1 GLY 5 N -0.0118 0.0371 0.0107 2 GLY 5 CA -0.0090 0.0356 0.0082 3 GLY 5 C -0.0088 0.0302 0.0073 4 GLY 5 O -0.0117 0.0273 0.0092 5 LEU 6 N -0.0053 0.0287 0.0042 6 LEU 6 CA -0.0046 0.0235 0.0029 7 LEU 6 C -0.0018 0.0225 0.0006 8 LEU 6 O 0.0010 0.0253 -0.0014 9 LEU 6 CB -0.0030 0.0222 0.0014 10 LEU 6 CG -0.0034 0.0168 0.0011 11 LEU 6 CD1 -0.0075 0.0147 0.0040 12 LEU 6 CD2 -0.0024 0.0161 0.0001 13 TYR 7 N -0.0059 0.0159 0.0026 14 TYR 7 CA -0.0041 0.0138 0.0018 15 TYR 7 C -0.0046 0.0122 0.0008 16 TYR 7 O -0.0067 0.0123 0.0004 17 TYR 7 CB -0.0043 0.0126 0.0011 18 TYR 7 CG -0.0032 0.0138 0.0020 19 TYR 7 CD1 -0.0044 0.0157 0.0028 20 TYR 7 CD2 -0.0008 0.0129 0.0020 21 TYR 7 CE1 -0.0034 0.0168 0.0036 22 TYR 7 CE2 0.0002 0.0139 0.0028 23 TYR 7 CZ -0.0010 0.0159 0.0036 24 TYR 7 OH 0.0000 0.0169 0.0044 25 ARG 8 N -0.0026 0.0107 0.0005 26 ARG 8 CA -0.0027 0.0090 -0.0005 27 ARG 8 C -0.0017 0.0067 -0.0016 28 ARG 8 O 0.0005 0.0064 -0.0013 29 ARG 8 CB -0.0012 0.0096 0.0001 30 ARG 8 CG -0.0013 0.0079 -0.0008 31 ARG 8 CD 0.0006 0.0083 -0.0002 32 ARG 8 NE -0.0001 0.0104 0.0008 33 ARG 8 CZ 0.0015 0.0120 0.0020 34 ARG 8 NH1 0.0039 0.0116 0.0023 35 ARG 8 NH2 0.0006 0.0138 0.0028 36 MET 9 N -0.0018 0.0038 0.0003 37 MET 9 CA -0.0019 0.0030 0.0006 38 MET 9 C -0.0014 0.0023 0.0009 39 MET 9 O -0.0016 0.0022 0.0009 40 MET 9 CB -0.0030 0.0027 0.0006 41 MET 9 CG -0.0032 0.0018 0.0010 42 MET 9 SD -0.0044 0.0015 0.0010 43 MET 9 CE -0.0047 0.0017 0.0009 44 THR 10 N -0.0009 0.0018 0.0012 45 THR 10 CA -0.0004 0.0011 0.0015 46 THR 10 C -0.0006 0.0002 0.0018 47 THR 10 O -0.0006 0.0002 0.0018 48 THR 10 CB 0.0007 0.0013 0.0015 49 THR 10 CG2 0.0010 0.0014 0.0015 50 THR 10 OG1 0.0011 0.0005 0.0018 51 TYR 11 N -0.0007 0.0006 0.0035 52 TYR 11 CA -0.0011 0.0008 0.0041 53 TYR 11 C -0.0006 0.0012 0.0047 54 TYR 11 O -0.0001 0.0013 0.0046 55 TYR 11 CB -0.0010 0.0008 0.0039 56 TYR 11 CG -0.0003 0.0009 0.0040 57 TYR 11 CD1 0.0003 0.0007 0.0035 58 TYR 11 CD2 -0.0002 0.0013 0.0046 59 TYR 11 CE1 0.0009 0.0009 0.0036 60 TYR 11 CE2 0.0005 0.0014 0.0047 61 TYR 11 CZ 0.0010 0.0012 0.0042 62 TYR 11 OH 0.0017 0.0014 0.0043 63 ILE 12 N -0.0010 0.0015 0.0052 64 ILE 12 CA -0.0007 0.0019 0.0059 65 ILE 12 C -0.0006 0.0021 0.0062 66 ILE 12 O -0.0009 0.0020 0.0060 67 ILE 12 CB -0.0011 0.0021 0.0063 68 ILE 12 CG1 -0.0019 0.0020 0.0065 69 ILE 12 CG2 -0.0012 0.0019 0.0060 70 ILE 12 CD1 -0.0024 0.0021 0.0067 71 SER 13 N 0.0020 -0.0000 0.0084 72 SER 13 CA 0.0031 0.0015 0.0094 73 SER 13 C 0.0028 0.0025 0.0093 74 SER 13 O 0.0020 0.0017 0.0086 75 SER 13 CB 0.0049 0.0006 0.0106 76 SER 13 OG 0.0055 0.0003 0.0111 77 ARG 14 N 0.0033 0.0042 0.0100 78 ARG 14 CA 0.0031 0.0054 0.0100 79 ARG 14 C 0.0047 0.0054 0.0112 80 ARG 14 O 0.0059 0.0060 0.0122 81 ARG 14 CB 0.0025 0.0075 0.0098 82 ARG 14 CG 0.0008 0.0076 0.0086 83 ARG 14 CD 0.0000 0.0097 0.0082 84 ARG 14 NE -0.0015 0.0098 0.0071 85 ARG 14 CZ -0.0029 0.0095 0.0060 86 ARG 14 NH1 -0.0030 0.0091 0.0059 87 ARG 14 NH2 -0.0042 0.0097 0.0051 88 ALA 15 N 0.0065 0.0027 0.0063 89 ALA 15 CA 0.0066 0.0002 0.0100 90 ALA 15 C 0.0078 0.0040 0.0079 91 ALA 15 O 0.0073 0.0072 0.0025 92 ALA 15 CB 0.0026 -0.0063 0.0094 93 VAL 16 N 0.0095 0.0035 0.0122 94 VAL 16 CA 0.0107 0.0066 0.0109 95 VAL 16 C 0.0070 0.0037 0.0062 96 VAL 16 O 0.0038 -0.0017 0.0061 97 VAL 16 CB 0.0134 0.0065 0.0171 98 VAL 16 CG1 0.0175 0.0110 0.0208 99 VAL 16 CG2 0.0115 0.0002 0.0211 100 PRO 17 N 0.0086 0.0501 -0.0254 101 PRO 17 CA 0.0026 0.0138 -0.0526 102 PRO 17 C -0.0037 -0.0324 -0.0245 103 PRO 17 O -0.0100 -0.0711 -0.0465 104 PRO 17 CB 0.0061 0.0393 -0.0645 105 PRO 17 CG 0.0134 0.0840 -0.0356 106 PRO 17 CD 0.0155 0.0952 -0.0178 107 GLY 18 N -0.0022 -0.0299 0.0233 108 GLY 18 CA -0.0077 -0.0710 0.0527 109 GLY 18 C -0.0117 -0.1007 0.0720 110 GLY 18 O -0.0151 -0.1289 0.1060 111 LEU 19 N 0.0041 -0.0235 0.0030 112 LEU 19 CA 0.0029 -0.0175 0.0024 113 LEU 19 C 0.0033 -0.0140 0.0030 114 LEU 19 O 0.0062 -0.0150 0.0054 115 LEU 19 CB 0.0058 -0.0153 0.0050 116 LEU 19 CG 0.0042 -0.0097 0.0042 117 LEU 19 CD1 0.0011 -0.0108 0.0015 118 LEU 19 CD2 0.0081 -0.0065 0.0077 119 GLY 20 N 0.0002 -0.0098 0.0008 120 GLY 20 CA 0.0002 -0.0061 0.0011 121 GLY 20 C -0.0002 0.0002 0.0012 122 GLY 20 O -0.0000 0.0018 0.0015 123 TYR 21 N -0.0168 0.0178 -0.0118 124 TYR 21 CA -0.0200 0.0117 -0.0060 125 TYR 21 C -0.0114 0.0074 -0.0049 126 TYR 21 O -0.0110 0.0002 0.0008 127 TYR 21 CB -0.0286 0.0155 -0.0068 128 TYR 21 CG -0.0384 0.0180 -0.0060 129 TYR 21 CD1 -0.0407 0.0254 -0.0114 130 TYR 21 CD2 -0.0453 0.0128 0.0001 131 TYR 21 CE1 -0.0496 0.0276 -0.0108 132 TYR 21 CE2 -0.0542 0.0149 0.0008 133 TYR 21 CZ -0.0564 0.0224 -0.0047 134 TYR 21 OH -0.0653 0.0245 -0.0040 135 ASN 22 N -0.0046 0.0117 -0.0103 136 ASN 22 CA 0.0038 0.0080 -0.0096 137 ASN 22 C 0.0104 0.0012 -0.0059 138 ASN 22 O 0.0132 -0.0053 -0.0014 139 ASN 22 CB 0.0098 0.0144 -0.0164 140 ASN 22 CG 0.0036 0.0212 -0.0202 141 ASN 22 ND2 0.0070 0.0282 -0.0268 142 ASN 22 OD1 -0.0042 0.0203 -0.0173 143 ASP 23 N 0.0032 -0.0040 -0.0063 144 ASP 23 CA 0.0043 -0.0085 -0.0056 145 ASP 23 C 0.0037 -0.0088 -0.0016 146 ASP 23 O 0.0043 -0.0111 -0.0019 147 ASP 23 CB 0.0050 -0.0119 -0.0049 148 ASP 23 CG 0.0059 -0.0126 -0.0092 149 ASP 23 OD1 0.0069 -0.0150 -0.0122 150 ASP 23 OD2 0.0054 -0.0108 -0.0096 151 LEU 24 N 0.0026 -0.0066 0.0022 152 LEU 24 CA 0.0020 -0.0067 0.0062 153 LEU 24 C 0.0016 -0.0047 0.0050 154 LEU 24 O 0.0020 -0.0067 0.0063 155 LEU 24 CB 0.0007 -0.0042 0.0101 156 LEU 24 CG 0.0010 -0.0068 0.0129 157 LEU 24 CD1 -0.0003 -0.0037 0.0164 158 LEU 24 CD2 0.0017 -0.0109 0.0153 159 ARG 25 N 0.0004 -0.0043 0.0001 160 ARG 25 CA 0.0001 -0.0048 0.0010 161 ARG 25 C 0.0034 -0.0069 0.0001 162 ARG 25 O 0.0036 -0.0087 0.0019 163 ARG 25 CB -0.0019 -0.0017 -0.0005 164 ARG 25 CG -0.0002 0.0001 -0.0042 165 ARG 25 CD -0.0020 0.0028 -0.0053 166 ARG 25 NE -0.0022 0.0056 -0.0083 167 ARG 25 CZ -0.0050 0.0083 -0.0085 168 ARG 25 NH1 -0.0078 0.0085 -0.0059 169 ARG 25 NH2 -0.0048 0.0107 -0.0112 170 ASP 26 N 0.0059 -0.0068 -0.0026 171 ASP 26 CA 0.0092 -0.0090 -0.0033 172 ASP 26 C 0.0102 -0.0123 -0.0007 173 ASP 26 O 0.0115 -0.0144 0.0004 174 ASP 26 CB 0.0117 -0.0082 -0.0066 175 ASP 26 CG 0.0151 -0.0102 -0.0077 176 ASP 26 OD1 0.0153 -0.0105 -0.0077 177 ASP 26 OD2 0.0175 -0.0116 -0.0086 178 ILE 27 N 0.0066 -0.0090 -0.0020 179 ILE 27 CA 0.0062 -0.0105 -0.0014 180 ILE 27 C 0.0061 -0.0103 -0.0011 181 ILE 27 O 0.0061 -0.0114 -0.0015 182 ILE 27 CB 0.0056 -0.0111 -0.0000 183 ILE 27 CG1 0.0057 -0.0114 -0.0004 184 ILE 27 CG2 0.0051 -0.0125 0.0007 185 ILE 27 CD1 0.0052 -0.0112 0.0009 186 MET 28 N 0.0060 -0.0089 -0.0004 187 MET 28 CA 0.0058 -0.0086 0.0001 188 MET 28 C 0.0064 -0.0086 -0.0014 189 MET 28 O 0.0063 -0.0093 -0.0014 190 MET 28 CB 0.0057 -0.0070 0.0010 191 MET 28 CG 0.0054 -0.0066 0.0019 192 MET 28 