1 GLY 1 N 0.0031 0.0191 -0.0749 2 GLY 1 CA 0.0112 0.0302 -0.0592 3 GLY 1 C 0.0143 0.0167 -0.0408 4 GLY 1 O 0.0120 0.0011 -0.0365 5 ARG 2 N 0.0166 0.0262 -0.0183 6 ARG 2 CA 0.0182 0.0203 -0.0045 7 ARG 2 C 0.0209 0.0319 0.0072 8 ARG 2 O 0.0216 0.0449 0.0054 9 ARG 2 CB 0.0178 0.0171 -0.0058 10 ARG 2 CG 0.0190 0.0077 0.0071 11 ARG 2 CD 0.0187 0.0047 0.0065 12 ARG 2 NE 0.0160 -0.0065 -0.0054 13 ARG 2 CZ 0.0152 -0.0160 -0.0057 14 ARG 2 NH1 0.0168 -0.0164 0.0046 15 ARG 2 NH2 0.0128 -0.0253 -0.0171 16 ILE 3 N 0.0207 0.0176 0.0102 17 ILE 3 CA 0.0166 0.0113 0.0021 18 ILE 3 C 0.0169 0.0384 0.0344 19 ILE 3 O -0.0019 0.0606 0.0578 20 ILE 3 CB -0.0241 -0.0033 -0.0211 21 ILE 3 CG1 -0.0184 -0.0333 -0.0558 22 ILE 3 CG2 -0.0336 -0.0047 -0.0242 23 ILE 3 CD1 -0.0597 -0.0483 -0.0797 24 ALA 4 N 0.0057 0.0381 0.0184 25 ALA 4 CA 0.0045 0.0401 0.0176 26 ALA 4 C 0.0017 0.0451 0.0157 27 ALA 4 O -0.0015 0.0452 0.0130 28 ALA 4 CB 0.0026 0.0359 0.0155 29 SER 5 N 0.0039 0.0314 0.0168 30 SER 5 CA 0.0055 0.0354 0.0142 31 SER 5 C 0.0044 0.0343 0.0100 32 SER 5 O 0.0053 0.0371 0.0068 33 SER 5 CB 0.0074 0.0382 0.0176 34 SER 5 OG 0.0065 0.0358 0.0199 35 ILE 6 N -0.0032 0.0369 0.0044 36 ILE 6 CA -0.0032 0.0322 0.0014 37 ILE 6 C -0.0019 0.0298 -0.0021 38 ILE 6 O -0.0032 0.0291 -0.0007 39 ILE 6 CB -0.0068 0.0284 0.0042 40 ILE 6 CG1 -0.0079 0.0308 0.0073 41 ILE 6 CG2 -0.0070 0.0232 0.0010 42 ILE 6 CD1 -0.0118 0.0283 0.0114 43 PRO 7 N -0.0026 0.0334 -0.0097 44 PRO 7 CA -0.0006 0.0293 -0.0145 45 PRO 7 C -0.0036 0.0227 -0.0126 46 PRO 7 O -0.0058 0.0181 -0.0110 47 PRO 7 CB 0.0022 0.0277 -0.0199 48 PRO 7 CG 0.0034 0.0340 -0.0191 49 PRO 7 CD -0.0004 0.0359 -0.0121 50 GLY 8 N -0.0080 0.0200 -0.0139 51 GLY 8 CA -0.0089 0.0126 -0.0117 52 GLY 8 C -0.0092 0.0115 -0.0048 53 GLY 8 O -0.0099 0.0057 -0.0032 54 GLU 9 N -0.0120 0.0205 0.0000 55 GLU 9 CA -0.0083 0.0177 0.0044 56 GLU 9 C -0.0092 0.0119 0.0041 57 GLU 9 O -0.0078 0.0071 0.0062 58 GLU 9 CB -0.0057 0.0224 0.0068 59 GLU 9 CG -0.0014 0.0207 0.0117 60 GLU 9 CD 0.0010 0.0258 0.0137 61 GLU 9 OE1 -0.0008 0.0306 0.0112 62 GLU 9 OE2 0.0045 0.0250 0.0177 63 ALA 10 N -0.0092 0.0143 -0.0028 64 ALA 10 CA -0.0104 0.0083 -0.0055 65 ALA 10 C -0.0126 -0.0004 -0.0104 66 ALA 10 O -0.0123 -0.0081 -0.0089 67 ALA 10 CB -0.0123 0.0142 -0.0111 68 GLU 11 N -0.0170 -0.0040 -0.0194 69 GLU 11 CA -0.0180 -0.0099 -0.0239 70 GLU 11 C -0.0149 -0.0165 -0.0196 71 GLU 11 O -0.0148 -0.0234 -0.0221 72 GLU 11 CB -0.0203 -0.0055 -0.0273 73 GLU 11 CG -0.0221 -0.0104 -0.0331 74 GLU 11 CD -0.0238 -0.0060 -0.0351 75 GLU 11 OE1 -0.0238 0.0009 -0.0324 76 GLU 11 OE2 -0.0250 -0.0097 -0.0392 77 TYR 12 N -0.0126 -0.0152 -0.0104 78 TYR 12 CA -0.0091 -0.0191 -0.0069 79 TYR 12 C -0.0078 -0.0201 -0.0043 80 TYR 12 O -0.0052 -0.0225 -0.0004 81 TYR 12 CB -0.0086 -0.0180 -0.0022 82 TYR 12 CG -0.0090 -0.0184 -0.0047 83 TYR 12 CD1 -0.0064 -0.0230 -0.0063 84 TYR 12 CD2 -0.0121 -0.0142 -0.0055 85 TYR 12 CE1 -0.0068 -0.0233 -0.0091 86 TYR 12 CE2 -0.0125 -0.0145 -0.0083 87 TYR 12 CZ -0.0099 -0.0191 -0.0102 88 TYR 12 OH -0.0106 -0.0194 -0.0133 89 LEU 13 N -0.0090 -0.0125 -0.0072 90 LEU 13 CA -0.0080 -0.0139 0.0002 91 LEU 13 C -0.0067 -0.0246 0.0001 92 LEU 13 O -0.0070 -0.0288 -0.0076 93 LEU 13 CB -0.0091 -0.0065 -0.0015 94 LEU 13 CG -0.0083 -0.0059 0.0069 95 LEU 13 CD1 -0.0077 -0.0022 0.0167 96 LEU 13 CD2 -0.0094 0.0010 0.0040 97 GLY 14 N -0.0075 -0.0203 0.0013 98 GLY 14 CA -0.0043 -0.0272 0.0009 99 GLY 14 C -0.0005 -0.0348 0.0003 100 GLY 14 O 0.0025 -0.0410 -0.0004 101 ARG 15 N 0.0060 -0.0481 -0.0111 102 ARG 15 CA 0.0084 -0.0475 -0.0078 103 ARG 15 C 0.0080 -0.0432 -0.0005 104 ARG 15 O 0.0065 -0.0407 0.0026 105 ARG 15 CB 0.0039 -0.0470 -0.0110 106 ARG 15 CG 0.0044 -0.0513 -0.0181 107 ARG 15 CD 0.0015 -0.0511 -0.0203 108 ARG 15 NE -0.0060 -0.0475 -0.0206 109 ARG 15 CZ -0.0097 -0.0451 -0.0196 110 ARG 15 NH1 -0.0070 -0.0455 -0.0179 111 ARG 15 NH2 -0.0165 -0.0420 -0.0202 112 GLY 16 N 0.0032 -0.0205 0.0076 113 GLY 16 CA 0.0040 -0.0159 0.0127 114 GLY 16 C 0.0028 -0.0114 0.0148 115 GLY 16 O 0.0049 -0.0090 0.0200 116 VAL 17 N -0.0004 -0.0081 0.0145 117 VAL 17 CA -0.0017 -0.0034 0.0163 118 VAL 17 C -0.0018 -0.0035 0.0184 119 VAL 17 O -0.0012 -0.0052 0.0161 120 VAL 17 CB -0.0026 0.0004 0.0124 121 VAL 17 CG1 -0.0040 0.0053 0.0144 122 VAL 17 CG2 -0.0026 0.0007 0.0108 123 SER 18 N 0.0011 0.0043 0.0179 124 SER 18 CA -0.0003 0.0056 0.0180 125 SER 18 C -0.0029 0.0069 0.0190 126 SER 18 O -0.0037 0.0064 0.0201 127 SER 18 CB -0.0003 0.0039 0.0192 128 SER 18 OG -0.0017 0.0053 0.0194 129 TYR 19 N -0.0080 0.0187 0.0184 130 TYR 19 CA -0.0049 0.0182 0.0183 131 TYR 19 C -0.0069 0.0186 0.0188 132 TYR 19 O -0.0049 0.0183 0.0199 133 TYR 19 CB -0.0016 0.0180 0.0218 134 TYR 19 CG 0.0003 0.0177 0.0217 135 TYR 19 CD1 0.0032 0.0169 0.0188 136 TYR 19 CD2 -0.0007 0.0181 0.0248 137 TYR 19 CE1 0.0051 0.0166 0.0188 138 TYR 19 CE2 0.0012 0.0178 0.0249 139 TYR 19 CZ 0.0040 0.0171 0.0219 140 TYR 19 OH 0.0057 0.0168 0.0219 141 CYS 20 N -0.0041 0.0227 0.0122 142 CYS 20 CA -0.0090 0.0245 0.0121 143 CYS 20 C -0.0096 0.0205 0.0130 144 CYS 20 O -0.0067 0.0211 0.0127 145 CYS 20 CB -0.0083 0.0308 0.0108 146 CYS 20 SG -0.0150 0.0336 0.0105 147 ALA 21 N -0.0072 0.0181 0.0110 148 ALA 21 CA -0.0077 0.0147 0.0122 149 ALA 21 C -0.0088 0.0135 0.0139 150 ALA 21 O -0.0087 0.0105 0.0139 151 ALA 21 CB -0.0090 0.0144 0.0140 152 THR 22 N -0.0106 0.0203 0.0175 153 THR 22 CA -0.0138 0.0183 0.0216 154 THR 22 C -0.0095 0.0169 0.0166 155 THR 22 O -0.0109 0.0118 0.0190 156 THR 22 CB -0.0192 0.0260 0.0271 157 THR 22 OG1 -0.0172 0.0354 0.0234 158 THR 22 CG2 -0.0243 0.0258 0.0333 159 CYS 23 N -0.0142 0.0212 0.0204 160 CYS 23 CA -0.0070 0.0214 0.0150 161 CYS 23 C -0.0005 0.0093 0.0111 162 CYS 23 O 0.0003 0.0031 0.0111 163 CYS 23 CB -0.0006 0.0328 0.0092 164 CYS 23 SG 0.0049 0.0377 0.0047 165 ASP 24 N -0.0003 0.0061 0.0040 166 ASP 24 CA 0.0028 0.0038 0.0043 167 ASP 24 C 0.0029 0.0008 0.0075 168 ASP 24 O 0.0054 -0.0013 0.0080 169 ASP 24 CB 0.0032 0.0045 0.0033 170 ASP 24 CG 0.0035 0.0073 0.0000 171 ASP 24 OD1 0.0037 0.0087 -0.0017 172 ASP 24 OD2 0.0036 0.0080 -0.0009 173 GLY 25 N 0.0029 0.0013 0.0115 174 GLY 25 CA 0.0039 0.0023 0.0150 175 GLY 25 C 0.0061 -0.0016 0.0157 176 GLY 25 O 0.0063 -0.0011 0.0166 177 ALA 26 N 0.0131 -0.0096 0.0148 178 ALA 26 CA 0.0231 -0.0191 0.0179 179 ALA 26 C 0.0159 -0.0207 0.0101 180 ALA 26 O 0.0222 -0.0220 0.0150 181 ALA 26 CB 0.0319 -0.0363 0.0146 182 PHE 27 N 0.0295 -0.0243 0.0278 183 PHE 27 CA 0.0136 -0.0286 0.0082 184 PHE 27 C 0.0044 0.0001 0.0132 185 PHE 27 O -0.0046 -0.0016 0.0024 186 PHE 27 CB -0.0077 -0.0361 -0.0189 187 PHE 27 CG 0.0012 -0.0642 -0.0240 188 PHE 27 CD1 0.0051 -0.0596 -0.0173 189 PHE 27 CD2 0.0051 -0.0952 -0.0360 190 PHE 27 CE1 0.0130 -0.0848 -0.0219 191 PHE 27 CE2 0.0129 -0.1207 -0.0408 192 PHE 27 CZ 0.0169 -0.1155 -0.0337 193 TYR 28 N 0.0086 -0.0011 0.0079 194 TYR 28 CA 0.0075 0.0006 0.0106 195 TYR 28 C 0.0102 0.0027 0.0113 196 TYR 28 O 0.0097 0.0040 0.0131 197 TYR 28 CB 0.0048 -0.0006 0.0108 198 TYR 28 CG 0.0020 -0.0024 0.0105 199 TYR 28 CD1 0.0000 -0.0016 0.0126 200 TYR 28 CD2 0.0014 -0.0049 0.0080 201 TYR 28 CE1 -0.0024 -0.0033 0.0122 202 TYR 28 CE2 -0.0010 -0.0066 0.0075 203 TYR 28 CZ -0.0029 -0.0058 0.0097 204 TYR 28 OH -0.0052 -0.0075 0.0092 205 ARG 29 N 0.0128 0.0033 0.0092 206 ARG 29 CA 0.0208 0.0075 0.0140 207 ARG 29 C 0.0183 0.0141 0.0180 208 ARG 29 O 0.0153 0.0125 0.0161 209 ARG 29 CB 0.0296 0.0016 0.0121 210 ARG 29 CG 0.0388 0.0057 0.0172 211 ARG 29 CD 0.0476 0.0003 0.0157 212 ARG 29 NE 0.0489 -0.0075 0.0107 213 ARG 29 CZ 0.0528 -0.0084 0.0110 214 ARG 29 NH1 0.0563 -0.0024 0.0160 215 ARG 29 NH2 0.0532 -0.0156 0.0061 216 ASN 30 N 0.0218 0.0145 0.0134 217 ASN 30 CA 0.0191 0.0219 0.0178 218 ASN 30 C 0.0093 0.0226 0.0183 219 ASN 30 O 0.0064 0.0263 0.0205 220 ASN 30 CB 0.0246 0.0244 0.0192 221 ASN 30 CG 0.0339 0.0263 0.0202 222 ASN 30 OD1 0.0402 0.0222 0.0177 223 ASN 30 ND2 0.0348 0.0328 0.0239 224 ARG 31 N 0.0077 0.0134 0.0137 225 ARG 31 CA 0.0035 0.0117 0.0173 226 ARG 31 C 0.0036 0.0092 0.0168 227 ARG 31 O 0.0069 0.0076 0.0135 228 ARG 31 CB 0.0013 0.0072 0.0186 229 ARG 31 CG 0.0007 0.0095 0.0195 230 ARG 31 CD -0.0021 0.0055 0.0215 231 ARG 31 NE -0.0019 0.0078 0.0217 232 ARG 31 CZ -0.0040 0.0120 0.0243 233 ARG 31 NH1 -0.0067 0.0144 0.0272 234 ARG 31 NH2 -0.0034 0.0139 0.0241 235 GLU 32 N 0.0056 0.0062 0.0153 236 GLU 32 CA 0.0059 0.0032 0.0148 237 GLU 32 C 0.0061 0.0009 0.0157 238 GLU 32 O 0.0060 0.0011 0.0181 239 GLU 32 CB 0.0059 0.0027 0.0166 240 GLU 32 CG 0.0057 0.0048 0.0159 241 GLU 32 CD 0.0059 0.0036 0.0137 242 GLU 32 OE1 0.0059 0.0050 0.0113 243 GLU 32 OE2 0.0061 0.0012 0.0143 244 VAL 33 N 0.0025 0.0018 0.0145 245 VAL 33 CA 0.0029 0.0017 0.0149 246 VAL 33 C 0.0032 0.0003 0.0147 247 VAL 33 O 0.0029 -0.0005 0.0140 248 VAL 33 CB 0.0022 0.0025 0.0146 249 VAL 33 CG1 0.0019 0.0039 0.0148 250 VAL 33 CG2 0.0015 0.0020 0.0134 251 VAL 34 N 0.0020 -0.0002 0.0124 252 VAL 