1 THR 5 N -0.0088 -0.0179 0.0180 2 THR 5 CA -0.0161 -0.0179 0.0137 3 THR 5 C -0.0142 -0.0160 0.0118 4 THR 5 O -0.0172 -0.0133 0.0056 5 THR 5 CB -0.0238 -0.0230 0.0175 6 THR 5 OG1 -0.0209 -0.0268 0.0254 7 THR 5 CG2 -0.0301 -0.0235 0.0145 8 GLU 6 N -0.0171 -0.0111 0.0104 9 GLU 6 CA -0.0122 -0.0161 0.0155 10 GLU 6 C -0.0070 -0.0095 0.0024 11 GLU 6 O -0.0132 -0.0074 0.0024 12 GLU 6 CB 0.0019 -0.0268 0.0247 13 GLU 6 CG 0.0006 -0.0357 0.0395 14 GLU 6 CD 0.0157 -0.0450 0.0459 15 GLU 6 OE1 0.0191 -0.0481 0.0489 16 GLU 6 OE2 0.0252 -0.0500 0.0487 17 GLU 7 N -0.0061 -0.0119 0.0043 18 GLU 7 CA -0.0049 -0.0091 0.0015 19 GLU 7 C -0.0075 -0.0085 -0.0011 20 GLU 7 O -0.0072 -0.0062 -0.0039 21 GLU 7 CB -0.0013 -0.0078 0.0021 22 GLU 7 CG -0.0001 -0.0053 -0.0002 23 GLU 7 CD 0.0035 -0.0045 0.0011 24 GLU 7 OE1 0.0044 -0.0058 0.0034 25 GLU 7 OE2 0.0055 -0.0022 -0.0005 26 GLN 8 N -0.0119 -0.0066 -0.0004 27 GLN 8 CA -0.0142 -0.0068 -0.0024 28 GLN 8 C -0.0159 -0.0071 -0.0035 29 GLN 8 O -0.0167 -0.0063 -0.0059 30 GLN 8 CB -0.0157 -0.0079 -0.0013 31 GLN 8 CG -0.0147 -0.0072 -0.0020 32 GLN 8 CD -0.0162 -0.0082 -0.0010 33 GLN 8 OE1 -0.0167 -0.0094 0.0013 34 GLN 8 NE2 -0.0171 -0.0078 -0.0028 35 ILE 9 N -0.0136 -0.0096 -0.0070 36 ILE 9 CA -0.0159 -0.0100 -0.0089 37 ILE 9 C -0.0162 -0.0075 -0.0105 38 ILE 9 O -0.0179 -0.0068 -0.0124 39 ILE 9 CB -0.0169 -0.0128 -0.0084 40 ILE 9 CG1 -0.0178 -0.0124 -0.0094 41 ILE 9 CG2 -0.0153 -0.0145 -0.0061 42 ILE 9 CD1 -0.0172 -0.0142 -0.0080 43 ALA 10 N -0.0191 -0.0052 -0.0100 44 ALA 10 CA -0.0221 -0.0028 -0.0097 45 ALA 10 C -0.0219 -0.0014 -0.0069 46 ALA 10 O -0.0234 -0.0003 -0.0073 47 ALA 10 CB -0.0236 -0.0014 -0.0094 48 GLU 11 N -0.0190 -0.0034 -0.0033 49 GLU 11 CA -0.0184 -0.0007 0.0002 50 GLU 11 C -0.0179 0.0003 0.0016 51 GLU 11 O -0.0199 0.0019 0.0041 52 GLU 11 CB -0.0148 0.0003 0.0008 53 GLU 11 CG -0.0157 -0.0001 0.0005 54 GLU 11 CD -0.0121 0.0001 0.0001 55 GLU 11 OE1 -0.0100 -0.0015 -0.0025 56 GLU 11 OE2 -0.0113 0.0022 0.0028 57 PHE 12 N -0.0142 -0.0066 -0.0019 58 PHE 12 CA -0.0107 -0.0068 -0.0014 59 PHE 12 C -0.0090 -0.0065 -0.0015 60 PHE 12 O -0.0068 -0.0080 -0.0001 61 PHE 12 CB -0.0093 -0.0050 -0.0028 62 PHE 12 CG -0.0100 -0.0057 -0.0023 63 PHE 12 CD1 -0.0114 -0.0040 -0.0037 64 PHE 12 CD2 -0.0093 -0.0081 -0.0002 65 PHE 12 CE1 -0.0120 -0.0046 -0.0033 66 PHE 12 CE2 -0.0100 -0.0087 0.0002 67 PHE 12 CZ -0.0113 -0.0070 -0.0013 68 LYS 13 N -0.0117 -0.0034 -0.0045 69 LYS 13 CA -0.0148 -0.0026 -0.0073 70 LYS 13 C -0.0183 -0.0011 -0.0029 71 LYS 13 O -0.0184 -0.0010 -0.0029 72 LYS 13 CB -0.0186 -0.0018 -0.0121 73 LYS 13 CG -0.0194 -0.0020 -0.0173 74 LYS 13 CD -0.0205 -0.0022 -0.0228 75 LYS 13 CE -0.0152 -0.0042 -0.0258 76 LYS 13 NZ -0.0168 -0.0042 -0.0314 77 GLU 14 N -0.0199 0.0021 -0.0040 78 GLU 14 CA -0.0255 0.0025 0.0038 79 GLU 14 C -0.0182 -0.0018 0.0107 80 GLU 14 O -0.0194 -0.0019 0.0132 81 GLU 14 CB -0.0328 0.0037 0.0110 82 GLU 14 CG -0.0440 0.0081 0.0102 83 GLU 14 CD -0.0502 0.0096 0.0138 84 GLU 14 OE1 -0.0529 0.0119 0.0083 85 GLU 14 OE2 -0.0524 0.0083 0.0234 86 ALA 15 N -0.0143 0.0007 0.0109 87 ALA 15 CA -0.0098 -0.0016 0.0152 88 ALA 15 C -0.0055 -0.0017 0.0129 89 ALA 15 O -0.0045 -0.0029 0.0161 90 ALA 15 CB -0.0068 -0.0027 0.0168 91 PHE 16 N -0.0008 -0.0031 0.0075 92 PHE 16 CA 0.0001 -0.0033 0.0063 93 PHE 16 C -0.0023 -0.0031 0.0067 94 PHE 16 O -0.0015 -0.0031 0.0076 95 PHE 16 CB 0.0010 -0.0035 0.0030 96 PHE 16 CG 0.0022 -0.0037 0.0016 97 PHE 16 CD1 0.0003 -0.0037 0.0001 98 PHE 16 CD2 0.0052 -0.0039 0.0018 99 PHE 16 CE1 0.0013 -0.0038 -0.0013 100 PHE 16 CE2 0.0063 -0.0041 0.0003 101 PHE 16 CZ 0.0043 -0.0040 -0.0011 102 SER 17 N -0.0040 -0.0008 0.0039 103 SER 17 CA -0.0062 -0.0001 0.0037 104 SER 17 C -0.0062 -0.0009 0.0076 105 SER 17 O -0.0068 -0.0006 0.0070 106 SER 17 CB -0.0107 0.0014 0.0025 107 SER 17 OG -0.0106 0.0019 -0.0001 108 LEU 18 N -0.0029 0.0038 0.0098 109 LEU 18 CA -0.0035 0.0054 0.0099 110 LEU 18 C -0.0040 0.0042 0.0083 111 LEU 18 O -0.0051 0.0055 0.0073 112 LEU 18 CB -0.0023 0.0062 0.0124 113 LEU 18 CG -0.0027 0.0075 0.0125 114 LEU 18 CD1 -0.0040 0.0101 0.0120 115 LEU 18 CD2 -0.0014 0.0078 0.0149 116 PHE 19 N 0.0001 0.0058 0.0101 117 PHE 19 CA 0.0010 0.0047 0.0093 118 PHE 19 C 0.0005 0.0048 0.0071 119 PHE 19 O 0.0005 0.0047 0.0066 120 PHE 19 CB 0.0027 0.0033 0.0095 121 PHE 19 CG 0.0035 0.0030 0.0115 122 PHE 19 CD1 0.0042 0.0026 0.0125 123 PHE 19 CD2 0.0034 0.0033 0.0126 124 PHE 19 CE1 0.0049 0.0023 0.0144 125 PHE 19 CE2 0.0042 0.0030 0.0146 126 PHE 19 CZ 0.0049 0.0025 0.0155 127 ASP 20 N 0.0015 0.0019 0.0058 128 ASP 20 CA 0.0003 0.0009 0.0052 129 ASP 20 C -0.0010 0.0015 0.0052 130 ASP 20 O -0.0012 0.0009 0.0050 131 ASP 20 CB 0.0008 -0.0006 0.0048 132 ASP 20 CG -0.0004 -0.0017 0.0042 133 ASP 20 OD1 -0.0002 -0.0029 0.0037 134 ASP 20 OD2 -0.0016 -0.0012 0.0041 135 LYS 21 N -0.0010 0.0040 0.0042 136 LYS 21 CA -0.0015 0.0053 0.0036 137 LYS 21 C -0.0027 0.0039 0.0038 138 LYS 21 O -0.0022 0.0046 0.0037 139 LYS 21 CB -0.0032 0.0074 0.0025 140 LYS 21 CG -0.0019 0.0095 0.0022 141 LYS 21 CD 0.0008 0.0101 0.0027 142 LYS 21 CE 0.0016 0.0128 0.0020 143 LYS 21 NZ 0.0040 0.0133 0.0024 144 ASP 22 N -0.0052 0.0013 0.0059 145 ASP 22 CA -0.0074 -0.0010 0.0060 146 ASP 22 C -0.0061 -0.0041 0.0056 147 ASP 22 O -0.0078 -0.0062 0.0057 148 ASP 22 CB -0.0102 -0.0008 0.0064 149 ASP 22 CG -0.0100 -0.0016 0.0063 150 ASP 22 OD1 -0.0077 -0.0023 0.0060 151 ASP 22 OD2 -0.0124 -0.0016 0.0066 152 GLY 23 N -0.0042 -0.0021 0.0052 153 GLY 23 CA -0.0022 -0.0055 0.0056 154 GLY 23 C -0.0038 -0.0091 0.0053 155 GLY 23 O -0.0032 -0.0120 0.0054 156 ASP 24 N -0.0050 -0.0087 0.0058 157 ASP 24 CA -0.0060 -0.0110 0.0056 158 ASP 24 C -0.0034 -0.0119 0.0049 159 ASP 24 O -0.0039 -0.0136 0.0047 160 ASP 24 CB -0.0085 -0.0099 0.0063 161 ASP 24 CG -0.0074 -0.0078 0.0065 162 ASP 24 OD1 -0.0085 -0.0078 0.0067 163 ASP 24 OD2 -0.0053 -0.0062 0.0063 164 GLY 25 N -0.0015 -0.0101 0.0037 165 GLY 25 CA 0.0004 -0.0103 0.0029 166 GLY 25 C 0.0012 -0.0087 0.0032 167 GLY 25 O 0.0027 -0.0089 0.0026 168 THR 26 N 0.0018 -0.0064 0.0049 169 THR 26 CA 0.0023 -0.0040 0.0051 170 THR 26 C 0.0021 -0.0015 0.0056 171 THR 26 O 0.0008 -0.0015 0.0062 172 THR 26 CB 0.0005 -0.0041 0.0059 173 THR 26 OG1 -0.0018 -0.0033 0.0071 174 THR 26 CG2 0.0003 -0.0068 0.0056 175 ILE 27 N 0.0034 0.0004 0.0063 176 ILE 27 CA 0.0033 0.0020 0.0067 177 ILE 27 C 0.0026 0.0028 0.0071 178 ILE 27 O 0.0031 0.0029 0.0070 179 ILE 27 CB 0.0048 0.0028 0.0064 180 ILE 27 CG1 0.0056 0.0017 0.0059 181 ILE 27 CG2 0.0045 0.0044 0.0069 182 ILE 27 CD1 0.0073 0.0020 0.0054 183 THR 28 N 0.0017 0.0060 0.0059 184 THR 28 CA -0.0003 0.0069 0.0058 185 THR 28 C -0.0002 0.0088 0.0045 186 THR 28 O 0.0014 0.0093 0.0038 187 THR 28 CB -0.0007 0.0064 0.0062 188 THR 28 OG1 -0.0021 0.0053 0.0073 189 THR 28 CG2 -0.0008 0.0076 0.0054 190 THR 29 N 0.0016 0.0114 0.0007 191 THR 29 CA 0.0012 0.0101 -0.0002 192 THR 29 C 0.0023 0.0087 -0.0006 193 THR 29 O 0.0017 0.0076 -0.0014 194 THR 29 CB 0.0013 0.0100 -0.0002 195 THR 29 OG1 0.0029 0.0101 0.0004 196 THR 29 CG2 0.0001 0.0112 0.0000 197 LYS 30 N 0.0006 0.0092 -0.0017 198 LYS 30 CA 0.0008 0.0098 -0.0021 199 LYS 30 C 0.0013 0.0102 -0.0017 200 LYS 30 O 0.0015 0.0107 -0.0018 201 LYS 30 CB 0.0007 0.0099 -0.0024 202 LYS 30 CG 0.0002 0.0094 -0.0027 203 LYS 30 CD 0.0002 0.0090 -0.0022 204 LYS 30 CE -0.0003 0.0084 -0.0024 205 LYS 30 NZ -0.0005 0.0080 -0.0022 206 GLU 31 N -0.0023 0.0096 0.0027 207 GLU 31 CA -0.0004 0.0099 0.0031 208 GLU 31 C 0.0010 0.0108 0.0032 209 GLU 31 O 0.0021 0.0121 0.0031 210 GLU 31 CB 0.0001 0.0079 0.0037 211 GLU 31 CG -0.0011 0.0072 0.0036 212 GLU 31 CD -0.0008 0.0053 0.0041 213 GLU 31 OE1 -0.0009 0.0047 0.0042 214 GLU 31 OE2 -0.0003 0.0042 0.0045 215 LEU 32 N -0.0002 0.0090 0.0020 216 LEU 32 CA -0.0004 0.0089 0.0020 217 LEU 32 C -0.0004 0.0089 0.0012 218 LEU 32 O -0.0002 0.0090 0.0011 219 LEU 32 CB -0.0011 0.0085 0.0022 220 LEU 32 CG -0.0014 0.0083 0.0021 221 LEU 32 CD1 -0.0011 0.0085 0.0025 222 LEU 32 CD2 -0.0020 0.0079 0.0023 223 GLY 33 N 0.0011 0.0093 -0.0034 224 GLY 33 CA 0.0019 0.0086 -0.0088 225 GLY 33 C 0.0056 0.0129 -0.0095 226 GLY 33 O 0.0055 0.0122 -0.0115 227 THR 34 N 0.0038 0.0181 -0.0071 228 THR 34 CA 0.0050 0.0211 -0.0072 229 THR 34 C 0.0069 0.0221 -0.0051 230 THR 34 O 0.0077 0.0245 -0.0055 231 THR 34 CB 0.0048 0.0222 -0.0082 232 THR 34 OG1 0.0066 0.0236 -0.0065 233 THR 34 CG2 0.0033 0.0201 -0.0091 234 VAL 35 N -0.0001 0.0193 0.0021 235 VAL 35 CA 0.0013 0.0199 0.0068 236 VAL 35 C 0.0011 0.0184 0.0075 237 VAL 35 O 0.0022 0.0209 0.0097 238 VAL 35 CB 0.0017 0.0175 0.0102 239 VAL 35 CG1 0.0029 0.0177 0.0150 240 VAL 35 CG2 0.0020 0.0195 0.0100 241 MET 36 N -0.0021 0.0131 0.0029 242 MET 36 CA -0.0049 0.0079 0.0018 243 MET 36 C -0.0022 0.0074 -0.0023 244 MET 36 O -0.0037 0.0054 -0.0020 245 MET 36 CB -0.0064 0.0032 -0.0005 246 MET 36 CG -0.0092 0.0027 0.0028 247 MET 36 SD -0.0132 0.0035 0.0089 248 MET 36 CE -0.0180 -0.0021 0.0102 249 ARG 37 N 0.0024 0.0106 -0.0091 250 ARG 37 CA 0.0064 0.0120 -0.0161 251 ARG 37 C 0.0096 0.0178 -0.0136 252 ARG 37 O 0.0105 0.0172 -0.0168 253 ARG 37 CB 0.0106 0.0143 -0.0222 254 ARG 37 CG 0.0098 0.0087 -0.0300 255 ARG 37 CD 0.0083 0.0059 -0.0314 256 ARG 37 NE 0.0131 0.0114 -0.0334 257 ARG 37 CZ 0.0119 0.0096 -0.0334 258 ARG 37 NH1 0.0069 0.0032 -0.0328 259 ARG 37 NH2 0.0158 0.0147 -0.0339 260 SER 38 N 0.0072 0.0298 -0.0077 261 SER 38 CA 0.0104 0.0396 -0.0030 262 SER 38 C 0.0101 0.0375 0.0054 263 SER 38 O 0.0123 0.0443 0.0085 264 SER 38 CB 0.0121 0.0445 0.0004 265 SER 38 OG 0.0115 0.0411 0.0105 266 LEU 39 N 0.0044 0.0273 0.0062 267 LEU 39 CA 0.0007 0.0227 0.0142 268 LEU 39 C -0.0010 0.0154 0.0081 269 LEU 39 O -0.0046 0.0103 0.0146 270 LEU 39 CB -0.0040 0.0165 0.0232 271 LEU 39 CG -0.0028 0.0241 0.0322 272 LEU 39 CD1 -0.0077 0.0177 0.0420 273 LEU 39 CD2 -0.0000 0.0334 0.0370 274 GLY 40 N 0.0005 0.0113 -0.0044 275 GLY 40 CA -0.0006 -0.0006 -0.0140 276 GLY 40 C -0.0076 -0.0133 -0.0160 277 GLY 40 O -0.0124 -0.0245 -0.0195 278 GLN 41 N -0.0073 -0.0118 -0.0135 279 GLN 41 CA -0.0124 -0.0199 -0.0147 280 GLN 41 C -0.0068 -0.0179 -0.0200 281 GLN 41 O -0.0032 -0.0097 -0.0169 282 GLN 41 CB -0.0200 -0.0199 -0.0050 283 GLN 41 CG -0.0270 -0.0281 -0.0037 284 GLN 41 CD -0.0347 -0.0280 0.0064 285 GLN 41 OE1 -0.0412 -0.0347 0.0083 286 GLN 41 NE2 -0.0337 -0.0204 0.0122 287 ASN 42 N -0.0029 -0.0251 -0.0242 288 ASN 42 CA 0.0028 -0.0238 -0.0317 