1 GLY 1 N -0.0099 0.0026 0.0287 2 GLY 1 CA -0.0127 -0.0063 0.0186 3 GLY 1 C -0.0074 -0.0030 0.0066 4 GLY 1 O -0.0012 0.0062 0.0050 5 ARG 2 N -0.0055 -0.0041 -0.0142 6 ARG 2 CA -0.0011 -0.0072 -0.0127 7 ARG 2 C 0.0011 -0.0041 -0.0100 8 ARG 2 O -0.0010 -0.0021 -0.0106 9 ARG 2 CB -0.0018 -0.0123 -0.0151 10 ARG 2 CG 0.0027 -0.0164 -0.0138 11 ARG 2 CD 0.0022 -0.0213 -0.0161 12 ARG 2 NE -0.0002 -0.0244 -0.0188 13 ARG 2 CZ 0.0003 -0.0295 -0.0205 14 ARG 2 NH1 0.0029 -0.0325 -0.0200 15 ARG 2 NH2 -0.0020 -0.0317 -0.0228 16 ILE 3 N -0.0003 -0.0032 0.0061 17 ILE 3 CA -0.0054 -0.0117 -0.0048 18 ILE 3 C -0.0075 -0.0077 -0.0065 19 ILE 3 O -0.0089 0.0049 -0.0041 20 ILE 3 CB -0.0133 -0.0099 -0.0161 21 ILE 3 CG1 -0.0108 -0.0168 -0.0148 22 ILE 3 CG2 -0.0195 -0.0164 -0.0280 23 ILE 3 CD1 -0.0180 -0.0138 -0.0247 24 ALA 4 N 0.0044 -0.0056 -0.0007 25 ALA 4 CA 0.0065 -0.0040 0.0050 26 ALA 4 C 0.0031 -0.0061 0.0103 27 ALA 4 O 0.0011 -0.0074 0.0114 28 ALA 4 CB 0.0111 -0.0008 0.0058 29 SER 5 N 0.0019 -0.0054 0.0150 30 SER 5 CA -0.0016 -0.0089 0.0189 31 SER 5 C 0.0007 -0.0086 0.0250 32 SER 5 O -0.0015 -0.0112 0.0291 33 SER 5 CB -0.0053 -0.0114 0.0171 34 SER 5 OG -0.0034 -0.0097 0.0165 35 ILE 6 N 0.0019 -0.0051 0.0219 36 ILE 6 CA 0.0027 -0.0051 0.0238 37 ILE 6 C 0.0042 -0.0044 0.0243 38 ILE 6 O 0.0053 -0.0036 0.0231 39 ILE 6 CB 0.0034 -0.0047 0.0238 40 ILE 6 CG1 0.0018 -0.0055 0.0235 41 ILE 6 CG2 0.0045 -0.0045 0.0257 42 ILE 6 CD1 0.0023 -0.0051 0.0228 43 PRO 7 N 0.0063 -0.0090 0.0223 44 PRO 7 CA 0.0094 -0.0076 0.0236 45 PRO 7 C 0.0081 -0.0059 0.0231 46 PRO 7 O 0.0063 -0.0082 0.0223 47 PRO 7 CB 0.0120 -0.0115 0.0247 48 PRO 7 CG 0.0114 -0.0138 0.0244 49 PRO 7 CD 0.0072 -0.0129 0.0226 50 GLY 8 N 0.0115 -0.0163 0.0102 51 GLY 8 CA 0.0126 -0.0139 0.0094 52 GLY 8 C 0.0130 -0.0137 0.0068 53 GLY 8 O 0.0138 -0.0119 0.0060 54 GLU 9 N 0.0127 -0.0034 0.0081 55 GLU 9 CA 0.0152 -0.0049 0.0066 56 GLU 9 C 0.0161 -0.0078 0.0020 57 GLU 9 O 0.0201 -0.0095 0.0009 58 GLU 9 CB 0.0123 -0.0037 0.0073 59 GLU 9 CG 0.0145 -0.0048 0.0064 60 GLU 9 CD 0.0113 -0.0035 0.0073 61 GLU 9 OE1 0.0073 -0.0017 0.0085 62 GLU 9 OE2 0.0127 -0.0042 0.0066 63 ALA 10 N 0.0198 -0.0106 -0.0006 64 ALA 10 CA 0.0208 -0.0092 -0.0021 65 ALA 10 C 0.0229 -0.0109 -0.0030 66 ALA 10 O 0.0233 -0.0107 -0.0035 67 ALA 10 CB 0.0212 -0.0070 -0.0037 68 GLU 11 N 0.0194 -0.0158 -0.0039 69 GLU 11 CA 0.0212 -0.0145 -0.0026 70 GLU 11 C 0.0221 -0.0129 -0.0034 71 GLU 11 O 0.0235 -0.0113 -0.0036 72 GLU 11 CB 0.0215 -0.0155 -0.0002 73 GLU 11 CG 0.0233 -0.0144 0.0015 74 GLU 11 CD 0.0234 -0.0155 0.0038 75 GLU 11 OE1 0.0222 -0.0172 0.0040 76 GLU 11 OE2 0.0249 -0.0147 0.0052 77 TYR 12 N 0.0079 -0.0164 -0.0037 78 TYR 12 CA 0.0055 -0.0135 -0.0061 79 TYR 12 C 0.0052 -0.0133 -0.0077 80 TYR 12 O 0.0036 -0.0114 -0.0105 81 TYR 12 CB 0.0053 -0.0135 -0.0099 82 TYR 12 CG 0.0049 -0.0128 -0.0085 83 TYR 12 CD1 0.0023 -0.0096 -0.0073 84 TYR 12 CD2 0.0069 -0.0154 -0.0081 85 TYR 12 CE1 0.0020 -0.0091 -0.0057 86 TYR 12 CE2 0.0066 -0.0148 -0.0064 87 TYR 12 CZ 0.0041 -0.0117 -0.0051 88 TYR 12 OH 0.0038 -0.0112 -0.0031 89 LEU 13 N 0.0147 -0.0051 -0.0148 90 LEU 13 CA 0.0138 -0.0045 -0.0129 91 LEU 13 C 0.0129 -0.0056 -0.0124 92 LEU 13 O 0.0133 -0.0058 -0.0133 93 LEU 13 CB 0.0146 -0.0023 -0.0124 94 LEU 13 CG 0.0137 -0.0014 -0.0104 95 LEU 13 CD1 0.0130 -0.0016 -0.0094 96 LEU 13 CD2 0.0145 0.0007 -0.0100 97 GLY 14 N 0.0079 -0.0050 -0.0193 98 GLY 14 CA 0.0083 -0.0099 -0.0189 99 GLY 14 C 0.0068 -0.0098 -0.0203 100 GLY 14 O 0.0068 -0.0137 -0.0203 101 ARG 15 N -0.0017 -0.0071 -0.0210 102 ARG 15 CA -0.0027 -0.0053 -0.0210 103 ARG 15 C -0.0024 -0.0070 -0.0245 104 ARG 15 O -0.0021 -0.0074 -0.0242 105 ARG 15 CB -0.0018 -0.0057 -0.0170 106 ARG 15 CG -0.0022 -0.0037 -0.0132 107 ARG 15 CD -0.0018 -0.0033 -0.0096 108 ARG 15 NE 0.0005 -0.0070 -0.0083 109 ARG 15 CZ 0.0013 -0.0079 -0.0066 110 ARG 15 NH1 0.0002 -0.0057 -0.0060 111 ARG 15 NH2 0.0034 -0.0113 -0.0055 112 GLY 16 N 0.0003 -0.0093 -0.0187 113 GLY 16 CA 0.0008 -0.0090 -0.0196 114 GLY 16 C 0.0032 -0.0055 -0.0175 115 GLY 16 O 0.0030 -0.0052 -0.0159 116 VAL 17 N 0.0114 -0.0026 -0.0119 117 VAL 17 CA 0.0111 -0.0030 -0.0121 118 VAL 17 C 0.0104 -0.0019 -0.0123 119 VAL 17 O 0.0106 -0.0008 -0.0119 120 VAL 17 CB 0.0122 -0.0033 -0.0116 121 VAL 17 CG1 0.0118 -0.0036 -0.0118 122 VAL 17 CG2 0.0128 -0.0044 -0.0114 123 SER 18 N 0.0153 0.0044 -0.0128 124 SER 18 CA 0.0139 0.0057 -0.0108 125 SER 18 C 0.0139 0.0069 -0.0100 126 SER 18 O 0.0146 0.0063 -0.0109 127 SER 18 CB 0.0115 