SD 0.0058 -0.0066 0.0008 193 MET 28 CE 0.0065 -0.0050 -0.0004 194 GLY 29 N 0.0083 -0.0105 -0.0051 195 GLY 29 CA 0.0093 -0.0112 -0.0051 196 GLY 29 C 0.0095 -0.0115 -0.0052 197 GLY 29 O 0.0097 -0.0125 -0.0055 198 LYS 30 N 0.0094 -0.0107 -0.0050 199 LYS 30 CA 0.0095 -0.0110 -0.0050 200 LYS 30 C 0.0086 -0.0117 -0.0055 201 LYS 30 O 0.0089 -0.0125 -0.0057 202 LYS 30 CB 0.0095 -0.0100 -0.0047 203 LYS 30 CG 0.0105 -0.0093 -0.0042 204 LYS 30 CD 0.0103 -0.0083 -0.0038 205 LYS 30 CE 0.0113 -0.0076 -0.0034 206 LYS 30 NZ 0.0111 -0.0066 -0.0030 207 SER 31 N 0.0057 -0.0071 -0.0059 208 SER 31 CA 0.0052 -0.0077 -0.0058 209 SER 31 C 0.0054 -0.0078 -0.0061 210 SER 31 O 0.0053 -0.0085 -0.0064 211 SER 31 CB 0.0046 -0.0075 -0.0050 212 SER 31 OG 0.0048 -0.0068 -0.0047 213 GLU 32 N 0.0057 -0.0072 -0.0060 214 GLU 32 CA 0.0059 -0.0073 -0.0063 215 GLU 32 C 0.0064 -0.0077 -0.0071 216 GLU 32 O 0.0063 -0.0082 -0.0074 217 GLU 32 CB 0.0063 -0.0065 -0.0062 218 GLU 32 CG 0.0059 -0.0064 -0.0057 219 GLU 32 CD 0.0062 -0.0055 -0.0054 220 GLU 32 OE1 0.0067 -0.0050 -0.0056 221 GLU 32 OE2 0.0058 -0.0054 -0.0049 222 VAL 33 N 0.0078 -0.0097 -0.0087 223 VAL 33 CA 0.0088 -0.0100 -0.0061 224 VAL 33 C 0.0087 -0.0077 -0.0061 225 VAL 33 O 0.0089 -0.0085 -0.0057 226 VAL 33 CB 0.0097 -0.0096 -0.0035 227 VAL 33 CG1 0.0106 -0.0089 -0.0010 228 VAL 33 CG2 0.0101 -0.0124 -0.0031 229 ASN 34 N 0.0083 -0.0049 -0.0065 230 ASN 34 CA 0.0083 -0.0026 -0.0063 231 ASN 34 C 0.0075 -0.0030 -0.0085 232 ASN 34 O 0.0077 -0.0028 -0.0079 233 ASN 34 CB 0.0081 0.0005 -0.0064 234 ASN 34 CG 0.0090 0.0012 -0.0039 235 ASN 34 ND2 0.0090 0.0003 -0.0040 236 ASN 34 OD1 0.0096 0.0026 -0.0019 237 ASN 35 N 0.0042 -0.0030 -0.0058 238 ASN 35 CA 0.0018 -0.0049 -0.0075 239 ASN 35 C 0.0022 -0.0091 -0.0075 240 ASN 35 O 0.0013 -0.0112 -0.0083 241 ASN 35 CB -0.0015 -0.0036 -0.0095 242 ASN 35 CG -0.0023 0.0004 -0.0097 243 ASN 35 ND2 -0.0049 0.0010 -0.0113 244 ASN 35 OD1 -0.0004 0.0028 -0.0083 245 SER 36 N 0.0036 -0.0104 -0.0068 246 SER 36 CA 0.0046 -0.0143 -0.0064 247 SER 36 C 0.0071 -0.0153 -0.0049 248 SER 36 O 0.0071 -0.0182 -0.0052 249 SER 36 CB 0.0058 -0.0153 -0.0057 250 SER 36 OG 0.0091 -0.0147 -0.0036 251 HIS 37 N 0.0118 -0.0193 0.0010 252 HIS 37 CA 0.0169 -0.0189 0.0071 253 HIS 37 C 0.0124 -0.0157 0.0027 254 HIS 37 O 0.0144 -0.0209 0.0036 255 HIS 37 CB 0.0223 -0.0106 0.0157 256 HIS 37 CG 0.0262 -0.0071 0.0211 257 HIS 37 CD2 0.0267 0.0034 0.0245 258 HIS 37 ND1 0.0300 -0.0150 0.0235 259 HIS 37 CE1 0.0327 -0.0096 0.0282 260 HIS 37 NE2 0.0309 0.0016 0.0289 261 VAL 38 N 0.0064 -0.0070 -0.0022 262 VAL 38 CA 0.0021 -0.0031 -0.0063 263 VAL 38 C -0.0042 -0.0099 -0.0154 264 VAL 38 O -0.0058 -0.0114 -0.0178 265 VAL 38 CB -0.0015 0.0098 -0.0071 266 VAL 38 CG1 -0.0031 0.0146 -0.0078 267 VAL 38 CG2 0.0039 0.0163 0.0009 268 GLY 39 N -0.0025 -0.0036 -0.0081 269 GLY 39 CA -0.0034 -0.0050 -0.0108 270 GLY 39 C -0.0061 -0.0038 -0.0114 271 GLY 39 O -0.0079 -0.0044 -0.0136 272 LEU 40 N -0.0063 -0.0022 -0.0093 273 LEU 40 CA -0.0087 -0.0011 -0.0097 274 LEU 40 C -0.0076 -0.0016 -0.0096 275 LEU 40 O -0.0052 -0.0019 -0.0080 276 LEU 40 CB -0.0102 0.0014 -0.0074 277 LEU 40 CG -0.0114 0.0024 -0.0071 278 LEU 40 CD1 -0.0117 0.0046 -0.0043 279 LEU 40 CD2 -0.0143 0.0025 -0.0093 280 THR 41 N -0.0057 -0.0014 -0.0018 281 THR 41 CA -0.0043 -0.0019 -0.0015 282 THR 41 C -0.0035 -0.0031 -0.0009 283 THR 41 O -0.0040 -0.0035 -0.0008 284 THR 41 CB -0.0031 -0.0005 -0.0019 285 THR 41 CG2 -0.0038 0.0007 -0.0025 286 THR 41 OG1 -0.0026 0.0001 -0.0021 287 GLY 42 N -0.0022 -0.0038 -0.0005 288 GLY 42 CA -0.0013 -0.0049 0.0001 289 GLY 42 C -0.0007 -0.0061 0.0006 290 GLY 42 O -0.0005 -0.0058 0.0005 291 LEU 43 N 0.0007 -0.0087 0.0023 292 LEU 43 CA 0.0012 -0.0088 0.0029 293 LEU 43 C 0.0008 -0.0090 0.0035 294 LEU 43 O 0.0003 -0.0090 0.0035 295 LEU 43 CB 0.0017 -0.0087 0.0028 296 LEU 43 CG 0.0023 -0.0088 0.0033 297 LEU 43 CD1 0.0027 -0.0088 0.0033 298 LEU 43 CD2 0.0027 -0.0087 0.0031 299 LEU 44 N 0.0011 -0.0090 0.0040 300 LEU 44 CA 0.0008 -0.0092 0.0047 301 LEU 44 C 0.0013 -0.0093 0.0052 302 LEU 44 O 0.0019 -0.0092 0.0052 303 LEU 44 CB 0.0005 -0.0092 0.0049 304 LEU 44 CG 0.0003 -0.0094 0.0056 305 LEU 44 CD1 -0.0003 -0.0095 0.0058 306 LEU 44 CD2 0.0002 -0.0094 0.0057 307 CYS 45 N 0.0015 -0.0094 0.0066 308 CYS 45 CA 0.0015 -0.0091 0.0070 309 CYS 45 C 0.0013 -0.0086 0.0077 310 CYS 45 O 0.0008 -0.0085 0.0078 311 CYS 45 CB 0.0009 -0.0092 0.0068 312 CYS 45 SG 0.0008 -0.0087 0.0075 313 PHE 46 N 0.0017 -0.0082 0.0083 314 PHE 46 CA 0.0016 -0.0077 0.0090 315 PHE 46 C 0.0014 -0.0074 0.0094 316 PHE 46 O 0.0018 -0.0075 0.0093 317 PHE 46 CB 0.0024 -0.0075 0.0093 318 PHE 46 CG 0.0023 -0.0070 0.0100 319 PHE 46 CD1 0.0016 -0.0068 0.0102 320 PHE 46 CD2 0.0029 -0.0067 0.0105 321 PHE 46 CE1 0.0015 -0.0063 0.0109 322 PHE 46 CE2 0.0029 -0.0062 0.0111 323 PHE 46 CZ 0.0022 -0.0060 0.0113 324 GLY 47 N 0.0009 -0.0037 0.0076 325 GLY 47 CA 0.0008 -0.0029 0.0096 326 GLY 47 C -0.0004 -0.0038 0.0109 327 GLY 47 O -0.0014 -0.0052 0.0105 328 ASN 48 N -0.0002 -0.0030 0.0124 329 ASN 48 CA -0.0013 -0.0037 0.0137 330 ASN 48 C -0.0019 -0.0048 0.0127 331 ASN 48 O -0.0031 -0.0060 0.0132 332 ASN 48 CB -0.0024 -0.0045 0.0149 333 ASN 48 CG -0.0032 -0.0046 0.0168 334 ASN 48 ND2 -0.0045 -0.0059 0.0174 335 ASN 48 OD1 -0.0026 -0.0036 0.0177 336 SER 49 N -0.0031 -0.0020 0.0082 337 SER 49 CA -0.0019 -0.0017 0.0086 338 SER 49 C -0.0013 -0.0019 0.0092 339 SER 49 O -0.0005 -0.0013 0.0092 340 SER 49 CB -0.0015 -0.0007 0.0078 341 SER 49 OG -0.0015 -0.0006 0.0076 342 ILE 50 N -0.0018 -0.0026 0.0097 343 ILE 50 CA -0.0013 -0.0029 0.0104 344 ILE 50 C -0.0015 -0.0038 0.0113 345 ILE 50 O -0.0024 -0.0043 0.0113 346 ILE 50 CB -0.0017 -0.0028 0.0100 347 ILE 50 CG1 -0.0011 -0.0019 0.0094 348 ILE 50 CG2 -0.0017 -0.0034 0.0107 349 ILE 50 CD1 -0.0015 -0.0017 0.0089 350 PHE 51 N 0.0009 -0.0055 0.0090 351 PHE 51 CA 0.0012 -0.0059 0.0087 352 PHE 51 C 0.0008 -0.0057 0.0078 353 PHE 51 O 0.0003 -0.0050 0.0077 354 PHE 51 CB 0.0013 -0.0058 0.0094 355 PHE 51 CG 0.0018 -0.0062 0.0103 356 PHE 51 CD1 0.0024 -0.0070 0.0102 357 PHE 51 CD2 0.0017 -0.0057 0.0111 358 PHE 51 CE1 0.0028 -0.0073 0.0110 359 PHE 51 CE2 0.0022 -0.0061 0.0119 360 PHE 51 CZ 0.0027 -0.0069 0.0118 361 LEU 52 N 0.0010 -0.0063 0.0072 362 LEU 52 CA 0.0007 -0.0062 0.0064 363 LEU 52 C 0.0011 -0.0067 0.0063 364 LEU 52 O 0.0015 -0.0075 0.0062 365 LEU 52 CB 0.0006 -0.0063 0.0055 366 LEU 52 CG 0.0004 -0.0065 0.0046 367 LEU 52 CD1 -0.0002 -0.0058 0.0043 368 LEU 52 CD2 0.0005 -0.0069 0.0039 369 GLN 53 N -0.0006 -0.0059 0.0051 370 GLN 53 CA -0.0006 -0.0053 0.0043 371 GLN 53 C -0.0008 -0.0051 0.0038 372 GLN 53 O -0.0013 -0.0055 0.0039 373 GLN 53 CB -0.0012 -0.0055 0.0039 374 GLN 53 CG -0.0013 -0.0049 0.0030 375 GLN 53 CD -0.0017 -0.0050 0.0027 376 GLN 53 NE2 -0.0015 -0.0044 0.0021 377 GLN 53 OE1 -0.0022 -0.0055 0.0030 378 ILE 54 N -0.0004 -0.0045 0.0033 379 ILE 54 CA -0.0005 -0.0042 0.0027 380 ILE 54 C -0.0007 -0.0038 0.0019 381 ILE 54 O -0.0003 -0.0033 0.0017 382 ILE 54 CB 0.0002 -0.0038 0.0029 383 ILE 54 CG1 0.0001 -0.0034 0.0022 384 ILE 54 CG2 0.0010 -0.0034 0.0031 385 ILE 54 CD1 0.0008 -0.0031 0.0024 386 LEU 55 N -0.0042 0.0013 -0.0003 387 LEU 55 CA -0.0050 0.0021 -0.0008 388 LEU 55 C -0.0047 0.0029 -0.0007 389 LEU 55 O -0.0042 0.0026 -0.0004 390 LEU 55 CB -0.0059 0.0013 -0.0013 391 LEU 55 CG -0.0065 0.0006 -0.0016 392 LEU 55 CD1 -0.0068 -0.0005 -0.0017 393 LEU 55 CD2 -0.0074 0.0012 -0.0022 394 GLU 56 N -0.0051 0.0039 -0.0010 395 GLU 56 CA -0.0049 0.0048 -0.0010 396 GLU 56 C -0.0058 0.0054 -0.0016 397 GLU 56 O -0.0063 0.0057 -0.0019 398 GLU 56 CB -0.0041 0.0056 -0.0006 399 GLU 56 CG -0.0032 0.0051 0.0001 400 GLU 56 CD -0.0023 0.0060 0.0005 401 GLU 56 OE1 -0.0025 0.0070 0.0003 402 GLU 56 OE2 -0.0015 0.0057 0.0010 403 GLY 57 N -0.0091 0.0110 -0.0037 404 GLY 57 CA -0.0111 0.0123 -0.0036 405 GLY 57 C -0.0113 0.0135 -0.0035 406 GLY 57 O -0.0097 0.0138 -0.0036 407 SER 58 N -0.0134 0.0142 -0.0034 408 SER 58 CA -0.0138 0.0152 -0.0034 409 SER 58 C -0.0137 0.0135 -0.0034 410 SER 58 O -0.0140 0.0115 -0.0035 411 SER 58 CB -0.0160 0.0163 -0.0033 412 SER 58 OG -0.0178 0.0148 -0.0033 413 ARG 59 N -0.0096 0.0109 0.0013 414 ARG 59 CA -0.0066 0.0096 -0.0010 415 ARG 59 C -0.0068 0.0091 -0.0042 416 ARG 59 O -0.0065 0.0085 -0.0074 417 ARG 59 CB -0.0031 0.0089 0.0013 418 ARG 59 CG 0.0001 0.0076 -0.0003 419 ARG 59 CD 0.0032 0.0071 0.0024 420 ARG 59 NE 0.0043 0.0069 0.0033 421 ARG 59 CZ 0.0067 0.0066 0.0059 422 ARG 59 NH1 0.0083 0.0065 0.0079 423 ARG 59 NH2 0.0075 0.0065 0.0065 424 GLN 60 N -0.0073 0.0094 -0.0036 425 GLN 60 CA -0.0072 0.0089 -0.0065 426 GLN 60 C -0.0103 0.0093 -0.0093 427 GLN 60 O -0.0098 0.0086 -0.0126 428 GLN 60 CB -0.0072 0.0091 -0.0050 429 GLN 60 CG -0.0068 0.0085 -0.0078 430 GLN 60 CD -0.0103 0.0094 -0.0093 431 GLN 60 NE2 -0.0118 0.0102 -0.0073 432 GLN 60 OE1 -0.0117 0.0093 -0.0122 433 ALA 61 N -0.0139 0.0107 -0.0074 434 ALA 61 CA -0.0143 0.0109 -0.0078 435 ALA 61 C -0.0136 0.0099 -0.0073 436 ALA 61 O -0.0140 0.0092 -0.0079 437 ALA 61 CB -0.0145 0.0126 -0.0075 438 ILE 62 N -0.0125 0.0098 -0.0062 439 ILE 62 CA -0.0117 0.0089 -0.0056 440 ILE 62 C -0.0118 0.0072 -0.0062 441 ILE 62 O -0.0118 0.0063 -0.0064 442 ILE 62 CB -0.0105 0.0091 -0.0044 443 ILE 62 CG1 -0.0103 0.0107 -0.0038 444 ILE 62 CG2 -0.0097 0.0079 -0.0038 445 ILE 62 CD1 -0.0093 0.0112 -0.0027 446 SER 63 N -0.0091 0.0082 -0.0032 447 SER 63 CA -0.0075 0.0067 -0.0049 448 SER 63 C -0.0084 0.0068 -0.0075 449 SER 63 O -0.0079 0.0061 -0.0093 450 SER 63 CB -0.0058 0.0056 -0.0039 451 SER 63 OG -0.0050 0.0055 -0.0014 452 HIS 64 N -0.0096 0.0077 -0.0077 453 HIS 64 CA -0.0104 0.0078 -0.0101 454 HIS 64 C -0.0119 0.0087 -0.0114 455 HIS 64 O -0.0120 0.0083 -0.0137 456 HIS 64 CB -0.0114 0.0086 -0.0098 457 HIS 64 CG -0.0130 0.0094 -0.0119 458 HIS 64 CD2 -0.0150 0.0109 -0.0119 459 HIS 64 ND1 -0.0125 0.0086 -0.0142 460 HIS 64 CE1 -0.0141 0.0095 -0.0157 461 HIS 64 NE2 -0.0157 0.0109 -0.0143 462 THR 65 N -0.0106 0.0107 -0.0074 463 THR 65 CA -0.0108 0.0106 -0.0077 464 THR 65 C -0.0095 0.0085 -0.0076 465 THR 65 O -0.0101 0.0075 -0.0087 466 THR 65 CB -0.0106 0.0126 -0.0064 467 THR 65 CG2 -0.0102 0.0122 -0.0062 468 THR 65 OG1 -0.0123 0.0144 -0.0070 469 TYR 66 N -0.0078 0.0078 -0.0064 470 TYR 66 CA -0.0066 0.0057 -0.0063 471 TYR 66 C -0.0072 0.0038 -0.0079 472 TYR 66 O -0.0070 0.0023 -0.0086 473 TYR 66 CB -0.0046 0.0054 -0.0047 474 TYR 66 CG -0.0032 0.0034 -0.0044 475 TYR 66 CD1 -0.0029 0.0031 -0.0043 476 TYR 66 CD2 -0.0021 0.0019 -0.0042 477 TYR 66 CE1 -0.0016 0.0013 -0.0041 478 TYR 66 CE2 -0.0007 0.0000 -0.0039 479 TYR 66 CZ -0.0005 -0.0002 -0.0039 480 TYR 66 OH 0.0008 -0.0020 -0.0036 481 HIS 67 N -0.0093 0.0060 -0.0108 482 HIS 67 CA -0.0100 0.0048 -0.0118 483 HIS 67 C -0.0108 0.0048 -0.0127 484 HIS 67 O -0.0110 0.0036 -0.0131 485 HIS 67 CB -0.0106 0.0049 -0.0124 486 HIS 67 CG -0.0115 0.0040 -0.0135 487 HIS 67 CD2 -0.0116 0.0025 -0.0139 488 HIS 67 ND1 -0.0125 0.0045 -0.0145 489 HIS 67 CE1 -0.0131 0.0034 -0.0154 490 HIS 67 NE2 -0.0126 0.0022 -0.0150 491 ARG 68 N -0.0113 0.0062 -0.0129 492 ARG 68 CA -0.0120 0.0063 -0.0137 493 ARG 68 C -0.0114 0.0058 -0.0131 494 ARG 68 O -0.0119 0.0051 -0.0137 495 ARG 68 CB -0.0126 0.0079 -0.0140 496 ARG 68 CG -0.0136 0.0082 -0.0151 497 ARG 68 CD -0.0141 0.0099 -0.0152 498 ARG 68 NE -0.0138 0.0107 -0.0148 499 ARG 68 CZ -0.0135 0.0121 -0.0142 500 ARG 68 NH1 -0.0134 0.0129 -0.0140 501 ARG 68 NH2 -0.0133 0.0126 -0.0139 502 ILE 69 N -0.0078 0.0049 -0.0110 503 ILE 69 CA -0.0068 0.0037 -0.0109 504 ILE 69 C -0.0062 0.0016 -0.0112 505 ILE 69 O -0.0062 0.0002 -0.0116 506 ILE 69 CB -0.0051 0.0048 -0.0100 507 ILE 69 CG1 -0.0057 0.0063 -0.0098 508 ILE 69 CG2 -0.0035 0.0034 -0.0098 509 ILE 69 CD1 -0.0041 0.0073 -0.0090 510 LEU 70 N -0.0056 0.0014 -0.0111 511 LEU 70 CA -0.0049 -0.0005 -0.0113 512 LEU 70 C -0.0064 -0.0020 -0.0123 513 LEU 70 O -0.0059 -0.0038 -0.0125 514 LEU 70 CB -0.0042 -0.0003 -0.0110 515 LEU 70 CG -0.0021 0.0002 -0.0101 516 LEU 70 CD1 -0.0016 0.0006 -0.0098 517 LEU 70 CD2 -0.0007 -0.0014 -0.0100 518 GLN 71 N -0.0119 -0.0025 -0.0148 519 GLN 71 CA -0.0136 -0.0040 -0.0161 520 GLN 71 C -0.0105 -0.0012 -0.0140 521 GLN 71 O -0.0116 -0.0023 -0.0146 522 GLN 71 CB -0.0159 -0.0034 -0.0225 523 GLN 71 CG -0.0195 -0.0067 -0.0249 524 GLN 71 CD -0.0213 -0.0055 -0.0314 525 GLN 71 NE2 -0.0240 -0.0075 -0.0338 526 GLN 71 OE1 -0.0203 -0.0028 -0.0342 527 ASP 72 N -0.0066 0.0023 -0.0115 528 ASP 72 CA -0.0034 0.0049 -0.0092 529 ASP 72 C -0.0039 0.0016 -0.0040 530 ASP 72 O -0.0045 -0.0010 -0.0003 531 ASP 72 CB 0.0007 0.0093 -0.0076 532 ASP 72 CG 0.0039 0.0135 -0.0085 533 ASP 72 OD1 0.0047 0.0131 -0.0056 534 ASP 72 OD2 0.0054 0.0173 -0.0120 535 PRO 73 N 0.0008 0.0040 0.0048 536 PRO 73 CA 0.0001 0.0038 0.0075 537 PRO 73 C 0.0026 0.0027 0.0081 538 PRO 73 O 0.0024 0.0023 0.0106 539 PRO 73 CB -0.0003 0.0035 0.0104 540 PRO 73 CG 0.0011 0.0031 0.0093 541 PRO 73 CD 0.0022 0.0032 0.0058 542 ARG 74 N 0.0050 0.0021 0.0060 543 ARG 74 CA 0.0075 0.0010 0.0064 544 ARG 74 C 0.0070 0.0015 0.0048 545 ARG 74 O 0.0090 0.0006 0.0050 546 ARG 74 CB 0.0105 0.0000 0.0050 547 ARG 74 CG 0.0116 -0.0008 0.0070 548 ARG 74 CD 0.0149 -0.0019 0.0060 549 ARG 74 NE 0.0151 -0.0016 0.0034 550 ARG 74 CZ 0.0148 -0.0015 0.0039 551 ARG 74 NH1 0.0142 -0.0018 0.0068 552 ARG 74 NH2 0.0150 -0.0012 0.0013 553 HIS 75 N 0.0080 0.0031 0.0116 554 HIS 75 CA 0.0079 0.0036 0.0103 555 HIS 75 C 0.0080 0.0051 0.0103 556 HIS 75 O 0.0082 0.0057 0.0114 557 HIS 75 CB 0.0077 0.0028 0.0097 558 HIS 75 CG 0.0079 0.0030 0.0104 559 HIS 75 CD2 0.0081 0.0036 0.0116 560 HIS 75 