289 ASN 42 C 0.0008 -0.0311 -0.0326 290 ASN 42 O 0.0018 -0.0387 -0.0381 291 ASN 42 CB 0.0081 -0.0251 -0.0399 292 ASN 42 CG 0.0113 -0.0170 -0.0401 293 ASN 42 OD1 0.0085 -0.0156 -0.0354 294 ASN 42 ND2 0.0174 -0.0113 -0.0459 295 PRO 43 N -0.0007 -0.0221 -0.0230 296 PRO 43 CA -0.0031 -0.0233 -0.0224 297 PRO 43 C 0.0042 -0.0228 -0.0257 298 PRO 43 O 0.0108 -0.0189 -0.0273 299 PRO 43 CB -0.0079 -0.0165 -0.0170 300 PRO 43 CG -0.0044 -0.0098 -0.0158 301 PRO 43 CD -0.0028 -0.0145 -0.0186 302 THR 44 N 0.0026 -0.0200 -0.0259 303 THR 44 CA 0.0094 -0.0180 -0.0243 304 THR 44 C 0.0091 -0.0090 -0.0184 305 THR 44 O 0.0029 -0.0051 -0.0161 306 THR 44 CB 0.0073 -0.0219 -0.0270 307 THR 44 OG1 -0.0013 -0.0184 -0.0249 308 THR 44 CG2 0.0064 -0.0311 -0.0330 309 GLU 45 N 0.0085 -0.0061 -0.0118 310 GLU 45 CA 0.0087 -0.0021 -0.0082 311 GLU 45 C 0.0041 0.0013 -0.0082 312 GLU 45 O 0.0026 0.0042 -0.0066 313 GLU 45 CB 0.0125 -0.0010 -0.0048 314 GLU 45 CG 0.0131 0.0032 -0.0009 315 GLU 45 CD 0.0160 0.0032 0.0011 316 GLU 45 OE1 0.0157 0.0062 0.0034 317 GLU 45 OE2 0.0193 -0.0002 0.0001 318 ALA 46 N 0.0032 0.0012 -0.0093 319 ALA 46 CA -0.0015 0.0041 -0.0094 320 ALA 46 C -0.0055 0.0044 -0.0113 321 ALA 46 O -0.0088 0.0078 -0.0103 322 ALA 46 CB -0.0031 0.0028 -0.0113 323 GLU 47 N -0.0029 -0.0023 -0.0133 324 GLU 47 CA -0.0097 -0.0022 -0.0144 325 GLU 47 C -0.0089 0.0032 -0.0113 326 GLU 47 O -0.0147 0.0066 -0.0103 327 GLU 47 CB -0.0098 -0.0092 -0.0183 328 GLU 47 CG -0.0122 -0.0147 -0.0217 329 GLU 47 CD -0.0112 -0.0218 -0.0255 330 GLU 47 OE1 -0.0056 -0.0244 -0.0261 331 GLU 47 OE2 -0.0170 -0.0247 -0.0281 332 LEU 48 N -0.0037 0.0027 -0.0074 333 LEU 48 CA -0.0032 0.0056 -0.0062 334 LEU 48 C -0.0040 0.0087 -0.0049 335 LEU 48 O -0.0062 0.0107 -0.0040 336 LEU 48 CB 0.0005 0.0055 -0.0062 337 LEU 48 CG 0.0013 0.0043 -0.0067 338 LEU 48 CD1 -0.0017 0.0022 -0.0076 339 LEU 48 CD2 0.0047 0.0022 -0.0076 340 GLN 49 N -0.0029 0.0111 -0.0040 341 GLN 49 CA -0.0041 0.0127 -0.0023 342 GLN 49 C -0.0060 0.0137 -0.0032 343 GLN 49 O -0.0065 0.0145 -0.0020 344 GLN 49 CB -0.0046 0.0136 -0.0011 345 GLN 49 CG -0.0054 0.0150 0.0010 346 GLN 49 CD -0.0038 0.0147 0.0029 347 GLN 49 OE1 -0.0042 0.0154 0.0041 348 GLN 49 NE2 -0.0020 0.0135 0.0032 349 ASP 50 N -0.0067 0.0134 -0.0067 350 ASP 50 CA -0.0084 0.0139 -0.0070 351 ASP 50 C -0.0047 0.0128 -0.0063 352 ASP 50 O -0.0056 0.0126 -0.0046 353 ASP 50 CB -0.0104 0.0154 -0.0114 354 ASP 50 CG -0.0148 0.0167 -0.0120 355 ASP 50 OD1 -0.0177 0.0168 -0.0091 356 ASP 50 OD2 -0.0153 0.0177 -0.0158 357 MET 51 N -0.0022 0.0116 -0.0021 358 MET 51 CA -0.0041 0.0120 -0.0026 359 MET 51 C -0.0038 0.0146 -0.0022 360 MET 51 O -0.0056 0.0160 -0.0026 361 MET 51 CB -0.0040 0.0099 -0.0027 362 MET 51 CG -0.0048 0.0074 -0.0032 363 MET 51 SD -0.0046 0.0051 -0.0033 364 MET 51 CE -0.0030 0.0026 -0.0032 365 ILE 52 N 0.0008 0.0140 -0.0000 366 ILE 52 CA 0.0007 0.0126 0.0009 367 ILE 52 C 0.0003 0.0126 0.0012 368 ILE 52 O 0.0009 0.0116 0.0014 369 ILE 52 CB -0.0002 0.0119 0.0020 370 ILE 52 CG1 0.0006 0.0109 0.0021 371 ILE 52 CG2 -0.0010 0.0111 0.0031 372 ILE 52 CD1 0.0013 0.0112 0.0014 373 ASN 53 N -0.0015 0.0115 0.0005 374 ASN 53 CA -0.0020 0.0098 0.0010 375 ASN 53 C 0.0015 0.0091 0.0008 376 ASN 53 O 0.0020 0.0066 0.0015 377 ASN 53 CB -0.0044 0.0121 0.0006 378 ASN 53 CG -0.0083 0.0120 0.0010 379 ASN 53 OD1 -0.0106 0.0138 0.0007 380 ASN 53 ND2 -0.0088 0.0099 0.0017 381 GLU 54 N 0.0079 0.0041 -0.0010 382 GLU 54 CA 0.0094 0.0029 0.0048 383 GLU 54 C 0.0090 0.0050 0.0058 384 GLU 54 O 0.0104 0.0022 0.0087 385 GLU 54 CB 0.0095 0.0057 0.0091 386 GLU 54 CG 0.0114 0.0032 0.0148 387 GLU 54 CD 0.0114 0.0069 0.0199 388 GLU 54 OE1 0.0124 0.0065 0.0245 389 GLU 54 OE2 0.0103 0.0103 0.0188 390 VAL 55 N 0.0141 0.0069 0.0062 391 VAL 55 CA 0.0139 0.0067 0.0058 392 VAL 55 C 0.0138 0.0066 0.0054 393 VAL 55 O 0.0138 0.0064 0.0049 394 VAL 55 CB 0.0134 0.0067 0.0059 395 VAL 55 CG1 0.0134 0.0068 0.0064 396 VAL 55 CG2 0.0129 0.0066 0.0060 397 ASP 56 N 0.0077 0.0088 0.0026 398 ASP 56 CA 0.0063 0.0072 0.0041 399 ASP 56 C 0.0066 0.0073 0.0039 400 ASP 56 O 0.0057 0.0090 0.0043 401 ASP 56 CB 0.0042 0.0082 0.0058 402 ASP 56 CG 0.0027 0.0064 0.0075 403 ASP 56 OD1 0.0010 0.0074 0.0088 404 ASP 56 OD2 0.0035 0.0040 0.0072 405 ALA 57 N 0.0104 0.0066 0.0021 406 ALA 57 CA 0.0114 0.0074 0.0010 407 ALA 57 C 0.0097 0.0070 0.0032 408 ALA 57 O 0.0102 0.0091 0.0028 409 ALA 57 CB 0.0133 0.0051 -0.0019 410 ASP 58 N 0.0074 0.0042 0.0056 411 ASP 58 CA 0.0045 0.0026 0.0082 412 ASP 58 C 0.0008 0.0049 0.0109 413 ASP 58 O -0.0019 0.0033 0.0134 414 ASP 58 CB 0.0046 -0.0027 0.0090 415 ASP 58 CG 0.0040 -0.0044 0.0098 416 ASP 58 OD1 0.0038 -0.0086 0.0106 417 ASP 58 OD2 0.0037 -0.0014 0.0096 418 GLY 59 N -0.0001 0.0075 0.0112 419 GLY 59 CA -0.0035 0.0103 0.0136 420 GLY 59 C -0.0069 0.0080 0.0161 421 GLY 59 O -0.0102 0.0098 0.0184 422 ASN 60 N -0.0038 0.0046 0.0148 423 ASN 60 CA -0.0063 0.0025 0.0174 424 ASN 60 C -0.0070 0.0046 0.0178 425 ASN 60 O -0.0092 0.0032 0.0201 426 ASN 60 CB -0.0060 -0.0021 0.0175 427 ASN 60 CG -0.0033 -0.0039 0.0151 428 ASN 60 OD1 -0.0015 -0.0015 0.0131 429 ASN 60 ND2 -0.0029 -0.0080 0.0151 430 GLY 61 N -0.0049 0.0068 0.0131 431 GLY 61 CA -0.0046 