 VAL 78 N 0.0039 0.0060 -0.0113 602 VAL 78 CA 0.0026 0.0061 -0.0127 603 VAL 78 C 0.0005 0.0062 -0.0151 604 VAL 78 O -0.0008 0.0074 -0.0151 605 VAL 78 CB 0.0017 0.0082 -0.0111 606 VAL 78 CG1 0.0006 0.0081 -0.0125 607 VAL 78 CG2 0.0037 0.0083 -0.0085 608 ILE 79 N -0.0051 0.0069 -0.0130 609 ILE 79 CA -0.0052 0.0065 -0.0123 610 ILE 79 C -0.0061 0.0056 -0.0133 611 ILE 79 O -0.0061 0.0061 -0.0147 612 ILE 79 CB -0.0043 0.0076 -0.0121 613 ILE 79 CG1 -0.0034 0.0086 -0.0111 614 ILE 79 CG2 -0.0045 0.0071 -0.0113 615 ILE 79 CD1 -0.0025 0.0097 -0.0107 616 ASP 80 N -0.0105 0.0042 -0.0152 617 ASP 80 CA -0.0096 0.0024 -0.0148 618 ASP 80 C -0.0100 0.0017 -0.0129 619 ASP 80 O -0.0105 0.0020 -0.0122 620 ASP 80 CB -0.0084 0.0013 -0.0159 621 ASP 80 CG -0.0078 0.0018 -0.0179 622 ASP 80 OD1 -0.0080 0.0025 -0.0185 623 ASP 80 OD2 -0.0071 0.0013 -0.0188 624 VAL 81 N -0.0103 -0.0021 -0.0032 625 VAL 81 CA -0.0082 -0.0016 -0.0012 626 VAL 81 C -0.0079 -0.0020 -0.0011 627 VAL 81 O -0.0094 -0.0010 -0.0018 628 VAL 81 CB -0.0081 0.0012 0.0001 629 VAL 81 CG1 -0.0058 0.0017 0.0022 630 VAL 81 CG2 -0.0085 0.0017 0.0000 631 ALA 82 N -0.0121 -0.0061 0.0006 632 ALA 82 CA -0.0106 -0.0052 0.0016 633 ALA 82 C -0.0104 -0.0046 0.0008 634 ALA 82 O -0.0111 -0.0045 -0.0009 635 ALA 82 CB -0.0092 -0.0038 0.0014 636 PRO 83 N -0.0145 -0.0071 0.0026 637 PRO 83 CA -0.0128 -0.0050 0.0007 638 PRO 83 C -0.0100 -0.0007 -0.0040 639 PRO 83 O -0.0077 0.0011 -0.0043 640 PRO 83 CB -0.0093 -0.0052 0.0060 641 PRO 83 CG -0.0104 -0.0084 0.0110 642 PRO 83 CD -0.0118 -0.0082 0.0085 643 PRO 84 N -0.0193 0.0053 -0.0080 644 PRO 84 CA -0.0173 0.0130 -0.0118 645 PRO 84 C -0.0076 0.0108 -0.0110 646 PRO 84 O -0.0045 0.0024 -0.0070 647 PRO 84 CB -0.0280 0.0133 -0.0116 648 PRO 84 CG -0.0323 0.0029 -0.0065 649 PRO 84 CD -0.0287 -0.0007 -0.0048 650 ASP 85 N 0.0113 0.0383 -0.0422 651 ASP 85 CA 0.0375 0.0274 -0.0443 652 ASP 85 C 0.0697 0.0047 -0.0411 653 ASP 85 O 0.0876 -0.0139 -0.0357 654 ASP 85 CB 0.0193 0.0149 -0.0303 655 ASP 85 CG -0.0095 0.0407 -0.0365 656 ASP 85 OD1 -0.0049 0.0687 -0.0555 657 ASP 85 OD2 -0.0366 0.0326 -0.0223 658 GLY 86 N 0.0149 -0.0040 -0.0163 659 GLY 86 CA 0.0153 -0.0028 -0.0103 660 GLY 86 C 0.0156 -0.0008 0.0001 661 GLY 86 O 0.0167 0.0004 0.0059 662 HIS 87 N 0.0167 -0.0144 -0.0120 663 HIS 87 CA 0.0138 -0.0153 0.0124 664 HIS 87 C -0.0003 -0.0039 0.0141 665 HIS 