ND1 0.0077 0.0025 0.0100 561 HIS 75 CE1 0.0079 0.0028 0.0108 562 HIS 75 NE2 0.0081 0.0034 0.0118 563 HIS 76 N 0.0079 0.0058 0.0091 564 HIS 76 CA 0.0080 0.0072 0.0090 565 HIS 76 C 0.0078 0.0075 0.0076 566 HIS 76 O 0.0076 0.0066 0.0068 567 HIS 76 CB 0.0081 0.0080 0.0093 568 HIS 76 CG 0.0079 0.0077 0.0083 569 HIS 76 CD2 0.0078 0.0085 0.0075 570 HIS 76 ND1 0.0077 0.0064 0.0080 571 HIS 76 CE1 0.0076 0.0064 0.0070 572 HIS 76 NE2 0.0077 0.0077 0.0067 573 SER 77 N 0.0069 0.0123 0.0058 574 SER 77 CA 0.0050 0.0120 0.0053 575 SER 77 C 0.0044 0.0100 0.0049 576 SER 77 O 0.0028 0.0097 0.0045 577 SER 77 CB 0.0037 0.0135 0.0051 578 SER 77 OG 0.0042 0.0154 0.0054 579 ALA 78 N 0.0056 0.0086 0.0051 580 ALA 78 CA 0.0052 0.0066 0.0048 581 ALA 78 C 0.0037 0.0060 0.0043 582 ALA 78 O 0.0037 0.0067 0.0044 583 ALA 78 CB 0.0069 0.0053 0.0051 584 GLU 79 N 0.0036 0.0068 0.0046 585 GLU 79 CA 0.0022 0.0059 0.0044 586 GLU 79 C 0.0021 0.0041 0.0040 587 GLU 79 O 0.0024 0.0039 0.0040 588 GLU 79 CB 0.0005 0.0068 0.0046 589 GLU 79 CG 0.0002 0.0084 0.0049 590 GLU 79 CD -0.0014 0.0094 0.0051 591 GLU 79 OE1 -0.0013 0.0109 0.0054 592 GLU 79 OE2 -0.0028 0.0086 0.0049 593 ILE 80 N 0.0017 0.0029 0.0037 594 ILE 80 CA 0.0015 0.0012 0.0033 595 ILE 80 C -0.0004 0.0008 0.0032 596 ILE 80 O -0.0015 0.0012 0.0033 597 ILE 80 CB 0.0022 -0.0001 0.0031 598 ILE 80 CG1 0.0040 0.0003 0.0032 599 ILE 80 CG2 0.0021 -0.0019 0.0027 600 ILE 80 CD1 0.0045 -0.0005 0.0030 601 ILE 81 N -0.0006 0.0020 0.0022 602 ILE 81 CA -0.0014 0.0018 0.0023 603 ILE 81 C -0.0016 0.0010 0.0021 604 ILE 81 O -0.0022 0.0008 0.0021 605 ILE 81 CB -0.0015 0.0021 0.0023 606 ILE 81 CG1 -0.0017 0.0029 0.0026 607 ILE 81 CG2 -0.0022 0.0016 0.0023 608 ILE 81 CD1 -0.0016 0.0032 0.0026 609 ALA 82 N -0.0011 0.0005 0.0019 610 ALA 82 CA -0.0013 -0.0003 0.0017 611 ALA 82 C -0.0005 -0.0008 0.0015 612 ALA 82 O 0.0001 -0.0006 0.0015 613 ALA 82 CB -0.0019 -0.0006 0.0017 614 PHE 83 N 0.0018 0.0014 0.0009 615 PHE 83 CA 0.0004 0.0027 0.0005 616 PHE 83 C 0.0012 0.0041 0.0011 617 PHE 83 O 0.0018 0.0037 0.0013 618 PHE 83 CB -0.0009 0.0016 -0.0003 619 PHE 83 CG -0.0023 0.0029 -0.0008 620 PHE 83 CD1 -0.0022 0.0038 -0.0006 621 PHE 83 CD2 -0.0039 0.0031 -0.0015 622 PHE 83 CE1 -0.0036 0.0050 -0.0010 623 PHE 83 CE2 -0.0052 0.0042 -0.0019 624 PHE 83 CZ -0.0051 0.0051 -0.0017 625 ASP 84 N 0.0013 0.0058 0.0015 626 ASP 84 CA 0.0022 0.0072 0.0022 627 ASP 84 C 0.0013 0.0091 0.0021 628 ASP 84 O 0.0004 0.0095 0.0017 629 ASP 84 CB 0.0041 0.0072 0.0030 630 ASP 84 CG 0.0042 0.0070 0.0031 631 ASP 84 OD1 0.0040 0.0054 0.0027 632 ASP 84 OD2 0.0046 0.0083 0.0035 633 PRO 85 N 0.0011 0.0194 -0.0029 634 PRO 85 CA -0.0006 0.0212 -0.0016 635 PRO 85 C -0.0002 0.0217 -0.0013 636 PRO 85 O 0.0019 0.0214 -0.0015 637 PRO 85 CB 0.0004 0.0231 -0.0003 638 PRO 85 CG 0.0028 0.0224 -0.0008 639 PRO 85 CD 0.0035 0.0202 -0.0024 640 VAL 86 N -0.0023 0.0224 -0.0007 641 VAL 86 CA -0.0024 0.0228 -0.0004 642 VAL 86 C -0.0036 0.0249 0.0011 643 VAL 86 O -0.0049 0.0258 0.0018 644 VAL 86 CB -0.0039 0.0210 -0.0017 645 VAL 86 CG1 -0.0021 0.0191 -0.0030 646 VAL 86 CG2 -0.0063 0.0203 -0.0021 647 LEU 87 N -0.0346 -0.0061 -0.0058 648 LEU 87 CA -0.0276 -0.0135 -0.0184 649 LEU 87 C -0.0100 -0.0053 -0.0218 650 LEU 87 O -0.0000 -0.0100 -0.0335 651 LEU 87 CB -0.0368 -0.0182 -0.0170 652 LEU 87 CG -0.0369 -0.0302 -0.0295 653 LEU 87 CD1 -0.0469 -0.0321 -0.0247 654 LEU 87 CD2 -0.0202 -0.0289 -0.0396 655 GLN 88 N -0.0057 0.0071 -0.0116 656 GLN 88 CA 0.0108 0.0158 -0.0138 657 GLN 88 C 0.0142 0.0297 -0.0015 658 GLN 88 O 0.0034 0.0335 0.0098 659 GLN 88 CB 0.0144 0.0162 -0.0158 660 GLN 88 CG 0.0029 0.0195 -0.0045 661 GLN 88 CD 0.0066 0.0197 -0.0069 662 GLN 88 NE2 -0.0009 0.0249 0.0036 663 GLN 88 OE1 0.0160 0.0152 -0.0180 664 ARG 89 N 0.0004 0.0103 -0.0009 665 ARG 89 CA 0.0006 0.0085 0.0007 666 ARG 89 C 0.0031 0.0079 0.0011 667 ARG 89 O 0.0047 0.0090 0.0002 668 ARG 89 CB -0.0005 0.0082 0.0010 669 ARG 89 CG -0.0025 0.0093 -0.0000 670 ARG 89 CD -0.0031 0.0091 0.0002 671 ARG 89 NE -0.0049 0.0078 0.0013 672 ARG 89 CZ -0.0071 0.0082 0.0009 673 ARG 89 NH1 -0.0077 0.0099 -0.0005 674 ARG 89 NH2 -0.0086 0.0070 0.0020 675 GLU 90 N 0.0035 0.0062 0.0026 676 GLU 90 CA 0.0058 0.0054 0.0033 677 GLU 90 C 0.0059 0.0041 0.0044 678 GLU 90 O 0.0078 0.0035 0.0050 679 GLU 90 CB 0.0064 0.0045 0.0041 680 GLU 90 CG 0.0065 0.0057 0.0030 681 GLU 90 CD 0.0082 0.0052 0.0035 682 GLU 90 OE1 0.0077 0.0039 0.0046 683 GLU 90 OE2 0.0100 0.0060 0.0028 684 PHE 91 N 0.0029 -0.0004 0.0037 685 PHE 91 CA 0.0019 -0.0012 0.0034 686 PHE 91 C 0.0001 -0.0001 0.0029 687 PHE 91 O -0.0014 -0.0009 0.0025 688 PHE 91 CB 0.0014 -0.0033 0.0035 689 PHE 91 CG 0.0030 -0.0046 0.0040 690 PHE 91 CD1 0.0038 -0.0055 0.0043 691 PHE 91 CD2 0.0037 -0.0047 0.0042 692 PHE 91 CE1 0.0053 -0.0067 0.0048 693 PHE 91 CE2 0.0052 -0.0059 0.0048 694 PHE 91 CZ 0.0060 -0.0068 0.0051 695 VAL 92 N 0.0004 0.0018 0.0028 696 VAL 92 CA -0.0012 0.0031 0.0023 697 VAL 92 C -0.0022 0.0027 0.0020 698 VAL 92 O -0.0039 0.0028 0.0015 699 VAL 92 CB -0.0005 0.0051 0.0023 700 VAL 92 CG1 0.0012 0.0055 0.0028 701 VAL 92 CG2 -0.0020 0.0065 0.0018 702 GLN 93 N -0.0008 -0.0003 0.0029 703 GLN 93 CA -0.0014 0.0012 0.0018 704 GLN 93 C -0.0016 0.0004 0.0001 705 GLN 93 O -0.0021 0.0013 -0.0014 706 GLN 93 CB -0.0013 0.0024 0.0030 707 GLN 93 CG -0.0009 0.0025 0.0051 708 GLN 93 CD -0.0004 0.0010 0.0062 709 GLN 93 NE2 0.0000 0.0002 0.0075 710 GLN 93 OE1 -0.0003 0.0005 0.0059 711 TRP 94 N -0.0013 -0.0011 0.0002 712 TRP 94 CA -0.0015 -0.0017 -0.0012 713 TRP 94 C -0.0014 -0.0033 -0.0024 714 TRP 94 O -0.0010 -0.0048 -0.0016 715 TRP 94 CB -0.0012 -0.0021 -0.0004 716 TRP 94 CG -0.0012 -0.0007 0.0010 717 TRP 94 CD1 -0.0008 -0.0007 0.0029 718 TRP 94 CD2 -0.0016 0.0011 0.0005 719 TRP 94 CE2 -0.0014 0.0020 0.0022 720 TRP 94 CE3 -0.0021 0.0020 -0.0011 721 TRP 94 NE1 -0.0009 0.0009 0.0036 722 TRP 94 CZ2 -0.0017 0.0038 0.0023 723 TRP 94 CZ3 -0.0025 0.0038 -0.0011 724 TRP 94 CH2 -0.0023 0.0047 0.0007 725 SER 95 N 0.0007 -0.0063 -0.0057 726 SER 95 CA -0.0001 -0.0064 -0.0056 727 SER 95 C -0.0004 -0.0066 -0.0048 728 SER 95 O -0.0012 -0.0066 -0.0047 729 SER 95 CB 0.0000 -0.0064 -0.0057 730 SER 95 OG -0.0001 -0.0062 -0.0065 731 MET 96 N 0.0001 -0.0066 -0.0041 732 MET 96 CA -0.0001 -0.0068 -0.0033 733 MET 96 C 0.0007 -0.0068 -0.0028 734 MET 96 O 0.0012 -0.0068 -0.0027 735 MET 96 CB -0.0008 -0.0069 -0.0028 736 MET 96 CG -0.0014 -0.0070 -0.0023 737 MET 96 SD -0.0021 -0.0069 -0.0031 738 MET 96 CE -0.0027 -0.0069 -0.0033 739 LYS 97 N 0.0001 -0.0068 -0.0006 740 LYS 97 CA 0.0008 -0.0054 0.0006 741 LYS 97 C 0.0004 -0.0061 0.0022 742 LYS 97 O -0.0004 -0.0075 0.0028 743 LYS 97 CB 0.0014 -0.0044 0.0013 744 LYS 97 CG 0.0024 -0.0028 0.0021 745 LYS 97 CD 0.0029 -0.0020 0.0009 746 LYS 97 CE 0.0040 -0.0002 0.0013 747 