34 CA 0.0016 0.0003 0.0125 253 VAL 34 C 0.0006 0.0021 0.0127 254 VAL 34 O 0.0010 0.0033 0.0123 255 VAL 34 CB 0.0031 0.0005 0.0117 256 VAL 34 CG1 0.0027 0.0011 0.0118 257 VAL 34 CG2 0.0041 -0.0013 0.0115 258 VAL 35 N 0.0014 0.0058 0.0101 259 VAL 35 CA 0.0008 0.0066 0.0100 260 VAL 35 C 0.0013 0.0059 0.0100 261 VAL 35 O 0.0012 0.0046 0.0100 262 VAL 35 CB -0.0008 0.0066 0.0096 263 VAL 35 CG1 -0.0014 0.0073 0.0095 264 VAL 35 CG2 -0.0012 0.0074 0.0095 265 VAL 36 N 0.0022 0.0079 0.0098 266 VAL 36 CA 0.0013 0.0078 0.0100 267 VAL 36 C 0.0014 0.0072 0.0095 268 VAL 36 O 0.0015 0.0065 0.0089 269 VAL 36 CB 0.0004 0.0074 0.0100 270 VAL 36 CG1 -0.0005 0.0076 0.0104 271 VAL 36 CG2 0.0005 0.0078 0.0103 272 GLY 37 N 0.0004 0.0045 0.0069 273 GLY 37 CA -0.0002 0.0045 0.0065 274 GLY 37 C -0.0018 0.0036 0.0053 275 GLY 37 O -0.0028 0.0037 0.0047 276 LEU 38 N -0.0162 0.0083 0.0075 277 LEU 38 CA -0.0140 0.0087 0.0063 278 LEU 38 C -0.0130 0.0062 0.0054 279 LEU 38 O -0.0136 0.0047 0.0056 280 LEU 38 CB -0.0143 0.0099 0.0066 281 LEU 38 CG -0.0122 0.0105 0.0055 282 LEU 38 CD1 -0.0105 0.0121 0.0047 283 LEU 38 CD2 -0.0128 0.0117 0.0060 284 ASN 39 N -0.0150 0.0009 0.0038 285 ASN 39 CA -0.0168 -0.0008 -0.0035 286 ASN 39 C -0.0101 0.0009 -0.0067 287 ASN 39 O -0.0046 0.0032 -0.0033 288 ASN 39 CB -0.0194 -0.0024 -0.0084 289 ASN 39 CG -0.0146 -0.0008 -0.0081 290 ASN 39 OD1 -0.0083 0.0009 -0.0103 291 ASN 39 ND2 -0.0176 -0.0014 -0.0052 292 PRO 40 N -0.0078 -0.0045 -0.0091 293 PRO 40 CA -0.0028 -0.0021 -0.0124 294 PRO 40 C -0.0038 -0.0003 -0.0111 295 PRO 40 O -0.0011 0.0049 -0.0118 296 PRO 40 CB 0.0005 -0.0079 -0.0167 297 PRO 40 CG -0.0012 -0.0111 -0.0163 298 PRO 40 CD -0.0073 -0.0107 -0.0112 299 GLU 41 N -0.0122 0.0013 -0.0106 300 GLU 41 CA -0.0070 0.0031 -0.0121 301 GLU 41 C -0.0033 0.0059 -0.0053 302 GLU 41 O 0.0031 0.0084 -0.0053 303 GLU 41 CB -0.0106 0.0010 -0.0153 304 GLU 41 CG -0.0056 0.0023 -0.0186 305 GLU 41 CD -0.0096 0.0003 -0.0210 306 GLU 41 OE1 -0.0161 -0.0020 -0.0192 307 GLU 41 OE2 -0.0062 0.0009 -0.0246 308 ALA 42 N -0.0044 0.0069 0.0002 309 ALA 42 CA -0.0036 0.0078 0.0022 310 ALA 42 C -0.0026 0.0087 0.0024 311 ALA 42 O -0.0012 0.0099 0.0031 312 ALA 42 CB -0.0051 0.0068 0.0041 313 VAL 43 N -0.0021 0.0074 -0.0002 314 VAL 43 CA 0.0002 0.0099 -0.0016 315 VAL 43 C 0.0014 0.0099 -0.0022 316 VAL 43 O 0.0014 0.0125 -0.0024 317 VAL 43 CB 0.0028 0.0094 -0.0030 318 VAL 43 CG1 0.0055 0.0116 -0.0046 319 VAL 43 CG2 0.0018 0.0101 -0.0025 320 GLU 44 N -0.0005 0.0080 -0.0015 321 GLU 44 CA -0.0000 0.0098 -0.0029 322 GLU 44 C -0.0022 0.0128 0.0000 323 GLU 44 O -0.0022 0.0166 -0.0011 324 GLU 44 CB 0.0013 0.0060 -0.0041 325 GLU 44 CG 0.0038 0.0039 -0.0079 326 GLU 44 CD 0.0051 -0.0004 -0.0090 327 GLU 44 OE1 0.0053 -0.0004 -0.0094 328 GLU 44 OE2 0.0060 -0.0038 -0.0095 329 GLU 45 N -0.0060 0.0125 0.0035 330 GLU 45 CA -0.0055 0.0138 0.0048 331 GLU 45 C -0.0054 0.0139 0.0051 332 GLU 45 O -0.0054 0.0153 0.0053 333 GLU 45 CB -0.0046 0.0135 0.0064 334 GLU 45 CG -0.0047 0.0139 0.0064 335 GLU 45 CD -0.0049 0.0160 0.0065 336 GLU 45 OE1 -0.0043 0.0167 0.0078 337 GLU 45 OE2 -0.0056 0.0169 0.0052 338 ALA 46 N -0.0029 0.0131 0.0065 339 ALA 46 CA -0.0030 0.0122 0.0061 340 ALA 46 C -0.0046 0.0127 0.0051 341 ALA 46 O -0.0048 0.0130 0.0051 342 ALA 46 CB -0.0025 0.0101 0.0059 343 GLN 47 N -0.0046 0.0122 0.0049 344 GLN 47 CA -0.0068 0.0129 0.0037 345 GLN 47 C -0.0113 0.0127 0.0074 346 GLN 47 O -0.0145 0.0136 0.0063 347 GLN 47 CB -0.0025 0.0121 0.0038 348 GLN 47 CG 0.0023 0.0123 -0.0000 349 GLN 47 CD 0.0050 0.0121 -0.0012 350 GLN 47 OE1 0.0029 0.0133 -0.0043 351 GLN 47 NE2 0.0094 0.0106 0.0013 352 VAL 48 N -0.0118 0.0144 0.0105 353 VAL 48 CA -0.0115 0.0151 0.0105 354 VAL 48 C -0.0104 0.0141 0.0104 355 VAL 48 O -0.0107 0.0139 0.0104 356 VAL 48 CB -0.0108 0.0167 0.0104 357 VAL 48 CG1 -0.0103 0.0174 0.0104 358 VAL 48 CG2 -0.0121 0.0177 0.0106 359 LEU 49 N -0.0043 0.0111 0.0109 360 LEU 49 CA -0.0038 0.0112 0.0115 361 LEU 49 C -0.0039 0.0110 0.0116 362 LEU 49 O -0.0035 0.0113 0.0119 363 LEU 49 CB -0.0036 0.0107 0.0121 364 LEU 49 CG -0.0034 0.0110 0.0121 365 LEU 49 CD1 -0.0033 0.0104 0.0126 366 LEU 49 CD2 -0.0029 0.0117 0.0123 367 THR 50 N -0.0087 0.0140 0.0092 368 THR 50 CA -0.0104 0.0117 0.0079 369 THR 50 C -0.0131 0.0126 0.0079 370 THR 50 O -0.0145 0.0110 0.0068 371 THR 50 CB -0.0117 0.0100 0.0068 372 THR 50 OG1 -0.0135 0.0116 0.0073 373 THR 50 CG2 -0.0091 0.0084 0.0065 374 LYS 51 N -0.0123 0.0062 0.0171 375 LYS 51 CA -0.0094 0.0047 0.0168 376 LYS 51 C -0.0022 0.0029 0.0141 377 LYS 51 O 0.0012 0.0012 0.0138 378 LYS 51 CB -0.0121 0.0092 0.0132 379 LYS 51 CG -0.0194 0.0113 0.0156 380 LYS 51 CD -0.0223 0.0164 0.0115 381 LYS 51 CE -0.0294 0.0182 0.0141 382 LYS 51 NZ -0.0333 0.0224 0.0117 383 PHE 52 N 0.0085 0.0079 0.0159 384 PHE 52 CA 0.0096 0.0064 0.0139 385 PHE 52 C 0.0090 0.0071 0.0145 386 PHE 52 O 0.0107 0.0058 0.0149 387 PHE 52 CB 0.0087 0.0062 0.0103 388 PHE 52 CG 0.0091 0.0056 0.0095 389 PHE 52 CD1 0.0116 0.0036 0.0096 390 PHE 52 CD2 0.0071 0.0071 0.0086 391 PHE 52 CE1 0.0120 0.0030 0.0088 392 PHE 52 CE2 0.0075 0.0065 0.0078 393 PHE 52 CZ 0.0099 0.0045 0.0079 394 ALA 53 N 0.0043 0.0089 0.0122 395 ALA 53 CA 0.0040 0.0091 0.0126 396 ALA 53 C 0.0039 0.0100 0.0116 397 ALA 53 O 0.0044 0.0101 0.0104 398 ALA 53 CB 0.0046 0.0079 0.0129 399 SER 54 N 0.0082 0.0142 0.0097 400 SER 54 CA 0.0084 0.0150 0.0107 401 SER 54 C 0.0074 0.0095 0.0103 402 SER 54 O 0.0073 0.0092 0.0075 403 SER 54 CB 0.0090 0.0174 0.0169 404 SER 54 OG 0.0101 0.0232 0.0174 405 THR 55 N 0.0029 0.0084 0.0074 406 THR 55 CA 0.0037 0.0052 0.0068 407 THR 55 C 0.0046 0.0044 0.0080 408 THR 55 O 0.0053 0.0056 0.0105 409 THR 55 CB 0.0049 0.0034 0.0080 410 THR 55 OG1 0.0042 0.0040 0.0070 411 THR 55 CG2 0.0058 0.0001 0.0073 412 VAL 56 N 0.0001 0.0023 0.0059 413 VAL 56 CA 0.0016 0.0029 0.0070 414 VAL 56 C 0.0035 0.0000 0.0066 415 VAL 56 O 0.0025 -0.0020 0.0051 416 VAL 56 CB -0.0005 0.0041 0.0064 417 VAL 56 CG1 0.0012 0.0046 0.0075 418 VAL 56 CG2 -0.0025 0.0070 0.0068 419 HIS 57 N 0.0023 -0.0020 0.0053 420 HIS 57 CA 0.0031 -0.0042 0.0057 421 HIS 57 C 0.0027 -0.0038 0.0055 422 HIS 57 O 0.0036 -0.0021 0.0059 423 HIS 57 CB 0.0056 -0.0045 0.0070 424 HIS 57 CG 0.0063 -0.0050 0.0073 425 HIS 57 ND1 0.0059 -0.0073 0.0071 426 HIS 57 CD2 0.0072 -0.0034 0.0078 427 HIS 57 CE1 0.0066 -0.0071 0.0075 428 HIS 57 NE2 0.0074 -0.0048 0.0079 429 TRP 58 N 0.0015 -0.0007 0.0001 430 TRP 58 CA 0.0018 0.0006 0.0006 431 TRP 58 C 0.0033 0.0004 0.0001 432 TRP 58 O 0.0033 -0.0008 -0.0005 433 TRP 58 CB 0.0002 0.0007 0.0012 434 TRP 58 CG 0.0002 0.0022 0.0019 435 TRP 58 CD1 0.0012 0.0037 0.0023 436 TRP 58 CD2 -0.0009 0.0023 0.0023 437 TRP 58 NE1 0.0008 0.0047 0.0029 438 TRP 58 CE2 -0.0005 0.0039 0.0029 439 TRP 58 CE3 -0.0021 0.0013 0.0021 440 TRP 58 CZ2 -0.0013 0.0044 0.0034 441 TRP 58 CZ3 -0.0029 0.0018 0.0026 442 TRP 58 CH2 -0.0025 0.0034 0.0033 443 ILE 59 N 0.0015 -0.0030 0.0004 444 ILE 59 CA 0.0015 -0.0027 0.0002 445 ILE 59 C 0.0015 -0.0023 0.0003 446 ILE 59 O 0.0014 -0.0021 0.0004 447 ILE 59 CB 0.0016 -0.0027 -0.0003 448 ILE 59 CG1 0.0017 -0.0031 -0.0004 449 ILE 59 CG2 0.0016 -0.0023 -0.0005 450 ILE 59 CD1 0.0017 -0.0031 -0.0008 451 THR 60 N 0.0011 -0.0004 -0.0021 452 THR 60 CA 0.0014 0.0010 -0.0012 453 THR 60 C 0.0037 0.0009 -0.0023 454 THR 60 O 0.0043 -0.0008 -0.0039 455 THR 60 CB -0.0008 0.0005 -0.0006 456 THR 60 OG1 -0.0011 -0.0016 -0.0020 457 THR 60 CG2 -0.0032 0.0005 0.0005 458 PRO 61 N 0.0038 0.0022 -0.0028 459 PRO 61 CA 0.0068 0.0029 -0.0047 460 PRO 61 C 0.0078 0.0030 -0.0059 461 PRO 61 O 0.0102 0.0034 -0.0076 462 PRO 61 CB 0.0088 0.0046 -0.0024 463 PRO 61 CG 0.0074 0.0050 0.0008 464 PRO 61 CD 0.0041 0.0034 0.0005 465 LYS 62 N 0.0069 0.0122 -0.0016 466 LYS 62 CA 0.0035 0.0105 0.0003 467 LYS 62 C -0.0002 0.0075 0.0024 468 LYS 62 O -0.0001 0.0074 0.0024 469 LYS 62 CB 0.0015 0.0153 0.0014 470 LYS 62 CG -0.0017 0.0191 0.0031 471 LYS 62 CD -0.0035 0.0241 0.0041 472 LYS 62 CE 0.0000 0.0287 0.0021 473 LYS 62 NZ -0.0021 0.0335 0.0033 474 ASP 63 N -0.0060 0.0126 0.0058 475 ASP 63 CA -0.0044 0.0104 0.0092 476 ASP 63 C -0.0044 0.0110 0.0073 477 ASP 63 O -0.0075 0.0137 0.0055 478 ASP 63 CB -0.0072 0.0107 0.0145 479 ASP 63 CG -0.0067 0.0091 0.0184 480 ASP 63 OD1 -0.0085 0.0106 0.0178 481 ASP 63 OD2 -0.0046 0.0066 0.0219 482 PRO 64 N -0.0038 0.0125 0.0023 483 PRO 64 CA -0.0037 0.0128 0.0014 484 PRO 64 C -0.0054 0.0134 0.0038 485 PRO 64 O -0.0056 0.0140 0.0030 486 PRO 64 CB -0.0010 0.0104 0.0009 487 PRO 64 CG 0.0004 0.0091 0.0010 488 PRO 64 CD -0.0015 0.0101 0.0030 489 HIS 65 N -0.0032 0.0210 0.0044 490 HIS 65 CA -0.0015 0.0209 0.0039 491 HIS 65 C -0.0045 0.0189 0.0021 492 HIS 65 O -0.0034 0.0180 0.0008 493 HIS 65 CB -0.0004 0.0239 0.0072 494 HIS 65 CG 0.0030 0.0259 0.0089 495 HIS 65 ND1 0.0019 0.0281 0.0116 496 HIS 65 CD2 0.0074 0.0260 0.0081 497 HIS 65 CE1 0.0055 0.0294 0.0125 498 HIS 65 NE2 0.0090 0.0283 0.0104 499 THR 66 N -0.0149 0.0207 0.0062 500 