87 O -0.0117 0.0076 -0.0015 666 HIS 87 CB 0.0076 -0.0129 0.0326 667 HIS 87 CG 0.0233 -0.0264 0.0368 668 HIS 87 ND1 0.0203 -0.0265 0.0561 669 HIS 87 CD2 0.0410 -0.0393 0.0245 670 HIS 87 CE1 0.0360 -0.0394 0.0552 671 HIS 87 NE2 0.0489 -0.0475 0.0365 672 GLN 88 N -0.0175 0.0135 0.0132 673 GLN 88 CA -0.0180 0.0108 0.0148 674 GLN 88 C -0.0038 0.0041 0.0034 675 GLN 88 O 0.0059 0.0077 -0.0080 676 GLN 88 CB -0.0255 0.0283 0.0149 677 GLN 88 CG -0.0407 0.0335 0.0281 678 GLN 88 CD -0.0485 0.0512 0.0283 679 GLN 88 OE1 -0.0430 0.0628 0.0178 680 GLN 88 NE2 -0.0619 0.0540 0.0407 681 ALA 89 N -0.0132 -0.0133 0.0106 682 ALA 89 CA -0.0152 -0.0184 0.0071 683 ALA 89 C -0.0195 -0.0265 0.0013 684 ALA 89 O -0.0157 -0.0317 -0.0002 685 ALA 89 CB -0.0062 -0.0211 0.0087 686 ILE 90 N -0.0322 -0.0363 0.0066 687 ILE 90 CA -0.0363 -0.0431 0.0041 688 ILE 90 C -0.0330 -0.0446 0.0014 689 ILE 90 O -0.0347 -0.0506 -0.0018 690 ILE 90 CB -0.0447 -0.0433 0.0082 691 ILE 90 CG1 -0.0460 -0.0374 0.0130 692 ILE 90 CG2 -0.0481 -0.0431 0.0102 693 ILE 90 CD1 -0.0544 -0.0382 0.0167 694 ALA 91 N -0.0249 -0.0410 0.0079 695 ALA 91 CA -0.0158 -0.0367 0.0027 696 ALA 91 C -0.0050 -0.0299 0.0009 697 ALA 91 O -0.0050 -0.0279 0.0055 698 ALA 91 CB -0.0154 -0.0325 0.0116 699 ASN 92 N -0.0016 -0.0242 0.0051 700 ASN 92 CA 0.0069 -0.0169 0.0026 701 ASN 92 C 0.0076 -0.0082 0.0105 702 ASN 92 O 0.0044 -0.0077 0.0148 703 ASN 92 CB 0.0132 -0.0176 -0.0054 704 ASN 92 CG 0.0132 -0.0259 -0.0138 705 ASN 92 OD1 0.0147 -0.0271 -0.0168 706 ASN 92 ND2 0.0117 -0.0318 -0.0180 707 TYR 93 N 0.0076 -0.0002 0.0076 708 TYR 93 CA 0.0095 0.0020 0.0113 709 TYR 93 C 0.0124 0.0049 0.0099 710 TYR 93 O 0.0123 0.0046 0.0077 711 TYR 93 CB 0.0079 0.0007 0.0152 712 TYR 93 CG 0.0050 -0.0022 0.0170 713 TYR 93 CD1 0.0050 -0.0018 0.0208 714 TYR 93 CD2 0.0022 -0.0052 0.0149 715 TYR 93 CE1 0.0023 -0.0044 0.0225 716 TYR 93 CE2 -0.0005 -0.0078 0.0166 717 TYR 93 CZ -0.0005 -0.0074 0.0205 718 TYR 93 OH -0.0032 -0.0101 0.0223 719 GLU 94 N 0.0089 0.0120 0.0081 720 GLU 94 CA 0.0083 0.0127 0.0075 721 GLU 94 C 0.0080 0.0135 0.0066 722 GLU 94 O 0.0076 0.0137 0.0067 723 GLU 94 CB 0.0072 0.0129 0.0084 724 GLU 94 CG 0.0064 0.0136 0.0079 725 GLU 94 CD 0.0070 0.0135 0.0075 726 GLU 94 OE1 0.0066 0.0134 0.0080 727 GLU 94 OE2 0.0080 0.0134 0.0067 728 ILE 95 N 0.0058 0.0130 0.0039 729 ILE 95 CA 0.0058 0.0133 0.0043 730 ILE 