0.0078 0.0115 432 GLY 61 C -0.0020 0.0069 0.0103 433 GLY 61 O -0.0016 0.0077 0.0088 434 THR 62 N -0.0000 0.0044 0.0095 435 THR 62 CA 0.0018 0.0035 0.0086 436 THR 62 C 0.0044 0.0025 0.0074 437 THR 62 O 0.0047 0.0018 0.0074 438 THR 62 CB 0.0010 0.0012 0.0097 439 THR 62 OG1 0.0010 -0.0015 0.0104 440 THR 62 CG2 -0.0016 0.0021 0.0110 441 ILE 63 N 0.0061 0.0007 0.0061 442 ILE 63 CA 0.0092 -0.0004 0.0055 443 ILE 63 C 0.0093 -0.0026 0.0052 444 ILE 63 O 0.0082 -0.0022 0.0055 445 ILE 63 CB 0.0116 0.0022 0.0052 446 ILE 63 CG1 0.0137 0.0016 0.0048 447 ILE 63 CG2 0.0106 0.0056 0.0057 448 ILE 63 CD1 0.0165 0.0001 0.0041 449 ASP 64 N 0.0100 -0.0035 0.0023 450 ASP 64 CA 0.0099 -0.0067 0.0012 451 ASP 64 C 0.0127 -0.0068 -0.0006 452 ASP 64 O 0.0148 -0.0046 -0.0010 453 ASP 64 CB 0.0093 -0.0089 0.0006 454 ASP 64 CG 0.0118 -0.0087 -0.0008 455 ASP 64 OD1 0.0115 -0.0102 -0.0012 456 ASP 64 OD2 0.0141 -0.0070 -0.0015 457 PHE 65 N 0.0113 -0.0063 -0.0079 458 PHE 65 CA 0.0099 -0.0066 -0.0090 459 PHE 65 C 0.0145 -0.0058 -0.0111 460 PHE 65 O 0.0157 -0.0054 -0.0088 461 PHE 65 CB 0.0048 -0.0079 -0.0129 462 PHE 65 CG 0.0025 -0.0084 -0.0127 463 PHE 65 CD1 0.0021 -0.0087 -0.0177 464 PHE 65 CD2 0.0010 -0.0084 -0.0076 465 PHE 65 CE1 0.0001 -0.0091 -0.0177 466 PHE 65 CE2 -0.0011 -0.0089 -0.0074 467 PHE 65 CZ -0.0015 -0.0092 -0.0125 468 PRO 66 N 0.0148 -0.0100 -0.0141 469 PRO 66 CA 0.0202 -0.0089 -0.0168 470 PRO 66 C 0.0243 -0.0055 -0.0131 471 PRO 66 O 0.0281 -0.0043 -0.0140 472 PRO 66 CB 0.0215 -0.0100 -0.0207 473 PRO 66 CG 0.0164 -0.0123 -0.0209 474 PRO 66 CD 0.0126 -0.0118 -0.0161 475 GLU 67 N 0.0229 -0.0074 -0.0048 476 GLU 67 CA 0.0252 -0.0024 -0.0022 477 GLU 67 C 0.0266 0.0014 -0.0001 478 GLU 67 O 0.0313 0.0043 0.0002 479 GLU 67 CB 0.0210 -0.0005 0.0005 480 GLU 67 CG 0.0205 -0.0025 -0.0007 481 GLU 67 CD 0.0153 -0.0018 0.0015 482 GLU 67 OE1 0.0113 -0.0004 0.0038 483 GLU 67 OE2 0.0151 -0.0030 0.0007 484 PHE 68 N 0.0243 -0.0027 -0.0007 485 PHE 68 CA 0.0217 -0.0033 0.0028 486 PHE 68 C 0.0213 -0.0033 0.0009 487 PHE 68 O 0.0228 -0.0031 0.0032 488 PHE 68 CB 0.0166 -0.0043 0.0037 489 PHE 68 CG 0.0135 -0.0050 0.0071 490 PHE 68 CD1 0.0137 -0.0050 0.0122 491 PHE 68 CD2 0.0102 -0.0056 0.0053 492 PHE 68 CE1 0.0107 -0.0056 0.0154 493 PHE 68 CE2 0.0072 -0.0063 0.0084 494 PHE 68 CZ 0.0075 -0.0063 0.0135 495 LEU 69 N 0.0180 -0.0047 -0.0027 496 LEU 69 CA 0.0158 -0.0048 -0.0072 497 LEU 69 C 0.0191 -0.0020 -0.0087 498 LEU 69 O 0.0178 -0.0026 -0.0098 499 LEU 69 CB 0.0140 -0.0049 -0.0111 500 LEU 69 CG 0.0111 -0.0053 -0.0162 501 LEU 69 CD1 0.0131 -0.0031 -0.0191 502 LEU 69 CD2 0.0065 -0.0088 -0.0153 503 THR 70 N 0.0283 0.0017 -0.0155 504 THR 70 CA 0.0367 0.0060 -0.0178 505 THR 70 C 0.0401 0.0094 -0.0098 506 THR 70 O 0.0450 0.0119 -0.0114 507 THR 70 CB 0.0421 0.0083 -0.0219 508 THR 70 OG1 0.0441 0.0108 -0.0143 509 THR 70 CG2 0.0384 0.0051 -0.0287 510 MET 71 N 0.0400 0.0049 0.0064 511 MET 71 CA 0.0421 0.0030 0.0125 512 MET 71 C 0.0364 -0.0002 0.0129 513 MET 71 O 0.0371 -0.0002 0.0136 514 MET 71 CB 0.0439 0.0007 0.0189 515 MET 71 CG 0.0438 -0.0025 0.0251 516 MET 71 SD 0.0369 -0.0079 0.0288 517 MET 71 CE 0.0356 -0.0110 0.0338 518 MET 72 N 0.0268 -0.0067 0.0094 519 MET 72 CA 0.0162 -0.0121 0.0101 520 MET 72 C 0.0104 -0.0094 0.0039 521 MET 72 O 0.0058 -0.0141 0.0068 522 MET 72 CB 0.0103 -0.0137 0.0088 523 MET 72 CG 0.0063 -0.0222 0.0165 524 MET 72 SD 0.0172 -0.0255 0.0261 525 MET 72 CE 0.0124 -0.0348 0.0343 526 ALA 73 N 0.0082 -0.0048 -0.0082 527 ALA 73 CA 0.0006 0.0007 -0.0195 528 ALA 73 C 0.0043 0.0009 -0.0169 529 ALA 73 O -0.0040 -0.0069 -0.0155 530 ALA 73 CB 0.0028 0.0127 -0.0299 531 ARG 74 N 0.0120 0.0098 -0.0252 532 ARG 74 CA 0.0255 0.0115 -0.0175 533 ARG 74 C 0.0197 -0.0058 0.0023 534 ARG 74 O 0.0141 -0.0085 0.0018 535 ARG 74 CB 0.0528 0.0209 -0.0103 536 ARG 74 CG 0.0657 0.0404 -0.0281 537 ARG 74 CD 0.0923 0.0479 -0.0187 538 ARG 74 NE 0.1044 0.0509 -0.0139 539 ARG 74 CZ 0.1020 0.0613 -0.0303 540 ARG 74 NH1 0.0896 0.0696 -0.0510 541 ARG 74 NH2 0.1121 0.0631 -0.0253 542 LYS 75 N 0.0155 -0.0131 0.0125 543 LYS 75 CA 0.0134 -0.0223 0.0202 544 LYS 75 C 0.0014 -0.0285 0.0184 545 LYS 75 O -0.0011 -0.0357 0.0238 546 LYS 75 CB 0.0187 -0.0278 0.0289 547 LYS 75 CG 0.0146 -0.0378 0.0360 548 LYS 75 CD 0.0172 -0.0443 0.0440 549 LYS 75 CE 0.0279 -0.0449 0.0515 550 LYS 75 NZ 0.0266 -0.0484 0.0541 551 MET 76 N -0.0113 -0.0308 0.0081 552 MET 76 CA -0.0267 -0.0386 0.0060 553 MET 76 C -0.0299 -0.0355 -0.0002 554 MET 76 O -0.0397 -0.0434 0.0020 555 MET 76 CB -0.0366 -0.0391 -0.0008 556 MET 76 CG -0.0349 -0.0445 0.0069 557 MET 76 SD -0.0492 -0.0592 0.0140 558 MET 76 CE -0.0451 -0.0664 0.0257 559 LYS 77 N -0.0227 -0.0313 0.0002 560 LYS 77 CA -0.0260 -0.0267 -0.0070 561 LYS 77 C -0.0210 -0.0357 0.0063 562 LYS 77 O -0.0321 -0.0411 0.0056 563 LYS 77 CB -0.0145 -0.0101 -0.0190 564 LYS 77 CG -0.0129 0.0011 -0.0306 565 LYS 77 CD -0.0274 0.0083 -0.0479 566 LYS 77 CE -0.0219 0.0214 -0.0594 567 LYS 77 NZ -0.0028 0.0335 -0.0614 568 ASP 78 N -0.0177 -0.0299 0.0014 569 ASP 78 CA -0.0124 -0.0317 0.0099 570 ASP 78 C -0.0185 -0.0382 0.0178 571 ASP 78 O -0.0155 -0.0401 0.0245 572 ASP 78 CB -0.0027 -0.0293 0.0139 573 ASP 78 CG 0.0034 -0.0228 0.0061 