THR 66 CA -0.0200 0.0210 0.0017 501 THR 66 C -0.0187 0.0216 -0.0047 502 THR 66 O -0.0231 0.0218 -0.0080 503 THR 66 CB -0.0216 0.0211 0.0007 504 THR 66 OG1 -0.0164 0.0213 -0.0011 505 THR 66 CG2 -0.0245 0.0206 0.0066 506 LEU 67 N -0.0074 0.0152 -0.0055 507 LEU 67 CA -0.0037 0.0118 -0.0104 508 LEU 67 C 0.0025 0.0136 -0.0135 509 LEU 67 O 0.0065 0.0123 -0.0172 510 LEU 67 CB -0.0030 0.0124 -0.0105 511 LEU 67 CG -0.0083 0.0087 -0.0093 512 LEU 67 CD1 -0.0064 0.0092 -0.0104 513 LEU 67 CD2 -0.0107 0.0022 -0.0123 514 ASP 68 N -0.0022 0.0203 -0.0149 515 ASP 68 CA -0.0012 0.0212 -0.0068 516 ASP 68 C 0.0190 0.0178 -0.0094 517 ASP 68 O 0.0210 0.0160 -0.0206 518 ASP 68 CB -0.0203 0.0232 -0.0141 519 ASP 68 CG -0.0244 0.0257 0.0005 520 ASP 68 OD1 -0.0210 0.0244 -0.0056 521 ASP 68 OD2 -0.0309 0.0290 0.0181 522 GLY 69 N 0.0191 0.0214 -0.0074 523 GLY 69 CA 0.0274 0.0231 -0.0090 524 GLY 69 C 0.0278 0.0185 -0.0115 525 GLY 69 O 0.0335 0.0207 -0.0120 526 HIS 70 N 0.0191 0.0145 -0.0142 527 HIS 70 CA 0.0192 0.0125 -0.0154 528 HIS 70 C 0.0185 0.0162 -0.0128 529 HIS 70 O 0.0206 0.0166 -0.0137 530 HIS 70 CB 0.0150 0.0075 -0.0161 531 HIS 70 CG 0.0159 0.0038 -0.0188 532 HIS 70 ND1 0.0143 0.0042 -0.0177 533 HIS 70 CD2 0.0181 -0.0000 -0.0223 534 HIS 70 CE1 0.0156 0.0005 -0.0206 535 HIS 70 NE2 0.0180 -0.0021 -0.0235 536 ALA 71 N 0.0166 0.0139 -0.0105 537 ALA 71 CA 0.0156 0.0152 -0.0097 538 ALA 71 C 0.0172 0.0176 -0.0091 539 ALA 71 O 0.0166 0.0188 -0.0085 540 ALA 71 CB 0.0129 0.0158 -0.0089 541 ASP 72 N 0.0212 0.0186 -0.0104 542 ASP 72 CA 0.0239 0.0228 -0.0092 543 ASP 72 C 0.0243 0.0187 -0.0089 544 ASP 72 O 0.0226 0.0216 -0.0099 545 ASP 72 CB 0.0307 0.0257 -0.0059 546 ASP 72 CG 0.0306 0.0316 -0.0061 547 ASP 72 OD1 0.0254 0.0329 -0.0088 548 ASP 72 OD2 0.0359 0.0347 -0.0035 549 GLU 73 N 0.0186 0.0114 -0.0103 550 GLU 73 CA 0.0128 0.0128 -0.0094 551 GLU 73 C 0.0098 0.0135 -0.0083 552 GLU 73 O 0.0056 0.0146 -0.0108 553 GLU 73 CB 0.0119 0.0127 -0.0043 554 GLU 73 CG 0.0059 0.0141 -0.0034 555 GLU 73 CD 0.0051 0.0140 0.0017 556 GLU 73 OE1 0.0092 0.0128 0.0044 557 GLU 73 OE2 0.0003 0.0151 0.0027 558 LEU 74 N 0.0071 0.0114 -0.0076 559 LEU 74 CA 0.0046 0.0115 -0.0075 560 LEU 74 C 0.0039 0.0130 -0.0107 561 LEU 74 O 0.0010 0.0137 -0.0115 562 LEU 74 CB 0.0059 0.0105 -0.0053 563 LEU 74 CG 0.0035 0.0105 -0.0049 564 LEU 74 CD1 0.0000 0.0102 -0.0035 565 LEU 74 CD2 0.0052 0.0095 -0.0029 566 LEU 75 N 0.0088 0.0107 -0.0112 567 LEU 75 CA 0.0088 0.0111 -0.0145 568 LEU 75 C 0.0067 0.0121 -0.0176 569 LEU 75 O 0.0057 0.0128 -0.0201 570 LEU 75 CB 0.0128 0.0101 -0.0159 571 LEU 75 CG 0.0150 0.0092 -0.0133 572 LEU 75 CD1 0.0190 0.0082 -0.0144 573 LEU 75 CD2 0.0137 0.0096 -0.0134 574 ALA 76 N 0.0090 0.0108 -0.0296 575 ALA 76 CA 0.0009 0.0083 -0.0340 576 ALA 76 C -0.0097 0.0056 -0.0329 577 ALA 76 O -0.0171 0.0033 -0.0375 578 ALA 76 CB 0.0009 0.0087 -0.0283 579 HIS 77 N -0.0062 0.0030 -0.0232 580 HIS 77 CA -0.0127 0.0025 -0.0218 581 HIS 77 C -0.0136 0.0002 -0.0282 582 HIS 77 O -0.0076 0.0004 -0.0304 583 HIS 77 CB -0.0118 0.0053 -0.0140 584 HIS 77 CG -0.0195 0.0053 -0.0108 585 HIS 77 ND1 -0.0224 0.0038 -0.0140 586 HIS 77 CD2 -0.0249 0.0064 -0.0053 587 HIS 77 CE1 -0.0295 0.0040 -0.0105 588 HIS 77 NE2 -0.0313 0.0055 -0.0051 589 PRO 78 N -0.0267 -0.0109 -0.0383 590 PRO 78 CA -0.0317 -0.0157 -0.0606 591 PRO 78 C -0.0235 -0.0086 -0.0269 592 PRO 78 O -0.0177 -0.0154 -0.0422 593 PRO 78 CB -0.0812 -0.0039 -0.0836 594 PRO 78 CG -0.0949 -0.0003 -0.0888 595 PRO 78 CD -0.0687 0.0026 -0.0464 596 SER 79 N -0.0113 0.0021 -0.0152 597 SER 79 CA -0.0087 0.0036 -0.0091 598 SER 79 C -0.0022 -0.0003 -0.0068 599 SER 79 O 0.0008 0.0001 -0.0022 600 SER 79 CB -0.0108 0.0086 -0.0037 601 SER 79 OG -0.0170 0.0126 -0.0054 602 VAL 80 N -0.0029 -0.0006 -0.0129 603 VAL 80 CA 0.0016 -0.0006 -0.0122 604 VAL 80 C 0.0046 -0.0040 -0.0148 605 VAL 80 O 0.0033 -0.0069 -0.0175 606 VAL 80 CB 0.0013 0.0005 -0.0113 607 VAL 80 CG1 0.0060 0.0002 -0.0109 608 VAL 80 CG2 -0.0008 0.0044 -0.0083 609 LYS 81 N 0.0017 -0.0079 -0.0036 610 LYS 81 CA 0.0034 -0.0109 -0.0032 611 LYS 81 C 0.0042 -0.0105 -0.0029 612 LYS 81 O 0.0058 -0.0081 -0.0024 613 LYS 81 CB 0.0066 -0.0116 -0.0023 614 LYS 81 CG 0.0060 -0.0129 -0.0025 615 LYS 81 CD 0.0091 -0.0143 -0.0016 616 LYS 81 CE 0.0085 -0.0158 -0.0019 617 LYS 81 NZ 0.0082 -0.0132 -0.0019 618 LEU 82 N 0.0017 -0.0089 -0.0035 619 LEU 82 CA 0.0021 -0.0069 -0.0037 620 LEU 82 C 0.0039 -0.0072 -0.0049 621 LEU 82 O 0.0041 -0.0090 -0.0052 622 LEU 