95 C 0.0061 0.0141 0.0040 731 ILE 95 O 0.0063 0.0143 0.0032 732 ILE 95 CB 0.0056 0.0127 0.0039 733 ILE 95 CG1 0.0053 0.0118 0.0042 734 ILE 95 CG2 0.0057 0.0130 0.0042 735 ILE 95 CD1 0.0051 0.0112 0.0036 736 GLU 96 N 0.0040 0.0132 0.0054 737 GLU 96 CA 0.0047 0.0098 0.0063 738 GLU 96 C 0.0043 0.0116 0.0058 739 GLU 96 O 0.0024 0.0138 0.0032 740 GLU 96 CB 0.0029 0.0056 0.0039 741 GLU 96 CG 0.0030 0.0035 0.0041 742 GLU 96 CD 0.0015 -0.0008 0.0020 743 GLU 96 OE1 0.0016 -0.0029 0.0023 744 GLU 96 OE2 0.0000 -0.0021 0.0001 745 VAL 97 N 0.0036 0.0109 0.0073 746 VAL 97 CA 0.0031 0.0111 0.0062 747 VAL 97 C 0.0021 0.0094 0.0064 748 VAL 97 O 0.0023 0.0086 0.0078 749 VAL 97 CB 0.0041 0.0121 0.0067 750 VAL 97 CG1 0.0035 0.0122 0.0055 751 VAL 97 CG2 0.0052 0.0137 0.0065 752 ARG 98 N 0.0003 0.0087 0.0072 753 ARG 98 CA 0.0001 0.0068 0.0072 754 ARG 98 C 0.0002 0.0086 0.0071 755 ARG 98 O -0.0003 0.0111 0.0064 756 ARG 98 CB -0.0022 0.0049 0.0054 757 ARG 98 CG -0.0024 0.0029 0.0054 758 ARG 98 CD -0.0046 0.0009 0.0037 759 ARG 98 NE -0.0046 -0.0013 0.0039 760 ARG 98 CZ -0.0060 -0.0016 0.0027 761 ARG 98 NH1 -0.0078 0.0001 0.0010 762 ARG 98 NH2 -0.0058 -0.0036 0.0031 763 ARG 99 N -0.0048 0.0086 0.0082 764 ARG 99 CA -0.0055 0.0077 0.0063 765 ARG 99 C -0.0072 0.0071 0.0060 766 ARG 99 O -0.0083 0.0071 0.0073 767 ARG 99 CB -0.0061 0.0075 0.0062 768 ARG 99 CG -0.0079 0.0073 0.0075 769 ARG 99 CD -0.0083 0.0071 0.0073 770 ARG 99 NE -0.0100 0.0070 0.0087 771 ARG 99 CZ -0.0108 0.0068 0.0088 772 ARG 99 NH1 -0.0100 0.0067 0.0078 773 ARG 99 NH2 -0.0124 0.0066 0.0100 774 ILE 100 N -0.0105 0.0065 0.0070 775 ILE 100 CA -0.0105 0.0050 0.0063 776 ILE 100 C -0.0110 0.0033 0.0061 777 ILE 100 O -0.0106 0.0033 0.0055 778 ILE 100 CB -0.0093 0.0051 0.0047 779 ILE 100 CG1 -0.0087 0.0069 0.0048 780 ILE 100 CG2 -0.0094 0.0035 0.0040 781 ILE 100 CD1 -0.0076 0.0071 0.0033 782 PRO 101 N -0.0127 0.0018 0.0086 783 PRO 101 CA -0.0129 -0.0004 0.0089 784 PRO 101 C -0.0110 -0.0018 0.0088 785 PRO 101 O -0.0093 -0.0013 0.0085 786 PRO 101 CB -0.0136 -0.0003 0.0090 787 PRO 101 CG -0.0145 0.0020 0.0089 788 PRO 101 CD -0.0133 0.0033 0.0086 789 VAL 102 N -0.0096 -0.0003 0.0118 790 VAL 102 CA -0.0093 -0.0009 0.0144 791 VAL 102 C -0.0097 0.0025 0.0160 792 VAL 102 O -0.0095 0.0026 0.0190 793 VAL 102 CB -0.0091 -0.0031 0.0129 794 VAL 102 CG1 -0.0086 -0.0068 0.0121 795 VAL 102 