1 THR 5 N 0.0001 -0.0205 0.0032 2 THR 5 CA -0.0016 -0.0199 0.0034 3 THR 5 C -0.0070 -0.0193 0.0027 4 THR 5 O -0.0092 -0.0171 0.0043 5 THR 5 CB 0.0005 -0.0228 0.0011 6 THR 5 OG1 0.0022 -0.0260 -0.0015 7 THR 5 CG2 0.0044 -0.0218 0.0029 8 GLU 6 N 0.0018 -0.0096 -0.0137 9 GLU 6 CA -0.0120 -0.0175 -0.0082 10 GLU 6 C -0.0186 -0.0136 0.0031 11 GLU 6 O -0.0270 -0.0121 0.0136 12 GLU 6 CB -0.0169 -0.0306 -0.0181 13 GLU 6 CG -0.0261 -0.0403 -0.0195 14 GLU 6 CD -0.0346 -0.0529 -0.0251 15 GLU 6 OE1 -0.0463 -0.0585 -0.0192 16 GLU 6 OE2 -0.0296 -0.0582 -0.0365 17 GLU 7 N -0.0162 -0.0052 0.0053 18 GLU 7 CA -0.0183 -0.0004 0.0091 19 GLU 7 C -0.0144 -0.0116 0.0097 20 GLU 7 O -0.0153 -0.0094 0.0101 21 GLU 7 CB -0.0225 0.0064 0.0226 22 GLU 7 CG -0.0238 0.0064 0.0326 23 GLU 7 CD -0.0279 0.0131 0.0459 24 GLU 7 OE1 -0.0280 0.0105 0.0539 25 GLU 7 OE2 -0.0313 0.0219 0.0482 26 GLN 8 N -0.0115 -0.0114 0.0115 27 GLN 8 CA -0.0115 -0.0154 0.0104 28 GLN 8 C -0.0123 -0.0167 0.0042 29 GLN 8 O -0.0127 -0.0166 0.0018 30 GLN 8 CB -0.0107 -0.0205 0.0139 31 GLN 8 CG -0.0100 -0.0197 0.0193 32 GLN 8 CD -0.0092 -0.0249 0.0228 33 GLN 8 OE1 -0.0089 -0.0272 0.0241 34 GLN 8 NE2 -0.0089 -0.0267 0.0245 35 ILE 9 N -0.0082 -0.0115 0.0072 36 ILE 9 CA -0.0074 -0.0111 0.0097 37 ILE 9 C -0.0034 -0.0135 0.0090 38 ILE 9 O -0.0030 -0.0138 0.0088 39 ILE 9 CB -0.0084 -0.0090 0.0142 40 ILE 9 CG1 -0.0048 -0.0098 0.0176 41 ILE 9 CG2 -0.0104 -0.0077 0.0150 42 ILE 9 CD1 -0.0040 -0.0089 0.0215 43 ALA 10 N 0.0025 -0.0128 0.0103 44 ALA 10 CA 0.0087 -0.0146 0.0083 45 ALA 10 C 0.0084 -0.0197 0.0030 46 ALA 10 O 0.0127 -0.0218 0.0007 47 ALA 10 CB 0.0104 -0.0129 0.0100 48 GLU 11 N 0.0036 -0.0165 -0.0032 49 GLU 11 CA 0.0023 -0.0233 -0.0110 50 GLU 11 C 0.0017 -0.0269 -0.0151 51 GLU 11 O 0.0065 -0.0305 -0.0215 52 GLU 11 CB -0.0062 -0.0262 -0.0110 53 GLU 11 CG -0.0047 -0.0242 -0.0092 54 GLU 11 CD -0.0134 -0.0253 -0.0070 55 GLU 11 OE1 -0.0183 -0.0217 -0.0006 56 GLU 11 OE2 -0.0154 -0.0304 -0.0124 57 PHE 12 N -0.0086 -0.0119 -0.0025 58 PHE 12 CA -0.0096 -0.0123 -0.0031 59 PHE 12 C -0.0056 -0.0120 -0.0026 60 PHE 12 O -0.0048 -0.0135 -0.0048 61 PHE 12 CB -0.0133 -0.0107 -0.0008 62 PHE 12 CG -0.0177 -0.0116 -0.0020 63 PHE 12 CD1 -0.0205 -0.0100 0.0002 64 PHE 12 CD2 -0.0190 -0.0139 -0.0055 65 PHE 12 CE1 -0.0246 -0.0107 -0.0008 66 PHE 12 CE2 -0.0231 -0.0147 -0.0066 67 PHE 12 CZ -0.0259 -0.0131 -0.0043 68 LYS 13 N 0.0053 -0.0149 0.0006 69 LYS 13 CA 0.0099 -0.0160 0.0047 70 LYS 13 C 0.0144 -0.0189 -0.0004 71 LYS 13 O 0.0152 -0.0192 0.0001 72 LYS 13 CB 0.0144 -0.0167 0.0105 73 LYS 13 CG 0.0162 -0.0160 0.0174 74 LYS 13 CD 0.0173 -0.0151 0.0239 75 LYS 13 CE 0.0107 -0.0116 0.0275 76 LYS 13 NZ 0.0124 -0.0109 0.0342 77 GLU 14 N 0.0181 -0.0235 0.0006 78 GLU 14 CA 0.0290 -0.0270 -0.0136 79 GLU 14 C 0.0139 -0.0128 -0.0249 80 GLU 14 O 0.0151 -0.0136 -0.0254 81 GLU 14 CB 0.0448 -0.0322 -0.0341 82 GLU 14 CG 0.0672 -0.0483 -0.0334 83 GLU 14 CD 0.0811 -0.0541 -0.0474 84 GLU 14 OE1 0.0872 -0.0607 -0.0398 85 GLU 14 OE2 0.0859 -0.0512 -0.0686 86 ALA 15 N 0.0056 -0.0110 -0.0193 87 ALA 15 CA 0.0020 -0.0073 -0.0220 88 ALA 15 C -0.0010 -0.0058 -0.0167 89 ALA 15 O -0.0015 -0.0052 -0.0174 90 ALA 15 CB -0.0010 -0.0039 -0.0258 91 PHE 16 N -0.0057 -0.0022 -0.0058 92 PHE 16 CA -0.0051 -0.0013 -0.0042 93 PHE 16 C -0.0007 -0.0021 -0.0045 94 PHE 16 O -0.0002 -0.0027 -0.0054 95 PHE 16 CB -0.0062 0.0011 -0.0002 96 PHE 16 CG -0.0060 0.0021 0.0017 97 PHE 16 CD1 -0.0023 0.0028 0.0037 98 PHE 16 CD2 -0.0093 0.0025 0.0016 99 PHE 16 CE1 -0.0019 0.0038 0.0055 100 PHE 16 CE2 -0.0091 0.0035 0.0034 101 PHE 16 CZ -0.0053 0.0041 0.0054 102 SER 17 N 0.0036 -0.0055 -0.0084 103 SER 17 CA 0.0042 -0.0054 -0.0086 104 SER 17 C 0.0033 -0.0008 -0.0144 105 SER 17 O 0.0014 -0.0007 -0.0141 106 SER 17 CB 0.0113 -0.0080 -0.0068 107 SER 17 OG 0.0131 -0.0115 -0.0027 108 LEU 18 N -0.0002 -0.0023 -0.0175 109 LEU 18 CA 0.0006 -0.0039 -0.0195 110 LEU 18 C -0.0001 -0.0027 -0.0181 111 LEU 18 O 0.0015 -0.0040 -0.0180 112 LEU 18 CB -0.0008 -0.0047 -0.0233 113 LEU 18 CG -0.0005 -0.0060 -0.0254 114 LEU 18 CD1 0.0027 -0.0087 -0.0253 115 LEU 18 CD2 -0.0024 -0.0063 -0.0290 116 PHE 19 N -0.0004 0.0002 -0.0181 117 PHE 19 CA -0.0019 0.0012 -0.0174 118 PHE 19 C -0.0011 0.0012 -0.0149 119 PHE 19 O -0.0011 0.0012 -0.0147 120 PHE 19 CB -0.0043 0.0025 -0.0173 121 PHE 19 CG -0.0055 0.0026 -0.0197 122 PHE 19 CD1 -0.0066 0.0029 -0.0213 123 PHE 19 CD2 -0.0054 0.0024 -0.0205 124 PHE 19 CE1 -0.0077 0.0030 -0.0236 125 PHE 19 CE2 -0.0065 0.0025 -0.0229 126 PHE 19 CZ -0.0076 0.0028 -0.0244 127 ASP 20 N -0.0000 0.0012 -0.0112 128 ASP 20 CA 0.0031 0.0036 -0.0102 129 ASP 20 C 0.0071 0.0038 -0.0114 130 ASP 20 O 0.0084 0.0062 -0.0099 131 ASP 20 CB 0.0018 0.0070 -0.0072 132 ASP 20 CG 0.0046 0.0094 -0.0061 133 ASP 20 OD1 0.0044 0.0125 -0.0037 134 ASP 20 OD2 0.0071 0.0083 -0.0078 135 LYS 21 N 0.0052 0.0023 -0.0134 136 LYS 21 CA 0.0076 0.0016 -0.0139 137 LYS 21 C 0.0103 0.0045 -0.0139 138 LYS 21 O 0.0112 0.0049 -0.0140 139 LYS 21 CB 0.0097 -0.0019 -0.0149 140 LYS 21 CG 0.0073 -0.0053 -0.0151 141 LYS 21 CD 0.0043 -0.0052 -0.0145 142 LYS 21 CE 0.0037 -0.0089 -0.0151 143 LYS 21 NZ -0.0002 -0.0098 -0.0146 144 ASP 22 N 0.0193 0.0127 -0.0196 145 ASP 