574 ASP 78 OD1 0.0121 -0.0199 0.0081 575 ASP 78 OD2 -0.0009 -0.0206 -0.0024 576 THR 79 N -0.0274 -0.0373 0.0175 577 THR 79 CA -0.0284 -0.0367 0.0187 578 THR 79 C -0.0249 -0.0387 0.0142 579 THR 79 O -0.0243 -0.0377 0.0140 580 THR 79 CB -0.0335 -0.0403 0.0224 581 THR 79 OG1 -0.0339 -0.0408 0.0226 582 THR 79 CG2 -0.0351 -0.0463 0.0213 583 ASP 80 N -0.0251 -0.0356 0.0107 584 ASP 80 CA -0.0200 -0.0368 0.0101 585 ASP 80 C -0.0099 -0.0355 0.0119 586 ASP 80 O -0.0041 -0.0355 0.0124 587 ASP 80 CB -0.0215 -0.0440 0.0037 588 ASP 80 CG -0.0304 -0.0441 0.0030 589 ASP 80 OD1 -0.0347 -0.0494 -0.0019 590 ASP 80 OD2 -0.0327 -0.0386 0.0075 591 SER 81 N -0.0174 -0.0378 0.0143 592 SER 81 CA -0.0178 -0.0380 0.0142 593 SER 81 C -0.0182 -0.0281 0.0092 594 SER 81 O -0.0114 -0.0237 0.0095 595 SER 81 CB -0.0265 -0.0448 0.0144 596 SER 81 OG -0.0244 -0.0541 0.0197 597 GLU 82 N -0.0225 -0.0208 0.0004 598 GLU 82 CA -0.0239 -0.0104 -0.0072 599 GLU 82 C -0.0127 -0.0003 -0.0057 600 GLU 82 O -0.0103 0.0077 -0.0092 601 GLU 82 CB -0.0327 -0.0060 -0.0162 602 GLU 82 CG -0.0355 0.0045 -0.0249 603 GLU 82 CD -0.0417 0.0027 -0.0281 604 GLU 82 OE1 -0.0441 0.0107 -0.0349 605 GLU 82 OE2 -0.0439 -0.0076 -0.0231 606 GLU 83 N -0.0097 0.0021 0.0020 607 GLU 83 CA 0.0022 0.0109 0.0027 608 GLU 83 C 0.0136 0.0096 0.0087 609 GLU 83 O 0.0216 0.0193 0.0071 610 GLU 83 CB 0.0046 0.0111 0.0037 611 GLU 83 CG -0.0030 0.0198 -0.0045 612 GLU 83 CD 0.0019 0.0229 -0.0039 613 GLU 83 OE1 0.0041 0.0148 0.0015 614 GLU 83 OE2 0.0036 0.0342 -0.0092 615 GLU 84 N 0.0092 0.0004 0.0154 616 GLU 84 CA 0.0209 -0.0031 0.0259 617 GLU 84 C 0.0176 0.0021 0.0203 618 GLU 84 O 0.0284 0.0107 0.0223 619 GLU 84 CB 0.0200 -0.0211 0.0366 620 GLU 84 CG 0.0320 -0.0265 0.0485 621 GLU 84 CD 0.0264 -0.0428 0.0549 622 GLU 84 OE1 0.0166 -0.0460 0.0501 623 GLU 84 OE2 0.0329 -0.0530 0.0659 624 ILE 85 N 0.0027 0.0024 0.0034 625 ILE 85 CA 0.0011 0.0051 0.0016 626 ILE 85 C 0.0014 0.0136 -0.0014 627 ILE 85 O 0.0039 0.0170 -0.0013 628 ILE 85 CB -0.0060 0.0008 -0.0007 629 ILE 85 CG1 -0.0054 -0.0076 0.0027 630 ILE 85 CG2 -0.0081 0.0046 -0.0032 631 ILE 85 CD1 -0.0129 -0.0126 0.0006 632 ARG 86 N 0.0026 0.0187 -0.0029 633 ARG 86 CA 0.0041 0.0324 -0.0096 634 ARG 86 C 0.0170 0.0396 -0.0040 635 ARG 86 O 0.0201 0.0502 -0.0078 636 ARG 86 CB -0.0013 0.0376 -0.0167 637 ARG 86 CG -0.0141 0.0370 -0.0260 638 ARG 86 CD -0.0181 0.0427 -0.0323 639 ARG 86 NE -0.0268 0.0488 -0.0424 640 ARG 86 CZ -0.0382 0.0442 -0.0484 641 ARG 86 NH1 -0.0444 0.0320 -0.0460 642 ARG 86 NH2 -0.0440 0.0526 -0.0576 643 GLU 87 N 0.0185 0.0361 0.0069 644 GLU 87 CA 0.0296 0.0419 0.0154 645 GLU 87 C 0.0222 0.0364 0.0169 646 GLU 87 O 0.0270 0.0415 0.0091 647 GLU 87 CB 0.0364 0.0422 0.0350 648 GLU 87 CG 0.0523 0.0530 0.0360 649 GLU 87 CD 0.0603 0.0545 0.0541 650 GLU 87 OE1 0.0714 0.0622 0.0540 651 GLU 87 OE2 0.0552 0.0478 0.0684 652 ALA 88 N 0.0117 0.0270 0.0144 653 ALA 88 CA 0.0063 0.0227 0.0164 654 ALA 88 C 0.0052 0.0195 0.0093 655 ALA 88 O 0.0039 0.0183 0.0093 656 ALA 88 CB 0.0015 0.0194 0.0201 657 PHE 89 N -0.0011 0.0181 -0.0004 658 PHE 89 CA -0.0013 0.0168 -0.0023 659 PHE 89 C -0.0008 0.0187 -0.0017 660 PHE 89 O -0.0012 0.0175 -0.0013 661 PHE 89 CB -0.0009 0.0164 -0.0059 662 PHE 89 CG -0.0012 0.0146 -0.0077 663 PHE 89 CD1 -0.0022 0.0114 -0.0076 664 PHE 89 CD2 -0.0005 0.0160 -0.0092 665 PHE 89 CE1 -0.0026 0.0097 -0.0091 666 PHE 89 CE2 -0.0008 0.0143 -0.0107 667 PHE 89 CZ -0.0019 0.0111 -0.0107 668 ARG 90 N 0.0044 0.0259 -0.0008 669 ARG 90 CA 0.0082 0.0332 -0.0008 670 ARG 90 C 0.0006 0.0330 0.0142 671 ARG 90 O 0.0006 0.0328 0.0139 672 ARG 90 CB 0.0179 0.0501 -0.0032 673 ARG 90 CG 0.0274 0.0550 -0.0171 674 ARG 90 CD 0.0363 0.0704 -0.0194 675 ARG 90 NE 0.0430 0.0688 -0.0345 676 ARG 90 CZ 0.0483 0.0781 -0.0357 677 ARG 90 NH1 0.0477 0.0889 -0.0234 678 ARG 90 NH2 0.0539 0.0754 -0.0496 679 VAL 91 N 0.0024 0.0229 0.0089 680 VAL 91 CA -0.0018 0.0226 0.0134 681 VAL 91 C -0.0070 0.0162 0.0119 682 VAL 91 O -0.0091 0.0141 0.0119 683 VAL 91 CB -0.0033 0.0270 0.0201 684 VAL 91 CG1 0.0005 0.0318 0.0212 685 VAL 91 CG2 -0.0098 0.0245 0.0246 686 PHE 92 N -0.0083 0.0139 0.0130 687 PHE 92 CA -0.0106 0.0068 0.0131 688 PHE 92 C -0.0098 0.0068 0.0090 689 PHE 92 O -0.0111 0.0043 0.0118 690 PHE 92 CB -0.0119 0.0009 0.0102 691 PHE 92 CG -0.0139 -0.0020 0.0153 692 PHE 92 CD1 -0.0165 -0.0076 0.0195 693 PHE 92 CD2 -0.0132 0.0004 0.0158 694 PHE 92 CE1 -0.0184 -0.0107 0.0240 695 PHE 92 CE2 -0.0150 -0.0024 0.0204 696 PHE 92 CZ -0.0177 -0.0080 0.0245 697 ASP 93 N -0.0077 0.0102 0.0061 698 ASP 93 CA -0.0071 0.0088 0.0055 699 ASP 93 C -0.0085 0.0102 0.0072 700 ASP 93 O -0.0078 0.0118 0.0059 701 ASP 93 CB -0.0049 0.0090 0.0023 702 ASP 93 CG -0.0042 0.0073 0.0018 703 ASP 93 OD1 -0.0029 0.0081 -0.0003 704 ASP 93 OD2 -0.0052 0.0050 0.0037 705 LYS 94 N -0.0081 0.0092 0.0085 706 LYS 94 CA -0.0138 0.0079 0.0107 707 LYS 94 C -0.0123 0.0035 0.0119 708 LYS 94 O -0.0159 0.0046 0.0126 709 LYS 94 CB -0.0194 0.0057 0.0134 710 LYS 94 CG -0.0252 0.0041 0.0158 711 LYS 94 CD -0.0320 0.0061 0.0173 712 LYS 94 CE -0.0372 0.0052 0.0193 713 LYS 94 NZ -0.0423 0.0110 0.0189 714 ASP 95 N -0.0134 0.0065 0.0122 715 ASP 95 CA -0.0127 0.0063 0.0112 716 ASP 95 C -0.0109 0.0072 0.0084 717 ASP 95 O -0.0100 0.0060 0.0071 718 ASP 95 CB -0.0130 0.0031 0.0117 719 ASP 95 CG -0.0119 0.0005 0.0102 720 ASP 95 OD1 -0.0121 -0.0022 0.0107 721 ASP 95 OD2 -0.0107 0.0010 0.0084 722 GLY 96 N -0.0031 0.0096 0.0056 723 GLY 96 CA -0.0023 0.0103 0.0033 724 GLY 96 C -0.0017 0.0087 0.0015 725 GLY 96 O -0.0012 0.0097 0.0002 726 ASN 97 N -0.0067 0.0071 0.0027 727 ASN 97 CA -0.0051 0.0043 0.0012 728 ASN 97 C -0.0031 0.0035 -0.0010 729 ASN 97 O -0.0016 0.0013 -0.0024 730 ASN 97 CB -0.0063 0.0014 0.0032 731 ASN 97 CG -0.0065 -0.0010 0.0039 732 ASN 97 OD1 -0.0067 0.0002 0.0038 733 ASN 97 ND2 -0.0065 -0.0042 0.0044 734 GLY 98 N -0.0040 0.0055 -0.0023 735 GLY 98 CA -0.0022 0.0060 -0.0034 736 GLY 98 C -0.0035 0.0049 -0.0027 737 GLY 98 O -0.0023 0.0057 -0.0034 738 TYR 99 N -0.0047 0.0026 0.0003 739 TYR 99 CA -0.0055 0.0003 0.0014 740 TYR 99 C -0.0085 0.0010 0.0042 741 TYR 99 O -0.0104 0.0013 0.0059 742 TYR 99 CB -0.0051 -0.0039 0.0018 743 TYR 99 CG -0.0022 -0.0050 -0.0008 744 TYR 99 CD1 -0.0017 -0.0058 -0.0011 745 TYR 99 CD2 0.0001 -0.0052 -0.0028 746 TYR 99 CE1 0.0010 -0.0069 -0.0035 747 TYR 99 CE2 0.0028 -0.0063 -0.0052 748 TYR 99 CZ 0.0032 -0.0071 -0.0054 749 TYR 99 OH 0.0058 -0.0082 -0.0077 750 ILE 100 N -0.0109 0.0000 0.0042 751 ILE 100 CA -0.0120 -0.0001 0.0066 752 ILE 100 C -0.0123 -0.0030 0.0079 753 ILE 100 O -0.0117 -0.0048 0.0072 754 ILE 100 CB -0.0120 0.0004 0.0064 755 ILE 100 CG1 -0.0119 0.0035 0.0054 756 ILE 100 CG2 -0.0131 -0.0002 0.0090 757 ILE 100 CD1 -0.0116 0.0038 0.0047 758 SER 101 N -0.0140 -0.0027 0.0113 759 SER 101 CA -0.0144 -0.0050 0.0122 760 SER 101 C -0.0161 -0.0046 0.0132 761 SER 101 O -0.0170 -0.0025 0.0132 762 SER 101 CB -0.0149 -0.0066 0.0131 763 SER 101 OG -0.0169 -0.0055 0.0140 764 ALA 102 N -0.0155 0.0002 0.0152 765 ALA 102 CA -0.0146 0.0004 0.0139 766 ALA 102 C -0.0149 -0.0003 0.0130 767 ALA 102 O -0.0146 -0.0006 0.0117 768 ALA 102 CB -0.0136 0.0017 0.0143 769 ALA 103 N -0.0117 0.0030 0.0126 770 ALA 103 CA -0.0108 0.0023 0.0117 771 ALA 103 C -0.0110 0.0002 0.0116 772 ALA 103 O -0.0099 -0.0007 0.0105 773 ALA 103 CB -0.0111 0.0030 0.0121 774 GLU 104 N -0.0149 -0.0013 0.0132 775 GLU 104 CA -0.0146 -0.0014 0.0137 776 GLU 104 C -0.0147 -0.0021 0.0145 777 GLU 104 O -0.0141 -0.0022 0.0151 778 GLU 104 CB -0.0148 -0.0011 0.0131 779 GLU 104 CG -0.0144 -0.0003 0.0124 780 GLU 104 CD -0.0147 0.0000 0.0118 781 GLU 104 OE1 -0.0154 -0.0003 0.0116 782 GLU 104 OE2 -0.0141 0.0006 0.0115 783 LEU 105 N -0.0155 -0.0021 0.0141 784 LEU 105 CA -0.0151 -0.0034 0.0137 785 LEU 105 C -0.0129 -0.0034 0.0126 786 LEU 105 O -0.0122 -0.0050 0.0120 787 LEU 105 CB -0.0160 -0.0025 0.0143 788 LEU 105 CG -0.0156 -0.0037 0.0139 789 LEU 105 CD1 -0.0165 -0.0060 0.0142 790 LEU 105 CD2 -0.0164 -0.0026 0.0145 791 ARG 106 N -0.0086 -0.0027 0.0075 792 ARG 106 CA -0.0063 -0.0019 0.0037 793 ARG 106 C -0.0059 -0.0058 0.0016 794 ARG 106 O -0.0048 -0.0071 -0.0009 795 ARG 106 CB -0.0052 0.0015 0.0029 796 ARG 106 CG -0.0029 0.0030 -0.0008 797 ARG 106 CD -0.0020 0.0069 -0.0010 798 ARG 106 NE -0.0009 0.0063 -0.0032 799 ARG 106 CZ -0.0016 0.0068 -0.0019 800 ARG 106 NH1 -0.0032 0.0080 0.0015 801 ARG 106 NH2 -0.0006 0.0060 -0.0038 802 HIS 107 N -0.0022 -0.0015 0.0031 803 HIS 107 CA 0.0036 -0.0077 0.0014 804 HIS 107 C 0.0030 -0.0187 0.0035 805 HIS 107 O 0.0098 -0.0238 0.0012 806 HIS 107 CB 0.0012 -0.0066 0.0023 807 HIS 107 CG 0.0080 -0.0115 -0.0001 808 HIS 107 ND1 0.0168 -0.0091 -0.0048 809 HIS 107 CD2 0.0068 -0.0184 0.0017 810 HIS 107 CE1 0.0207 -0.0146 -0.0058 811 HIS 107 NE2 0.0147 -0.0201 -0.0019 812 VAL 108 N -0.0005 -0.0102 0.0137 813 VAL 108 CA -0.0006 -0.0182 0.0175 814 VAL 108 C -0.0004 -0.0189 0.0177 815 VAL 108 O 0.0029 -0.0255 0.0185 816 VAL 108 CB -0.0062 -0.0216 0.0232 817 VAL 108 CG1 -0.0109 -0.0160 0.0240 818 VAL 108 CG2 -0.0102 -0.0256 0.0281 819 MET 109 N 0.0000 -0.0186 0.0133 820 MET 109 CA -0.0006 -0.0147 0.0118 821 MET 109 C 0.0042 -0.0168 0.0027 822 MET 109 O 0.0054 -0.0186 0.0014 823 MET 109 CB -0.0046 -0.0046 0.0137 824 MET 109 CG -0.0079 -0.0016 0.0189 825 MET 109 SD -0.0102 -0.0094 0.0296 826 MET 109 CE -0.0121 -0.0059 0.0312 827 THR 110 N 0.0108 -0.0212 -0.0058 828 THR 110 CA 0.0154 -0.0241 -0.0191 829 THR 110 C 0.0200 -0.0377 -0.0191 830 THR 110 O 0.0224 -0.0389 -0.0261 831 THR 110 CB 0.0172 -0.0198 -0.0308 832 THR 110 OG1 0.0231 -0.0313 -0.0381 833 THR 110 CG2 0.0140 -0.0136 -0.0268 834 ASN 111 N 0.0278 -0.0437 -0.0136 835 ASN 111 CA 0.0339 -0.0640 -0.0109 836 ASN 111 C 0.0299 -0.0725 -0.0016 837 ASN 111 O 0.0364 -0.0887 -0.0015 838 ASN 111 CB 0.0312 -0.0736 -0.0026 839 ASN 111 CG 0.0368 -0.0688 -0.0121 840 ASN 111 OD1 0.0298 -0.0657 -0.0050 841 ASN 111 ND2 0.0486 -0.0679 -0.0274 842 LEU 112 N 0.0226 -0.0504 0.0084 843 LEU 112 CA 0.0186 -0.0499 0.0194 844 LEU 112 C 0.0169 -0.0429 0.0111 845 LEU 112 O 0.0134 -0.0413 0.0186 846 LEU 112 CB 0.0096 -0.0430 0.0328 847 LEU 112 CG 0.0115 -0.0532 0.0464 848 LEU 112 CD1 0.0205 -0.0641 0.0404 849 LEU 112 CD2 0.0034 -0.0458 0.0564 850 GLY 113 N 0.0186 -0.0392 -0.0051 851 GLY 113 CA 0.0126 -0.0288 -0.0201 852 GLY 113 C 0.0009 -0.0084 -0.0238 853 GLY 113 O -0.0051 0.0020 -0.0334 854 GLU 114 N 0.0005 -0.0060 -0.0169 855 GLU 114 CA -0.0038 0.0084 -0.0183 856 GLU 114 C -0.0040 0.0074 -0.0240 857 GLU 114 O -0.0017 0.0017 -0.0162 858 GLU 114 CB -0.0046 0.0157 -0.0031 859 GLU 114 CG -0.0051 0.0199 0.0045 860 GLU 114 CD -0.0095 0.0331 -0.0021 861 GLU 114 OE1 -0.0126 0.0421 -0.0079 862 GLU 114 OE2 -0.0094 0.0332 -0.0006 863 LYS 115 N -0.0067 0.0188 -0.0309 864 LYS 115 CA -0.0099 0.0037 -0.0409 865 LYS 115 C -0.0121 0.0201 -0.0369 866 LYS 115 O -0.0240 0.0387 -0.0436 867 LYS 115 CB -0.0245 -0.0060 -0.0623 868 LYS 115 CG -0.0264 -0.0133 -0.0675 869 LYS 115 CD -0.0443 -0.0175 -0.0906 870 LYS 115 CE -0.0458 -0.0377 -0.1006 871 LYS 115 NZ -0.0627 -0.0415 -0.1224 872 LEU 116 N -0.0032 0.0078 -0.0197 873 LEU 116 CA -0.0011 0.0133 -0.0150 874 LEU 116 C -0.0007 0.0141 -0.0130 875 LEU 116 O -0.0025 0.0090 -0.0116 876 LEU 116 CB -0.0014 0.0115 -0.0082 877 LEU 116 CG -0.0005 0.0140 -0.0070 878 LEU 116 CD1 -0.0006 0.0146 -0.0136 879 LEU 116 CD2 -0.0019 0.0094 -0.0016 880 THR 117 N 0.0078 0.0110 -0.0113 881 THR 117 CA 0.0087 0.0134 -0.0063 882 THR 117 C 0.0064 0.0138 -0.0011 883 THR 117 O 0.0050 0.0126 -0.0018 884 THR 117 CB 0.0145 0.0169 -0.0069 885 THR 117 OG1 0.0163 0.0185 -0.0057 886 THR 117 CG2 0.0173 0.0166 -0.0127 887 ASP 118 N 0.0081 0.0155 0.0024 888 ASP 118 CA 0.0053 0.0166 0.0060 889 ASP 118 C 0.0064 0.0178 0.0065 890 ASP 118 O 0.0037 0.0175 0.0086 891 ASP 118 CB 0.0053 0.0195 0.0095 892 ASP 118 CG 0.0024 0.0206 0.0133 893 ASP 118 OD1 0.0037 0.0237 0.0160 894 ASP 118 OD2 -0.0011 0.0183 0.0135 895 GLU 119 N 0.0109 0.0185 0.0070 896 GLU 119 CA 0.0137 0.0204 0.0073 897 GLU 119 C 0.0106 0.0143 0.0024 898 GLU 119 O 0.0086 0.0151 0.0046 899 GLU 119 CB 0.0234 0.0239 0.0047 900 GLU 119 CG 0.0269 0.0243 0.0029 901 GLU 119 CD 0.0360 0.0292 0.0023 902 GLU 119 OE1 0.0415 0.0278 -0.0030 903 GLU 119 OE2 0.0373 0.0349 0.0081 904 GLU 120 N 0.0109 0.0148 0.0002 905 GLU 120 CA 0.0094 0.0119 -0.0039 906 GLU 120 C 0.0033 0.0090 -0.0012 907 GLU 120 O 0.0024 0.0082 -0.0018 908 GLU 120 CB 0.0098 0.0090 -0.0106 909 GLU 120 CG 0.0162 0.0117 -0.0141 910 GLU 120 CD 0.0170 0.0091 -0.0206 911 GLU 120 OE1 0.0208 0.0097 -0.0249 912 GLU 120 OE2 0.0136 0.0067 -0.0209 913 VAL 121 N -0.0011 0.0075 0.0043 914 VAL 121 CA -0.0052 0.0064 0.0056 915 VAL 121 C -0.0065 0.0083 0.0084 916 VAL 121 O -0.0093 0.0072 0.0089 917 VAL 121 CB -0.0067 0.0063 0.0064 918 VAL 121 CG1 -0.0106 0.0064 0.0088 919 VAL 121 CG2 -0.0064 0.0037 0.0035 920 ASP 122 N -0.0028 0.0094 0.0091 921 ASP 122 CA -0.0046 0.0112 0.0100 922 ASP 122 C -0.0055 0.0079 0.0076 923 ASP 122 O -0.0091 0.0082 0.0072 924 ASP 122 CB -0.0010 0.0141 0.0127 925 ASP 122 CG -0.0027 0.0183 0.0152 926 ASP 122 OD1 -0.0071 0.0194 0.0152 927 ASP 122 OD2 0.0004 0.0205 0.0173 928 GLU 123 N -0.0051 0.0074 0.0063 929 GLU 123 CA -0.0049 0.0062 0.0052 930 GLU 123 C -0.0084 0.0027 0.0046 931 GLU 123 O -0.0099 0.0025 0.0053 932 GLU 123 CB -0.0010 0.0055 0.0023 933 GLU 123 CG -0.0004 0.0049 0.0015 934 GLU 123 CD 0.0036 0.0044 -0.0013 935 GLU 123 OE1 0.0044 0.0026 -0.0032 936 GLU 123 OE2 0.0061 0.0061 -0.0015 937 MET 124 N -0.0116 0.0014 0.0046 938 MET 124 CA -0.0118 0.0006 0.0050 939 MET 124 C -0.0128 0.0012 0.0047 940 MET 124 O -0.0139 0.0006 0.0050 941 MET 124 CB -0.0103 0.0002 0.0052 942 MET 124 CG -0.0095 -0.0007 0.0056 943 MET 124 SD -0.0078 -0.0012 0.0058 944 MET 124 CE -0.0083 -0.0026 0.0065 945 ILE 125 N -0.0166 -0.0002 0.0082 946 ILE 125 CA -0.0151 -0.0011 0.0081 947 ILE 125 C -0.0119 -0.0022 0.0073 948 ILE 125 O -0.0102 -0.0012 0.0057 949 ILE 125 CB -0.0165 -0.0030 0.0104 950 ILE 125 CG1 -0.0197 -0.0016 0.0109 951 ILE 125 CG2 -0.0151 -0.0045 0.0108 952 ILE 125 CD1 -0.0202 0.0000 0.0099 953 ARG 126 N -0.0113 -0.0012 0.0036 954 ARG 126 CA -0.0098 0.0002 0.0047 955 ARG 126 C -0.0100 -0.0004 0.0035 956 ARG 126 O -0.0107 -0.0002 0.0050 957 ARG 126 CB -0.0072 0.0018 0.0044 958 ARG 126 CG -0.0070 0.0027 0.0065 959 ARG 126 CD -0.0044 0.0045 0.0068 960 ARG 126 NE -0.0030 0.0047 0.0048 961 ARG 126 CZ -0.0011 0.0053 0.0031 962 ARG 126 NH1 -0.0005 0.0057 0.0031 963 ARG 126 NH2 0.0004 0.0056 0.0015 964 GLU 127 N -0.0075 -0.0006 0.0016 965 GLU 127 CA -0.0070 -0.0002 -0.0003 966 GLU 127 C -0.0071 0.0013 -0.0021 967 GLU 127 O -0.0062 0.0010 -0.0039 968 GLU 127 CB -0.0077 0.0006 0.0003 969 GLU 127 CG -0.0074 0.0013 -0.0015 970 GLU 127 CD -0.0076 0.0013 -0.0009 971 GLU 127 OE1 -0.0076 0.0021 -0.0021 972 GLU 127 OE2 -0.0078 0.0004 0.0009 973 ALA 128 N -0.0057 0.0016 -0.0033 974 ALA 128 CA -0.0023 0.0028 -0.0036 975 ALA 128 C 0.0005 -0.0005 -0.0044 976 ALA 128 O 0.0036 0.0005 -0.0048 977 ALA 128 CB -0.0037 0.0047 -0.0032 978 ASN 129 N 0.0016 -0.0033 -0.0009 979 ASN 129 CA 0.0042 -0.0075 -0.0010 980 ASN 129 C 0.0099 -0.0097 -0.0029 981 ASN 129 O 0.0107 -0.0130 -0.0025 982 ASN 129 CB 0.0004 -0.0119 0.0019 983 ASN 129 CG 0.0023 -0.0165 0.0022 984 ASN 129 OD1 0.0051 -0.0153 0.0006 985 ASN 129 ND2 0.0009 -0.0216 0.0041 986 ILE 130 N 0.0150 -0.0112 -0.0057 987 ILE 130 CA 0.0201 -0.0130 -0.0086 988 ILE 130 C 0.0219 -0.0176 -0.0082 989 ILE 130 O 0.0238 -0.0220 -0.0078 990 ILE 130 CB 0.0224 -0.0081 -0.0120 991 ILE 130 CG1 0.0205 -0.0040 -0.0122 992 ILE 130 CG2 0.0279 -0.0094 -0.0152 993 ILE 