CG2 -0.0095 -0.0015 0.0096 796 ALA 103 N -0.0086 0.0161 0.0294 797 ALA 103 CA -0.0081 0.0216 0.0316 798 ALA 103 C -0.0090 -0.0222 0.0153 799 ALA 103 O -0.0027 -0.0244 0.0161 800 ALA 103 CB 0.0348 0.0447 0.0510 801 THR 104 N -0.0067 -0.0099 0.0115 802 THR 104 CA -0.0060 -0.0113 0.0102 803 THR 104 C -0.0051 -0.0089 0.0064 804 THR 104 O -0.0056 -0.0058 0.0065 805 THR 104 CB -0.0071 -0.0107 0.0132 806 THR 104 OG1 -0.0081 -0.0126 0.0169 807 THR 104 CG2 -0.0064 -0.0128 0.0121 808 PRO 105 N -0.0021 -0.0097 0.0050 809 PRO 105 CA 0.0014 -0.0074 0.0038 810 PRO 105 C 0.0017 -0.0034 0.0041 811 PRO 105 O 0.0038 -0.0007 0.0035 812 PRO 105 CB 0.0045 -0.0102 0.0023 813 PRO 105 CG 0.0028 -0.0144 0.0026 814 PRO 105 CD -0.0013 -0.0139 0.0044 815 ASN 106 N -0.0014 -0.0058 0.0093 816 ASN 106 CA 0.0010 -0.0083 0.0005 817 ASN 106 C 0.0015 -0.0120 -0.0089 818 ASN 106 O 0.0048 -0.0138 -0.0171 819 ASN 106 CB 0.0109 -0.0032 -0.0002 820 ASN 106 CG 0.0106 0.0004 0.0085 821 ASN 106 OD1 0.0034 -0.0018 0.0126 822 ASN 106 ND2 0.0189 0.0063 0.0117 823 ALA 107 N -0.0066 0.0053 0.0082 824 ALA 107 CA -0.0105 0.0086 0.0101 825 ALA 107 C -0.0089 0.0139 0.0097 826 ALA 107 O -0.0061 0.0146 0.0085 827 ALA 107 CB -0.0137 0.0064 0.0115 828 ALA 108 N -0.0167 0.0212 0.0090 829 ALA 108 CA -0.0080 0.0337 0.0170 830 ALA 108 C -0.0089 0.0179 0.0119 831 ALA 108 O 0.0068 0.0173 0.0195 832 ALA 108 CB -0.0228 0.0605 0.0176 833 GLY 109 N -0.0136 0.0105 0.0068 834 GLY 109 CA -0.0125 0.0102 0.0064 835 GLY 109 C -0.0087 0.0040 0.0033 836 GLY 109 O -0.0100 -0.0019 0.0018 837 ASP 110 N -0.0092 0.0080 0.0088 838 ASP 110 CA -0.0089 0.0081 0.0098 839 ASP 110 C -0.0062 0.0072 0.0106 840 ASP 110 O -0.0045 0.0063 0.0094 841 ASP 110 CB -0.0097 0.0079 0.0076 842 ASP 110 CG -0.0124 0.0086 0.0065 843 ASP 110 OD1 -0.0141 0.0096 0.0080 844 ASP 110 OD2 -0.0127 0.0082 0.0040 845 CYS 111 N 0.0001 -0.0018 0.0099 846 CYS 111 CA 0.0036 -0.0020 0.0107 847 CYS 111 C 0.0085 0.0003 0.0106 848 CYS 111 O 0.0107 -0.0010 0.0117 849 CYS 111 CB 0.0043 -0.0070 0.0133 850 CYS 111 SG 0.0079 -0.0073 0.0141 851 PHE 112 N 0.0037 0.0067 0.0137 852 PHE 112 CA 0.0037 0.0066 0.0132 853 PHE 112 C 0.0052 0.0074 0.0143 854 PHE 112 O 0.0047 0.0073 0.0152 855 PHE 112 CB 0.0041 0.0064 0.0109 856 PHE 112 CG 0.0039 0.0062 0.0102 857 PHE 112 CD1 0.0051 0.0064 0.0086 858 PHE 112 CD2 0.0027 0.0058 0.0111 859 PHE 