LYS 97 NZ 0.0044 0.0006 0.0003 748 LEU 98 N 0.0009 -0.0052 0.0029 749 LEU 98 CA 0.0006 -0.0056 0.0045 750 LEU 98 C 0.0012 -0.0046 0.0062 751 LEU 98 O 0.0021 -0.0032 0.0060 752 LEU 98 CB 0.0008 -0.0054 0.0041 753 LEU 98 CG 0.0002 -0.0064 0.0052 754 LEU 98 CD1 0.0006 -0.0057 0.0072 755 LEU 98 CD2 -0.0009 -0.0081 0.0052 756 VAL 99 N 0.0020 -0.0057 0.0070 757 VAL 99 CA 0.0006 -0.0056 0.0063 758 VAL 99 C -0.0008 -0.0027 0.0076 759 VAL 99 O -0.0027 -0.0014 0.0076 760 VAL 99 CB -0.0016 -0.0073 0.0041 761 VAL 99 CG1 -0.0036 -0.0065 0.0036 762 VAL 99 CG2 -0.0001 -0.0103 0.0028 763 GLN 100 N 0.0001 -0.0017 0.0088 764 GLN 100 CA -0.0012 0.0010 0.0100 765 GLN 100 C -0.0033 0.0011 0.0090 766 GLN 100 O -0.0031 -0.0008 0.0078 767 GLN 100 CB 0.0012 0.0023 0.0121 768 GLN 100 CG 0.0001 0.0051 0.0135 769 GLN 100 CD 0.0015 0.0072 0.0156 770 GLN 100 NE2 0.0002 0.0097 0.0167 771 GLN 100 OE1 0.0038 0.0065 0.0163 772 ILE 101 N -0.0052 0.0009 0.0016 773 ILE 101 CA -0.0057 0.0013 0.0041 774 ILE 101 C -0.0069 0.0021 -0.0003 775 ILE 101 O -0.0056 0.0012 0.0003 776 ILE 101 CB -0.0014 -0.0016 0.0074 777 ILE 101 CG1 0.0028 -0.0046 0.0038 778 ILE 101 CG2 -0.0010 -0.0018 0.0125 779 ILE 101 CD1 0.0045 -0.0059 0.0015 780 ASP 102 N -0.0093 0.0037 -0.0046 781 ASP 102 CA -0.0106 0.0045 -0.0091 782 ASP 102 C -0.0128 0.0061 -0.0072 783 ASP 102 O -0.0110 0.0048 -0.0079 784 ASP 102 CB -0.0138 0.0067 -0.0131 785 ASP 102 CG -0.0174 0.0093 -0.0101 786 ASP 102 OD1 -0.0176 0.0095 -0.0050 787 ASP 102 OD2 -0.0201 0.0111 -0.0128 788 SER 105 N -0.0054 0.0069 -0.0074 789 SER 105 CA -0.0051 0.0102 -0.0115 790 SER 105 C 0.0006 0.0129 -0.0088 791 SER 105 O 0.0029 0.0107 -0.0032 792 SER 105 CB -0.0103 0.0069 -0.0130 793 SER 105 OG -0.0093 0.0044 -0.0083 794 PRO 106 N 0.0030 0.0176 -0.0127 795 PRO 106 CA 0.0083 0.0203 -0.0105 796 PRO 106 C 0.0071 0.0174 -0.0077 797 PRO 106 O 0.0022 0.0147 -0.0096 798 PRO 106 CB 0.0096 0.0256 -0.0163 799 PRO 106 CG 0.0042 0.0250 -0.0216 800 PRO 106 CD 0.0012 0.0209 -0.0193 801 GLU 107 N 0.0063 0.0245 -0.0054 802 GLU 107 CA 0.0025 0.0209 -0.0014 803 GLU 107 C 0.0011 0.0153 -0.0024 804 GLU 107 O -0.0018 0.0113 -0.0000 805 GLU 107 CB 0.0003 0.0245 0.0040 806 GLU 107 CG 0.0006 0.0267 0.0047 807 GLU 107 CD -0.0023 0.0225 0.0069 808 GLU 107 OE1 -0.0054 0.0199 0.0104 809 GLU 107 OE2 -0.0014 0.0217 0.0050 810 LYS 108 N 0.0031 0.0150 -0.0057 811 LYS 108 CA 0.0020 0.0096 -0.0069 812 LYS 108 C 0.0021 0.0045 -0.0100 813 LYS 108 O -0.0001 -0.0006 -0.0093 814 LYS 108 CB 0.0043 0.0106 -0.0100 815 LYS 108 CG 0.0035 0.0144 -0.0067 816 LYS 108 CD -0.0003 0.0113 -0.0024 817 LYS 108 CE -0.0012 0.0050 -0.0045 818 LYS 108 NZ 0.0010 0.0047 -0.0081 819 MET 109 N 0.0009 0.0024 -0.0067 820 MET 109 CA 0.0013 0.0008 -0.0077 821 MET 109 C 0.0009 -0.0001 -0.0067 822 MET 109 O 0.0009 -0.0018 -0.0066 823 MET 109 CB 0.0021 0.0015 -0.0093 824 MET 109 CG 0.0027 0.0012 -0.0107 825 MET 109 SD 0.0036 0.0023 -0.0127 826 MET 109 CE 0.0041 0.0021 -0.0139 827 ARG 110 N 0.0005 0.0009 -0.0059 828 ARG 110 CA 0.0001 0.0000 -0.0048 829 ARG 110 C -0.0006 -0.0008 -0.0033 830 ARG 110 O -0.0009 -0.0022 -0.0026 831 ARG 110 CB -0.0002 0.0014 -0.0044 832 ARG 110 CG 0.0005 0.0024 -0.0059 833 ARG 110 CD 0.0002 0.0037 -0.0054 834 ARG 110 NE 0.0004 0.0056 -0.0059 835 ARG 110 CZ -0.0002 0.0069 -0.0048 836 ARG 110 NH1 -0.0009 0.0065 -0.0031 837 ARG 110 NH2 0.0000 0.0085 -0.0053 838 ARG 111 N -0.0035 0.0046 -0.0078 839 ARG 111 CA -0.0069 0.0008 -0.0043 840 ARG 111 C -0.0040 -0.0049 -0.0036 841 ARG 111 O -0.0053 -0.0080 -0.0017 842 ARG 111 CB -0.0103 0.0013 -0.0024 843 ARG 111 CG -0.0145 -0.0017 0.0014 844 ARG 111 CD -0.0182 0.0007 0.0026 845 ARG 111 NE -0.0223 0.0046 0.0035 846 ARG 111 CZ -0.0263 0.0035 0.0064 847 ARG 111 NH1 -0.0268 -0.0016 0.0087 848 ARG 111 NH2 -0.0299 0.0074 0.0069 849 LEU 112 N -0.0001 -0.0065 -0.0054 850 LEU 112 CA 0.0031 -0.0118 -0.0051 851 LEU 112 C 0.0057 -0.0125 -0.0064 852 LEU 112 O 0.0064 -0.0168 -0.0051 853 LEU 112 CB 0.0068 -0.0129 -0.0069 854 LEU 112 CG 0.0045 -0.0130 -0.0055 855 LEU 112 CD1 0.0083 -0.0123 -0.0080 856 LEU 112 CD2 0.0025 -0.0181 -0.0022 857 TYR 113 N 0.0046 -0.0097 -0.0049 858 TYR 113 CA 0.0041 -0.0085 -0.0045 859 TYR 113 C 0.0037 -0.0079 -0.0057 860 TYR 113 O 0.0032 -0.0069 -0.0059 861 TYR 113 CB 0.0042 -0.0087 -0.0035 862 TYR 113 CG 0.0043 -0.0086 -0.0021 863 TYR 113 CD1 0.0039 -0.0077 -0.0018 864 TYR 113 CD2 0.0047 -0.0093 -0.0012 865 TYR 113 CE1 0.0039 -0.0076 -0.0006 866 TYR 113 CE2 0.0048 -0.0092 0.0001 867 TYR 113 CZ 0.0044 -0.0084 0.0003 868 TYR 113 OH 0.0044 -0.0082 0.0016 869 LEU 114 N 0.0040 -0.0086 -0.0064 870 LEU 114 CA 0.0036 -0.0081 -0.0076 871 LEU 114 C 0.0034 -0.0077 -0.0086 872 LEU 114 O 0.0029 -0.0068 -0.0092 873 LEU 114 CB 0.0040 -0.0090 -0.0082 874 LEU 114 CG 0.0037 -0.0085 -0.0088 875 LEU 114 CD1 0.0036 -0.0081 -0.0078 876 LEU 114 CD2 0.0041 -0.0095 -0.0097 877 LYS 115 N 0.0019 -0.0079 -0.0080 878 LYS 115 CA 0.0015 -0.0087 -0.0082 879 LYS 115 C 0.0018 -0.0083 -0.0080 880 LYS 115 O 0.0013 -0.0084 -0.0083 881 LYS 115 CB 0.0017 -0.0099 -0.0080 882 LYS 115 CG 0.0014 -0.0107 -0.0081 883 LYS 115 CD 0.0008 -0.0117 -0.0085 884 LYS 115 CE 0.0012 -0.0124 -0.0082 885 LYS 115 NZ 0.0022 -0.0127 -0.0075 886 TYR 116 N 0.0027 -0.0080 -0.0074 887 TYR 116 CA 0.0032 -0.0078 -0.0071 888 TYR 116 C 0.0034 -0.0066 -0.0070 889 TYR 116 O 0.0040 -0.0063 -0.0067 890 TYR 116 CB 0.0041 -0.0085 -0.0065 891 TYR 116 CG 0.0039 -0.0098 -0.0066 892 TYR 116 CD1 0.0035 -0.0104 -0.0068 893 TYR 116 CD2 0.0042 -0.0104 -0.0063 894 TYR 116 CE1 0.0033 -0.0116 -0.0069 895 TYR 116 CE2 0.0041 -0.0116 -0.0064 896 TYR 116 CZ 0.0036 -0.0122 -0.0067 897 TYR 116 OH 0.0035 -0.0133 -0.0067 898 SER 117 N 0.0010 -0.0058 -0.0078 899 SER 117 CA 0.0012 -0.0042 -0.0077 900 SER 117 C 0.0018 -0.0050 -0.0105 901 SER 117 O 0.0019 -0.0072 -0.0120 902 SER 117 CB 0.0004 -0.0051 -0.0050 903 SER 117 OG -0.0002 -0.0082 -0.0047 904 GLY 118 N 0.0023 -0.0030 -0.0111 905 GLY 118 CA 0.0029 -0.0034 -0.0136 906 GLY 118 C 0.0025 -0.0047 -0.0130 907 GLY 118 O 0.0030 -0.0052 -0.0151 908 GLU 119 N 0.0012 -0.0024 -0.0102 909 GLU 119 CA 0.0001 -0.0061 -0.0066 910 GLU 119 C 0.0013 -0.0105 -0.0053 911 GLU 119 O 0.0011 -0.0100 -0.0053 912 GLU 119 CB -0.0041 -0.0041 -0.0029 913 GLU 119 CG -0.0053 -0.0023 -0.0028 914 GLU 119 CD -0.0062 0.0031 -0.0050 915 GLU 119 OE1 -0.0060 0.0054 -0.0067 916 GLU 119 OE2 -0.0073 0.0051 -0.0051 917 VAL 120 N 0.0026 -0.0148 -0.0041 918 VAL 120 CA 0.0040 -0.0193 -0.0028 919 VAL 120 C 0.0008 -0.0199 0.0012 920 VAL 120 O 0.0012 -0.0215 0.0018 921 VAL 120 CB 0.0061 -0.0237 -0.0025 922 VAL 120 CG1 0.0101 -0.0243 -0.0068 923 VAL 120 CG2 0.0041 -0.0231 -0.0006 924 ALA 121 N 0.0020 -0.0110 0.0109 925 ALA 121 CA 0.0013 -0.0112 0.0128 926 ALA 121 C -0.0001 -0.0097 0.0110 927 ALA 