130 CD1 0.0225 0.0012 -0.0154 994 ASP 131 N 0.0249 -0.0203 -0.0126 995 ASP 131 CA 0.0272 -0.0259 -0.0117 996 ASP 131 C 0.0241 -0.0320 -0.0072 997 ASP 131 O 0.0254 -0.0369 -0.0060 998 ASP 131 CB 0.0269 -0.0230 -0.0126 999 ASP 131 CG 0.0202 -0.0216 -0.0092 1000 ASP 131 OD1 0.0187 -0.0189 -0.0094 1001 ASP 131 OD2 0.0163 -0.0237 -0.0060 1002 GLY 132 N 0.0199 -0.0314 -0.0071 1003 GLY 132 CA 0.0142 -0.0372 -0.0047 1004 GLY 132 C 0.0116 -0.0410 -0.0036 1005 GLY 132 O 0.0100 -0.0484 -0.0031 1006 ASP 133 N 0.0107 -0.0334 -0.0014 1007 ASP 133 CA 0.0075 -0.0352 0.0013 1008 ASP 133 C 0.0015 -0.0343 0.0052 1009 ASP 133 O -0.0016 -0.0360 0.0078 1010 ASP 133 CB 0.0088 -0.0317 -0.0005 1011 ASP 133 CG 0.0073 -0.0245 -0.0014 1012 ASP 133 OD1 0.0076 -0.0215 -0.0024 1013 ASP 133 OD2 0.0059 -0.0218 -0.0012 1014 GLY 134 N 0.0015 -0.0271 0.0030 1015 GLY 134 CA -0.0036 -0.0263 0.0082 1016 GLY 134 C -0.0064 -0.0192 0.0093 1017 GLY 134 O -0.0109 -0.0178 0.0137 1018 GLN 135 N -0.0050 -0.0173 0.0061 1019 GLN 135 CA -0.0058 -0.0127 0.0062 1020 GLN 135 C -0.0038 -0.0090 0.0041 1021 GLN 135 O -0.0010 -0.0103 0.0021 1022 GLN 135 CB -0.0045 -0.0127 0.0052 1023 GLN 135 CG -0.0076 -0.0126 0.0076 1024 GLN 135 CD -0.0066 -0.0151 0.0071 1025 GLN 135 OE1 -0.0034 -0.0165 0.0048 1026 GLN 135 NE2 -0.0095 -0.0157 0.0095 1027 VAL 136 N -0.0058 -0.0053 0.0028 1028 VAL 136 CA -0.0045 -0.0027 0.0006 1029 VAL 136 C -0.0038 0.0002 -0.0008 1030 VAL 136 O -0.0056 0.0020 0.0006 1031 VAL 136 CB -0.0061 -0.0012 0.0020 1032 VAL 136 CG1 -0.0092 -0.0003 0.0050 1033 VAL 136 CG2 -0.0054 0.0023 0.0003 1034 ASN 137 N -0.0011 -0.0003 -0.0039 1035 ASN 137 CA -0.0003 0.0027 -0.0059 1036 ASN 137 C 0.0002 0.0065 -0.0076 1037 ASN 137 O -0.0000 0.0065 -0.0075 1038 ASN 137 CB 0.0023 0.0004 -0.0077 1039 ASN 137 CG 0.0055 -0.0009 -0.0105 1040 ASN 137 OD1 0.0075 -0.0033 -0.0117 1041 ASN 137 ND2 0.0060 0.0003 -0.0114 1042 TYR 138 N -0.0033 0.0141 -0.0068 1043 TYR 138 CA -0.0045 0.0141 -0.0103 1044 TYR 138 C -0.0032 0.0102 -0.0139 1045 TYR 138 O -0.0023 0.0080 -0.0150 1046 TYR 138 CB -0.0078 0.0182 -0.0124 1047 TYR 138 CG -0.0088 0.0179 -0.0156 1048 TYR 138 CD1 -0.0080 0.0178 -0.0137 1049 TYR 138 CD2 -0.0102 0.0175 -0.0204 1050 TYR 138 CE1 -0.0087 0.0173 -0.0165 1051 TYR 138 CE2 -0.0109 0.0171 -0.0233 1052 TYR 138 CZ -0.0102 0.0170 -0.0213 1053 TYR 138 OH -0.0109 0.0165 -0.0243 1054 GLU 139 N 0.0011 0.0098 -0.0146 1055 GLU 139 CA 0.0048 0.0079 -0.0178 1056 GLU 139 C 0.0044 0.0053 -0.0158 1057 GLU 139 O 0.0052 0.0068 -0.0176 1058 GLU 139 CB 0.0081 0.0038 -0.0193 1059 GLU 139 CG 0.0121 0.0015 -0.0227 1060 GLU 139 CD 0.0155 -0.0004 -0.0256 1061 GLU 139 OE1 0.0187 -0.0027 -0.0281 1062 GLU 139 OE2 0.0147 0.0005 -0.0252 1063 GLU 140 N 0.0055 0.0041 -0.0128 1064 GLU 140 CA 0.0056 0.0022 -0.0113 1065 GLU 140 C 0.0035 0.0048 -0.0106 1066 GLU 140 O 0.0040 0.0047 -0.0112 1067 GLU 140 CB 0.0052 -0.0007 -0.0083 1068 GLU 140 CG 0.0072 -0.0034 -0.0089 1069 GLU 140 CD 0.0063 -0.0056 -0.0058 1070 GLU 140 OE1 0.0040 -0.0044 -0.0036 1071 GLU 140 OE2 0.0081 -0.0086 -0.0057 1072 PHE 141 N -0.0018 0.0032 -0.0081 1073 PHE 141 CA -0.0025 0.0049 -0.0065 1074 PHE 141 C -0.0021 0.0062 -0.0070 1075 PHE 141 O -0.0029 0.0062 -0.0057 1076 PHE 141 CB -0.0028 0.0067 -0.0058 1077 PHE 141 CG -0.0036 0.0083 -0.0040 1078 PHE 141 CD1 -0.0032 0.0106 -0.0044 1079 PHE 141 CD2 -0.0048 0.0077 -0.0020 1080 PHE 141 CE1 -0.0040 0.0122 -0.0028 1081 PHE 141 CE2 -0.0056 0.0093 -0.0004 1082 PHE 141 CZ -0.0052 0.0115 -0.0008 1083 VAL 142 N -0.0011 0.0091 -0.0112 1084 VAL 142 CA -0.0007 0.0102 -0.0131 1085 VAL 142 C 0.0004 0.0086 -0.0138 1086 VAL 142 O 0.0004 0.0091 -0.0143 1087 VAL 142 CB -0.0005 0.0116 -0.0150 1088 VAL 142 CG1 -0.0009 0.0121 -0.0147 1089 VAL 142 CG2 0.0010 0.0106 -0.0171 1090 GLN 143 N 0.0031 0.0114 -0.0143 1091 GLN 143 CA 0.0044 0.0086 -0.0151 1092 GLN 143 C 0.0014 0.0077 -0.0115 1093 GLN 143 O 0.0018 0.0069 -0.0118 1094 GLN 143 CB 0.0068 0.0036 -0.0165 1095 GLN 143 CG 0.0082 0.0030 -0.0179 1096 GLN 143 CD 0.0118 0.0002 -0.0214 1097 GLN 143 OE1 0.0133 -0.0006 -0.0228 1098 GLN 143 NE2 0.0132 -0.0012 -0.0226 1099 MET 144 N -0.0006 0.0082 -0.0078 1100 MET 144 CA -0.0027 0.0081 -0.0069 1101 MET 144 C -0.0037 0.0105 -0.0066 1102 MET 144 O -0.0047 0.0112 -0.0062 1103 MET 144 CB -0.0039 0.0063 -0.0062 1104 MET 144 CG -0.0056 0.0054 -0.0054 1105 MET 144 SD -0.0051 0.0052 -0.0056 1106 MET 144 CE -0.0028 0.0034 -0.0065 1107 MET 145 N -0.0012 0.0095 -0.0057 1108 MET 145 CA -0.0020 0.0118 -0.0054 1109 MET 145 C -0.0012 0.0123 -0.0068 1110 MET 145 O -0.0016 0.0123 -0.0062 1111 MET 145 CB -0.0024 0.0138 -0.0057 1112 MET 145 CG -0.0040 0.0148 -0.0037 1113 MET 145 SD -0.0046 0.0127 -0.0020 1114 MET 145 CE -0.0059 0.0123 0.0002 1115 THR 146 N -0.0019 0.0135 -0.0106 1116 THR 146 CA -0.0002 0.0155 -0.0111 1117 THR 146 C 0.0026 0.0179 -0.0111 1118 THR 146 O 0.0033 0.0202 -0.0131 1119 THR 146 CB 0.0006 0.0141 -0.0087 1120 THR 146 OG1 0.0030 0.0141 -0.0062 1121 THR 146 CG2 -0.0020 0.0114 -0.0081 1122 ALA 147 N 0.0023 0.0160 -0.0111 1123 ALA 147 CA 0.0030 0.0158 -0.0112 1124 ALA 147 C 0.0013 0.0140 -0.0108 1125 ALA 147 O -0.0002 0.0150 -0.0106 1126 ALA 147 CB 0.0057 0.0150 -0.0116