112 CE1 0.0050 0.0062 0.0078 860 PHE 112 CE2 0.0026 0.0057 0.0104 861 PHE 112 CZ 0.0038 0.0059 0.0087 862 HIS 113 N 0.0079 0.0075 0.0120 863 HIS 113 CA 0.0080 0.0074 0.0120 864 HIS 113 C 0.0092 0.0077 0.0128 865 HIS 113 O 0.0100 0.0076 0.0131 866 HIS 113 CB 0.0082 0.0063 0.0112 867 HIS 113 CG 0.0071 0.0059 0.0103 868 HIS 113 ND1 0.0061 0.0064 0.0102 869 HIS 113 CD2 0.0068 0.0052 0.0095 870 HIS 113 CE1 0.0053 0.0059 0.0094 871 HIS 113 NE2 0.0056 0.0052 0.0090 872 THR 114 N 0.0052 0.0032 0.0107 873 THR 114 CA 0.0029 0.0016 0.0098 874 THR 114 C 0.0022 0.0009 0.0094 875 THR 114 O 0.0038 0.0010 0.0090 876 THR 114 CB 0.0033 -0.0002 0.0080 877 THR 114 OG1 0.0056 -0.0010 0.0067 878 THR 114 CG2 0.0036 0.0004 0.0085 879 ALA 115 N 0.0059 0.0131 0.0029 880 ALA 115 CA 0.0048 0.0122 0.0023 881 ALA 115 C 0.0060 0.0127 0.0030 882 ALA 115 O 0.0078 0.0132 0.0041 883 ALA 115 CB 0.0044 0.0095 0.0023 884 ARG 116 N 0.0087 0.0089 -0.0032 885 ARG 116 CA 0.0092 0.0077 -0.0015 886 ARG 116 C 0.0092 0.0042 -0.0015 887 ARG 116 O 0.0085 0.0027 -0.0039 888 ARG 116 CB 0.0088 0.0089 -0.0028 889 ARG 116 CG 0.0091 0.0124 -0.0021 890 ARG 116 CD 0.0101 0.0130 0.0011 891 ARG 116 NE 0.0102 0.0165 0.0015 892 ARG 116 CZ 0.0109 0.0177 0.0036 893 ARG 116 NH1 0.0113 0.0160 0.0050 894 ARG 116 NH2 0.0112 0.0205 0.0048 895 LEU 117 N 0.0112 -0.0034 0.0052 896 LEU 117 CA 0.0071 -0.0072 0.0056 897 LEU 117 C 0.0052 -0.0104 0.0025 898 LEU 117 O 0.0042 -0.0106 0.0041 899 LEU 117 CB 0.0044 -0.0071 0.0113 900 LEU 117 CG 0.0001 -0.0109 0.0122 901 LEU 117 CD1 0.0004 -0.0110 0.0112 902 LEU 117 CD2 -0.0028 -0.0111 0.0177 903 SER 118 N 0.0189 -0.0180 0.0013 904 SER 118 CA 0.0171 -0.0276 -0.0024 905 SER 118 C 0.0098 -0.0324 -0.0014 906 SER 118 O 0.0087 -0.0295 0.0004 907 SER 118 CB 0.0255 -0.0320 -0.0081 908 SER 118 OG 0.0330 -0.0276 -0.0093 909 THR 119 N 0.0112 -0.0429 -0.0092 910 THR 119 CA -0.0018 -0.0479 -0.0107 911 THR 119 C -0.0008 -0.0492 -0.0121 912 THR 119 O 0.0088 -0.0533 -0.0178 913 THR 119 CB -0.0070 -0.0590 -0.0193 914 THR 119 OG1 -0.0083 -0.0585 -0.0186 915 THR 119 CG2 -0.0215 -0.0636 -0.0201 916 GLY 120 N -0.0169 -0.0352 -0.0068 917 GLY 120 CA -0.0192 -0.0275 0.0003 918 GLY 120 C -0.0120 -0.0203 0.0150 919 GLY 120 O -0.0151 -0.0120 0.0223 920 SER 121 N -0.0058 -0.0189 0.0160 921 SER 121 CA -0.0026 -0.0155 0.0219 922 SER 121 C -0.0068 -0.0099 0.0240 