22 CA 0.0253 0.0185 -0.0191 146 ASP 22 C 0.0227 0.0253 -0.0145 147 ASP 22 O 0.0271 0.0303 -0.0138 148 ASP 22 CB 0.0299 0.0171 -0.0219 149 ASP 22 CG 0.0265 0.0169 -0.0205 150 ASP 22 OD1 0.0203 0.0174 -0.0175 151 ASP 22 OD2 0.0307 0.0161 -0.0227 152 GLY 23 N 0.0190 0.0158 -0.0113 153 GLY 23 CA 0.0142 0.0237 -0.0102 154 GLY 23 C 0.0171 0.0320 -0.0081 155 GLY 23 O 0.0164 0.0390 -0.0067 156 ASP 24 N 0.0174 0.0268 -0.0096 157 ASP 24 CA 0.0179 0.0291 -0.0085 158 ASP 24 C 0.0131 0.0291 -0.0055 159 ASP 24 O 0.0129 0.0307 -0.0045 160 ASP 24 CB 0.0207 0.0267 -0.0116 161 ASP 24 CG 0.0175 0.0219 -0.0124 162 ASP 24 OD1 0.0178 0.0206 -0.0134 163 ASP 24 OD2 0.0145 0.0198 -0.0119 164 GLY 25 N 0.0091 0.0231 -0.0041 165 GLY 25 CA 0.0066 0.0190 0.0014 166 GLY 25 C 0.0035 0.0129 0.0000 167 GLY 25 O 0.0012 0.0090 0.0041 168 THR 26 N 0.0034 0.0114 -0.0028 169 THR 26 CA 0.0008 0.0084 -0.0039 170 THR 26 C 0.0013 0.0063 -0.0068 171 THR 26 O 0.0040 0.0071 -0.0085 172 THR 26 CB 0.0008 0.0076 -0.0048 173 THR 26 OG1 0.0037 0.0074 -0.0078 174 THR 26 CG2 0.0008 0.0098 -0.0021 175 ILE 27 N -0.0003 0.0074 -0.0078 176 ILE 27 CA -0.0002 0.0058 -0.0090 177 ILE 27 C -0.0002 0.0056 -0.0092 178 ILE 27 O -0.0013 0.0061 -0.0090 179 ILE 27 CB -0.0018 0.0051 -0.0098 180 ILE 27 CG1 -0.0020 0.0056 -0.0094 181 ILE 27 CG2 -0.0015 0.0034 -0.0110 182 ILE 27 CD1 -0.0038 0.0055 -0.0098 183 THR 28 N 0.0020 0.0084 -0.0128 184 THR 28 CA 0.0025 0.0075 -0.0139 185 THR 28 C 0.0022 0.0064 -0.0140 186 THR 28 O 0.0019 0.0066 -0.0134 187 THR 28 CB 0.0033 0.0085 -0.0148 188 THR 28 OG1 0.0038 0.0088 -0.0154 189 THR 28 CG2 0.0038 0.0084 -0.0155 190 THR 29 N 0.0053 0.0135 -0.0111 191 THR 29 CA 0.0053 0.0123 -0.0106 192 THR 29 C 0.0051 0.0095 -0.0096 193 THR 29 O 0.0043 0.0080 -0.0099 194 THR 29 CB 0.0069 0.0134 -0.0092 195 THR 29 OG1 0.0086 0.0133 -0.0073 196 THR 29 CG2 0.0070 0.0161 -0.0102 197 LYS 30 N 0.0047 0.0084 -0.0119 198 LYS 30 CA 0.0042 0.0074 -0.0112 199 LYS 30 C 0.0026 0.0071 -0.0115 200 LYS 30 O 0.0020 0.0061 -0.0109 201 LYS 30 CB 0.0047 0.0076 -0.0111 202 LYS 30 CG 0.0062 0.0083 -0.0112 203 LYS 30 CD 0.0062 0.0095 -0.0123 204 LYS 30 CE 0.0076 0.0103 -0.0125 205 LYS 30 NZ 0.0079 0.0105 -0.0125 206 GLU 31 N 0.0045 0.0035 -0.0156 207 GLU 31 CA 0.0040 0.0031 -0.0160 208 GLU 31 C 0.0028 0.0026 -0.0169 209 GLU 31 O 0.0026 0.0016 -0.0175 210 GLU 31 CB 0.0038 0.0043 -0.0155 211 GLU 31 CG 0.0052 0.0045 -0.0147 212 GLU 31 CD 0.0051 0.0056 -0.0141 213 GLU 31 OE1 0.0059 0.0058 -0.0137 214 GLU 31 OE2 0.0042 0.0065 -0.0141 215 LEU 32 N 0.0016 0.0070 -0.0126 216 LEU 32 CA 0.0014 0.0068 -0.0127 217 LEU 32 C 0.0015 0.0058 -0.0113 218 LEU 32 O 0.0007 0.0051 -0.0112 219 LEU 32 CB 0.0024 0.0080 -0.0131 220 LEU 32 CG 0.0023 0.0079 -0.0131 221 LEU 32 CD1 0.0009 0.0076 -0.0141 222 LEU 32 CD2 0.0035 0.0090 -0.0134 223 GLY 33 N 0.0036 0.0063 -0.0106 224 GLY 33 CA 0.0040 0.0046 -0.0078 225 GLY 33 C 0.0006 0.0039 -0.0066 226 GLY 33 O -0.0001 0.0023 -0.0040 227 THR 34 N -0.0005 0.0041 -0.0091 228 THR 34 CA -0.0034 0.0029 -0.0079 229 THR 34 C -0.0064 0.0024 -0.0076 230 THR 34 O -0.0083 0.0008 -0.0057 231 THR 34 CB -0.0044 0.0037 -0.0091 232 THR 34 OG1 -0.0079 0.0042 -0.0101 233 THR 34 CG2 -0.0019 0.0054 -0.0111 234 VAL 35 N -0.0062 0.0003 -0.0121 235 VAL 35 CA -0.0074 -0.0000 -0.0139 236 VAL 35 C -0.0050 0.0007 -0.0105 237 VAL 35 O -0.0072 -0.0005 -0.0092 238 VAL 35 CB -0.0064 0.0011 -0.0194 239 VAL 35 CG1 -0.0071 0.0010 -0.0211 240 VAL 35 CG2 -0.0093 0.0002 -0.0229 241 MET 36 N -0.0041 0.0012 -0.0060 242 MET 36 CA -0.0015 0.0011 -0.0022 243 MET 36 C -0.0041 -0.0005 0.0027 244 MET 36 O -0.0050 -0.0013 0.0056 245 MET 36 CB 0.0038 0.0022 -0.0011 246 MET 36 CG 0.0071 0.0038 -0.0054 247 MET 36 SD 0.0055 0.0039 -0.0076 248 MET 36 CE 0.0115 0.0054 -0.0079 249 ARG 37 N -0.0048 0.0010 0.0052 250 ARG 37 CA -0.0075 0.0001 0.0097 251 ARG 37 C -0.0133 -0.0002 0.0110 252 ARG 37 O -0.0151 -0.0011 0.0159 253 ARG 37 CB -0.0078 0.0004 0.0085 254 ARG 37 CG -0.0037 -0.0002 0.0116 255 ARG 37 CD 0.0007 0.0004 0.0084 256 ARG 37 NE -0.0017 0.0010 0.0051 257 ARG 37 CZ 0.0018 0.0017 0.0013 258 ARG 37 NH1 0.0071 0.0018 0.0011 259 ARG 37 NH2 -0.0003 0.0024 -0.0023 260 SER 38 N -0.0147 -0.0020 0.0069 261 SER 38 CA -0.0218 -0.0029 0.0075 262 SER 38 C -0.0222 -0.0036 0.0099 263 SER 38 O -0.0272 -0.0049 0.0126 264 SER 38 CB -0.0253 -0.0013 0.0011 265 SER 38 OG -0.0249 -0.0002 -0.0027 266 LEU 39 N -0.0196 -0.0025 0.0101 267 LEU 39 CA -0.0168 -0.0018 0.0122 268 LEU 39 C -0.0134 -0.0008 0.0206 269 LEU 39 O -0.0103 -0.0001 0.0224 270 LEU 39 CB -0.0109 -0.0008 0.0056 271 LEU 39 CG -0.0146 -0.0018 -0.0026 272 LEU 39 CD1 -0.0088 -0.0008 -0.0083 273 LEU 39 CD2 -0.0218 -0.0034 -0.0011 274 GLY 40 N -0.0142 -0.0004 0.0241 275 GLY 40 CA -0.0115 0.0018 0.0318 276 GLY 40 C -0.0030 0.0023 0.0323 277 GLY 40 O 0.0011 0.0041 0.0384 278 GLN 41 N -0.0013 0.0012 0.0226 279 GLN 41 CA 0.0054 0.0011 0.0222 280 GLN 41 C 0.0061 0.0011 0.0194 281 GLN 41 O 0.0034 0.0012 0.0145 282 GLN 41 CB 0.0081 0.0011 0.0188 283 GLN 41 CG 0.0147 0.0010 0.0186 284 GLN 41 CD 0.0162 0.0011 0.0165 285 GLN 41 OE1 0.0214 0.0010 0.0165 286 GLN 41 NE2 0.0115 0.0011 0.0148 287 ASN 42 N 0.0060 -0.0009 0.0192 288 ASN 42 CA 