82 CB 0.0003 -0.0065 -0.0024 623 LEU 82 CG 0.0006 -0.0044 -0.0025 624 LEU 82 CD1 0.0009 -0.0020 -0.0025 625 LEU 82 CD2 -0.0012 -0.0045 -0.0013 626 TRP 83 N 0.0024 -0.0099 -0.0044 627 TRP 83 CA 0.0043 -0.0107 -0.0044 628 TRP 83 C 0.0033 -0.0096 -0.0045 629 TRP 83 O 0.0043 -0.0076 -0.0051 630 TRP 83 CB 0.0072 -0.0096 -0.0048 631 TRP 83 CG 0.0082 -0.0106 -0.0046 632 TRP 83 CD1 0.0079 -0.0093 -0.0049 633 TRP 83 CD2 0.0094 -0.0131 -0.0041 634 TRP 83 NE1 0.0090 -0.0109 -0.0046 635 TRP 83 CE2 0.0099 -0.0133 -0.0041 636 TRP 83 CE3 0.0101 -0.0152 -0.0037 637 TRP 83 CZ2 0.0111 -0.0155 -0.0037 638 TRP 83 CZ3 0.0112 -0.0175 -0.0032 639 TRP 83 CH2 0.0117 -0.0176 -0.0032 640 GLU 84 N 0.0015 -0.0099 -0.0082 641 GLU 84 CA 0.0040 -0.0071 -0.0071 642 GLU 84 C 0.0078 -0.0060 -0.0097 643 GLU 84 O 0.0086 -0.0078 -0.0130 644 GLU 84 CB 0.0031 -0.0075 -0.0065 645 GLU 84 CG 0.0035 -0.0097 -0.0101 646 GLU 84 CD 0.0037 -0.0093 -0.0098 647 GLU 84 OE1 0.0028 -0.0078 -0.0066 648 GLU 84 OE2 0.0050 -0.0103 -0.0127 649 LYS 85 N 0.0063 -0.0079 -0.0113 650 LYS 85 CA 0.0118 -0.0063 -0.0138 651 LYS 85 C 0.0092 -0.0073 -0.0160 652 LYS 85 O 0.0118 -0.0067 -0.0212 653 LYS 85 CB 0.0163 -0.0052 -0.0200 654 LYS 85 CG 0.0194 -0.0042 -0.0186 655 LYS 85 CD 0.0256 -0.0025 -0.0237 656 LYS 85 CE 0.0257 -0.0026 -0.0265 657 LYS 85 NZ 0.0217 -0.0042 -0.0332 658 THR 86 N 0.0032 -0.0076 -0.0126 659 THR 86 CA 0.0022 -0.0078 -0.0127 660 THR 86 C 0.0020 -0.0086 -0.0121 661 THR 86 O 0.0025 -0.0091 -0.0115 662 THR 86 CB 0.0013 -0.0077 -0.0130 663 THR 86 OG1 0.0012 -0.0083 -0.0125 664 THR 86 CG2 0.0016 -0.0069 -0.0136 665 ARG 87 N -0.0030 -0.0092 -0.0215 666 ARG 87 CA -0.0051 -0.0144 -0.0184 667 ARG 87 C -0.0047 -0.0028 -0.0106 668 ARG 87 O -0.0061 0.0041 -0.0004 669 ARG 87 CB -0.0107 -0.0275 -0.0095 670 ARG 87 CG -0.0122 -0.0377 -0.0123 671 ARG 87 CD -0.0175 -0.0449 0.0006 672 ARG 87 NE -0.0211 -0.0555 0.0045 673 ARG 87 CZ -0.0235 -0.0696 0.0020 674 ARG 87 NH1 -0.0227 -0.0754 -0.0054 675 ARG 87 NH2 -0.0269 -0.0780 0.0070 676 LEU 88 N -0.0114 0.0020 0.0022 677 LEU 88 CA -0.0100 0.0031 0.0024 678 LEU 88 C -0.0069 0.0041 0.0025 679 LEU 88 O -0.0064 0.0060 0.0028 680 LEU 88 CB -0.0119 0.0055 0.0027 681 LEU 88 CG -0.0106 0.0071 0.0030 682 LEU 88 CD1 -0.0096 0.0051 0.0027 683 LEU 88 CD2 -0.0129 0.0092 0.0033 684 ILE 89 N -0.0135 0.0009 -0.0012 685 ILE 89 CA -0.0090 0.0018 -0.0013 686 ILE 89 C -0.0051 0.0060 -0.0027 687 ILE 89 O -0.0027 0.0090 -0.0037 688 ILE 89 CB -0.0056 -0.0032 0.0008 689 ILE 89 CG1 -0.0093 -0.0078 0.0024 690 ILE 89 CG2 -0.0007 -0.0023 0.0008 691 ILE 89 CD1 -0.0124 -0.0069 0.0019 692 ARG 90 N -0.0033 0.0082 -0.0005 693 ARG 90 CA -0.0016 0.0077 -0.0021 694 ARG 90 C -0.0044 0.0044 -0.0001 695 ARG 90 O -0.0068 0.0007 0.0015 696 ARG 90 CB 0.0021 0.0050 -0.0062 697 ARG 90 CG 0.0048 0.0049 -0.0089 698 ARG 90 CD 0.0088 0.0037 -0.0130 699 ARG 90 NE 0.0107 0.0083 -0.0139 700 ARG 90 CZ 0.0115 0.0081 -0.0147 701 ARG 90 NH1 0.0110 0.0037 -0.0151 702 ARG 90 NH2 0.0129 0.0127 -0.0151 703 ILE 91 N -0.0049 0.0087 0.0006 704 ILE 91 CA -0.0052 0.0050 0.0018 705 ILE 91 C -0.0046 0.0026 -0.0017 706 ILE 91 O -0.0041 0.0039 -0.0046 707 ILE 91 CB -0.0056 0.0054 0.0041 708 ILE 91 CG1 -0.0062 0.0079 0.0077 709 ILE 91 CG2 -0.0058 0.0014 0.0052 710 ILE 91 CD1 -0.0065 0.0094 0.0096 711 LYS 92 N -0.0004 -0.0022 0.0053 712 LYS 92 CA 0.0018 -0.0055 0.0013 713 LYS 92 C 0.0002 -0.0090 0.0025 714 LYS 92 O -0.0028 -0.0105 0.0061 715 LYS 92 CB 0.0026 -0.0092 -0.0008 716 LYS 92 CG 0.0045 -0.0065 -0.0025 717 LYS 92 CD 0.0046 -0.0108 -0.0040 718 LYS 92 CE 0.0080 -0.0105 -0.0086 719 LYS 92 NZ 0.0090 -0.0059 -0.0085 720 GLY 93 N -0.0076 -0.0179 0.0105 721 GLY 93 CA -0.0030 -0.0175 0.0090 722 GLY 93 C -0.0072 -0.0169 0.0109 723 GLY 93 O -0.0135 -0.0153 0.0143 724 GLU 94 N -0.0090 -0.0228 0.0207 725 GLU 94 CA -0.0099 -0.0209 0.0233 726 GLU 94 C -0.0041 -0.0408 -0.0018 727 GLU 94 O -0.0011 -0.0555 -0.0196 728 GLU 94 CB 0.0137 0.0011 0.0346 729 GLU 94 CG 0.0112 0.0228 0.0598 730 GLU 94 CD 0.0360 0.0435 0.0690 731 GLU 94 OE1 0.0297 0.0601 0.0906 732 GLU 94 OE2 0.0613 0.0428 0.0543 733 GLU 95 N 0.0192 -0.0631 -0.0321 734 GLU 95 CA 0.0112 -0.0526 -0.0012 735 GLU 95 C -0.0013 -0.0383 -0.0311 736 GLU 95 O 0.0084 -0.0498 -0.0235 737 GLU 95 CB -0.0141 -0.0211 0.0365 738 GLU 95 CG -0.0220 -0.0107 0.0750 739 GLU 95 CD 0.0018 -0.0383 0.1181 740 GLU 95 OE1 0.0034 -0.0395 0.1447 741 GLU 95 OE2 0.0186 -0.0585 0.1243 742 ALA 96 N 0.0217 -0.0389 -0.0079 