923 SER 121 O -0.0112 -0.0093 0.0212 924 SER 121 CB 0.0034 -0.0183 0.0237 925 SER 121 OG 0.0023 -0.0183 0.0229 926 ARG 122 N -0.0193 -0.0077 0.0345 927 ARG 122 CA -0.0199 -0.0114 0.0397 928 ARG 122 C -0.0100 -0.0331 0.0500 929 ARG 122 O -0.0087 -0.0390 0.0548 930 ARG 122 CB -0.0385 -0.0011 0.0546 931 ARG 122 CG -0.0490 0.0213 0.0443 932 ARG 122 CD -0.0666 0.0310 0.0584 933 ARG 122 NE -0.0755 0.0527 0.0466 934 ARG 122 CZ -0.0899 0.0663 0.0518 935 ARG 122 NH1 -0.0973 0.0615 0.0679 936 ARG 122 NH2 -0.0972 0.0852 0.0409 937 GLY 123 N -0.0015 -0.0043 0.0262 938 GLY 123 CA -0.0020 -0.0036 0.0257 939 GLY 123 C -0.0000 -0.0013 0.0261 940 GLY 123 O 0.0020 -0.0002 0.0270 941 PRO 124 N -0.0046 -0.0017 0.0073 942 PRO 124 CA -0.0064 -0.0007 0.0078 943 PRO 124 C -0.0079 0.0002 0.0086 944 PRO 124 O -0.0080 0.0003 0.0079 945 PRO 124 CB -0.0068 -0.0003 0.0057 946 PRO 124 CG -0.0060 -0.0008 0.0039 947 PRO 124 CD -0.0043 -0.0018 0.0050 948 ALA 125 N -0.0007 -0.0038 0.0058 949 ALA 125 CA -0.0018 -0.0040 0.0062 950 ALA 125 C -0.0025 -0.0041 0.0052 951 ALA 125 O -0.0027 -0.0041 0.0045 952 ALA 125 CB -0.0022 -0.0041 0.0069 953 THR 126 N -0.0018 0.0006 -0.0018 954 THR 126 CA -0.0016 0.0015 -0.0018 955 THR 126 C -0.0011 0.0032 -0.0022 956 THR 126 O -0.0009 0.0035 -0.0033 957 THR 126 CB -0.0015 0.0010 -0.0031 958 THR 126 OG1 -0.0019 -0.0006 -0.0029 959 THR 126 CG2 -0.0013 0.0019 -0.0030 960 ILE 127 N 0.0023 0.0027 -0.0014 961 ILE 127 CA 0.0014 0.0046 -0.0018 962 ILE 127 C 0.0007 0.0030 -0.0029 963 ILE 127 O 0.0018 0.0011 -0.0023 964 ILE 127 CB 0.0028 0.0064 -0.0000 965 ILE 127 CG1 0.0034 0.0081 0.0011 966 ILE 127 CG2 0.0017 0.0082 -0.0006 967 ILE 127 CD1 0.0050 0.0098 0.0030 968 SER 128 N 0.0040 0.0015 -0.0002 969 SER 128 CA 0.0038 0.0009 -0.0001 970 SER 128 C 0.0034 -0.0006 0.0008 971 SER 128 O 0.0031 -0.0008 0.0020 972 SER 128 CB 0.0040 0.0021 0.0006 973 SER 128 OG 0.0039 0.0027 0.0021 974 TRP 129 N 0.0039 0.0029 0.0032 975 TRP 129 CA 0.0035 0.0017 0.0037 976 TRP 129 C 0.0034 0.0010 0.0036 977 TRP 129 O 0.0037 0.0014 0.0029 978 TRP 129 CB 0.0037 0.0008 0.0028 979 TRP 129 CG 0.0041 0.0006 0.0015 980 TRP 129 CD1 0.0041 -0.0004 0.0009 981 TRP 129 CD2 0.0046 0.0015 0.0005 982 TRP 129 NE1 0.0046 -0.0002 -0.0004 983 TRP 129 CE2 0.0049 0.0009 -0.0006 984 TRP 129 CE3 0.0048 0.0026 0.0005 985 TRP 129 CZ2 0.0054 0.0014 -0.0018 986 TRP 129 