0.0041 -0.0101 128 SER 18 OG 0.0100 0.0053 -0.0082 129 TYR 19 N 0.0146 0.0172 -0.0071 130 TYR 19 CA 0.0156 0.0164 -0.0076 131 TYR 19 C 0.0129 0.0173 -0.0080 132 TYR 19 O 0.0133 0.0173 -0.0077 133 TYR 19 CB 0.0182 0.0168 -0.0051 134 TYR 19 CG 0.0209 0.0161 -0.0044 135 TYR 19 CD1 0.0231 0.0140 -0.0061 136 TYR 19 CD2 0.0214 0.0175 -0.0019 137 TYR 19 CE1 0.0256 0.0134 -0.0054 138 TYR 19 CE2 0.0239 0.0168 -0.0011 139 TYR 19 CZ 0.0260 0.0148 -0.0029 140 TYR 19 OH 0.0286 0.0142 -0.0021 141 CYS 20 N 0.0129 0.0297 -0.0108 142 CYS 20 CA 0.0003 0.0317 -0.0056 143 CYS 20 C -0.0019 0.0167 -0.0023 144 CYS 20 O 0.0049 0.0133 -0.0048 145 CYS 20 CB 0.0019 0.0457 -0.0085 146 CYS 20 SG -0.0153 0.0511 -0.0018 147 ALA 21 N 0.0071 0.0141 -0.0012 148 ALA 21 CA 0.0047 0.0057 0.0006 149 ALA 21 C 0.0008 0.0028 0.0054 150 ALA 21 O 0.0001 -0.0045 0.0050 151 ALA 21 CB 0.0023 0.0049 0.0038 152 THR 22 N -0.0008 0.0118 0.0259 153 THR 22 CA -0.0083 -0.0005 0.0423 154 THR 22 C 0.0058 -0.0113 0.0208 155 THR 22 O 0.0038 -0.0338 0.0302 156 THR 22 CB -0.0249 0.0261 0.0640 157 THR 22 OG1 -0.0209 0.0603 0.0479 158 THR 22 CG2 -0.0410 0.0309 0.0906 159 CYS 23 N 0.0116 -0.0018 0.0142 160 CYS 23 CA 0.0107 -0.0213 -0.0040 161 CYS 23 C 0.0101 -0.0256 -0.0086 162 CYS 23 O 0.0192 -0.0445 -0.0093 163 CYS 23 CB -0.0036 -0.0176 -0.0247 164 CYS 23 SG -0.0018 -0.0445 -0.0444 165 ASP 24 N 0.0028 -0.0079 -0.0009 166 ASP 24 CA 0.0020 -0.0089 -0.0030 167 ASP 24 C 0.0028 -0.0087 -0.0012 168 ASP 24 O 0.0023 -0.0097 -0.0027 169 ASP 24 CB 0.0004 -0.0063 -0.0059 170 ASP 24 CG -0.0005 -0.0065 -0.0081 171 ASP 24 OD1 0.0001 -0.0087 -0.0077 172 ASP 24 OD2 -0.0018 -0.0043 -0.0104 173 GLY 25 N 0.0016 -0.0088 0.0011 174 GLY 25 CA 0.0022 -0.0067 0.0005 175 GLY 25 C 0.0029 -0.0024 0.0006 176 GLY 25 O 0.0028 -0.0003 0.0019 177 ALA 26 N 0.0035 -0.0007 0.0045 178 ALA 26 CA -0.0003 0.0034 0.0033 179 ALA 26 C -0.0023 0.0056 0.0057 180 ALA 26 O -0.0049 0.0085 0.0035 181 ALA 26 CB -0.0020 0.0053 0.0052 182 PHE 27 N -0.0003 0.0079 -0.0036 183 PHE 27 CA -0.0012 0.0101 0.0008 184 PHE 27 C -0.0011 0.0094 0.0010 185 PHE 27 O -0.0020 0.0119 0.0038 186 PHE 27 CB -0.0012 0.0079 0.0057 187 PHE 27 CG -0.0013 0.0086 0.0056 188 PHE 27 CD1 -0.0002 0.0048 0.0035 189 PHE 27 CD2 -0.0025 0.0128 0.0076 190 PHE 27 CE1 -0.0003 0.0052 0.0034 191 PHE 27 CE2 -0.0026 0.0132 0.0075 192 PHE 27 CZ -0.0015 0.0094 0.0053 193 TYR 28 N 0.0035 -0.0023 -0.0060 194 TYR 28 CA 0.0033 -0.0009 -0.0060 195 TYR 28 C 0.0043 0.0000 -0.0059 196 TYR 28 O 0.0045 0.0012 -0.0059 197 TYR 28 CB 0.0033 -0.0007 -0.0060 198 TYR 28 CG 0.0021 -0.0015 -0.0060 199 TYR 28 CD1 0.0008 -0.0010 -0.0061 200 TYR 28 CD2 0.0024 -0.0028 -0.0061 201 TYR 28 CE1 -0.0003 -0.0018 -0.0061 202 TYR 28 CE2 0.0013 -0.0036 -0.0061 203 TYR 28 CZ -0.0001 -0.0031 -0.0061 204 TYR 28 OH -0.0011 -0.0040 -0.0062 205 ARG 29 N 0.0045 0.0125 0.0055 206 ARG 29 CA -0.0026 0.0131 -0.0034 207 ARG 29 C -0.0023 0.0109 -0.0060 208 ARG 29 O -0.0022 0.0148 -0.0004 209 ARG 29 CB -0.0114 0.0219 -0.0031 210 ARG 29 CG -0.0189 0.0219 -0.0133 211 ARG 29 CD -0.0278 0.0305 -0.0134 212 ARG 29 NE -0.0278 0.0342 -0.0083 213 ARG 29 CZ -0.0286 0.0321 -0.0124 214 ARG 29 NH1 -0.0299 0.0266 -0.0216 215 ARG 29 NH2 -0.0282 0.0356 -0.0070 216 ASN 30 N -0.0028 0.0181 -0.0049 217 ASN 30 CA -0.0023 0.0149 -0.0101 218 ASN 30 C 0.0083 0.0092 0.0023 219 ASN 30 O 0.0070 0.0120 0.0050 220 ASN 30 CB -0.0154 0.0273 -0.0148 221 ASN 30 CG -0.0243 0.0290 -0.0315 222 ASN 30 OD1 -0.0332 0.0387 -0.0321 223 ASN 30 ND2 -0.0218 0.0190 -0.0459 224 ARG 31 N 0.0058 0.0057 -0.0078 225 ARG 31 CA 0.0050 0.0050 -0.0065 226 ARG 31 C 0.0039 0.0038 -0.0064 227 ARG 31 O 0.0037 0.0033 -0.0075 228 ARG 31 CB 0.0048 0.0047 -0.0070 229 ARG 31 CG 0.0059 0.0059 -0.0070 230 ARG 31 CD 0.0057 0.0057 -0.0072 231 ARG 31 NE 0.0068 0.0069 -0.0075 232 ARG 31 CZ 0.0074 0.0079 -0.0063 233 ARG 31 NH1 0.0071 0.0078 -0.0047 234 ARG 31 NH2 0.0084 0.0090 -0.0067 235 GLU 32 N 0.0035 -0.0016 -0.0026 236 GLU 32 CA 0.0012 -0.0005 -0.0016 237 GLU 32 C -0.0013 -0.0024 -0.0038 238 GLU 32 O -0.0029 -0.0037 -0.0052 239 GLU 32 CB -0.0010 0.0017 0.0007 240 GLU 32 CG 0.0012 0.0038 0.0031 241 GLU 32 CD 0.0017 0.0058 0.0052 242 GLU 32 OE1 0.0049 0.0062 0.0058 243 GLU 32 OE2 -0.0010 0.0069 0.0062 244 VAL 33 N 0.0016 -0.0030 -0.0018 245 VAL 33 CA 0.0004 -0.0034 -0.0030 246 VAL 33 C -0.0010 -0.0026 -0.0024 247 VAL 33 O -0.0009 -0.0019 -0.0011 248 VAL 33 CB 0.0012 -0.0042 -0.0040 249 VAL 33 CG1 0.0027 -0.0050 -0.0046 250 VAL 33 