121 O -0.0008 -0.0083 0.0085 928 ALA 121 CB -0.0007 -0.0110 0.0158 929 PHE 122 N -0.0004 -0.0099 0.0123 930 PHE 122 CA -0.0017 -0.0086 0.0109 931 PHE 122 C -0.0049 -0.0069 0.0116 932 PHE 122 O -0.0063 -0.0069 0.0140 933 PHE 122 CB -0.0009 -0.0096 0.0121 934 PHE 122 CG -0.0018 -0.0084 0.0105 935 PHE 122 CD1 -0.0018 -0.0073 0.0074 936 PHE 122 CD2 -0.0027 -0.0084 0.0121 937 PHE 122 CE1 -0.0026 -0.0062 0.0059 938 PHE 122 CE2 -0.0036 -0.0074 0.0107 939 PHE 122 CZ -0.0035 -0.0063 0.0076 940 MET 123 N -0.0040 -0.0030 0.0107 941 MET 123 CA -0.0062 -0.0008 0.0110 942 MET 123 C -0.0069 -0.0002 0.0086 943 MET 123 O -0.0076 0.0005 0.0062 944 MET 123 CB -0.0074 0.0004 0.0108 945 MET 123 CG -0.0066 -0.0004 0.0127 946 MET 123 SD -0.0086 0.0016 0.0137 947 MET 123 CE -0.0073 0.0004 0.0165 948 PRO 124 N -0.0067 -0.0004 0.0091 949 PRO 124 CA -0.0072 0.0001 0.0068 950 PRO 124 C -0.0096 0.0024 0.0064 951 PRO 124 O -0.0102 0.0030 0.0043 952 PRO 124 CB -0.0061 -0.0009 0.0078 953 PRO 124 CG -0.0053 -0.0016 0.0109 954 PRO 124 CD -0.0060 -0.0009 0.0119 955 GLU 125 N -0.0105 0.0080 0.0091 956 GLU 125 CA -0.0121 0.0104 0.0088 957 GLU 125 C -0.0128 0.0114 0.0062 958 GLU 125 O -0.0141 0.0134 0.0055 959 GLU 125 CB -0.0128 0.0118 0.0113 960 GLU 125 CG -0.0130 0.0120 0.0113 961 GLU 125 CD -0.0116 0.0100 0.0126 962 GLU 125 OE1 -0.0108 0.0088 0.0142 963 GLU 125 OE2 -0.0114 0.0097 0.0122 964 THR 126 N -0.0120 0.0100 0.0047 965 THR 126 CA -0.0126 0.0108 0.0021 966 THR 126 C -0.0121 0.0098 -0.0004 967 THR 126 O -0.0125 0.0102 -0.0027 968 THR 126 CB -0.0122 0.0101 0.0020 969 THR 126 CG2 -0.0128 0.0112 0.0044 970 THR 126 OG1 -0.0106 0.0076 0.0022 971 MET 127 N -0.0101 0.0098 0.0033 972 MET 127 CA -0.0098 0.0076 0.0002 973 MET 127 C -0.0102 0.0079 -0.0004 974 MET 127 O -0.0099 0.0089 0.0021 975 MET 127 CB -0.0073 0.0042 0.0005 976 MET 127 CG -0.0054 0.0030 0.0033 977 MET 127 SD -0.0026 -0.0000 0.0050 978 MET 127 CE -0.0016 -0.0034 0.0016 979 THR 128 N -0.0110 0.0071 -0.0038 980 THR 128 CA -0.0117 0.0075 -0.0049 981 THR 128 C -0.0097 0.0052 -0.0038 982 THR 128 O -0.0077 0.0027 -0.0030 983 THR 128 CB -0.0131 0.0072 -0.0090 984 THR 128 CG2 -0.0147 0.0088 -0.0103 985 THR 128 OG1 -0.0115 0.0039 -0.0106 986 PRO 129 N -0.0082 0.0039 -0.0011 987 PRO 129 CA -0.0057 0.0022 -0.0016 988 PRO 129 C -0.0044 0.0001 -0.0034 989 PRO 129 O -0.0018 -0.0011 -0.0030 990 PRO 129 CB -0.0068 0.0020 -0.0026 991 PRO 129 CG -0.0099 0.0035 -0.0029 992 PRO 129 CD -0.0105 0.0051 -0.0013 993 ALA 130 N -0.0062 -0.0005 -0.0055 994 ALA 130 CA -0.0051 -0.0025 -0.0073 995 ALA 130 C -0.0034 -0.0025 -0.0060 996 ALA 130 O -0.0011 -0.0040 -0.0065 997 ALA 130 CB -0.0075 -0.0030 -0.0097 998 GLN 131 N -0.0028 -0.0013 -0.0082 999 GLN 131 CA -0.0013 -0.0028 -0.0071 1000 GLN 131 C 0.0005 -0.0038 -0.0040 1001 GLN 131 O 0.0024 -0.0061 -0.0036 1002 GLN 131 CB -0.0025 -0.0010 -0.0066 1003 GLN 131 CG -0.0036 -0.0009 -0.0096 1004 GLN 131 CD -0.0053 0.0015 -0.0092 1005 GLN 131 NE2 -0.0073 0.0030 -0.0115 1006 GLN 131 OE1 -0.0050 0.0021 -0.0067 1007 CYS 132 N -0.0001 -0.0021 -0.0017 1008 CYS 132 CA 0.0015 -0.0029 0.0012 1009 CYS 132 C 0.0032 -0.0054 0.0005 1010 CYS 132 O 0.0051 -0.0073 0.0019 1011 CYS 132 CB 0.0004 -0.0006 0.0034 1012 CYS 132 SG -0.0010 0.0021 0.0056 1013 LEU 133 N 0.0046 -0.0027 0.0002 1014 LEU 133 CA 0.0051 -0.0038 0.0001 1015 LEU 133 C 0.0061 -0.0057 -0.0010 1016 LEU 133 O 0.0067 -0.0072 -0.0003 1017 LEU 133 CB 0.0047 -0.0027 -0.0009 1018 LEU 133 CG 0.0052 -0.0037 -0.0013 1019 LEU 133 CD1 0.0054 -0.0046 0.0007 1020 LEU 133 CD2 0.0046 -0.0024 -0.0024 1021 GLN 134 N 0.0061 -0.0056 -0.0028 1022 GLN 134 CA 0.0070 -0.0074 -0.0040 1023 GLN 134 C 0.0076 -0.0088 -0.0027 1024 GLN 134 O 0.0084 -0.0105 -0.0026 1025 GLN 134 CB 0.0069 -0.0069 -0.0061 1026 GLN 134 CG 0.0066 -0.0061 -0.0078 1027 GLN 134 CD 0.0074 -0.0076 -0.0085 1028 GLN 134 NE2 0.0071 -0.0069 -0.0092 1029 GLN 134 OE1 0.0082 -0.0093 -0.0083 1030 PHE 135 N 0.0072 -0.0087 -0.0004 1031 PHE 135 CA 0.0072 -0.0095 0.0000 1032 PHE 135 C 0.0070 -0.0099 0.0010 1033 PHE 135 O 0.0071 -0.0108 0.0012 1034 PHE 135 CB 0.0071 -0.0092 0.0002 1035 PHE 135 CG 0.0071 -0.0098 0.0009 1036 PHE 135 CD1 0.0072 -0.0109 0.0008 1037 PHE 135 CD2 0.0068 -0.0094 0.0015 1038 PHE 135 CE1 0.0072 -0.0115 0.0015 1039 PHE 135 CE2 0.0067 -0.0100 0.0022 1040 PHE 135 CZ 0.0069 -0.0110 0.0022 1041 MET 136 N 0.0068 -0.0092 0.0016 1042 MET 136 CA 0.0066 -0.0095 0.0025 1043 MET 136 C 0.0067 -0.0101 0.0024 1044 MET 136 O 0.0067 -0.0108 0.0030 1045 MET 136 CB 0.0063 -0.0085 0.0030 1046 MET 136 CG 0.0060 -0.0081 0.0037 1047 MET 136 SD 0.0060 -0.0090 0.0043 1048 MET 136 CE 0.0060 -0.0098 0.0049 1049 ILE 137 N 0.0094 -0.0071 0.0053 1050 ILE 137 CA 0.0092 -0.0082 0.0053 1051 ILE 137 C 0.0092 -0.0100 0.0045 1052 ILE 137 O 0.0089 -0.0113 0.0052 1053 ILE 137 CB 0.0096 -0.0072 0.0044 1054 ILE 137 CG1 0.0095 -0.0056 0.0056 1055 ILE 137 CG2 0.0095 -0.0084 0.0040 1056 ILE 137 CD1 0.0098 -0.0045 0.0047 1057 ASP 138 N 0.0096 -0.0101 0.0029 1058 ASP 138 CA 0.0097 -0.0117 0.0019 1059 ASP 138 C 0.0093 -0.0132 0.0028 1060 ASP 138 O 0.0092 -0.0147 0.0022 1061 ASP 138 CB 0.0102 -0.0114 0.0001 1062 ASP 138 CG 0.0106 -0.0103 -0.0010 1063 ASP 138 OD1 0.0105 -0.0096 -0.0004 1064 ASP 138 OD2 0.0110 -0.0101 -0.0026 1065 ILE 139 N 0.0066 -0.0079 0.0044 1066 ILE 139 CA 0.0045 -0.0083 0.0025 1067 ILE 139 C 0.0024 -0.0072 0.0020 1068 ILE 139 O 0.0006 -0.0076 0.0003 1069 ILE 139 CB 0.0052 -0.0105 0.0005 1070 ILE 139 CG1 0.0054 -0.0115 -0.0004 1071 ILE 139 CG2 0.0076 -0.0117 0.0010 1072 ILE 139 CD1 0.0054 -0.0135 -0.0027 1073 ASP 140 N 0.0025 -0.0058 0.0036 1074 ASP 140 CA 0.0005 -0.0047 0.0034 1075 ASP 140 C -0.0018 -0.0033 0.0031 1076 ASP 140 O -0.0017 -0.0022 0.0045 1077 ASP 140 CB 0.0012 -0.0034 0.0053 1078 ASP 140 CG -0.0003 -0.0026 0.0049 1079 ASP 140 OD1 -0.0018 -0.0034 0.0031 1080 ASP 140 OD2 -0.0001 -0.0014 0.0065 1081 PRO 141 N -0.0056 0.0007 0.0035 1082 PRO 141 CA -0.0094 0.0065 0.0025 1083 PRO 141 C -0.0109 0.0110 0.0059 1084 PRO 141 O -0.0132 0.0159 0.0076 1085 PRO 141 CB -0.0115 0.0061 -0.0046 1086 PRO 141 CG -0.0088 0.0001 -0.0071 1087 PRO 141 CD -0.0053 -0.0032 -0.0025 1088 ALA 142 N -0.0097 0.0096 0.0070 1089 ALA 142 CA -0.0110 0.0137 0.0103 1090 ALA 142 C -0.0092 0.0146 0.0174 1091 ALA 142 O -0.0098 0.0176 0.0208 1092 ALA 142 CB -0.0105 0.0118 0.0087 1093 ARG 143 N -0.0120 0.0176 0.0123 1094 ARG 143 CA -0.0124 0.0175 0.0184 1095 ARG 143 C -0.0148 0.0213 0.0200 1096 ARG 143 O -0.0155 0.0219 0.0251 1097 ARG 143 CB -0.0095 0.0123 0.0205 1098 ARG 143 CG -0.0076 0.0089 0.0224 1099 ARG 143 CD -0.0054 0.0047 0.0264 1100 ARG 143 NE -0.0032 0.0008 0.0275 1101 ARG 143 CZ -0.0012 -0.0022 0.0236 1102 ARG 143 NH1 -0.0009 -0.0019 0.0182 1103 ARG 143 NH2 0.0007 -0.0056 0.0251 1104 SER 144 N -0.0160 0.0240 0.0158 1105 SER 144 CA -0.0183 0.0277 0.0167 1106 SER 144 C -0.0174 0.0258 0.0207 1107 SER 144 O -0.0192 0.0283 0.0247 1108 SER 144 CB -0.0213 0.0325 0.0190 1109 SER 144 OG -0.0210 0.0315 0.0235 1110 GLY 5 N -0.0285 0.0157 -0.0145 1111 GLY 5 CA -0.0299 0.0119 -0.0133 1112 GLY 5 C -0.0244 0.0092 -0.0124 1113 GLY 5 O -0.0198 0.0121 -0.0132 1114 LEU 6 N -0.0248 0.0037 -0.0107 1115 LEU 6 CA -0.0198 0.0005 -0.0096 1116 LEU 6 C -0.0177 -0.0039 -0.0082 1117 LEU 6 O -0.0213 -0.0066 -0.0075 1118 LEU 6 CB -0.0217 -0.0023 -0.0088 1119 LEU 6 CG -0.0166 -0.0035 -0.0083 1120 LEU 6 CD1 -0.0131 0.0020 -0.0100 1121 LEU 6 CD2 -0.0190 -0.0061 -0.0076 1122 TYR 7 N -0.0110 0.0015 -0.0021 1123 TYR 7 CA -0.0085 -0.0019 -0.0013 1124 TYR 7 C -0.0057 -0.0027 -0.0003 1125 TYR 7 O -0.0048 0.0001 0.0001 1126 TYR 7 CB -0.0064 -0.0011 -0.0005 1127 TYR 7 CG -0.0088 -0.0018 -0.0014 1128 TYR 7 CD1 -0.0090 -0.0056 -0.0015 1129 TYR 7 CD2 -0.0108 0.0014 -0.0020 1130 TYR 7 CE1 -0.0111 -0.0062 -0.0023 1131 TYR 7 CE2 -0.0130 0.0008 -0.0028 1132 TYR 7 CZ -0.0131 -0.0030 -0.0029 1133 TYR 7 OH -0.0153 -0.0036 -0.0037 1134 ARG 8 N -0.0043 -0.0064 0.0001 1135 ARG 8 CA -0.0014 -0.0077 0.0011 1136 ARG 8 C 0.0018 -0.0100 0.0022 1137 ARG 8 O 0.0010 -0.0129 0.0019 1138 ARG 8 CB -0.0031 -0.0103 0.0005 1139 ARG 8 CG -0.0002 -0.0116 0.0015 1140 ARG 8 CD -0.0019 -0.0147 0.0008 1141 ARG 8 NE -0.0050 -0.0130 -0.0002 1142 ARG 8 CZ -0.0082 -0.0149 -0.0014 1143 ARG 8 NH1 -0.0089 -0.0186 -0.0017 1144 ARG 8 NH2 -0.0109 -0.0130 -0.0023 1145 MET 9 N 0.0110 -0.0076 0.0022 1146 MET 9 CA 0.0116 -0.0077 0.0021 1147 MET 9 C 0.0118 -0.0080 0.0020 1148 MET 9 O 0.0119 -0.0079 0.0020 1149 MET 9 CB 0.0119 -0.0071 0.0022 1150 MET 9 CG 0.0125 -0.0072 0.0021 1151 MET 9 SD 0.0128 -0.0066 0.0023 1152 MET 9 CE 0.0133 -0.0068 0.0021 1153 THR 10 N 0.0120 -0.0084 0.0018 1154 THR 10 CA 0.0123 -0.0088 0.0016 1155 THR 10 C 0.0129 -0.0088 0.0015 1156 THR 10 O 0.0130 -0.0089 0.0015 1157 THR 10 CB 0.0120 -0.0094 0.0015 1158 THR 10 CG2 0.0119 -0.0096 0.0014 1159 THR 10 OG1 0.0123 -0.0097 0.0013 1160 TYR 11 N 0.0190 -0.0049 0.0012 1161 TYR 11 CA 0.0182 -0.0052 0.0019 1162 TYR 11 C 0.0182 -0.0046 0.0027 1163 TYR 11 O 0.0188 -0.0040 0.0026 1164 TYR 11 CB 0.0177 -0.0060 0.0014 1165 TYR 11 CG 0.0179 -0.0059 0.0014 1166 TYR 11 CD1 0.0173 -0.0060 0.0020 1167 TYR 11 CD2 0.0185 -0.0058 0.0007 1168 TYR 11 CE1 0.0174 -0.0059 0.0020 1169 TYR 11 CE2 0.0186 -0.0057 0.0006 1170 TYR 11 CZ 0.0181 -0.0058 0.0013 1171 TYR 11 OH 0.0182 -0.0057 0.0013 1172 ILE 12 N 0.0175 -0.0048 0.0034 1173 ILE 12 CA 0.0174 -0.0043 0.0042 1174 ILE 12 C 0.0167 -0.0048 0.0044 1175 ILE 12 O 0.0162 -0.0055 0.0041 1176 ILE 12 CB 0.0173 -0.0038 0.0050 1177 ILE 12 CG1 0.0165 -0.0044 0.0053 1178 ILE 12 CG2 0.0179 -0.0033 0.0047 1179 ILE 12 CD1 0.0164 -0.0040 0.0060 1180 SER 13 N 0.0078 -0.0011 0.0060 1181 SER 13 CA 0.0067 -0.0021 0.0078 1182 SER 13 C 0.0080 -0.0002 0.0125 1183 SER 13 O 0.0103 0.0024 0.0137 1184 SER 13 CB 0.0076 -0.0015 0.0045 1185 SER 13 OG 0.0076 -0.0012 0.0068 1186 ARG 14 N 0.0066 -0.0016 0.0151 1187 ARG 14 CA 0.0075 -0.0001 0.0197 1188 ARG 14 C 0.0087 0.0013 0.0196 1189 ARG 14 O 0.0074 -0.0004 0.0176 1190 ARG 14 CB 0.0047 -0.0027 0.0233 1191 ARG 14 CG 0.0037 -0.0037 0.0243 1192 ARG 14 CD 0.0012 -0.0062 0.0282 1193 ARG 14 NE 0.0004 -0.0069 0.0294 1194 ARG 14 CZ 0.0019 -0.0049 0.0322 1195 ARG 14 NH1 0.0044 -0.0020 0.0342 1196 ARG 14 NH2 0.0010 -0.0059 0.0330 1197 ALA 15 N -0.0003 0.0026 0.0205 1198 ALA 15 CA 0.0024 0.0014 0.0160 1199 ALA 15 C -0.0020 0.0012 0.0168 1200 ALA 15 O -0.0061 0.0025 0.0218 1201 ALA 15 CB 0.0102 0.0026 0.0173 1202 VAL 16 N -0.0011 -0.0003 0.0119 1203 VAL 16 CA -0.0041 -0.0005 0.0122 1204 VAL 16 C 0.0009 0.0014 0.0164 1205 VAL 16 O 0.0073 0.0021 0.0166 1206 VAL 16 CB -0.0050 -0.0030 0.0051 1207 VAL 16 CG1 -0.0112 -0.0048 0.0017 1208 VAL 16 CG2 0.0018 -0.0038 0.0008 1209 PRO 17 N -0.0167 0.0018 0.0394 1210 PRO 17 CA 0.0116 -0.0105 0.0533 1211 PRO 17 C 0.0416 -0.0146 0.0330 1212 PRO 17 O 0.0667 -0.0255 0.0455 1213 PRO 17 CB 0.0056 -0.0098 0.0578 1214 PRO 17 CG -0.0221 0.0031 0.0407 1215 PRO 17 CD -0.0390 0.0102 0.0334 1216 GLY 18 N 0.0400 -0.0064 0.0023 1217 GLY 18 CA 0.0680 -0.0097 -0.0188 1218 GLY 18 C 0.0806 -0.0120 -0.0251 1219 GLY 18 O 0.0980 -0.0114 -0.0489 1220 LEU 19 N 0.0069 0.0057 -0.0038 1221 LEU 19 CA -0.0003 0.0082 -0.0019 1222 LEU 19 C -0.0078 0.0091 -0.0027 1223 LEU 19 O -0.0091 0.0064 -0.0079 1224 LEU 19 CB -0.0017 0.0058 -0.0064 1225 LEU 19 CG 0.0028 0.0072 -0.0026 1226 LEU 19 CD1 -0.0007 0.0064 -0.0051 1227 LEU 19 CD2 0.0029 0.0119 0.0055 1228 GLY 20 N -0.0128 0.0131 0.0025 1229 GLY 20 CA -0.0201 0.0145 0.0023 1230 GLY 20 C -0.0277 0.0167 0.0037 1231 GLY 20 O -0.0275 0.0167 0.0039 1232 TYR 21 N -0.0431 0.0256 -0.0175 1233 TYR 21 CA -0.0318 0.0144 -0.0064 1234 TYR 21 C -0.0296 0.0034 -0.0061 1235 TYR 21 O -0.0197 -0.0001 0.0049 1236 TYR 21 CB -0.0309 0.0024 -0.0078 1237 TYR 21 CG -0.0297 0.0118 -0.0045 1238 TYR 21 CD1 -0.0394 0.0191 -0.0145 1239 TYR 21 CD2 -0.0189 0.0134 0.0087 1240 TYR 21 CE1 -0.0384 0.0277 -0.0115 1241 TYR 21 CE2 -0.0177 0.0220 0.0118 1242 TYR 21 CZ -0.0275 0.0291 0.0017 1243 TYR 21 OH -0.0264 0.0377 0.0047 1244 ASN 22 N -0.0387 -0.0025 -0.0181 1245 ASN 22 CA -0.0372 -0.0133 -0.0185 1246 ASN 22 C -0.0331 -0.0030 -0.0115 1247 ASN 22 O -0.0253 -0.0100 -0.0038 1248 ASN 22 CB -0.0486 -0.0198 -0.0333 1249 ASN 22 CG -0.0519 -0.0327 -0.0399 1250 ASN 22 ND2 -0.0631 -0.0340 -0.0534 1251 ASN 22 OD1 -0.0445 -0.0413 -0.0329 1252 ASP 23 N -0.0134 0.0077 -0.0094 1253 ASP 23 CA -0.0132 0.0114 -0.0073 1254 ASP 23 C -0.0115 0.0115 -0.0026 1255 ASP 23 O -0.0107 0.0123 -0.0001 1256 ASP 23 CB -0.0145 0.0157 -0.0091 1257 ASP 23 CG -0.0162 0.0164 -0.0134 1258 ASP 23 OD1 -0.0165 0.0175 -0.0137 1259 ASP 23 OD2 -0.0173 0.0158 -0.0165 1260 LEU 24 N -0.0109 0.0107 -0.0013 1261 LEU 24 CA -0.0092 0.0107 0.0032 1262 LEU 24 C -0.0079 0.0071 0.0053 1263 LEU 24 O -0.0067 0.0078 0.0088 1264 LEU 24 CB -0.0089 0.0102 0.0039 1265 LEU 24 CG -0.0098 0.0144 0.0032 1266 LEU 24 CD1 -0.0094 0.0137 0.0040 1267 LEU 24 CD2 -0.0095 0.0183 0.0059 1268 ARG 25 N -0.0085 -0.0024 0.0010 1269 ARG 25 CA -0.0052 -0.0088 0.0028 1270 ARG 25 C -0.0058 -0.0087 0.0019 1271 ARG 25 O -0.0026 -0.0110 0.0059 1272 ARG 25 CB -0.0052 -0.0156 -0.0011 1273 ARG 25 CG -0.0022 -0.0184 0.0022 1274 ARG 25 CD -0.0029 -0.0241 -0.0023 1275 ARG 25 NE -0.0017 -0.0244 -0.0006 1276 ARG 25 CZ -0.0044 -0.0235 -0.0045 1277 ARG 25 NH1 -0.0084 -0.0222 -0.0105 1278 ARG 25 NH2 -0.0030 -0.0238 -0.0023 1279 ASP 26 N -0.0097 -0.0062 -0.0033 1280 ASP 26 CA -0.0105 -0.0055 -0.0042 1281 ASP 26 C -0.0091 -0.0002 0.0014 1282 ASP 26 O -0.0071 -0.0015 0.0039 1283 ASP 26 CB -0.0152 -0.0032 -0.0107 1284 ASP 26 CG -0.0161 -0.0035 -0.0125 