CZ3 0.0053 0.0032 -0.0006 987 TRP 129 CH2 0.0056 0.0026 -0.0017 988 ASP 130 N 0.0040 -0.0101 0.0101 989 ASP 130 CA 0.0041 -0.0092 0.0104 990 ASP 130 C 0.0022 -0.0101 0.0061 991 ASP 130 O 0.0011 -0.0138 0.0041 992 ASP 130 CB 0.0056 -0.0120 0.0144 993 ASP 130 CG 0.0076 -0.0105 0.0187 994 ASP 130 OD1 0.0082 -0.0061 0.0193 995 ASP 130 OD2 0.0086 -0.0136 0.0216 996 ALA 131 N 0.0019 -0.0105 0.0037 997 ALA 131 CA 0.0018 -0.0106 0.0028 998 ALA 131 C -0.0003 -0.0107 0.0022 999 ALA 131 O -0.0012 -0.0109 0.0011 1000 ALA 131 CB 0.0032 -0.0107 0.0011 1001 ASP 132 N -0.0040 -0.0049 0.0040 1002 ASP 132 CA -0.0075 -0.0045 0.0035 1003 ASP 132 C -0.0078 -0.0044 0.0032 1004 ASP 132 O -0.0066 -0.0046 0.0053 1005 ASP 132 CB -0.0096 -0.0042 0.0064 1006 ASP 132 CG -0.0133 -0.0038 0.0058 1007 ASP 132 OD1 -0.0143 -0.0036 0.0033 1008 ASP 132 OD2 -0.0152 -0.0035 0.0079 1009 ALA 133 N -0.0104 -0.0084 0.0063 1010 ALA 133 CA -0.0098 -0.0086 0.0064 1011 ALA 133 C -0.0097 -0.0082 0.0065 1012 ALA 133 O -0.0093 -0.0084 0.0066 1013 ALA 133 CB -0.0098 -0.0093 0.0061 1014 SER 134 N -0.0144 -0.0059 0.0059 1015 SER 134 CA -0.0147 -0.0053 0.0062 1016 SER 134 C -0.0130 -0.0030 0.0073 1017 SER 134 O -0.0128 -0.0022 0.0077 1018 SER 134 CB -0.0178 -0.0049 0.0066 1019 SER 134 OG -0.0190 -0.0027 0.0078 1020 TYR 135 N -0.0100 -0.0010 0.0058 1021 TYR 135 CA -0.0088 0.0008 0.0059 1022 TYR 135 C -0.0070 0.0009 0.0054 1023 TYR 135 O -0.0071 0.0003 0.0053 1024 TYR 135 CB -0.0098 0.0026 0.0067 1025 TYR 135 CG -0.0116 0.0028 0.0072 1026 TYR 135 CD1 -0.0115 0.0039 0.0075 1027 TYR 135 CD2 -0.0133 0.0019 0.0075 1028 TYR 135 CE1 -0.0131 0.0040 0.0080 1029 TYR 135 CE2 -0.0150 0.0020 0.0080 1030 TYR 135 CZ -0.0148 0.0031 0.0083 1031 TYR 135 OH -0.0165 0.0032 0.0088 1032 THR 136 N -0.0060 0.0052 0.0040 1033 THR 136 CA -0.0059 0.0081 0.0016 1034 THR 136 C -0.0064 0.0105 0.0019 1035 THR 136 O -0.0062 0.0093 0.0020 1036 THR 136 CB -0.0048 0.0072 -0.0021 1037 THR 136 OG1 -0.0043 0.0049 -0.0025 1038 THR 136 CG2 -0.0048 0.0103 -0.0045 1039 TYR 137 N -0.0016 0.0090 -0.0009 1040 TYR 137 CA -0.0016 0.0108 0.0002 1041 TYR 137 C -0.0007 0.0123 -0.0016 1042 TYR 137 O -0.0001 0.0128 -0.0032 1043 TYR 137 CB -0.0018 0.0124 0.0018 1044 TYR 137 CG -0.0026 0.0111 0.0036 1045 TYR 137 CD1 -0.0033 0.0107 0.0056 1046 TYR 137 CD2 -0.0027 0.0103 0.0034 1047 TYR 137 CE1 -0.0041 0.0095 0.0073 