CG2 0.0018 -0.0038 -0.0031 251 VAL 34 N 0.0016 -0.0033 -0.0008 252 VAL 34 CA 0.0017 -0.0044 -0.0009 253 VAL 34 C 0.0030 -0.0071 -0.0016 254 VAL 34 O 0.0025 -0.0088 -0.0012 255 VAL 34 CB -0.0005 -0.0048 0.0007 256 VAL 34 CG1 -0.0003 -0.0060 0.0006 257 VAL 34 CG2 -0.0017 -0.0021 0.0014 258 VAL 35 N 0.0079 -0.0067 -0.0011 259 VAL 35 CA 0.0087 -0.0070 -0.0005 260 VAL 35 C 0.0094 -0.0069 -0.0008 261 VAL 35 O 0.0097 -0.0065 -0.0015 262 VAL 35 CB 0.0090 -0.0070 -0.0006 263 VAL 35 CG1 0.0099 -0.0072 0.0000 264 VAL 35 CG2 0.0083 -0.0071 -0.0002 265 VAL 36 N 0.0151 -0.0007 -0.0039 266 VAL 36 CA 0.0137 -0.0013 -0.0035 267 VAL 36 C 0.0131 -0.0022 -0.0046 268 VAL 36 O 0.0133 -0.0026 -0.0058 269 VAL 36 CB 0.0129 -0.0016 -0.0031 270 VAL 36 CG1 0.0115 -0.0020 -0.0022 271 VAL 36 CG2 0.0137 -0.0009 -0.0024 272 GLY 37 N 0.0138 -0.0032 -0.0049 273 GLY 37 CA 0.0143 -0.0042 -0.0053 274 GLY 37 C 0.0144 -0.0042 -0.0066 275 GLY 37 O 0.0141 -0.0034 -0.0073 276 LEU 38 N 0.0134 -0.0033 -0.0177 277 LEU 38 CA 0.0139 -0.0042 -0.0222 278 LEU 38 C 0.0147 -0.0065 -0.0233 279 LEU 38 O 0.0159 -0.0102 -0.0224 280 LEU 38 CB 0.0148 -0.0067 -0.0233 281 LEU 38 CG 0.0154 -0.0080 -0.0280 282 LEU 38 CD1 0.0144 -0.0044 -0.0312 283 LEU 38 CD2 0.0163 -0.0104 -0.0285 284 ASN 39 N 0.0143 -0.0012 -0.0138 285 ASN 39 CA 0.0120 0.0045 -0.0096 286 ASN 39 C 0.0036 0.0050 -0.0079 287 ASN 39 O 0.0010 0.0013 -0.0099 288 ASN 39 CB 0.0173 0.0107 -0.0063 289 ASN 39 CG 0.0188 0.0112 -0.0062 290 ASN 39 OD1 0.0136 0.0118 -0.0049 291 ASN 39 ND2 0.0263 0.0109 -0.0076 292 PRO 40 N 0.0021 0.0114 0.0001 293 PRO 40 CA -0.0116 0.0139 0.0013 294 PRO 40 C -0.0160 0.0184 0.0054 295 PRO 40 O -0.0258 0.0162 0.0023 296 PRO 40 CB -0.0142 0.0200 0.0071 297 PRO 40 CG -0.0042 0.0164 0.0045 298 PRO 40 CD 0.0075 0.0141 0.0033 299 GLU 41 N -0.0107 0.0338 0.0062 300 GLU 41 CA -0.0077 0.0337 0.0047 301 GLU 41 C -0.0046 0.0263 0.0025 302 GLU 41 O -0.0060 0.0229 0.0030 303 GLU 41 CB -0.0023 0.0401 0.0025 304 GLU 41 CG 0.0004 0.0418 0.0012 305 GLU 41 CD 0.0062 0.0478 -0.0012 306 GLU 41 OE1 0.0087 0.0498 -0.0023 307 GLU 41 OE2 0.0082 0.0503 -0.0020 308 ALA 42 N 0.0022 0.0138 -0.0041 309 ALA 42 CA 0.0058 0.0054 -0.0058 310 ALA 42 C -0.0006 -0.0017 -0.0042 311 ALA 42 O 0.0005 -0.0066 -0.0049 312 ALA 42 CB 0.0112 0.0024 -0.0077 313 VAL 43 N -0.0047 -0.0072 -0.0031 314 VAL 43 CA -0.0122 -0.0124 -0.0036 315 VAL 43 C -0.0191 -0.0110 -0.0002 316 VAL 43 O -0.0230 -0.0160 -0.0019 317 VAL 43 CB -0.0148 -0.0120 -0.0024 318 VAL 43 CG1 -0.0233 -0.0164 -0.0020 319 VAL 43 CG2 -0.0087 -0.0148 -0.0064 320 GLU 44 N -0.0232 -0.0127 0.0020 321 GLU 44 CA -0.0422 0.0008 0.0082 322 GLU 44 C -0.0219 0.0008 0.0035 323 GLU 44 O -0.0349 -0.0104 0.0050 324 GLU 44 CB -0.0562 0.0367 0.0160 325 GLU 44 CG -0.0839 0.0324 0.0219 326 GLU 44 CD -0.0954 0.0666 0.0289 327 GLU 44 OE1 -0.1053 0.0902 0.0343 328 GLU 44 OE2 -0.0953 0.0688 0.0292 329 GLU 45 N -0.0120 0.0073 0.0052 330 GLU 45 CA -0.0063 0.0062 0.0033 331 GLU 45 C -0.0050 -0.0043 0.0006 332 GLU 45 O -0.0053 -0.0069 0.0001 333 GLU 45 CB 0.0034 0.0117 0.0018 334 GLU 45 CG 0.0026 0.0228 0.0044 335 GLU 45 CD 0.0004 0.0267 0.0059 336 GLU 45 OE1 0.0073 0.0303 0.0047 337 GLU 45 OE2 -0.0080 0.0258 0.0081 338 ALA 46 N -0.0066 -0.0083 0.0060 339 ALA 46 CA -0.0062 -0.0127 0.0061 340 ALA 46 C -0.0092 -0.0145 0.0074 341 ALA 46 O -0.0085 -0.0172 0.0073 342 ALA 46 CB -0.0060 -0.0146 0.0062 343 GLN 47 N -0.0203 -0.0236 0.0113 344 GLN 47 CA -0.0175 -0.0235 0.0116 345 GLN 47 C -0.0127 -0.0226 0.0077 346 GLN 47 O -0.0091 -0.0226 0.0082 347 GLN 47 CB -0.0216 -0.0234 0.0103 348 GLN 47 CG -0.0266 -0.0243 0.0141 349 GLN 47 CD -0.0289 -0.0244 0.0140 350 GLN 47 OE1 -0.0264 -0.0248 0.0166 351 GLN 47 NE2 -0.0335 -0.0240 0.0109 352 VAL 48 N -0.0098 -0.0096 0.0035 353 VAL 48 CA -0.0078 -0.0076 0.0028 354 VAL 48 C -0.0052 -0.0082 0.0044 355 VAL 48 O -0.0040 -0.0075 0.0044 356 VAL 48 CB -0.0074 -0.0058 0.0015 357 VAL 48 CG1 -0.0051 -0.0038 0.0008 358 VAL 48 CG2 -0.0099 -0.0050 -0.0003 359 LEU 49 N 0.0004 -0.0046 0.0025 360 LEU 49 CA 0.0011 -0.0047 0.0031 361 LEU 49 C 0.0014 -0.0048 0.0039 362 LEU 49 O 0.0022 -0.0048 0.0042 363 LEU 49 CB 0.0006 -0.0048 0.0034 364 LEU 49 CG 0.0005 -0.0046 0.0025 365 LEU 49 CD1 -0.0001 -0.0048 0.0028 366 LEU 49 CD2 0.0014 -0.0044 0.0021 367 THR 50 N -0.0051 0.0048 0.0151 368 THR 50 CA -0.0017 0.0081 0.0187 369 THR 50 C 0.0046 0.0097 0.0168 370 THR 50 O 0.0080 0.0127 0.0197 371 THR 50 CB -0.0029 0.0082 0.0198 372 THR 50 OG1 -0.0021 0.0059 