0.0067 -0.0008 0.0172 289 ASN 42 C 0.0117 -0.0013 0.0158 290 ASN 42 O 0.0144 -0.0017 0.0182 291 ASN 42 CB 0.0050 -0.0008 0.0205 292 ASN 42 CG -0.0002 -0.0003 0.0212 293 ASN 42 OD1 -0.0024 -0.0002 0.0234 294 ASN 42 ND2 -0.0023 -0.0000 0.0195 295 PRO 43 N 0.0104 -0.0027 0.0078 296 PRO 43 CA 0.0133 -0.0022 0.0069 297 PRO 43 C 0.0155 -0.0020 0.0064 298 PRO 43 O 0.0146 -0.0016 0.0058 299 PRO 43 CB 0.0125 -0.0008 0.0045 300 PRO 43 CG 0.0097 -0.0002 0.0035 301 PRO 43 CD 0.0080 -0.0016 0.0059 302 THR 44 N 0.0148 -0.0056 0.0064 303 THR 44 CA 0.0200 -0.0046 0.0054 304 THR 44 C 0.0204 0.0004 0.0026 305 THR 44 O 0.0169 0.0025 0.0017 306 THR 44 CB 0.0240 -0.0072 0.0066 307 THR 44 OG1 0.0236 -0.0057 0.0058 308 THR 44 CG2 0.0234 -0.0123 0.0095 309 GLU 45 N 0.0207 0.0009 0.0027 310 GLU 45 CA 0.0214 0.0047 0.0014 311 GLU 45 C 0.0210 0.0072 0.0003 312 GLU 45 O 0.0196 0.0100 -0.0014 313 GLU 45 CB 0.0252 0.0057 0.0024 314 GLU 45 CG 0.0261 0.0096 0.0012 315 GLU 45 CD 0.0250 0.0105 0.0004 316 GLU 45 OE1 0.0242 0.0134 -0.0011 317 GLU 45 OE2 0.0249 0.0078 0.0015 318 ALA 46 N 0.0225 0.0056 0.0024 319 ALA 46 CA 0.0221 0.0079 0.0015 320 ALA 46 C 0.0149 0.0086 0.0004 321 ALA 46 O 0.0130 0.0129 -0.0015 322 ALA 46 CB 0.0257 0.0036 0.0035 323 GLU 47 N 0.0174 0.0062 -0.0004 324 GLU 47 CA 0.0120 0.0063 -0.0008 325 GLU 47 C 0.0090 0.0100 -0.0035 326 GLU 47 O 0.0059 0.0122 -0.0051 327 GLU 47 CB 0.0090 0.0019 0.0018 328 GLU 47 CG 0.0110 -0.0019 0.0045 329 GLU 47 CD 0.0089 -0.0064 0.0072 330 GLU 47 OE1 0.0084 -0.0078 0.0081 331 GLU 47 OE2 0.0077 -0.0084 0.0085 332 LEU 48 N 0.0102 0.0098 -0.0047 333 LEU 48 CA 0.0094 0.0112 -0.0054 334 LEU 48 C 0.0099 0.0146 -0.0058 335 LEU 48 O 0.0081 0.0161 -0.0071 336 LEU 48 CB 0.0111 0.0101 -0.0044 337 LEU 48 CG 0.0099 0.0078 -0.0044 338 LEU 48 CD1 0.0075 0.0060 -0.0052 339 LEU 48 CD2 0.0122 0.0057 -0.0029 340 GLN 49 N 0.0089 0.0158 -0.0055 341 GLN 49 CA 0.0081 0.0170 -0.0044 342 GLN 49 C 0.0066 0.0175 -0.0048 343 GLN 49 O 0.0061 0.0184 -0.0039 344 GLN 49 CB 0.0081 0.0174 -0.0039 345 GLN 49 CG 0.0077 0.0186 -0.0026 346 GLN 49 CD 0.0088 0.0188 -0.0015 347 GLN 49 OE1 0.0085 0.0196 -0.0006 348 GLN 49 NE2 0.0102 0.0182 -0.0015 349 ASP 50 N 0.0031 0.0180 -0.0023 350 ASP 50 CA 0.0011 0.0196 -0.0041 351 ASP 50 C 0.0001 0.0189 -0.0056 352 ASP 50 O -0.0013 0.0206 -0.0066 353 ASP 50 CB 0.0002 0.0191 -0.0054 354 ASP 50 CG 0.0008 0.0204 -0.0042 355 ASP 50 OD1 0.0011 0.0226 -0.0031 356 ASP 50 OD2 0.0010 0.0189 -0.0045 357 MET 51 N 0.0022 0.0176 -0.0034 358 MET 51 CA 0.0011 0.0175 -0.0043 359 MET 51 C 0.0015 0.0197 -0.0030 360 MET 51 O -0.0002 0.0210 -0.0035 361 MET 51 CB 0.0018 0.0149 -0.0050 362 MET 51 CG 0.0011 0.0127 -0.0064 363 MET 51 SD 0.0022 0.0097 -0.0070 364 MET 51 CE 0.0034 0.0076 -0.0071 365 ILE 52 N -0.0017 0.0177 -0.0083 366 ILE 52 CA -0.0017 0.0163 -0.0067 367 ILE 52 C -0.0029 0.0154 -0.0057 368 ILE 52 O -0.0020 0.0143 -0.0044 369 ILE 52 CB -0.0025 0.0160 -0.0063 370 ILE 52 CG1 -0.0008 0.0159 -0.0062 371 ILE 52 CG2 -0.0036 0.0145 -0.0048 372 ILE 52 CD1 0.0005 0.0170 -0.0074 373 ASN 53 N -0.0019 0.0154 0.0011 374 ASN 53 CA -0.0027 0.0148 0.0017 375 ASN 53 C -0.0021 0.0145 0.0021 376 ASN 53 O -0.0024 0.0139 0.0029 377 ASN 53 CB -0.0040 0.0151 0.0011 378 ASN 53 CG -0.0048 0.0150 0.0009 379 ASN 53 OD1 -0.0058 0.0153 0.0003 380 ASN 53 ND2 -0.0044 0.0148 0.0013 381 GLU 54 N 0.0001 0.0112 0.0014 382 GLU 54 CA 0.0011 0.0102 0.0066 383 GLU 54 C 0.0004 0.0124 0.0073 384 GLU 54 O 0.0016 0.0100 0.0097 385 GLU 54 CB 0.0009 0.0124 0.0109 386 GLU 54 CG 0.0024 0.0100 0.0162 387 GLU 54 CD 0.0020 0.0131 0.0209 388 GLU 54 OE1 0.0026 0.0128 0.0251 389 GLU 54 OE2 0.0009 0.0159 0.0202 390 VAL 55 N -0.0022 0.0092 0.0070 391 VAL 55 CA -0.0018 0.0078 0.0065 392 VAL 55 C -0.0029 0.0060 0.0057 393 VAL 55 O -0.0022 0.0044 0.0052 394 VAL 55 CB -0.0022 0.0088 0.0068 395 VAL 55 CG1 -0.0017 0.0109 0.0077 396 VAL 55 CG2 -0.0044 0.0087 0.0066 397 ASP 56 N -0.0038 0.0057 0.0032 398 ASP 56 CA -0.0054 0.0037 0.0026 399 ASP 56 C -0.0053 0.0006 0.0037 400 ASP 56 O -0.0066 -0.0007 0.0031 401 ASP 56 CB -0.0078 0.0045 0.0005 402 ASP 56 CG -0.0094 0.0027 -0.0002 403 ASP 56 OD1 -0.0116 0.0025 -0.0018 404 ASP 56 OD2 -0.0084 0.0017 0.0009 405 ALA 57 N -0.0045 -0.0009 0.0052 406 ALA 57 CA -0.0056 -0.0039 0.0073 407 ALA 57 C -0.0091 -0.0064 0.0081 408 ALA 57 O -0.0111 -0.0082 0.0088 409 ALA 57 CB -0.0021 -0.0055 0.0099 410 ASP 58 N -0.0128 -0.0078 0.0099 411 ASP 58 CA -0.0156 -0.0106 0.0095 412 ASP 58 C -0.0189 -0.0100 0.0059 413 ASP 58 O -0.0212 -0.0119 0.0053 414 ASP 58 CB -0.0141 -0.0108 0.0112 415 ASP 58 CG -0.0127 -0.0072 0.0095 416 ASP 58 OD1 -0.0115 -0.0068 0.0104 417 ASP 58 OD2 -0.0128 -0.0044 0.0071 418 GLY 59 N -0.0174 -0.0078 0.0039 419 GLY 59 CA -0.0196 -0.0069 0.0018 420 GLY 59 C -0.0216 -0.0057 -0.0002 421 GLY 59 O -0.0237 -0.0060 -0.0022 422 ASN 60 N -0.0182 -0.0051 0.0002 423 ASN 60 CA -0.0181 -0.0038 -0.0017 424 ASN 60 C -0.0176 -0.0013 -0.0049 425 ASN 60 O -0.0176 -0.0001 -0.0068 426 ASN 60 CB -0.0159 -0.0030 0.0002 427 ASN 60 CG -0.0127 -0.0011 0.0019 428 ASN 60 OD1 -0.0120 -0.0003 0.0016 429 ASN 60 ND2 -0.0107 -0.0003 0.0037 430 GLY 61 N -0.0116 0.0009 -0.0040 431 GLY 61 CA -0.0115 0.0039 -0.0070 432 GLY 61 C -0.0082 0.0065 -0.0071 433 GLY 61 O -0.0078 0.0091 -0.0095 434 THR 62 N -0.0077 0.0028 -0.0060 435 THR 62 CA -0.0058 0.0045 -0.0055 436 THR 62 C -0.0063 0.0046 -0.0025 437 THR 62 O -0.0079 0.0038 -0.0004 438 THR 62 CB -0.0032 0.0065 -0.0056 439 THR 62 OG1 -0.0033 0.0069 -0.0031 440 THR 62 CG2 -0.0025 0.0064 -0.0087 441 ILE 63 N -0.0062 0.0033 -0.0008 442 ILE 63 CA -0.0067 0.0036 0.0001 443 ILE 63 C -0.0061 0.0045 0.0006 444 ILE 63 O -0.0053 0.0049 0.0002 445 ILE 63 CB -0.0074 0.0030 -0.0000 446 ILE 63 CG1 -0.0072 0.0036 0.0005 447 ILE 63 CG2 -0.0073 0.0023 -0.0011 448 ILE 63 CD1 -0.0079 0.0037 0.0015 449 ASP 64 N -0.0065 0.0026 0.0050 450 ASP 64 CA -0.0053 0.0039 0.0065 451 ASP 64 C -0.0058 0.0040 0.0073 452 ASP 64 O -0.0074 0.0031 0.0068 453 ASP 64 CB -0.0056 0.0045 0.0082 454 ASP 64 CG -0.0077 0.0042 0.0096 455 ASP 64 OD1 -0.0083 0.0046 0.0109 456 ASP 64 OD2 -0.0089 0.0036 0.0093 457 PHE 65 N -0.0066 0.0005 0.0133 458 PHE 65 CA -0.0076 0.0002 0.0123 459 PHE 65 C -0.0111 0.0013 0.0123 460 PHE 65 O -0.0129 0.0005 0.0101 461 PHE 65 CB -0.0052 0.0006 0.0142 462 PHE 65 CG -0.0056 -0.0003 0.0126 463 PHE 65 CD1 -0.0066 0.0010 0.0141 464 PHE 65 CD2 -0.0052 -0.0022 0.0097 465 PHE 65 CE1 -0.0070 0.0002 0.0126 466 PHE 65 CE2 -0.0057 -0.0030 0.0082 467 PHE 65 CZ -0.0066 -0.0017 0.0097 468 PRO 66 N -0.0088 0.0037 0.0105 469 PRO 66 CA -0.0112 0.0039 0.0111 470 PRO 66 C -0.0128 0.0028 0.0096 471 PRO 66 O -0.0146 0.0026 0.0094 472 PRO 66 CB -0.0116 0.0050 0.0129 473 PRO 66 CG -0.0093 0.0055 0.0136 474 PRO 66 CD -0.0077 0.0046 0.0119 475 GLU 67 N -0.0095 0.0029 0.0082 476 GLU 67 CA -0.0104 0.0015 0.0072 477 GLU 67 C -0.0106 0.0005 0.0062 478 GLU 67 O -0.0121 -0.0003 0.0059 479 GLU 67 CB -0.0093 0.0011 0.0064 480 GLU 67 CG -0.0095 0.0017 0.0070 481 GLU 67 CD -0.0081 0.0015 0.0065 482 GLU 67 OE1 -0.0067 0.0010 0.0057 483 GLU 67 OE2 -0.0083 0.0019 0.0069 484 PHE 68 N -0.0164 0.0002 0.0036 485 PHE 68 CA -0.0157 -0.0004 0.0019 486 PHE 68 C -0.0162 -0.0004 0.0019 487 PHE 68 O -0.0172 -0.0006 0.0006 488 PHE 68 CB -0.0135 -0.0008 0.0019 489 PHE 68 CG -0.0125 -0.0015 0.0003 490 PHE 68 CD1 -0.0124 -0.0020 -0.0014 491 PHE 68 CD2 -0.0118 -0.0015 0.0004 492 PHE 68 CE1 -0.0115 -0.0026 -0.0029 493 PHE 68 CE2 -0.0108 -0.0021 -0.0010 494 PHE 68 CZ -0.0107 -0.0027 -0.0027 495 LEU 69 N -0.0151 -0.0021 0.0053 496 LEU 69 CA -0.0156 -0.0019 0.0053 497 LEU 69 C -0.0167 -0.0016 0.0050 498 LEU 69 O -0.0172 -0.0019 0.0046 499 LEU 69 CB -0.0153 -0.0013 0.0059 500 LEU 69 CG -0.0155 -0.0010 0.0061 501 LEU 69 CD1 -0.0166 -0.0007 0.0059 502 LEU 69 CD2 -0.0152 -0.0016 0.0057 503 THR 70 N -0.0130 -0.0018 0.0059 504 THR 70 CA -0.0123 -0.0016 0.0058 505 THR 70 C -0.0119 -0.0025 0.0070 506 THR 70 O -0.0120 -0.0026 0.0071 507 THR 70 CB -0.0110 -0.0007 0.0050 508 THR 70 OG1 -0.0097 -0.0010 0.0057 509 THR 70 CG2 -0.0112 0.0001 0.0038 510 MET 71 N -0.0108 -0.0007 0.0052 511 MET 71 CA -0.0103 -0.0007 0.0065 512 MET 71 C -0.0104 0.0006 0.0089 513 MET 71 O -0.0094 0.0000 0.0107 514 MET 71 CB -0.0111 -0.0000 0.0054 515 MET 71 CG -0.0110 0.0006 0.0071 516 MET 71 SD -0.0126 0.0033 0.0074 517 MET 71 CE -0.0121 0.0039 0.0101 518 MET 72 N -0.0144 -0.0055 0.0076 519 MET 72 CA -0.0145 -0.0052 0.0080 520 MET 72 C -0.0134 -0.0054 0.0078 521 MET 72 O -0.0129 -0.0049 0.0084 522 MET 72 CB -0.0157 -0.0054 0.0077 523 MET 72 CG -0.0164 -0.0046 0.0085 524 MET 72 SD -0.0163 -0.0039 0.0092 525 MET 72 CE -0.0176 -0.0031 0.0100 526 ALA 73 N -0.0088 -0.0043 0.0054 527 ALA 73 CA -0.0060 -0.0049 0.0031 528 ALA 73 C -0.0017 -0.0032 0.0053 529 ALA 73 O -0.0012 -0.0021 0.0076 530 ALA 73 CB -0.0055 -0.0069 -0.0014 531 ARG 74 N 0.0022 -0.0021 0.0070 532 ARG 74 CA 0.0065 0.0016 0.0085 533 ARG 74 C 0.0066 0.0053 0.0123 534 ARG 74 O 0.0106 0.0073 0.0123 535 ARG 74 CB 0.0063 0.0027 0.0098 536 ARG 74 CG 0.0097 0.0011 0.0064 537 ARG 74 CD 0.0110 0.0034 0.0081 538 ARG 74 NE 0.0067 0.0021 0.0089 539 ARG 74 CZ 0.0049 -0.0019 0.0058 540 ARG 74 NH1 0.0071 -0.0046 0.0020 541 ARG 74 NH2 0.0008 -0.0031 0.0067 542 LYS 75 N 0.0064 0.0032 0.0177 543 LYS 75 CA 0.0054 0.0043 0.0236 544 LYS 75 C 0.0023 0.0006 0.0211 545 LYS 75 O 0.0025 0.0021 0.0249 546 LYS 75 CB 0.0015 0.0036 0.0318 547 LYS 75 CG -0.0000 0.0040 0.0370 548 LYS 75 CD -0.0048 0.0022 0.0445 549 LYS 75 CE -0.0017 0.0073 0.0513 550 LYS 75 NZ 0.0024 0.0115 0.0524 551 MET 76 N 0.0025 -0.0026 0.0142 552 MET 76 CA 0.0010 -0.0051 0.0123 553 MET 76 C 0.0064 -0.0026 0.0084 554 MET 76 O 0.0066 -0.0024 0.0085 555 MET 76 CB -0.0035 -0.0108 0.0094 556 MET 76 CG -0.0091 -0.0131 0.0139 557 MET 76 SD -0.0136 -0.0155 0.0167 558 MET 76 CE -0.0103 -0.0097 0.0214 559 LYS 77 N 0.0080 -0.0006 0.0092 560 LYS 77 CA 0.0120 0.0020 0.0052 561 LYS 77 C 0.0144 0.0062 0.0082 562 LYS 77 O 0.0159 0.0069 0.0059 563 LYS 77 CB 0.0153 0.0042 0.0019 564 LYS 77 CG 0.0135 0.0011 -0.0001 565 LYS 77 CD 0.0138 -0.0018 -0.0064 566 LYS 77 CE 0.0181 0.0011 -0.0108 567 LYS 77 NZ 0.0193 0.0031 -0.0096 568 ASP 78 N 0.0126 0.0098 0.0084 569 ASP 78 CA 0.0139 0.0123 0.0108 570 ASP 78 C 0.0124 0.0065 0.0121 571 ASP 78 O 0.0131 0.0082 0.0127 572 ASP 78 CB 0.0166 0.0164 0.0174 573 ASP 78 CG 0.0182 0.0222 0.0161 574 ASP 78 OD1 0.0205 0.0267 