1048 TYR 137 CE2 -0.0035 0.0091 0.0051 1049 TYR 137 CZ -0.0042 0.0087 0.0070 1050 TYR 137 OH -0.0050 0.0076 0.0087 1051 TYR 138 N -0.0020 0.0186 -0.0008 1052 TYR 138 CA -0.0032 0.0189 -0.0029 1053 TYR 138 C -0.0023 0.0198 -0.0016 1054 TYR 138 O -0.0015 0.0181 0.0002 1055 TYR 138 CB -0.0044 0.0158 -0.0043 1056 TYR 138 CG -0.0054 0.0147 -0.0058 1057 TYR 138 CD1 -0.0069 0.0152 -0.0087 1058 TYR 138 CD2 -0.0047 0.0132 -0.0043 1059 TYR 138 CE1 -0.0079 0.0142 -0.0101 1060 TYR 138 CE2 -0.0057 0.0124 -0.0057 1061 TYR 138 CZ -0.0072 0.0128 -0.0086 1062 TYR 138 OH -0.0082 0.0118 -0.0100 1063 LEU 139 N -0.0011 0.0233 -0.0062 1064 LEU 139 CA -0.0004 0.0228 -0.0059 1065 LEU 139 C -0.0002 0.0225 -0.0047 1066 LEU 139 O -0.0001 0.0225 -0.0044 1067 LEU 139 CB 0.0004 0.0221 -0.0066 1068 LEU 139 CG 0.0012 0.0214 -0.0063 1069 LEU 139 CD1 0.0012 0.0215 -0.0065 1070 LEU 139 CD2 0.0019 0.0209 -0.0070 1071 THR 140 N 0.0029 0.0189 -0.0024 1072 THR 140 CA 0.0014 0.0177 -0.0033 1073 THR 140 C 0.0036 0.0185 -0.0016 1074 THR 140 O 0.0058 0.0174 0.0008 1075 THR 140 CB 0.0001 0.0136 -0.0031 1076 THR 140 OG1 -0.0020 0.0127 -0.0047 1077 THR 140 CG2 -0.0015 0.0125 -0.0042 1078 ILE 141 N 0.0028 0.0175 0.0003 1079 ILE 141 CA 0.0033 0.0162 0.0002 1080 ILE 141 C 0.0037 0.0161 0.0020 1081 ILE 141 O 0.0039 0.0159 0.0033 1082 ILE 141 CB 0.0040 0.0145 -0.0004 1083 ILE 141 CG1 0.0037 0.0145 -0.0022 1084 ILE 141 CG2 0.0046 0.0131 -0.0006 1085 ILE 141 CD1 0.0043 0.0129 -0.0027 1086 SER 142 N 0.0085 0.0111 0.0086 1087 SER 142 CA 0.0083 0.0108 0.0092 1088 SER 142 C 0.0102 0.0116 0.0124 1089 SER 142 O 0.0106 0.0112 0.0148 1090 SER 142 CB 0.0054 0.0083 0.0098 1091 SER 142 OG 0.0051 0.0081 0.0096 1092 GLU 143 N 0.0158 0.0071 0.0241 1093 GLU 143 CA 0.0167 0.0061 0.0253 1094 GLU 143 C 0.0143 0.0112 0.0271 1095 GLU 143 O 0.0129 0.0150 0.0296 1096 GLU 143 CB 0.0200 0.0024 0.0300 1097 GLU 143 CG 0.0216 -0.0002 0.0308 1098 GLU 143 CD 0.0250 -0.0042 0.0350 1099 GLU 143 OE1 0.0264 -0.0061 0.0366 1100 GLU 143 OE2 0.0262 -0.0057 0.0366 1101 ASP 144 N 0.0161 0.0119 0.0276 1102 ASP 144 CA 0.0154 0.0194 0.0265 1103 ASP 144 C 0.0167 0.0211 0.0348 1104 ASP 144 O 0.0183 0.0159 0.0415 1105 ASP 144 CB 0.0140 0.0175 0.0180 1106 ASP 144 CG 0.0123 0.0199 0.0090 1107 ASP 144 OD1 0.0116 0.0272 0.0081 1108 ASP 144 OD2 0.0115 0.0148 0.0023 1109 ASP 144 OXT 0.0161 0.0279 0.0343