0.0149 373 THR 50 CG2 -0.0089 0.0073 0.0228 374 LYS 51 N 0.0066 0.0141 0.0027 375 LYS 51 CA 0.0136 0.0131 0.0010 376 LYS 51 C 0.0095 0.0136 0.0020 377 LYS 51 O 0.0144 0.0135 0.0009 378 LYS 51 CB 0.0175 0.0040 -0.0035 379 LYS 51 CG 0.0220 0.0029 -0.0048 380 LYS 51 CD 0.0241 -0.0067 -0.0090 381 LYS 51 CE 0.0292 -0.0077 -0.0104 382 LYS 51 NZ 0.0232 -0.0122 -0.0110 383 PHE 52 N 0.0088 0.0055 -0.0034 384 PHE 52 CA 0.0065 0.0053 -0.0033 385 PHE 52 C 0.0056 0.0064 -0.0049 386 PHE 52 O 0.0038 0.0069 -0.0057 387 PHE 52 CB 0.0062 0.0040 -0.0015 388 PHE 52 CG 0.0070 0.0029 0.0002 389 PHE 52 CD1 0.0059 0.0023 0.0009 390 PHE 52 CD2 0.0089 0.0023 0.0012 391 PHE 52 CE1 0.0067 0.0012 0.0025 392 PHE 52 CE2 0.0097 0.0012 0.0028 393 PHE 52 CZ 0.0086 0.0006 0.0035 394 ALA 53 N 0.0075 0.0029 -0.0047 395 ALA 53 CA 0.0060 0.0040 -0.0031 396 ALA 53 C 0.0067 0.0060 -0.0020 397 ALA 53 O 0.0080 0.0065 -0.0023 398 ALA 53 CB 0.0041 0.0029 -0.0029 399 SER 54 N 0.0043 0.0021 -0.0026 400 SER 54 CA 0.0050 0.0044 0.0016 401 SER 54 C 0.0018 0.0106 0.0048 402 SER 54 O 0.0035 0.0128 0.0103 403 SER 54 CB 0.0037 0.0035 -0.0017 404 SER 54 OG 0.0072 -0.0023 -0.0036 405 THR 55 N 0.0062 0.0083 0.0098 406 THR 55 CA 0.0031 0.0100 0.0112 407 THR 55 C 0.0003 0.0077 0.0082 408 THR 55 O -0.0012 0.0057 0.0058 409 THR 55 CB -0.0001 0.0125 0.0135 410 THR 55 OG1 0.0022 0.0148 0.0165 411 THR 55 CG2 -0.0032 0.0141 0.0148 412 VAL 56 N -0.0040 0.0089 0.0121 413 VAL 56 CA -0.0042 0.0055 0.0127 414 VAL 56 C -0.0048 0.0054 0.0131 415 VAL 56 O -0.0031 0.0059 0.0118 416 VAL 56 CB -0.0018 0.0035 0.0110 417 VAL 56 CG1 -0.0020 -0.0001 0.0115 418 VAL 56 CG2 -0.0012 0.0036 0.0105 419 HIS 57 N -0.0006 0.0025 0.0107 420 HIS 57 CA -0.0009 0.0043 0.0100 421 HIS 57 C 0.0003 0.0033 0.0106 422 HIS 57 O -0.0006 0.0013 0.0110 423 HIS 57 CB -0.0038 0.0048 0.0092 424 HIS 57 CG -0.0052 0.0059 0.0085 425 HIS 57 ND1 -0.0047 0.0085 0.0079 426 HIS 57 CD2 -0.0069 0.0047 0.0084 427 HIS 57 CE1 -0.0062 0.0088 0.0074 428 HIS 57 NE2 -0.0075 0.0066 0.0077 429 TRP 58 N 0.0084 -0.0003 0.0100 430 TRP 58 CA 0.0073 -0.0041 0.0082 431 TRP 58 C 0.0047 -0.0062 0.0105 432 TRP 58 O 0.0044 -0.0055 0.0117 433 TRP 58 CB 0.0091 -0.0046 0.0046 434 TRP 58 CG 0.0085 -0.0084 0.0020 435 TRP 58 CD1 0.0069 -0.0111 0.0020 436 TRP 58 CD2 0.0093 -0.0099 -0.0008 437 TRP 58 NE1 0.0068 -0.0141 -0.0007 438 TRP 58 CE2 0.0082 -0.0135 -0.0025 439 TRP 58 CE3 0.0109 -0.0085 -0.0021 440 TRP 58 CZ2 0.0087 -0.0156 -0.0053 441 TRP 58 CZ3 0.0113 -0.0107 -0.0050 442 TRP 58 CH2 0.0102 -0.0142 -0.0066 443 ILE 59 N 0.0063 -0.0024 0.0047 444 ILE 59 CA 0.0033 -0.0026 0.0058 445 ILE 59 C 0.0047 -0.0059 0.0049 446 ILE 59 O 0.0050 -0.0098 0.0043 447 ILE 59 CB -0.0011 -0.0039 0.0073 448 ILE 59 CG1 -0.0026 -0.0003 0.0083 449 ILE 59 CG2 -0.0041 -0.0045 0.0084 450 ILE 59 CD1 -0.0067 -0.0016 0.0097 451 THR 60 N 0.0089 -0.0055 0.0022 452 THR 60 CA 0.0106 -0.0073 0.0017 453 THR 60 C 0.0078 -0.0059 0.0023 454 THR 60 O 0.0063 -0.0021 0.0031 455 THR 60 CB 0.0155 -0.0061 0.0012 456 THR 60 OG1 0.0163 -0.0015 0.0017 457 THR 60 CG2 0.0184 -0.0074 0.0006 458 PRO 61 N 0.0097 -0.0037 -0.0003 459 PRO 61 CA 0.0076 -0.0041 0.0010 460 PRO 61 C 0.0067 -0.0041 0.0020 461 PRO 61 O 0.0050 -0.0043 0.0032 462 PRO 61 CB 0.0061 -0.0050 -0.0007 463 PRO 61 CG 0.0070 -0.0053 -0.0029 464 PRO 61 CD 0.0095 -0.0044 -0.0026 465 LYS 62 N 0.0145 0.0033 0.0001 466 LYS 62 CA -0.0048 -0.0006 0.0194 467 LYS 62 C 0.0177 0.0007 0.0241 468 LYS 62 O 0.0446 0.0046 0.0096 469 LYS 62 CB -0.0387 -0.0013 0.0024 470 LYS 62 CG -0.0352 0.0028 -0.0297 471 LYS 62 CD -0.0683 0.0023 -0.0482 472 LYS 62 CE -0.0800 0.0041 -0.0711 473 LYS 62 NZ -0.1106 0.0038 -0.0897 474 ASP 63 N 0.0078 0.0072 0.0148 475 ASP 63 CA 0.0199 0.0069 0.0193 476 ASP 63 C 0.0250 0.0050 0.0050 477 ASP 63 O 0.0142 0.0046 -0.0044 478 ASP 63 CB 0.0129 0.0090 0.0344 479 ASP 63 CG 0.0221 0.0089 0.0391 480 ASP 63 OD1 0.0197 0.0080 0.0296 481 ASP 63 OD2 0.0311 0.0097 0.0517 482 PRO 64 N 0.0230 -0.0044 -0.0023 483 PRO 64 CA 0.0249 -0.0040 -0.0099 484 PRO 64 C 0.0234 -0.0049 -0.0130 485 PRO 64 O 0.0240 -0.0050 -0.0197 486 PRO 64 CB 0.0324 -0.0007 -0.0103 487 PRO 64 CG 0.0341 0.0006 -0.0028 488 PRO 64 CD 0.0289 -0.0015 0.0023 489 HIS 65 N 0.0163 0.0035 -0.0094 490 HIS 65 CA 0.0123 0.0033 -0.0095 491 HIS 65 C 0.0057 0.0038 -0.0129 492 HIS 65 O 0.0021 0.0040 -0.0148 493 HIS 65 CB 0.0114 0.0015 -0.0027 494 HIS 65 CG 0.0179 0.0011 0.0004 495 HIS 65 ND1 0.0207 -0.0000 0.0052 496 HIS 65 CD2 0.0217 0.0016 -0.0006 