743 ALA 96 CA 0.0377 -0.0408 -0.0088 744 ALA 96 C 0.0308 -0.0399 -0.0083 745 ALA 96 O 0.0383 -0.0455 -0.0179 746 ALA 96 CB 0.0528 -0.0340 0.0068 747 GLY 97 N 0.0183 -0.0409 -0.0097 748 GLY 97 CA 0.0124 -0.0326 -0.0034 749 GLY 97 C 0.0075 -0.0249 0.0051 750 GLY 97 O 0.0066 -0.0243 0.0038 751 VAL 98 N 0.0057 -0.0189 0.0067 752 VAL 98 CA 0.0042 -0.0152 0.0100 753 VAL 98 C 0.0065 -0.0141 0.0133 754 VAL 98 O 0.0104 -0.0159 0.0144 755 VAL 98 CB 0.0045 -0.0140 0.0116 756 VAL 98 CG1 0.0030 -0.0101 0.0152 757 VAL 98 CG2 0.0019 -0.0148 0.0084 758 THR 99 N 0.0077 -0.0108 0.0074 759 THR 99 CA 0.0087 -0.0095 0.0092 760 THR 99 C 0.0074 -0.0105 0.0101 761 THR 99 O 0.0083 -0.0096 0.0108 762 THR 99 CB 0.0092 -0.0085 0.0118 763 THR 99 OG1 0.0073 -0.0098 0.0134 764 THR 99 CG2 0.0107 -0.0072 0.0111 765 ALA 100 N 0.0052 -0.0092 0.0067 766 ALA 100 CA 0.0042 -0.0087 0.0079 767 ALA 100 C 0.0031 -0.0067 0.0076 768 ALA 100 O 0.0031 -0.0057 0.0063 769 ALA 100 CB 0.0048 -0.0095 0.0078 770 VAL 101 N -0.0003 -0.0067 0.0045 771 VAL 101 CA 0.0002 -0.0048 0.0045 772 VAL 101 C 0.0010 -0.0054 0.0035 773 VAL 101 O 0.0007 -0.0073 0.0033 774 VAL 101 CB -0.0011 -0.0036 0.0063 775 VAL 101 CG1 -0.0018 -0.0027 0.0072 776 VAL 101 CG2 -0.0025 -0.0052 0.0072 777 GLU 102 N -0.0043 -0.0082 -0.0018 778 GLU 102 CA -0.0039 -0.0090 -0.0018 779 GLU 102 C -0.0065 -0.0071 -0.0004 780 GLU 102 O -0.0072 -0.0041 -0.0009 781 GLU 102 CB -0.0014 -0.0077 -0.0043 782 GLU 102 CG -0.0006 -0.0086 -0.0046 783 GLU 102 CD 0.0017 -0.0070 -0.0071 784 GLU 102 OE1 0.0033 -0.0061 -0.0086 785 GLU 102 OE2 0.0020 -0.0065 -0.0075 786 VAL 103 N -0.0079 -0.0108 -0.0051 787 VAL 103 CA -0.0083 -0.0108 -0.0051 788 VAL 103 C -0.0083 -0.0111 -0.0050 789 VAL 103 O -0.0080 -0.0114 -0.0049 790 VAL 103 CB -0.0087 -0.0109 -0.0049 791 VAL 103 CG1 -0.0087 -0.0106 -0.0050 792 VAL 103 CG2 -0.0087 -0.0114 -0.0048 793 ARG 104 N -0.0116 -0.0130 -0.0083 794 ARG 104 CA -0.0129 -0.0125 -0.0070 795 ARG 104 C -0.0143 -0.0119 -0.0063 796 ARG 104 O -0.0151 -0.0116 -0.0074 797 ARG 104 CB -0.0138 -0.0121 -0.0082 798 ARG 104 CG -0.0153 -0.0116 -0.0070 799 ARG 104 CD -0.0165 -0.0111 -0.0083 800 ARG 104 NE -0.0154 -0.0115 -0.0090 801 ARG 104 CZ -0.0159 -0.0113 -0.0103 802 ARG 104 NH1 -0.0176 -0.0107 -0.0112 803 ARG 104 NH2 -0.0149 -0.0117 -0.0106 804 HIS 105 N -0.0132 -0.0085 -0.0118 805 HIS 105 CA -0.0059 -0.0106 -0.0152 806 HIS 105 C -0.0052 -0.0157 -0.0123 807 HIS 105 O -0.0099 -0.0141 -0.0103 808 HIS 105 CB -0.0040 -0.0038 -0.0208 809 HIS 105 CG 0.0036 -0.0040 -0.0256 810 HIS 105 ND1 0.0055 -0.0018 -0.0282 811 HIS 105 CD2 0.0095 -0.0061 -0.0280 812 HIS 105 CE1 0.0124 -0.0026 -0.0322 813 HIS 105 NE2 0.0152 -0.0052 -0.0323 814 PRO 106 N -0.0058 -0.0139 -0.0142 815 PRO 106 CA -0.0059 -0.0176 -0.0123 816 PRO 106 C -0.0062 -0.0159 -0.0129 817 PRO 106 O -0.0037 -0.0142 -0.0160 818 PRO 106 CB -0.0020 -0.0217 -0.0136 819 PRO 106 CG -0.0011 -0.0211 -0.0147 820 PRO 106 CD -0.0025 -0.0157 -0.0163 821 GLY 107 N -0.0211 -0.0146 -0.0173 822 GLY 107 CA -0.0260 -0.0079 -0.0154 823 GLY 107 C -0.0259 -0.0055 -0.0136 824 GLY 107 O -0.0311 -0.0011 -0.0134 825 GLU 108 N -0.0168 -0.0086 -0.0136 826 GLU 108 CA -0.0170 -0.0064 -0.0128 827 GLU 108 C -0.0204 -0.0067 -0.0136 828 GLU 108 O -0.0220 -0.0041 -0.0129 829 GLU 108 CB -0.0136 -0.0071 -0.0124 830 GLU 108 CG -0.0103 -0.0053 -0.0109 831 GLU 108 CD -0.0106 -0.0014 -0.0094 832 GLU 108 OE1 -0.0131 -0.0000 -0.0093 833 GLU 108 OE2 -0.0083 0.0002 -0.0082 834 SER 109 N -0.0207 -0.0074 -0.0161 835 SER 109 CA -0.0200 -0.0081 -0.0212 836 SER 109 C -0.0169 -0.0127 -0.0223 837 SER 109 O -0.0158 -0.0140 -0.0267 838 SER 109 CB -0.0215 -0.0055 -0.0227 839 SER 109 OG -0.0213 -0.0054 -0.0281 840 ASP 110 N -0.0117 -0.0105 -0.0188 841 ASP 110 CA -0.0119 -0.0174 -0.0198 842 ASP 110 C -0.0147 -0.0188 -0.0146 843 ASP 110 O -0.0176 -0.0168 -0.0089 844 ASP 110 CB -0.0123 -0.0236 -0.0201 845 ASP 110 CG -0.0089 -0.0235 -0.0265 846 ASP 110 OD1 -0.0064 -0.0248 -0.0315 847 ASP 110 OD2 -0.0088 -0.0221 -0.0264 848 SER 111 N -0.0065 -0.0184 -0.0105 849 SER 111 CA -0.0069 -0.0181 -0.0102 850 SER 111 C -0.0064 -0.0215 -0.0084 851 SER 111 O -0.0047 -0.0242 -0.0085 852 SER 111 CB -0.0051 -0.0168 -0.0132 853 SER 111 OG -0.0055 -0.0135 -0.0151 854 GLN 112 N -0.0043 -0.0220 0.0000 855 GLN 112 CA -0.0020 -0.0215 0.0004 856 GLN 112 C -0.0008 -0.0228 -0.0011 857 GLN 112 O -0.0010 -0.0240 -0.0026 858 GLN 112 CB -0.0007 -0.0210 0.0009 859 GLN 112 CG 0.0012 -0.0198 