0.0204 575 ASP 78 OD2 0.0169 0.0219 0.0104 576 THR 79 N 0.0088 0.0028 0.0071 577 THR 79 CA 0.0106 0.0008 0.0047 578 THR 79 C 0.0134 -0.0015 -0.0007 579 THR 79 O 0.0151 -0.0026 -0.0041 580 THR 79 CB 0.0108 -0.0033 0.0092 581 THR 79 OG1 0.0130 -0.0061 0.0062 582 THR 79 CG2 0.0113 -0.0071 0.0126 583 ASP 80 N 0.0133 -0.0013 0.0002 584 ASP 80 CA 0.0146 -0.0015 0.0004 585 ASP 80 C 0.0114 -0.0009 -0.0010 586 ASP 80 O 0.0118 -0.0010 -0.0016 587 ASP 80 CB 0.0160 -0.0018 0.0044 588 ASP 80 CG 0.0200 -0.0025 0.0050 589 ASP 80 OD1 0.0211 -0.0027 0.0082 590 ASP 80 OD2 0.0221 -0.0027 0.0021 591 SER 81 N 0.0065 -0.0033 -0.0020 592 SER 81 CA 0.0009 -0.0043 -0.0034 593 SER 81 C 0.0009 -0.0084 -0.0083 594 SER 81 O -0.0020 -0.0101 -0.0105 595 SER 81 CB -0.0007 -0.0025 -0.0013 596 SER 81 OG -0.0029 0.0010 0.0028 597 GLU 82 N -0.0041 -0.0135 -0.0150 598 GLU 82 CA -0.0043 -0.0122 -0.0205 599 GLU 82 C 0.0004 -0.0098 -0.0214 600 GLU 82 O 0.0005 -0.0088 -0.0251 601 GLU 82 CB -0.0045 -0.0113 -0.0243 602 GLU 82 CG -0.0049 -0.0099 -0.0303 603 GLU 82 CD -0.0098 -0.0114 -0.0328 604 GLU 82 OE1 -0.0104 -0.0105 -0.0375 605 GLU 82 OE2 -0.0129 -0.0137 -0.0295 606 GLU 83 N 0.0055 -0.0072 -0.0159 607 GLU 83 CA 0.0119 -0.0047 -0.0170 608 GLU 83 C 0.0111 -0.0053 -0.0139 609 GLU 83 O 0.0137 -0.0041 -0.0176 610 GLU 83 CB 0.0189 -0.0023 -0.0148 611 GLU 83 CG 0.0218 -0.0008 -0.0211 612 GLU 83 CD 0.0295 0.0020 -0.0199 613 GLU 83 OE1 0.0319 0.0024 -0.0137 614 GLU 83 OE2 0.0334 0.0039 -0.0256 615 GLU 84 N 0.0126 -0.0054 -0.0134 616 GLU 84 CA 0.0103 -0.0068 -0.0079 617 GLU 84 C 0.0054 -0.0106 -0.0128 618 GLU 84 O 0.0059 -0.0102 -0.0131 619 GLU 84 CB 0.0066 -0.0090 -0.0000 620 GLU 84 CG 0.0105 -0.0057 0.0081 621 GLU 84 CD 0.0091 -0.0064 0.0139 622 GLU 84 OE1 0.0106 -0.0055 0.0122 623 GLU 84 OE2 0.0064 -0.0080 0.0208 624 ILE 85 N 0.0004 -0.0163 -0.0181 625 ILE 85 CA -0.0011 -0.0171 -0.0197 626 ILE 85 C -0.0003 -0.0136 -0.0221 627 ILE 85 O -0.0001 -0.0134 -0.0221 628 ILE 85 CB -0.0043 -0.0201 -0.0216 629 ILE 85 CG1 -0.0050 -0.0236 -0.0187 630 ILE 85 CG2 -0.0059 -0.0204 -0.0237 631 ILE 85 CD1 -0.0081 -0.0265 -0.0206 632 ARG 86 N 0.0036 -0.0091 -0.0209 633 ARG 86 CA 0.0047 -0.0050 -0.0242 634 ARG 86 C 0.0086 -0.0024 -0.0218 635 ARG 86 O 0.0097 0.0005 -0.0238 636 ARG 86 CB 0.0043 -0.0028 -0.0273 637 ARG 86 CG 0.0005 -0.0036 -0.0315 638 ARG 86 CD 0.0006 -0.0011 -0.0343 639 ARG 86 NE -0.0018 0.0001 -0.0390 640 ARG 86 CZ -0.0055 -0.0019 -0.0416 641 ARG 86 NH1 -0.0079 -0.0058 -0.0403 642 ARG 86 NH2 -0.0069 0.0002 -0.0459 643 GLU 87 N 0.0121 -0.0023 -0.0211 644 GLU 87 CA 0.0165 0.0005 -0.0168 645 GLU 87 C 0.0139 -0.0022 -0.0154 646 GLU 87 O 0.0157 0.0001 -0.0179 647 GLU 87 CB 0.0191 0.0008 -0.0090 648 GLU 87 CG 0.0250 0.0060 -0.0089 649 GLU 87 CD 0.0281 0.0068 -0.0017 650 GLU 87 OE1 0.0322 0.0106 -0.0022 651 GLU 87 OE2 0.0263 0.0037 0.0043 652 ALA 88 N 0.0092 -0.0053 -0.0154 653 ALA 88 CA 0.0087 -0.0066 -0.0144 654 ALA 88 C 0.0083 -0.0066 -0.0159 655 ALA 88 O 0.0086 -0.0065 -0.0153 656 ALA 88 CB 0.0078 -0.0085 -0.0137 657 PHE 89 N 0.0070 -0.0100 -0.0196 658 PHE 89 CA 0.0071 -0.0093 -0.0183 659 PHE 89 C 0.0066 -0.0100 -0.0182 660 PHE 89 O 0.0070 -0.0093 -0.0179 661 PHE 89 CB 0.0068 -0.0091 -0.0167 662 PHE 89 CG 0.0072 -0.0081 -0.0154 663 PHE 89 CD1 0.0081 -0.0067 -0.0153 664 PHE 89 CD2 0.0065 -0.0086 -0.0143 665 PHE 89 CE1 0.0085 -0.0058 -0.0142 666 PHE 89 CE2 0.0068 -0.0077 -0.0132 667 PHE 89 CZ 0.0078 -0.0063 -0.0131 668 ARG 90 N 0.0122 -0.0066 -0.0201 669 ARG 90 CA 0.0150 -0.0014 -0.0202 670 ARG 90 C 0.0138 -0.0012 -0.0127 671 ARG 90 O 0.0147 0.0004 -0.0130 672 ARG 90 CB 0.0191 0.0059 -0.0213 673 ARG 90 CG 0.0225 0.0098 -0.0284 674 ARG 90 CD 0.0260 0.0160 -0.0294 675 ARG 90 NE 0.0268 0.0151 -0.0369 676 ARG 90 CZ 0.0284 0.0178 -0.0373 677 ARG 90 NH1 0.0292 0.0214 -0.0310 678 ARG 90 NH2 0.0289 0.0165 -0.0443 679 VAL 91 N 0.0109 -0.0021 -0.0105 680 VAL 91 CA 0.0098 -0.0021 -0.0076 681 VAL 91 C 0.0075 -0.0053 -0.0082 682 VAL 91 O 0.0070 -0.0057 -0.0079 683 VAL 91 CB 0.0096 -0.0007 -0.0040 684 VAL 91 CG1 0.0109 0.0011 -0.0037 685 VAL 91 CG2 0.0071 -0.0026 -0.0013 686 PHE 92 N 0.0062 -0.0036 -0.0078 687 PHE 92 CA 0.0048 -0.0072 -0.0079 688 PHE 92 C 0.0053 -0.0072 -0.0103 689 PHE 92 O 0.0046 -0.0084 -0.0090 690 PHE 92 CB 0.0039 -0.0103 -0.0093 691 PHE 92 CG 0.0027 -0.0119 -0.0065 692 PHE 92 CD1 0.0012 -0.0148 -0.0044 693 PHE 92 CD2 0.0031 -0.0107 -0.0060 694 PHE 92 CE1 0.0001 -0.0164 -0.0018 695 PHE 92 CE2 0.0020 -0.0122 -0.0034 696 PHE 92 CZ 0.0005 -0.0151 -0.0013 697 ASP 93 N 0.0095 -0.0071 -0.0101 698 ASP 93 CA 0.0109 -0.0103 -0.0117 699 ASP 93 C 0.0113 -0.0129 -0.0134 700 ASP 93 O 0.0143 -0.0148 -0.0133 701 ASP 93 CB 0.0145 -0.0104 -0.0101 702 ASP 93 CG 0.0158 -0.0136 -0.0118 703 ASP 93 OD1 0.0190 -0.0149 -0.0112 704 ASP 93 OD2 0.0134 -0.0150 -0.0140 705 LYS 94 N 0.0117 -0.0133 -0.0133 706 LYS 94 CA 0.0073 -0.0129 -0.0103 707 LYS 94 C 0.0123 -0.0177 -0.0147 708 LYS 94 O 0.0117 -0.0133 -0.0133 709 LYS 94 CB -0.0031 -0.0175 -0.0044 710 LYS 94 CG -0.0076 -0.0174 -0.0014 711 LYS 94 CD -0.0173 -0.0143 0.0057 712 LYS 94 CE -0.0201 -0.0128 0.0079 713 LYS 94 NZ -0.0247 -0.0026 0.0132 714 ASP 95 N 0.0188 -0.0266 -0.0268 715 ASP 