497 HIS 65 CE1 0.0261 -0.0001 0.0071 498 HIS 65 NE2 0.0270 0.0008 0.0037 499 THR 66 N -0.0047 0.0031 -0.0123 500 THR 66 CA -0.0224 0.0063 -0.0285 501 THR 66 C -0.0185 0.0088 -0.0506 502 THR 66 O -0.0344 0.0112 -0.0619 503 THR 66 CB -0.0274 0.0073 -0.0338 504 THR 66 OG1 -0.0081 0.0070 -0.0413 505 THR 66 CG2 -0.0370 0.0054 -0.0138 506 LEU 67 N 0.0080 -0.0058 -0.0407 507 LEU 67 CA 0.0074 -0.0063 -0.0378 508 LEU 67 C 0.0067 -0.0070 -0.0355 509 LEU 67 O 0.0057 -0.0081 -0.0332 510 LEU 67 CB 0.0058 -0.0084 -0.0380 511 LEU 67 CG 0.0064 -0.0078 -0.0392 512 LEU 67 CD1 0.0047 -0.0100 -0.0389 513 LEU 67 CD2 0.0079 -0.0056 -0.0376 514 ASP 68 N -0.0026 0.0036 -0.0344 515 ASP 68 CA 0.0085 0.0079 -0.0129 516 ASP 68 C 0.0260 -0.0110 -0.0036 517 ASP 68 O 0.0336 -0.0186 0.0009 518 ASP 68 CB 0.0022 0.0208 -0.0100 519 ASP 68 CG 0.0093 0.0330 0.0129 520 ASP 68 OD1 0.0194 0.0271 0.0231 521 ASP 68 OD2 0.0045 0.0484 0.0204 522 GLY 69 N 0.0120 -0.0089 -0.0086 523 GLY 69 CA 0.0069 -0.0160 -0.0041 524 GLY 69 C 0.0040 -0.0205 -0.0028 525 GLY 69 O -0.0004 -0.0272 -0.0010 526 HIS 70 N -0.0282 -0.0277 -0.0123 527 HIS 70 CA -0.0249 -0.0216 -0.0129 528 HIS 70 C -0.0196 -0.0223 -0.0109 529 HIS 70 O -0.0181 -0.0184 -0.0115 530 HIS 70 CB -0.0227 -0.0184 -0.0131 531 HIS 70 CG -0.0218 -0.0113 -0.0148 532 HIS 70 ND1 -0.0163 -0.0084 -0.0137 533 HIS 70 CD2 -0.0258 -0.0070 -0.0173 534 HIS 70 CE1 -0.0170 -0.0023 -0.0157 535 HIS 70 NE2 -0.0227 -0.0012 -0.0179 536 ALA 71 N -0.0014 -0.0193 -0.0046 537 ALA 71 CA 0.0010 -0.0207 -0.0045 538 ALA 71 C 0.0033 -0.0216 -0.0004 539 ALA 71 O 0.0055 -0.0229 -0.0001 540 ALA 71 CB -0.0015 -0.0193 -0.0051 541 ASP 72 N 0.0103 -0.0231 0.0053 542 ASP 72 CA 0.0128 -0.0183 0.0057 543 ASP 72 C 0.0131 -0.0205 0.0059 544 ASP 72 O 0.0114 -0.0169 0.0053 545 ASP 72 CB 0.0194 -0.0163 0.0073 546 ASP 72 CG 0.0193 -0.0124 0.0071 547 ASP 72 OD1 0.0144 -0.0118 0.0058 548 ASP 72 OD2 0.0244 -0.0100 0.0083 549 GLU 73 N 0.0346 -0.0215 0.0044 550 GLU 73 CA 0.0175 -0.0223 0.0073 551 GLU 73 C -0.0058 -0.0205 0.0082 552 GLU 73 O -0.0206 -0.0119 0.0004 553 GLU 73 CB 0.0212 -0.0372 0.0235 554 GLU 73 CG 0.0063 -0.0386 0.0269 555 GLU 73 CD 0.0102 -0.0536 0.0432 556 GLU 73 OE1 0.0250 -0.0631 0.0520 557 GLU 73 OE2 -0.0017 -0.0554 0.0467 558 LEU 74 N -0.0096 -0.0213 0.0069 559 LEU 74 CA -0.0106 -0.0204 0.0094 560 LEU 74 C -0.0111 -0.0189 0.0115 561 LEU 74 O -0.0110 -0.0166 0.0129 562 LEU 74 CB -0.0122 -0.0230 0.0104 563 LEU 74 CG -0.0135 -0.0224 0.0132 564 LEU 74 CD1 -0.0127 -0.0204 0.0132 565 LEU 74 CD2 -0.0151 -0.0251 0.0139 566 LEU 75 N 0.0018 -0.0143 0.0135 567 LEU 75 CA 0.0009 -0.0114 0.0104 568 LEU 75 C 0.0004 -0.0094 0.0083 569 LEU 75 O -0.0013 -0.0071 0.0058 570 LEU 75 CB 0.0044 -0.0102 0.0093 571 LEU 75 CG 0.0043 -0.0115 0.0107 572 LEU 75 CD1 0.0083 -0.0107 0.0100 573 LEU 75 CD2 0.0006 -0.0106 0.0095 574 ALA 76 N -0.0035 -0.0079 0.0055 575 ALA 76 CA 0.0026 0.0051 0.0011 576 ALA 76 C 0.0117 0.0239 0.0056 577 ALA 76 O 0.0176 0.0361 0.0053 578 ALA 76 CB 0.0015 0.0039 -0.0208 579 HIS 77 N 0.0058 0.0169 0.0217 580 HIS 77 CA 0.0021 0.0216 0.0245 581 HIS 77 C -0.0030 0.0279 0.0281 582 HIS 77 O -0.0060 0.0256 0.0322 583 HIS 77 CB -0.0002 0.0157 0.0288 584 HIS 77 CG -0.0023 0.0197 0.0299 585 HIS 77 ND1 -0.0075 0.0253 0.0339 586 HIS 77 CD2 0.0003 0.0192 0.0271 587 HIS 77 CE1 -0.0080 0.0281 0.0336 588 HIS 77 NE2 -0.0034 0.0247 0.0295 589 PRO 78 N 0.0179 0.0341 0.0266 590 PRO 78 CA 0.0039 0.0382 0.0020 591 PRO 78 C 0.0071 0.0477 0.0696 592 PRO 78 O 0.0099 0.0437 0.0557 593 PRO 78 CB -0.0695 0.0743 -0.0400 594 PRO 78 CG -0.0808 0.0769 -0.0639 595 PRO 78 CD -0.0402 0.0641 0.0023 596 SER 79 N -0.0054 0.0263 0.0340 597 SER 79 CA -0.0067 0.0258 0.0343 598 SER 79 C -0.0091 0.0248 0.0347 599 SER 79 O -0.0105 0.0245 0.0352 600 SER 79 CB -0.0060 0.0247 0.0325 601 SER 79 OG -0.0037 0.0256 0.0320 602 VAL 80 N -0.0076 0.0188 0.0305 603 VAL 80 CA -0.0061 0.0129 0.0335 604 VAL 80 C -0.0059 0.0117 0.0345 605 VAL 80 O -0.0053 0.0125 0.0303 606 VAL 80 CB -0.0036 0.0080 0.0299 607 VAL 80 CG1 -0.0019 0.0016 0.0326 608 VAL 80 CG2 -0.0040 0.0088 0.0304 609 LYS 81 N 0.0074 0.0132 0.0174 610 LYS 81 CA 0.0056 0.0150 0.0182 611 LYS 81 C 0.0050 0.0115 0.0187 612 LYS 81 O 0.0032 0.0084 0.0197 613 LYS 81 CB 0.0018 0.0172 0.0200 614 LYS 81 CG 0.0023 0.0213 0.0196 615 LYS 81 CD -0.0014 0.0239 0.0212 616 LYS 81 CE -0.0009 0.0282 0.0208 617 LYS 81 NZ -0.0008 0.0280 0.0208 618 LEU 82 N 0.0161 0.0084 0.0136 619 LEU 82 CA 0.0157 0.0056 0.0138 620 