0.0021 860 GLN 112 CD 0.0030 -0.0199 0.0020 861 GLN 112 OE1 0.0044 -0.0208 0.0007 862 GLN 112 NE2 0.0030 -0.0188 0.0032 863 GLU 113 N 0.0042 -0.0175 0.0021 864 GLU 113 CA 0.0049 -0.0160 0.0014 865 GLU 113 C 0.0043 -0.0156 0.0009 866 GLU 113 O 0.0044 -0.0163 0.0014 867 GLU 113 CB 0.0068 -0.0156 0.0020 868 GLU 113 CG 0.0075 -0.0139 0.0012 869 GLU 113 CD 0.0092 -0.0134 0.0016 870 GLU 113 OE1 0.0094 -0.0135 0.0018 871 GLU 113 OE2 0.0103 -0.0129 0.0018 872 LEU 114 N 0.0063 -0.0109 0.0052 873 LEU 114 CA 0.0054 -0.0104 0.0046 874 LEU 114 C 0.0049 -0.0093 0.0054 875 LEU 114 O 0.0052 -0.0090 0.0062 876 LEU 114 CB 0.0052 -0.0106 0.0041 877 LEU 114 CG 0.0055 -0.0116 0.0032 878 LEU 114 CD1 0.0055 -0.0119 0.0029 879 LEU 114 CD2 0.0047 -0.0116 0.0022 880 LEU 115 N 0.0086 -0.0063 0.0082 881 LEU 115 CA 0.0085 -0.0066 0.0082 882 LEU 115 C 0.0074 -0.0057 0.0097 883 LEU 115 O 0.0063 -0.0059 0.0109 884 LEU 115 CB 0.0084 -0.0087 0.0079 885 LEU 115 CG 0.0095 -0.0097 0.0064 886 LEU 115 CD1 0.0090 -0.0119 0.0064 887 LEU 115 CD2 0.0108 -0.0093 0.0051 888 ALA 116 N 0.0057 -0.0060 0.0132 889 ALA 116 CA 0.0053 -0.0056 0.0147 890 ALA 116 C 0.0053 -0.0059 0.0145 891 ALA 116 O 0.0057 -0.0056 0.0134 892 ALA 116 CB 0.0057 -0.0040 0.0153 893 GLU 117 N 0.0056 -0.0065 0.0170 894 GLU 117 CA 0.0046 -0.0072 0.0185 895 GLU 117 C 0.0058 -0.0106 0.0180 896 GLU 117 O 0.0049 -0.0121 0.0196 897 GLU 117 CB 0.0046 -0.0044 0.0176 898 GLU 117 CG 0.0029 -0.0010 0.0188 899 GLU 117 CD 0.0034 0.0021 0.0171 900 GLU 117 OE1 0.0050 0.0032 0.0148 901 GLU 117 OE2 0.0024 0.0034 0.0181 902 GLY 118 N 0.0025 -0.0065 0.0154 903 GLY 118 CA 0.0025 -0.0057 0.0161 904 GLY 118 C 0.0022 -0.0035 0.0163 905 GLY 118 O 0.0023 -0.0027 0.0173 906 VAL 119 N 0.0018 -0.0011 0.0162 907 VAL 119 CA 0.0004 0.0016 0.0167 908 VAL 119 C -0.0004 0.0033 0.0170 909 VAL 119 O -0.0002 0.0037 0.0151 910 VAL 119 CB 0.0003 0.0030 0.0142 911 VAL 119 CG1 -0.0011 0.0058 0.0151 912 VAL 119 CG2 0.0013 0.0011 0.0137 913 PHE 120 N 0.0015 0.0065 0.0131 914 PHE 120 CA 0.0000 0.0087 0.0136 915 PHE 120 C -0.0004 0.0096 0.0138 916 PHE 120 O -0.0012 0.0083 0.0143 917 PHE 120 CB -0.0022 0.0080 0.0148 918 PHE 120 CG -0.0019 0.0073 0.0147 919 PHE 120 CD1 -0.0012 0.0049 0.0145 920 PHE 120 CD2 -0.0025 0.0091 0.0149 921 PHE 120 CE1 -0.0010 0.0043 0.0145 922 PHE 120 CE2 -0.0024 0.0085 0.0148 923 PHE 120 CZ -0.0016 0.0061 0.0147 924 VAL 121 N 0.0029 0.0152 0.0144 925 VAL 121 CA 0.0021 0.0157 0.0144 926 VAL 121 C 0.0021 0.0154 0.0142 927 VAL 121 O 0.0022 0.0148 0.0136 928 VAL 121 CB 0.0012 0.0156 0.0138 929 VAL 121 CG1 0.0003 0.0161 0.0138 930 VAL 121 CG2 0.0011 0.0157 0.0139 931 TYR 122 N 0.0034 0.0084 0.0064 932 TYR 122 CA 0.0026 0.0087 0.0061 933 TYR 122 C 0.0041 0.0070 0.0059 934 TYR 122 O 0.0037 0.0054 0.0046 935 TYR 122 CB 0.0004 0.0085 0.0046 936 TYR 122 CG -0.0011 0.0102 0.0047 937 TYR 122 CD1 -0.0015 0.0123 0.0058 938 TYR 122 CD2 -0.0019 0.0096 0.0039 939 TYR 122 CE1 -0.0027 0.0138 0.0061 940 TYR 122 CE2 -0.0031 0.0112 0.0041 941 TYR 122 CZ -0.0035 0.0133 0.0052 942 TYR 122 OH -0.0047 0.0148 0.0055 943 LEU 123 N 0.0105 0.0147 -0.0053 944 LEU 123 CA 0.0054 0.0123 -0.0038 945 LEU 123 C 0.0021 0.0115 -0.0088 946 LEU 123 O 0.0036 0.0125 -0.0121 947 LEU 123 CB 0.0053 0.0117 0.0006 948 LEU 123 CG 0.0084 0.0125 0.0060 949 LEU 123 CD1 0.0087 0.0122 0.0097 950 LEU 123 CD2 0.0062 0.0111 0.0093 951 GLN 124 N 0.0017 -0.0266 -0.0255 952 GLN 124 CA -0.0247 -0.0050 -0.0525 953 GLN 124 C -0.0015 -0.0095 -0.0363 954 GLN 124 O 0.0188 -0.0462 -0.0050 955 GLN 124 CB -0.0829 -0.0321 -0.0733 956 GLN 124 CG -0.1072 -0.0199 -0.0942 957 GLN 124 CD -0.1622 -0.0536 -0.1097 958 GLN 124 OE1 -0.1729 -0.1022 -0.0909 959 GLN 124 NE2 -0.1979 -0.0269 -0.1449 960 GLY 125 N 0.0056 -0.0132 -0.0482 961 GLY 125 CA 0.0154 -0.0194 -0.0319 962 GLY 125 C 0.0160 -0.0185 -0.0301 963 GLY 125 O 0.0089 -0.0148 -0.0423 964 SER 126 N 0.0483 -0.0193 -0.0224 965 SER 126 CA 0.0587 -0.0140 -0.0083 966 SER 126 C 0.0519 -0.0166 0.0039 967 SER 126 O 0.0606 -0.0123 0.0123 968 SER 126 CB 0.0743 -0.0073 -0.0159 969 SER 126 OG 0.0719 -0.0087 -0.0257 970 LYS 127 N 0.0473 -0.0242 -0.0081 971 LYS 127 CA 0.0327 -0.0364 0.0042 972 LYS 127 C 0.0310 -0.0444 0.0135 973 LYS 127 O 0.0414 -0.0399 0.0096 974 LYS 127 CB 0.0106 -0.0325 -0.0034 975 LYS 127 CG 0.0102 -0.0236 -0.0138 976 LYS 127 CD 0.0108 -0.0321 -0.0038 977 LYS 127 CE 0.0222 -0.0239 -0.0119 978 LYS 127 NZ 0.0427 -0.0290 -0.0030 979 LYS 127 OXT 0.0179 -0.0549 0.0241