95 CA 0.0238 -0.0337 -0.0301 716 ASP 95 C 0.0315 -0.0341 -0.0249 717 ASP 95 O 0.0347 -0.0385 -0.0269 718 ASP 95 CB 0.0193 -0.0363 -0.0359 719 ASP 95 CG 0.0176 -0.0332 -0.0341 720 ASP 95 OD1 0.0135 -0.0350 -0.0389 721 ASP 95 OD2 0.0201 -0.0288 -0.0280 722 GLY 96 N 0.0236 -0.0286 -0.0212 723 GLY 96 CA 0.0368 -0.0266 -0.0166 724 GLY 96 C 0.0431 -0.0345 -0.0181 725 GLY 96 O 0.0526 -0.0417 -0.0184 726 ASN 97 N 0.0309 -0.0325 -0.0173 727 ASN 97 CA 0.0304 -0.0322 -0.0176 728 ASN 97 C 0.0290 -0.0277 -0.0114 729 ASN 97 O 0.0288 -0.0271 -0.0109 730 ASN 97 CB 0.0268 -0.0320 -0.0248 731 ASN 97 CG 0.0210 -0.0260 -0.0254 732 ASN 97 OD1 0.0193 -0.0224 -0.0217 733 ASN 97 ND2 0.0181 -0.0251 -0.0298 734 GLY 98 N 0.0191 -0.0231 -0.0092 735 GLY 98 CA 0.0155 -0.0192 -0.0012 736 GLY 98 C 0.0104 -0.0119 -0.0024 737 GLY 98 O 0.0074 -0.0086 0.0041 738 TYR 99 N 0.0096 -0.0112 -0.0041 739 TYR 99 CA 0.0070 -0.0049 -0.0068 740 TYR 99 C 0.0070 -0.0048 -0.0133 741 TYR 99 O 0.0085 -0.0085 -0.0182 742 TYR 99 CB 0.0056 -0.0015 -0.0092 743 TYR 99 CG 0.0055 -0.0012 -0.0032 744 TYR 99 CD1 0.0070 -0.0049 -0.0037 745 TYR 99 CD2 0.0039 0.0025 0.0026 746 TYR 99 CE1 0.0069 -0.0046 0.0017 747 TYR 99 CE2 0.0038 0.0028 0.0079 748 TYR 99 CZ 0.0053 -0.0008 0.0074 749 TYR 99 OH 0.0052 -0.0006 0.0126 750 ILE 100 N 0.0037 -0.0016 -0.0110 751 ILE 100 CA 0.0045 -0.0017 -0.0116 752 ILE 100 C 0.0043 -0.0004 -0.0124 753 ILE 100 O 0.0036 0.0001 -0.0120 754 ILE 100 CB 0.0043 -0.0023 -0.0110 755 ILE 100 CG1 0.0046 -0.0037 -0.0103 756 ILE 100 CG2 0.0049 -0.0022 -0.0117 757 ILE 100 CD1 0.0042 -0.0042 -0.0095 758 SER 101 N 0.0023 0.0009 -0.0118 759 SER 101 CA -0.0033 -0.0007 -0.0155 760 SER 101 C -0.0064 -0.0011 -0.0107 761 SER 101 O -0.0037 -0.0001 -0.0049 762 SER 101 CB -0.0006 -0.0005 -0.0225 763 SER 101 OG 0.0043 0.0007 -0.0210 764 ALA 102 N -0.0085 0.0040 0.0091 765 ALA 102 CA -0.0069 0.0023 0.0108 766 ALA 102 C -0.0028 0.0030 0.0119 767 ALA 102 O -0.0012 0.0009 0.0140 768 ALA 102 CB -0.0082 0.0031 0.0098 769 ALA 103 N -0.0046 -0.0055 0.0177 770 ALA 103 CA -0.0044 -0.0060 0.0171 771 ALA 103 C -0.0055 -0.0083 0.0159 772 ALA 103 O -0.0044 -0.0093 0.0145 773 ALA 103 CB -0.0055 -0.0049 0.0187 774 GLU 104 N -0.0073 -0.0167 -0.0029 775 GLU 104 CA -0.0044 -0.0144 -0.0002 776 GLU 104 C -0.0062 -0.0153 0.0045 777 GLU 104 O -0.0044 -0.0136 0.0084 778 GLU 104 CB -0.0022 -0.0132 -0.0034 779 GLU 104 CG 0.0006 -0.0117 -0.0075 780 GLU 104 CD 0.0027 -0.0105 -0.0110 781 GLU 104 OE1 0.0011 -0.0118 -0.0122 782 GLU 104 OE2 0.0062 -0.0083 -0.0128 783 LEU 105 N -0.0013 -0.0155 0.0118 784 LEU 105 CA -0.0016 -0.0149 0.0122 785 LEU 105 C -0.0018 -0.0146 0.0109 786 LEU 105 O -0.0018 -0.0146 0.0109 787 LEU 105 CB -0.0024 -0.0136 0.0131 788 LEU 105 CG -0.0028 -0.0127 0.0136 789 LEU 105 CD1 -0.0024 -0.0135 0.0149 790 LEU 105 CD2 -0.0035 -0.0114 0.0143 791 ARG 106 N -0.0060 -0.0162 0.0208 792 ARG 106 CA -0.0000 -0.0166 0.0213 793 ARG 106 C -0.0001 -0.0172 0.0210 794 ARG 106 O 0.0029 -0.0206 0.0194 795 ARG 106 CB 0.0034 -0.0125 0.0241 796 ARG 106 CG 0.0098 -0.0133 0.0244 797 ARG 106 CD 0.0127 -0.0092 0.0271 798 ARG 106 NE 0.0150 -0.0058 0.0293 799 ARG 106 CZ 0.0129 -0.0012 0.0317 800 ARG 106 NH1 0.0088 0.0008 0.0323 801 ARG 106 NH2 0.0146 0.0016 0.0335 802 HIS 107 N -0.0058 -0.0186 0.0190 803 HIS 107 CA -0.0106 -0.0186 0.0180 804 HIS 107 C -0.0122 -0.0196 0.0120 805 HIS 107 O -0.0120 -0.0201 0.0093 806 HIS 107 CB -0.0158 -0.0177 0.0209 807 HIS 107 CG -0.0203 -0.0176 0.0206 808 HIS 107 ND1 -0.0199 -0.0172 0.0225 809 HIS 107 CD2 -0.0256 -0.0177 0.0187 810 HIS 107 CE1 -0.0248 -0.0171 0.0218 811 HIS 107 NE2 -0.0283 -0.0174 0.0195 812 VAL 108 N -0.0109 -0.0210 0.0106 813 VAL 108 CA -0.0113 -0.0203 0.0087 814 VAL 108 C -0.0101 -0.0213 0.0081 815 VAL 108 O -0.0106 -0.0206 0.0073 816 VAL 108 CB -0.0116 -0.0197 0.0068 817 VAL 108 CG1 -0.0114 -0.0200 0.0072 818 VAL 108 CG2 -0.0108 -0.0201 0.0047 819 MET 109 N -0.0062 -0.0241 0.0115 820 MET 109 CA -0.0027 -0.0246 0.0085 821 MET 109 C -0.0022 -0.0249 0.0075 822 MET 109 O -0.0011 -0.0257 0.0041 823 MET 109 CB 0.0009 -0.0239 0.0100 824 MET 109 CG 0.0033 -0.0245 0.0071 825 MET 109 SD 0.0001 -0.0256 0.0042 826 MET 109 CE 0.0036 -0.0264 0.0002 827 THR 110 N -0.0017 -0.0281 0.0109 828 THR 110 CA -0.0060 -0.0283 0.0089 829 THR 110 C -0.0108 -0.0277 0.0055 830 THR 110 O -0.0129 -0.0257 0.0017 831 THR 110 CB -0.0076 -0.0315 0.0125 832 THR 110 OG1 -0.0135 -0.0334 0.0120 833 THR 110 CG2 -0.0045 -0.0339 0.0176 834 ASN 111 N -0.0143 -0.0262 0.0027 835 ASN 111 CA -0.0183 -0.0279 -0.0005 836 ASN 111 C -0.0171 -0.0289 -0.0055 837 ASN 111 O -0.0196 -0.0302 -0.0088 838 ASN 111 CB -0.0232 -0.0285 0.0015 839 ASN 111 CG -0.0251 -0.0278 0.0059 840 ASN 111 OD1 -0.0270 -0.0274 0.0092 841 ASN 111 ND2 -0.0246 -0.0277 0.0060 842 LEU 112 N -0.0144 -0.0255 -0.0052 843 LEU 112 CA -0.0123 -0.0233 -0.0097 844 LEU 112 C -0.0107 -0.0219 -0.0123 845 LEU 112 O -0.0087 -0.0200 -0.0162 846 LEU 112 CB -0.0079 -0.0227 -0.0086 847 LEU 112 CG -0.0097 -0.0229 -0.0090 848 LEU 112 CD1 -0.0147 -0.0250 -0.0067 849 LEU 112 CD2 -0.0058 -0.0230 -0.0063 850 GLY 113 N -0.0137 -0.0202 -0.0073 851 GLY 113 CA -0.0196 -0.0156 -0.0129 852 GLY 113 C -0.0170 -0.0122 -0.0121 853 GLY 113 O -0.0212 -0.0065 -0.0168 854 GLU 114 N -0.0032 -0.0205 -0.0047 855 GLU 114 CA 0.0055 -0.0241 -0.0017 856 GLU 114 C 0.0056 -0.0259 0.0080 857 GLU 114 O 0.0037 -0.0257 0.0101 858 GLU 114 CB 0.0112 -0.0252 -0.0066 859 GLU 114 CG 0.0132 -0.0241 -0.0164 860 GLU 114 CD 0.0198 -0.0261 -0.0179 861 GLU 114 OE1 0.0252 -0.0290 -0.0125 862 GLU 114 OE2 0.0190 -0.0245 -0.0250 863 LYS 115 N 0.0188 0.0057 0.0056 864 LYS 115 CA 0.0137 -0.0414 0.0198 865 LYS 115 C 0.0427 -0.0404 0.0270 866 LYS 115 O 0.0349 -0.0212 0.0186 867 LYS 115 CB -0.0364 -0.0564 0.0120 868 LYS 115 CG -0.0698 -0.0408 -0.0017 869 LYS 115 CD -0.1204 -0.0517 -0.0111 870 LYS 115 CE -0.1293 -0.1020 0.0033 871 LYS 115 NZ -0.1732 -0.1170 -0.0030 872 LEU 116 N 0.0233 -0.0227 0.0263 873 LEU 116 CA 0.0255 -0.0217 0.0278 874 LEU 116 C 0.0265 -0.0181 0.0332 875 LEU 116 O 0.0230 -0.0164 0.0357 876 LEU 116 CB 0.0206 -0.0223 0.0269 877 LEU 116 CG 0.0206 -0.0252 0.0224 878 LEU 116 CD1 0.0230 -0.0281 0.0182 879 LEU 116 CD2 0.0145 -0.0257 0.0216 880 THR 117 N 0.0341 -0.0075 0.0353 881 THR 117 CA 0.0349 0.0053 0.0359 882 THR 117 C 0.0224 0.0104 0.0346 883 THR 117 O 0.0138 0.0033 0.0332 884 THR 117 CB 0.0411 0.0057 0.0367 885 THR 117 OG1 0.0318 0.0017 0.0354 886 THR 117 CG2 0.0524 -0.0020 0.0378 887 ASP 118 N 0.0202 0.0154 0.0294 888 ASP 118 CA 0.0130 0.0190 0.0282 889 ASP 118 C 0.0059 0.0166 0.0290 890 ASP 118 O -0.0007 0.0167 0.0290 891 ASP 118 CB 0.0133 0.0276 0.0253 892 ASP 118 CG 0.0055 0.0310 0.0242 893 ASP 118 OD1 0.0023 0.0362 0.0224 894 ASP 118 OD2 0.0024 0.0282 0.0251 895 GLU 119 N 0.0062 0.0193 0.0276 896 GLU 119 CA -0.0035 0.0172 0.0293 897 GLU 119 C -0.0068 0.0090 0.0358 898 GLU 119 O -0.0157 0.0079 0.0367 899 GLU 119 CB -0.0041 0.0171 0.0294 900 GLU 119 CG -0.0131 0.0130 0.0327 901 GLU 119 CD -0.0154 0.0146 0.0315 902 GLU 119 OE1 -0.0163 0.0096 0.0354 903 GLU 119 OE2 -0.0162 0.0219 0.0258 904 GLU 120 N 0.0029 0.0084 0.0381 905 GLU 120 CA -0.0008 -0.0027 0.0400 906 GLU 120 C -0.0085 -0.0038 0.0407 907 GLU 120 O -0.0164 -0.0101 0.0423 908 GLU 120 CB 0.0091 -0.0104 0.0404 909 GLU 120 CG 0.0164 -0.0109 0.0399 910 GLU 120 CD 0.0262 -0.0181 0.0402 911 GLU 120 OE1 0.0283 -0.0243 0.0410 912 GLU 120 OE2 0.0317 -0.0167 0.0396 913 VAL 121 N -0.0055 0.0037 0.0230 914 VAL 121 CA -0.0074 0.0030 0.0239 915 VAL 121 C -0.0126 0.0057 0.0240 916 VAL 121 O -0.0161 0.0042 0.0256 917 VAL 121 CB -0.0035 0.0043 0.0223 918 VAL 121 CG1 -0.0056 0.0055 0.0222 919 VAL 121 CG2 0.0011 0.0005 0.0228 920 ASP 122 N -0.0117 0.0129 0.0232 921 ASP 122 CA -0.0170 0.0141 0.0190 922 ASP 122 C -0.0223 0.0097 0.0206 923 ASP 122 O -0.0260 0.0100 0.0181 924 ASP 122 CB -0.0179 0.0160 0.0164 925 ASP 122 CG -0.0154 0.0213 0.0123 926 ASP 122 OD1 -0.0160 0.0233 0.0098 927 ASP 122 OD2 -0.0126 0.0235 0.0116 928 GLU 123 N -0.0247 0.0082 0.0237 929 GLU 123 CA -0.0327 0.0028 0.0294 930 GLU 123 C -0.0243 0.0090 0.0330 931 GLU 123 O -0.0290 0.0054 0.0299 932 GLU 123 CB -0.0410 -0.0023 0.0440 933 GLU 123 CG -0.0512 -0.0094 0.0489 934 GLU 123 CD -0.0595 -0.0146 0.0630 935 GLU 123 OE1 -0.0647 -0.0177 0.0728 936 GLU 123 OE2 -0.0602 -0.0150 0.0633 937 MET 124 N -0.0128 0.0158 0.0280 938 MET 124 CA -0.0131 0.0150 0.0283 939 MET 124 C -0.0150 0.0164 0.0268 940 MET 124 O -0.0168 0.0153 0.0267 941 MET 124 CB -0.0106 0.0151 0.0292 942 MET 124 CG -0.0091 0.0132 0.0308 943 MET 124 SD -0.0060 0.0135 0.0319 944 MET 124 CE -0.0070 0.0113 0.0326 945 ILE 125 N -0.0070 0.0215 0.0079 946 ILE 125 CA -0.0045 0.0205 0.0063 947 ILE 125 C -0.0057 0.0205 0.0064 948 ILE 125 O -0.0041 0.0212 0.0075 949 ILE 125 CB -0.0042 0.0186 0.0033 950 ILE 125 CG1 -0.0028 0.0187 0.0036 951 ILE 125 CG2 -0.0021 0.0171 0.0011 952 ILE 125 CD1 0.0009 0.0191 0.0044 953 ARG 126 N -0.0043 0.0185 0.0101 954 ARG 126 CA -0.0071 0.0140 0.0067 955 ARG 126 C -0.0022 0.0233 0.0139 956 ARG 126 O 0.0071 0.0226 0.0097 957 ARG 126 CB -0.0235 0.0074 0.0066 958 ARG 126 CG -0.0262 -0.0044 -0.0040 959 ARG 126 CD -0.0401 -0.0122 -0.0062 960 ARG 126 NE -0.0537 -0.0107 0.0006 961 ARG 126 CZ -0.0642 -0.0077 0.0077 962 ARG 126 NH1 -0.0621 -0.0051 0.0094 963 ARG 126 NH2 -0.0771 -0.0076 0.0129 964 GLU 127 N -0.0003 0.0149 0.0175 965 GLU 127 CA 0.0040 0.0199 0.0062 966 GLU 127 C 0.0056 0.0294 -0.0050 967 GLU 127 O 0.0129 0.0291 -0.0164 968 GLU 127 CB -0.0022 0.0269 0.0098 969 GLU 127 CG 0.0007 0.0337 -0.0011 970 GLU 127 CD -0.0027 0.0356 0.0026 971 GLU 127 OE1 -0.0024 0.0429 -0.0046 972 GLU 127 OE2 -0.0058 0.0288 0.0137 973 ALA 128 N 0.0120 0.0333 -0.0090 974 ALA 128 CA 0.0099 0.0326 -0.0089 975 ALA 128 C 0.0086 0.0336 -0.0071 976 ALA 128 O 0.0069 0.0330 -0.0070 977 ALA 128 CB 0.0090 0.0316 -0.0097 978 ASN 129 N 0.0044 0.0339 -0.0071 979 ASN 129 CA 0.0027 0.0354 -0.0042 980 ASN 129 C 0.0006 0.0386 -0.0003 981 ASN 129 O 0.0014 0.0430 -0.0004 982 ASN 129 CB 0.0047 0.0378 -0.0068 983 ASN 129 CG 0.0034 0.0394 -0.0043 984 ASN 129 OD1 0.0011 0.0369 -0.0014 985 ASN 129 ND2 0.0047 0.0434 -0.0055 986 ILE 130 N -0.0028 0.0460 0.0039 987 ILE 130 CA -0.0041 0.0513 0.0138 988 ILE 130 C -0.0054 0.0547 0.0219 989 ILE 130 O -0.0029 0.0641 0.0247 990 ILE 130 CB -0.0081 0.0441 0.0178 991 ILE 130 CG1 -0.0060 0.0420 0.0093 992 ILE 130 CG2 -0.0100 0.0483 0.0287 993 ILE 130 CD1 -0.0097 0.0347 0.0122 994 ASP 131 N -0.0126 0.0553 0.0297 995 ASP 131 CA -0.0151 0.0598 0.0347 996 ASP 131 C -0.0111 0.0678 0.0283 997 ASP 131 O -0.0126 0.0716 0.0314 998 ASP 131 CB -0.0177 0.0501 0.0385 999 ASP 131 CG -0.0136 0.0440 0.0302 1000 ASP 131 OD1 -0.0149 0.0354 0.0316 1001 ASP 131 OD2 -0.0089 0.0485 0.0220 1002 GLY 132 N -0.0095 0.0687 0.0258 1003 GLY 132 CA -0.0006 0.0781 0.0214 1004 GLY 132 C -0.0005 0.0790 0.0218 1005 GLY 132 O 0.0032 0.0902 0.0241 1006 ASP 133 N -0.0054 0.0582 0.0086 1007 ASP 133 CA -0.0038 0.0545 0.0043 1008 ASP 133 C -0.0004 0.0537 -0.0059 1009 ASP 133 O 0.0012 0.0512 -0.0105 1010 ASP 133 CB -0.0048 0.0454 0.0090 1011 ASP 133 CG -0.0041 0.0367 0.0084 1012 ASP 133 OD1 -0.0046 0.0287 0.0111 1013 ASP 133 OD2 -0.0032 0.0380 0.0054 1014 GLY 134 N -0.0069 0.0436 -0.0050 1015 GLY 134 CA -0.0036 0.0430 -0.0116 1016 GLY 134 C 0.0007 0.0352 -0.0122 1017 GLY 134 O 0.0041 0.0335 -0.0179 1018 GLN 135 N 0.0000 0.0279 -0.0130 1019 GLN 135 CA 0.0014 0.0219 -0.0130 1020 GLN 135 C 0.0019 0.0224 -0.0078 1021 GLN 135 O 0.0014 0.0266 -0.0032 1022 GLN 135 CB 0.0030 0.0161 -0.0109 1023 GLN 135 CG 0.0035 0.0115 -0.0166 1024 GLN 135 CD 0.0043 0.0082 -0.0161 1025 GLN 135 OE1 0.0048 0.0085 -0.0109 1026 GLN 135 NE2 0.0044 0.0050 -0.0217 1027 VAL 136 N 0.0057 0.0144 -0.0075 1028 VAL 136 CA 0.0051 0.0131 -0.0059 1029 VAL 136 C 0.0047 0.0104 -0.0045 1030 VAL 136 O 0.0054 0.0084 -0.0058 1031 VAL 136 CB 0.0059 0.0128 -0.0077 1032 VAL 136 CG1 0.0072 0.0117 -0.0105 1033 VAL 136 CG2 0.0055 0.0109 -0.0065 1034 ASN 137 N 0.0045 0.0124 -0.0039 1035 ASN 137 CA 0.0000 0.0051 0.0006 1036 ASN 137 C -0.0011 0.0004 -0.0010 1037 ASN 137 O 0.0015 0.0031 -0.0050 1038 ASN 137 CB -0.0023 0.0078 0.0092 1039 ASN 137 CG -0.0028 0.0125 0.0147 1040 ASN 137 OD1 -0.0043 0.0155 0.0215 1041 ASN 137 ND2 -0.0016 0.0132 0.0123 1042 TYR 138 N 0.0009 -0.0046 -0.0041 1043 TYR 138 CA -0.0006 -0.0063 -0.0076 1044 TYR 138 C 0.0016 -0.0061 -0.0093 1045 TYR 138 O 0.0029 -0.0069 -0.0128 1046 TYR 138 CB -0.0052 -0.0075 -0.0069 1047 TYR 138 CG -0.0065 -0.0092 -0.0109 1048 TYR 138 CD1 -0.0060 -0.0101 -0.0141 1049 TYR 138 CD2 -0.0079 -0.0098 -0.0114 1050 TYR 138 CE1 -0.0070 -0.0117 -0.0177 1051 TYR 138 CE2 -0.0089 -0.0114 -0.0151 1052 TYR 138 CZ -0.0084 -0.0123 -0.0182 1053 TYR 138 OH -0.0095 -0.0138 -0.0217 1054 GLU 139 N -0.0066 -0.0038 0.0016 1055 GLU 139 CA -0.0092 0.0022 0.0074 1056 GLU 139 C -0.0051 0.0095 0.0006 1057 GLU 139 O -0.0050 0.0085 0.0003 1058 GLU 139 CB -0.0129 0.0099 0.0155 1059 GLU 139 CG -0.0161 0.0166 0.0224 1060 GLU 139 CD -0.0214 0.0196 0.0328 1061 GLU 139 OE1 -0.0237 0.0259 0.0381 1062 GLU 139 OE2 -0.0229 0.0156 0.0350 1063 GLU 140 N -0.0066 0.0132 0.0043 1064 GLU 140 CA -0.0029 0.0172 -0.0001 1065 GLU 140 C -0.0020 0.0135 -0.0061 1066 GLU 140 O -0.0002 0.0148 -0.0090 1067 GLU 140 CB -0.0008 0.0215 -0.0007 1068 GLU 140 CG -0.0016 0.0254 0.0053 1069 GLU 140 CD -0.0004 0.0281 0.0051 1070 GLU 140 OE1 -0.0002 0.0255 0.0019 1071 GLU 140 OE2 0.0005 0.0330 0.0082 1072 PHE 141 N 0.0011 0.0024 -0.0117 1073 PHE 141 CA 0.0025 -0.0009 -0.0149 1074 PHE 141 C 0.0014 -0.0041 -0.0156 1075 PHE 141 O 0.0037 -0.0050 -0.0183 1076 PHE 141 CB 0.0018 -0.0028 -0.0153 1077 PHE 141 CG 0.0035 -0.0059 -0.0186 1078 PHE 141 CD1 0.0017 -0.0100 -0.0192 1079 PHE 141 CD2 0.0068 -0.0048 -0.0210 1080 PHE 141 CE1 0.0031 -0.0129 -0.0221 1081 PHE 141 CE2 0.0082 -0.0077 -0.0240 1082 PHE 141 CZ 0.0064 -0.0118 -0.0246 1083 VAL 142 N -0.0038 -0.0066 -0.0174 1084 VAL 142 CA -0.0055 -0.0109 -0.0167 1085 VAL 142 C -0.0055 -0.0095 -0.0164 1086 VAL 142 O -0.0048 -0.0127 -0.0174 1087 VAL 142 CB -0.0096 -0.0133 -0.0137 1088 VAL 142 CG1 -0.0109 -0.0119 -0.0125 1089 VAL 142 CG2 -0.0129 -0.0123 -0.0110 1090 GLN 143 N -0.0054 0.0029 -0.0080 1091 GLN 143 CA -0.0035 0.0108 -0.0074 1092 GLN 143 C 0.0024 0.0139 -0.0174 1093 GLN 143 O 0.0046 0.0177 -0.0194 1094 GLN 143 CB -0.0042 0.0204 -0.0007 1095 GLN 143 CG -0.0082 0.0192 0.0066 1096 GLN 143 CD -0.0114 0.0252 0.0161 1097 GLN 143 OE1 -0.0108 0.0290 0.0171 1098 GLN 143 NE2 -0.0146 0.0259 0.0227 1099 MET 144 N 0.0009 0.0129 -0.0143 1100 MET 144 CA 0.0064 0.0152 -0.0224 1101 MET 144 C 0.0076 0.0074 -0.0277 1102 MET 144 O 0.0111 0.0087 -0.0328 1103 MET 144 CB 0.0089 0.0188 -0.0252 1104 MET 144 CG 0.0141 0.0246 -0.0314 1105 MET 144 SD 0.0158 0.0320 -0.0312 1106 MET 144 CE 0.0119 0.0387 -0.0219 1107 MET 145 N 0.0130 -0.0073 -0.0289 1108 MET 145 CA 0.0124 -0.0156 -0.0352 1109 MET 145 C 0.0112 -0.0215 -0.0393 1110 MET 145 O 0.0174 -0.0248 -0.0448 1111 MET 145 CB 0.0047 -0.0186 -0.0339 1112 MET 145 CG 0.0092 -0.0203 -0.0373 1113 MET 145 SD 0.0144 -0.0103 -0.0319 1114 MET 145 CE 0.0261 -0.0114 -0.0383 1115 THR 146 N 0.0035 -0.0252 -0.0368 1116 THR 146 CA -0.0006 -0.0304 -0.0367 1117 THR 146 C 0.0046 -0.0229 -0.0361 1118 THR 146 O 0.0076 -0.0273 -0.0421 1119 THR 146 CB -0.0131 -0.0331 -0.0270 1120 THR 146 OG1 -0.0132 -0.0215 -0.0185 1121 THR 146 CG2 -0.0189 -0.0387 -0.0257 1122 ALA 147 N 0.0018 -0.0078 -0.0309 1123 ALA 147 CA 0.0073 0.0077 -0.0281 1124 ALA 147 C 0.0197 0.0235 -0.0350 1125 ALA 147 O 0.0300 0.0249 -0.0485 1126 ALA 147 CB -0.0028 0.0139 -0.0098