LEU 82 C 0.0106 0.0081 0.0145 621 LEU 82 O 0.0102 0.0133 0.0143 622 LEU 82 CB 0.0213 0.0064 0.0129 623 LEU 82 CG 0.0211 0.0038 0.0130 624 LEU 82 CD1 0.0204 -0.0029 0.0134 625 LEU 82 CD2 0.0265 0.0056 0.0121 626 TRP 83 N -0.0008 0.0057 0.0096 627 TRP 83 CA -0.0018 0.0062 0.0095 628 TRP 83 C -0.0010 0.0056 0.0097 629 TRP 83 O -0.0015 0.0045 0.0101 630 TRP 83 CB -0.0035 0.0056 0.0098 631 TRP 83 CG -0.0043 0.0061 0.0097 632 TRP 83 CD1 -0.0043 0.0054 0.0099 633 TRP 83 CD2 -0.0050 0.0075 0.0092 634 TRP 83 NE1 -0.0051 0.0063 0.0096 635 TRP 83 CE2 -0.0055 0.0076 0.0092 636 TRP 83 CE3 -0.0053 0.0087 0.0087 637 TRP 83 CZ2 -0.0063 0.0088 0.0087 638 TRP 83 CZ3 -0.0061 0.0100 0.0083 639 TRP 83 CH2 -0.0066 0.0101 0.0083 640 GLU 84 N 0.0044 0.0041 0.0066 641 GLU 84 CA 0.0075 0.0076 0.0080 642 GLU 84 C 0.0040 0.0121 0.0038 643 GLU 84 O 0.0006 0.0154 0.0000 644 GLU 84 CB 0.0134 0.0123 0.0112 645 GLU 84 CG 0.0129 0.0190 0.0087 646 GLU 84 CD 0.0184 0.0245 0.0114 647 GLU 84 OE1 0.0230 0.0228 0.0157 648 GLU 84 OE2 0.0180 0.0309 0.0091 649 LYS 85 N -0.0003 0.0123 0.0022 650 LYS 85 CA 0.0036 0.0142 -0.0004 651 LYS 85 C -0.0149 0.0138 -0.0011 652 LYS 85 O -0.0164 0.0200 -0.0104 653 LYS 85 CB 0.0158 0.0250 -0.0156 654 LYS 85 CG 0.0351 0.0267 -0.0167 655 LYS 85 CD 0.0495 0.0353 -0.0285 656 LYS 85 CE 0.0604 0.0430 -0.0391 657 LYS 85 NZ 0.0491 0.0527 -0.0542 658 THR 86 N -0.0118 0.0095 0.0043 659 THR 86 CA -0.0192 0.0087 0.0040 660 THR 86 C -0.0207 0.0029 0.0085 661 THR 86 O -0.0172 -0.0009 0.0122 662 THR 86 CB -0.0248 0.0099 0.0021 663 THR 86 OG1 -0.0258 0.0059 0.0053 664 THR 86 CG2 -0.0226 0.0155 -0.0022 665 ARG 87 N -0.0262 0.0031 0.0217 666 ARG 87 CA -0.0252 0.0052 0.0223 667 ARG 87 C -0.0225 0.0093 0.0244 668 ARG 87 O -0.0205 0.0090 0.0275 669 ARG 87 CB -0.0246 0.0017 0.0248 670 ARG 87 CG -0.0250 0.0027 0.0236 671 ARG 87 CD -0.0230 0.0017 0.0272 672 ARG 87 NE -0.0237 -0.0034 0.0285 673 ARG 87 CZ -0.0251 -0.0060 0.0277 674 ARG 87 NH1 -0.0261 -0.0043 0.0253 675 ARG 87 NH2 -0.0254 -0.0105 0.0293 676 LEU 88 N -0.0105 -0.0030 0.0245 677 LEU 88 CA -0.0079 -0.0038 0.0227 678 LEU 88 C -0.0086 -0.0032 0.0205 679 LEU 88 O -0.0103 -0.0021 0.0186 680 LEU 88 CB -0.0066 -0.0041 0.0210 681 LEU 88 CG -0.0040 -0.0049 0.0188 682 LEU 88 CD1 -0.0016 -0.0061 0.0203 683 LEU 88 CD2 -0.0028 -0.0052 0.0176 684 ILE 89 N 0.0045 -0.0018 0.0250 685 ILE 89 CA 0.0072 0.0004 0.0199 686 ILE 89 C 0.0056 -0.0021 0.0199 687 ILE 89 O 0.0078 0.0007 0.0186 688 ILE 89 CB 0.0080 -0.0013 0.0129 689 ILE 89 CG1 0.0094 0.0008 0.0125 690 ILE 89 CG2 0.0108 0.0009 0.0074 691 ILE 89 CD1 0.0131 0.0074 0.0143 692 ARG 90 N 0.0043 -0.0164 0.0164 693 ARG 90 CA 0.0033 -0.0136 0.0194 694 ARG 90 C -0.0035 -0.0125 0.0195 695 ARG 90 O -0.0072 -0.0150 0.0159 696 ARG 90 CB 0.0066 -0.0157 0.0177 697 ARG 90 CG 0.0072 -0.0130 0.0207 698 ARG 90 CD 0.0122 -0.0152 0.0192 699 ARG 90 NE 0.0183 -0.0153 0.0202 700 ARG 90 CZ 0.0219 -0.0187 0.0169 701 ARG 90 NH1 0.0207 -0.0226 0.0124 702 ARG 90 NH2 0.0270 -0.0182 0.0184 703 ILE 91 N -0.0016 -0.0128 0.0131 704 ILE 91 CA -0.0004 -0.0132 0.0130 705 ILE 91 C 0.0005 -0.0135 0.0126 706 ILE 91 O 0.0003 -0.0133 0.0117 707 ILE 91 CB -0.0005 -0.0131 0.0120 708 ILE 91 CG1 -0.0014 -0.0128 0.0125 709 ILE 91 CG2 0.0008 -0.0135 0.0119 710 ILE 91 CD1 -0.0018 -0.0125 0.0115 711 LYS 92 N -0.0121 -0.0234 0.0053 712 LYS 92 CA -0.0135 -0.0218 0.0072 713 LYS 92 C -0.0137 -0.0198 0.0069 714 LYS 92 O -0.0128 -0.0190 0.0050 715 LYS 92 CB -0.0138 -0.0203 0.0072 716 LYS 92 CG -0.0138 -0.0219 0.0077 717 LYS 92 CD -0.0140 -0.0201 0.0074 718 LYS 92 CE -0.0150 -0.0205 0.0094 719 LYS 92 NZ -0.0144 -0.0229 0.0093 720 GLY 93 N -0.0072 -0.0200 -0.0038 721 GLY 93 CA -0.0088 -0.0181 -0.0035 722 GLY 93 C -0.0062 -0.0171 -0.0026 723 GLY 93 O -0.0032 -0.0186 -0.0024 724 GLU 94 N -0.0108 -0.0133 -0.0048 725 GLU 94 CA -0.0073 -0.0092 -0.0014 726 GLU 94 C -0.0065 -0.0077 -0.0071 727 GLU 94 O -0.0088 -0.0101 -0.0132 728 GLU 94 CB -0.0027 -0.0035 0.0007 729 GLU 94 CG -0.0031 -0.0044 0.0062 730 GLU 94 CD 0.0016 0.0014 0.0077 731 GLU 94 OE1 0.0028 0.0024 0.0143 732 GLU 94 OE2 0.0040 0.0048 0.0022 733 GLU 95 N -0.0047 -0.0006 0.0001 734 GLU 95 CA -0.0038 0.0018 -0.0043 735 GLU 95 C -0.0039 0.0035 -0.0088 736 GLU 95 O -0.0058 0.0036 -0.0131 737 GLU 95 CB 0.0005 0.0049 -0.0028 738 GLU 95 CG 0.0016 0.0074 -0.0069 739 GLU 95 CD -0.0002 0.0058 -0.0069 740 GLU 95 OE1 0.0010 0.0054 -0.0030 741 GLU 95 OE2 -0.0029 0.0050 -0.0107 742 ALA 96 N -0.0048 0.0074 -0.0103 743 ALA 96 CA -0.0063 0.0098 -0.0161 744 ALA 96 C -0.0061 0.0051 -0.0209 745 ALA 96 O -0.0069 0.0061 -0.0242 746 ALA 96 CB -0.0075 0.0133 -0.0185 747 GLY 97 N -0.0070 -0.0016 -0.0183 748 GLY 97 CA -0.0081 -0.0069 -0.0226 749 GLY 97 C -0.0089 -0.0103 -0.0214 750 GLY 97 O -0.0090 -0.0098 -0.0164 751 VAL 98 N -0.0090 -0.0095 -0.0119 752 VAL 98 CA -0.0086 -0.0095 -0.0124 753 VAL 98 C -0.0090 -0.0095 -0.0130 754 VAL 98 O -0.0095 -0.0095 -0.0130 755 VAL 98 CB -0.0082 -0.0095 -0.0123 756 VAL 98 CG1 -0.0078 -0.0095 -0.0129 757 VAL 98 CG2 -0.0078 -0.0095 -0.0118 758 THR 99 N -0.0224 -0.0096 -0.0041 759 THR 99 CA -0.0211 -0.0098 -0.0014 760 THR 99 C -0.0232 -0.0101 0.0007 761 THR 99 O -0.0224 -0.0103 0.0027 762 THR 99 CB -0.0196 -0.0099 -0.0001 763 THR 99 OG1 -0.0214 -0.0100 0.0002 764 THR 99 CG2 -0.0171 -0.0096 -0.0020 765 ALA 100 N -0.0269 -0.0175 0.0086 766 ALA 100 CA -0.0250 -0.0174 0.0068 767 ALA 100 C -0.0222 -0.0170 0.0079 768 ALA 100 O -0.0215 -0.0168 0.0100 769 ALA 100 CB -0.0248 -0.0176 0.0042 770 VAL 101 N -0.0172 -0.0154 0.0088 771 VAL 101 CA -0.0153 -0.0146 0.0091 772 VAL 101 C -0.0141 -0.0149 0.0072 773 VAL 101 O -0.0148 -0.0157 0.0058 774 VAL 101 CB -0.0152 -0.0141 0.0103 775 VAL 101 CG1 -0.0161 -0.0137 0.0123 776 VAL 101 CG2 -0.0161 -0.0148 0.0094 777 GLU 102 N -0.0106 -0.0178 0.0129 778 GLU 102 CA -0.0051 -0.0201 0.0072 779 GLU 102 C -0.0036 -0.0173 0.0093 780 GLU 102 O -0.0008 -0.0116 0.0136 781 GLU 102 CB 0.0025 -0.0179 0.0051 782 GLU 102 CG 0.0089 -0.0203 -0.0012 783 GLU 102 CD 0.0164 -0.0174 -0.0025 784 GLU 102 OE1 0.0161 -0.0151 0.0001 785 GLU 102 OE2 0.0227 -0.0173 -0.0061 786 VAL 103 N -0.0060 -0.0065 0.0034 787 VAL 103 CA -0.0057 -0.0046 0.0050 788 VAL 103 C -0.0025 -0.0057 0.0013 789 VAL 103 O -0.0018 -0.0091 -0.0024 790 VAL 103 CB -0.0105 -0.0059 0.0077 791 VAL 103 CG1 -0.0137 -0.0046 0.0116 792 VAL 103 CG2 -0.0130 -0.0108 0.0049 793 ARG 104 N -0.0139 0.0123 0.0033 794 ARG 104 CA -0.0135 0.0076 0.0045 795 ARG 104 C -0.0282 0.0135 0.0123 796 ARG 104 O -0.0351 0.0276 0.0124 797 ARG 104 CB -0.0017 0.0154 -0.0058 798 ARG 104 CG -0.0004 0.0120 -0.0055 799 ARG 104 CD 0.0085 0.0232 -0.0150 800 ARG 104 NE 0.0241 0.0179 -0.0236 801 ARG 104 CZ 0.0349 0.0259 -0.0332 802 ARG 104 NH1 0.0323 0.0404 -0.0361 803 ARG 104 NH2 0.0486 0.0191 -0.0401 804 HIS 105 N -0.0555 0.0324 -0.0000 805 HIS 105 CA -0.0298 0.0212 -0.0147 806 HIS 105 C -0.0157 0.0026 -0.0019 807 HIS 105 O -0.0240 0.0051 0.0047 808 HIS 105 CB -0.0261 0.0354 -0.0431 809 HIS 105 CG -0.0062 0.0324 -0.0637 810 HIS 105 ND1 -0.0113 0.0425 -0.0741 811 HIS 105 CD2 0.0174 0.0207 -0.0748 812 HIS 105 CE1 0.0094 0.0369 -0.0914 813 HIS 105 NE2 0.0275 0.0236 -0.0927 814 PRO 106 N -0.0226 0.0028 -0.0071 815 PRO 106 CA -0.0146 -0.0065 -0.0005 816 PRO 106 C -0.0102 -0.0119 -0.0048 817 PRO 106 O -0.0084 -0.0141 -0.0163 818 PRO 106 CB -0.0094 -0.0128 -0.0030 819 PRO 106 CG -0.0160 -0.0050 -0.0051 820 PRO 106 CD -0.0231 0.0033 -0.0122 821 GLY 107 N -0.0662 0.0041 -0.0235 822 GLY 107 CA -0.0789 0.0051 -0.0039 823 GLY 107 C -0.0501 -0.0187 0.0141 824 GLY 107 O -0.0546 -0.0178 0.0197 825 GLU 108 N -0.0025 -0.0278 0.0079 826 GLU 108 CA -0.0075 -0.0163 0.0080 827 GLU 108 C -0.0043 -0.0102 0.0340 828 GLU 108 O -0.0020 -0.0135 0.0379 829 GLU 108 CB -0.0208 0.0066 -0.0060 830 GLU 108 CG -0.0251 0.0013 -0.0353 831 GLU 108 CD -0.0235 -0.0077 -0.0458 832 GLU 108 OE1 -0.0209 -0.0063 -0.0315 833 GLU 108 OE2 -0.0252 -0.0156 -0.0689 834 SER 109 N -0.0103 -0.0159 0.0111 835 SER 109 CA 0.0230 -0.0096 0.0138 836 SER 109 C 0.0204 -0.0102 0.0135 837 SER 109 O 0.0389 0.0083 0.0200 838 SER 109 CB 0.0548 -0.0302 0.0075 839 SER 109 OG 0.0867 -0.0157 0.0129 840 ASP 110 N 0.0003 -0.0023 0.0055 841 ASP 110 CA 0.0152 0.0101 0.0076 842 ASP 110 C 0.0426 0.0007 -0.0122 843 ASP 110 O 0.0588 -0.0043 -0.0235 844 ASP 110 CB 0.0233 0.0399 0.0257 845 ASP 110 CG -0.0043 0.0497 0.0458 846 ASP 110 OD1 -0.0171 0.0465 0.0495 847 ASP 110 OD2 -0.0127 0.0602 0.0575 848 SER 111 N 0.0407 -0.0400 -0.0116 849 SER 111 CA 0.0366 -0.0383 -0.0078 850 SER 111 C 0.0373 -0.0581 0.0012 851 SER 111 O 0.0458 -0.0736 -0.0006 852 SER 111 CB 0.0465 -0.0303 -0.0230 853 SER 111 OG 0.0464 -0.0111 -0.0325 854 GLN 112 N 0.0034 -0.0262 -0.0079 855 GLN 112 CA -0.0056 -0.0220 -0.0128 856 GLN 112 C -0.0123 -0.0189 -0.0041 857 GLN 112 O -0.0092 -0.0203 0.0028 858 GLN 112 CB -0.0039 -0.0228 -0.0211 859 GLN 112 CG -0.0116 -0.0192 -0.0300 860 GLN 112 CD -0.0124 -0.0189 -0.0349 861 GLN 112 OE1 -0.0166 -0.0169 -0.0303 862 GLN 112 NE2 -0.0083 -0.0208 -0.0446 863 GLU 113 N -0.0156 -0.0241 -0.0125 864 GLU 113 CA -0.0196 -0.0208 -0.0077 865 GLU 113 C -0.0251 -0.0188 -0.0104 866 GLU 113 O -0.0281 -0.0187 -0.0155 867 GLU 113 CB -0.0215 -0.0190 -0.0046 868 GLU 113 CG -0.0248 -0.0156 0.0014 869 GLU 113 CD -0.0247 -0.0144 0.0058 870 GLU 113 OE1 -0.0197 -0.0161 0.0089 871 GLU 113 OE2 -0.0296 -0.0118 0.0064 872 LEU 114 N -0.0245 -0.0040 -0.0053 873 LEU 114 CA -0.0248 -0.0047 -0.0043 874 LEU 114 C -0.0270 -0.0066 -0.0025 875 LEU 114 O -0.0267 -0.0078 -0.0005 876 LEU 114 CB -0.0218 -0.0047 -0.0027 877 LEU 114 CG -0.0194 -0.0029 -0.0043 878 LEU 114 CD1 -0.0164 -0.0031 -0.0025 879 LEU 114 CD2 -0.0201 -0.0021 -0.0061 880 LEU 115 N -0.0145 0.0057 -0.0148 881 LEU 115 CA -0.0253 0.0032 -0.0057 882 LEU 115 C -0.0182 -0.0031 -0.0010 883 LEU 115 O -0.0095 -0.0010 -0.0085 884 LEU 115 CB -0.0386 0.0127 -0.0114 885 LEU 115 CG -0.0465 0.0196 -0.0164 886 LEU 115 CD1 -0.0548 0.0305 -0.0266 887 LEU 115 CD2 -0.0573 0.0159 -0.0056 888 ALA 116 N -0.0144 -0.0039 -0.0050 889 ALA 116 CA -0.0124 -0.0059 -0.0059 890 ALA 116 C -0.0133 -0.0081 -0.0062 891 ALA 116 O -0.0157 -0.0086 -0.0058 892 ALA 116 CB -0.0121 -0.0072 -0.0063 893 GLU 117 N -0.0064 -0.0067 -0.0113 894 GLU 117 CA -0.0056 -0.0067 -0.0131 895 GLU 117 C -0.0066 -0.0090 -0.0164 896 GLU 117 O -0.0068 -0.0097 -0.0178 897 GLU 117 CB -0.0022 -0.0043 -0.0140 898 GLU 117 CG -0.0010 -0.0020 -0.0107 899 GLU 117 CD 0.0022 0.0005 -0.0112 900 GLU 117 OE1 0.0028 0.0011 -0.0113 901 GLU 117 OE2 0.0041 0.0019 -0.0118 902 GLY 118 N 0.0009 -0.0090 -0.0113 903 GLY 118 CA 0.0015 -0.0083 -0.0099 904 GLY 118 C 0.0026 -0.0071 -0.0102 905 GLY 118 O 0.0028 -0.0069 -0.0106 906 VAL 119 N 0.0081 -0.0038 -0.0085 907 VAL 119 CA 0.0069 -0.0048 -0.0084 908 VAL 119 C 0.0066 -0.0054 -0.0099 909 VAL 119 O 0.0065 -0.0055 -0.0105 910 VAL 119 CB 0.0061 -0.0053 -0.0073 911 VAL 119 CG1 0.0049 -0.0062 -0.0072 912 VAL 119 CG2 0.0065 -0.0046 -0.0058 913 PHE 120 N 0.0150 -0.0005 -0.0112 914 PHE 120 CA 0.0139 0.0019 -0.0094 915 PHE 120 C 0.0149 0.0034 -0.0095 916 PHE 120 O 0.0145 0.0022 -0.0097 917 PHE 120 CB 0.0110 0.0010 -0.0079 918 PHE 120 CG 0.0100 -0.0002 -0.0076 919 PHE 120 CD1 0.0099 -0.0030 -0.0088 920 PHE 120 CD2 0.0090 0.0015 -0.0062 921 PHE 120 CE1 0.0088 -0.0040 -0.0086 922 PHE 120 CE2 0.0079 0.0005 -0.0060 923 PHE 120 CZ 0.0078 -0.0023 -0.0071 924 VAL 121 N 0.0194 0.0090 -0.0079 925 VAL 121 CA 0.0196 0.0078 -0.0077 926 VAL 121 C 0.0182 0.0083 -0.0085 927 VAL 121 O 0.0182 0.0100 -0.0086 928 VAL 121 CB 0.0213 0.0080 -0.0067 929 VAL 121 CG1 0.0215 0.0067 -0.0065 930 VAL 121 CG2 0.0227 0.0076 -0.0059 931 TYR 122 N 0.0274 0.0113 -0.0099 932 TYR 122 CA 0.0240 0.0145 -0.0086 933 TYR 122 C 0.0263 0.0139 -0.0090 934 TYR 122 O 0.0241 0.0107 -0.0096 935 TYR 122 CB 0.0177 0.0126 -0.0083 936 TYR 122 CG 0.0156 0.0132 -0.0079 937 TYR 122 CD1 0.0149 0.0183 -0.0064 938 TYR 122 CD2 0.0145 0.0085 -0.0090 939 TYR 122 CE1 0.0133 0.0189 -0.0060 940 TYR 122 CE2 0.0128 0.0090 -0.0087 941 TYR 122 CZ 0.0123 0.0142 -0.0072 942 TYR 122 OH 0.0108 0.0147 -0.0069 943 LEU 123 N 0.0102 0.0019 -0.0158 944 LEU 123 CA 0.0060 -0.0027 -0.0139 945 LEU 123 C 0.0028 -0.0031 -0.0187 946 LEU 123 O 0.0048 -0.0003 -0.0210 947 LEU 123 CB 0.0077 -0.0042 -0.0077 948 LEU 123 CG 0.0110 -0.0040 -0.0023 949 LEU 123 CD1 0.0132 -0.0049 0.0033 950 LEU 123 CD2 0.0080 -0.0076 -0.0005 951 GLN 124 N -0.0256 -0.0158 -0.0392 952 GLN 124 CA -0.0190 -0.0180 -0.0313 953 GLN 124 C -0.0223 -0.0148 -0.0367 954 GLN 124 O -0.0257 -0.0064 -0.0462 955 GLN 124 CB -0.0062 -0.0106 -0.0244 956 GLN 124 CG -0.0029 -0.0154 -0.0176 957 GLN 124 CD 0.0092 -0.0069 -0.0123 958 GLN 124 OE1 0.0124 0.0046 -0.0177 959 GLN 124 NE2 0.0159 -0.0129 -0.0013 960 GLY 125 N -0.0156 -0.0109 -0.0238 961 GLY 125 CA 0.0088 0.0010 -0.0243 962 GLY 125 C 0.0199 0.0166 0.0093 963 GLY 125 O 0.0111 0.0193 0.0326 964 SER 126 N 0.0619 0.1039 0.0120 965 SER 126 CA 0.0732 0.0259 0.0188 966 SER 126 C 0.0262 -0.0925 0.0134 967 SER 126 O -0.0059 -0.1535 0.0087 968 SER 126 CB 0.0108 0.0747 0.0012 969 SER 126 OG -0.1068 0.0855 -0.0278 970 LYS 127 N -0.0288 -0.0045 0.0056 971 LYS 127 CA -0.0055 0.0206 -0.0091 972 LYS 127 C 0.0048 0.0452 -0.0409 973 LYS 127 O -0.0065 0.0417 -0.0503 974 LYS 127 CB 0.0277 0.0283 0.0228 975 LYS 127 CG 0.0210 0.0049 0.0576 976 LYS 127 CD 0.0134 0.0025 0.0515 977 LYS 127 CE -0.0114 -0.0275 0.0732 978 LYS 127 NZ -0.0454 -0.0387 0.0465 979 LYS 127 OXT 0.0266 0.0689 -0.0549