1285 ASP 26 OD1 -0.0139 -0.0091 -0.0121 1286 ASP 26 OD2 -0.0190 0.0019 -0.0141 1287 ILE 27 N -0.0074 0.0029 -0.0011 1288 ILE 27 CA -0.0059 0.0045 0.0002 1289 ILE 27 C -0.0026 0.0038 0.0014 1290 ILE 27 O -0.0010 0.0032 0.0019 1291 ILE 27 CB -0.0069 0.0079 0.0010 1292 ILE 27 CG1 -0.0101 0.0087 -0.0001 1293 ILE 27 CG2 -0.0050 0.0096 0.0025 1294 ILE 27 CD1 -0.0114 0.0118 0.0005 1295 MET 28 N -0.0016 0.0038 0.0019 1296 MET 28 CA 0.0015 0.0030 0.0030 1297 MET 28 C 0.0027 -0.0001 0.0024 1298 MET 28 O 0.0049 -0.0004 0.0032 1299 MET 28 CB 0.0021 0.0031 0.0033 1300 MET 28 CG 0.0050 0.0040 0.0049 1301 MET 28 SD 0.0049 0.0079 0.0064 1302 MET 28 CE 0.0050 0.0081 0.0065 1303 GLY 29 N 0.0004 -0.0052 -0.0079 1304 GLY 29 CA 0.0022 -0.0089 -0.0107 1305 GLY 29 C 0.0002 -0.0088 -0.0118 1306 GLY 29 O 0.0028 -0.0103 -0.0118 1307 LYS 30 N -0.0044 -0.0071 -0.0128 1308 LYS 30 CA -0.0066 -0.0070 -0.0141 1309 LYS 30 C -0.0050 -0.0048 -0.0108 1310 LYS 30 O -0.0039 -0.0061 -0.0115 1311 LYS 30 CB -0.0119 -0.0053 -0.0156 1312 LYS 30 CG -0.0139 -0.0079 -0.0195 1313 LYS 30 CD -0.0192 -0.0060 -0.0208 1314 LYS 30 CE -0.0212 -0.0086 -0.0248 1315 LYS 30 NZ -0.0263 -0.0067 -0.0260 1316 SER 31 N -0.0014 -0.0004 -0.0021 1317 SER 31 CA 0.0020 0.0015 -0.0017 1318 SER 31 C 0.0060 0.0003 -0.0017 1319 SER 31 O 0.0090 -0.0007 -0.0017 1320 SER 31 CB 0.0015 0.0061 -0.0012 1321 SER 31 OG 0.0004 0.0076 -0.0010 1322 GLU 32 N 0.0062 0.0004 -0.0017 1323 GLU 32 CA 0.0100 -0.0006 -0.0017 1324 GLU 32 C 0.0112 -0.0050 -0.0022 1325 GLU 32 O 0.0148 -0.0058 -0.0021 1326 GLU 32 CB 0.0095 0.0001 -0.0016 1327 GLU 32 CG 0.0117 0.0039 -0.0010 1328 GLU 32 CD 0.0100 0.0054 -0.0009 1329 GLU 32 OE1 0.0081 0.0030 -0.0013 1330 GLU 32 OE2 0.0105 0.0091 -0.0004 1331 VAL 33 N 0.0087 -0.0161 -0.0051 1332 VAL 33 CA 0.0098 -0.0202 -0.0044 1333 VAL 33 C 0.0116 -0.0168 -0.0024 1334 VAL 33 O 0.0150 -0.0185 0.0008 1335 VAL 33 CB 0.0059 -0.0237 -0.0085 1336 VAL 33 CG1 0.0065 -0.0263 -0.0081 1337 VAL 33 CG2 0.0052 -0.0286 -0.0096 1338 ASN 34 N 0.0092 -0.0119 -0.0042 1339 ASN 34 CA 0.0105 -0.0086 -0.0026 1340 ASN 34 C 0.0149 -0.0061 0.0019 1341 ASN 34 O 0.0176 -0.0063 0.0044 1342 ASN 34 CB 0.0071 -0.0037 -0.0055 1343 ASN 34 CG 0.0030 -0.0061 -0.0096 1344 ASN 34 ND2 0.0002 -0.0080 -0.0125 1345 ASN 34 OD1 0.0024 -0.0063 -0.0102 1346 ASN 35 N 0.0143 -0.0017 0.0013 1347 ASN 35 CA 0.0159 -0.0000 0.0050 1348 ASN 35 C 0.0163 -0.0037 0.0092 1349 ASN 35 O 0.0179 -0.0024 0.0132 1350 ASN 35 CB 0.0156 0.0012 0.0032 1351 ASN 35 CG 0.0157 0.0057 -0.0001 1352 ASN 35 ND2 0.0169 0.0090 0.0009 1353 ASN 35 OD1 0.0148 0.0061 -0.0033 1354 SER 36 N 0.0149 -0.0083 0.0084 1355 SER 36 CA 0.0152 -0.0119 0.0123 1356 SER 36 C 0.0162 -0.0112 0.0149 1357 SER 36 O 0.0175 -0.0117 0.0192 1358 SER 36 CB 0.0134 -0.0169 0.0106 1359 SER 36 OG 0.0137 -0.0203 0.0142 1360 HIS 37 N 0.0095 -0.0122 0.0177 1361 HIS 37 CA 0.0127 -0.0119 0.0237 1362 HIS 37 C 0.0186 -0.0101 0.0236 1363 HIS 37 O 0.0203 -0.0101 0.0282 1364 HIS 37 CB 0.0139 -0.0117 0.0253 1365 HIS 37 CG 0.0168 -0.0115 0.0315 1366 HIS 37 CD2 0.0226 -0.0100 0.0334 1367 HIS 37 ND1 0.0138 -0.0130 0.0366 1368 HIS 37 CE1 0.0175 -0.0124 0.0415 1369 HIS 37 NE2 0.0229 -0.0106 0.0396 1370 VAL 38 N 0.0217 -0.0086 0.0184 1371 VAL 38 CA 0.0277 -0.0067 0.0181 1372 VAL 38 C 0.0277 -0.0065 0.0163 1373 VAL 38 O 0.0313 -0.0057 0.0189 1374 VAL 38 CB 0.0314 -0.0050 0.0137 1375 VAL 38 CG1 0.0362 -0.0033 0.0108 1376 VAL 38 CG2 0.0343 -0.0046 0.0170 1377 GLY 39 N 0.0174 0.0026 0.0102 1378 GLY 39 CA 0.0186 0.0036 0.0087 1379 GLY 39 C 0.0192 0.0049 0.0069 1380 GLY 39 O 0.0211 0.0052 0.0060 1381 LEU 40 N 0.0176 0.0058 0.0064 1382 LEU 40 CA 0.0179 0.0072 0.0047 1383 LEU 40 C 0.0161 0.0086 0.0035 1384 LEU 40 O 0.0143 0.0085 0.0042 1385 LEU 40 CB 0.0175 0.0070 0.0050 1386 LEU 40 CG 0.0196 0.0061 0.0054 1387 LEU 40 CD1 0.0187 0.0060 0.0058 1388 LEU 40 CD2 0.0214 0.0071 0.0037 1389 THR 41 N 0.0080 0.0109 0.0039 1390 THR 41 CA 0.0066 0.0114 0.0026 1391 THR 41 C 0.0084 0.0091 0.0019 1392 THR 41 O 0.0106 0.0071 0.0023 1393 THR 41 CB 0.0041 0.0119 -0.0003 1394 THR 41 CG2 0.0022 0.0143 0.0004 1395 THR 41 OG1 0.0048 0.0096 -0.0026 1396 GLY 42 N 0.0074 0.0094 0.0009 1397 GLY 42 CA 0.0089 0.0072 0.0000 1398 GLY 42 C 0.0084 0.0082 0.0007 1399 GLY 42 O 0.0064 0.0105 0.0011 1400 LEU 43 N 0.0080 0.0094 -0.0001 1401 LEU 43 CA 0.0076 0.0100 0.0002 1402 LEU 43 C 0.0091 0.0089 0.0012 1403 LEU 43 O 0.0104 0.0074 0.0010 1404 LEU 43 CB 0.0065 0.0102 -0.0018 1405 LEU 43 CG 0.0059 0.0109 -0.0018 1406 LEU 43 CD1 0.0047 0.0128 -0.0007 1407 LEU 43 CD2 0.0051 0.0106 -0.0040 1408 LEU 44 N 0.0090 0.0095 0.0023 1409 LEU 44 CA 0.0104 0.0086 0.0034 1410 LEU 44 C 0.0099 0.0089 0.0029 1411 LEU 44 O 0.0087 0.0103 0.0030 1412 LEU 44 CB 0.0110 0.0092 0.0057 1413 LEU 44 CG 0.0121 0.0086 0.0071 1414 LEU 44 CD1 0.0137 0.0068 0.0068 1415 LEU 44 CD2 0.0123 0.0096 0.0093 1416 CYS 45 N 0.0078 0.0149 0.0056 1417 CYS 45 CA 0.0069 0.0161 0.0052 1418 CYS 45 C 0.0074 0.0151 0.0073 1419 CYS 45 O 0.0091 0.0131 0.0075 1420 CYS 45 CB 0.0073 0.0159 0.0021 1421 CYS 45 SG 0.0066 0.0168 0.0016 1422 PHE 46 N 0.0061 0.0165 0.0089 1423 PHE 46 CA 0.0064 0.0159 0.0111 1424 PHE 46 C 0.0057 0.0168 0.0101 1425 PHE 46 O 0.0042 0.0188 0.0092 1426 PHE 46 CB 0.0055 0.0166 0.0140 1427 PHE 46 CG 0.0057 0.0161 0.0163 1428 PHE 46 CD1 0.0074 0.0140 0.0165 1429 PHE 46 CD2 0.0042 0.0177 0.0182 1430 PHE 46 CE1 0.0076 0.0135 0.0186 1431 PHE 46 CE2 0.0044 0.0172 0.0203 1432 PHE 46 CZ 0.0061 0.0151 0.0205 1433 GLY 47 N 0.0091 0.0233 0.0088 1434 GLY 47 CA 0.0088 0.0261 0.0125 1435 GLY 47 C 0.0072 0.0214 0.0166 1436 GLY 47 O 0.0069 0.0159 0.0146 1437 ASN 48 N 0.0064 0.0234 0.0224 1438 ASN 48 CA 0.0049 0.0193 0.0269 1439 ASN 48 C 0.0038 0.0131 0.0279 1440 ASN 48 O 0.0030 0.0079 0.0282 1441 ASN 48 CB 0.0051 0.0179 0.0248 1442 ASN 48 CG 0.0037 0.0148 0.0299 1443 ASN 48 ND2 0.0036 0.0116 0.0280 1444 ASN 48 OD1 0.0026 0.0152 0.0355 1445 SER 49 N 0.0081 0.0161 0.0314 1446 SER 49 CA 0.0077 0.0120 0.0322 1447 SER 49 C 0.0084 0.0084 0.0284 1448 SER 49 O 0.0080 0.0042 0.0293 1449 SER 49 CB 0.0065 0.0098 0.0367 1450 SER 49 OG 0.0065 0.0062 0.0362 1451 ILE 50 N 0.0095 0.0100 0.0243 1452 ILE 50 CA 0.0102 0.0070 0.0203 1453 ILE 50 C 0.0111 0.0089 0.0168 1454 ILE 50 O 0.0116 0.0130 0.0158 1455 ILE 50 CB 0.0106 0.0065 0.0184 1456 ILE 50 CG1 0.0097 0.0052 0.0220 1457 ILE 50 CG2 0.0114 0.0030 0.0145 1458 ILE 50 CD1 0.0094 0.0000 0.0223 1459 PHE 51 N 0.0115 0.0044 0.0090 1460 PHE 51 CA 0.0115 0.0050 0.0079 1461 PHE 51 C 0.0114 0.0042 0.0065 1462 PHE 51 O 0.0115 0.0029 0.0065 1463 PHE 51 CB 0.0115 0.0048 0.0082 1464 PHE 51 CG 0.0115 0.0056 0.0094 1465 PHE 51 CD1 0.0116 0.0051 0.0107 1466 PHE 51 CD2 0.0114 0.0070 0.0093 1467 PHE 51 CE1 0.0116 0.0058 0.0119 1468 PHE 51 CE2 0.0115 0.0077 0.0104 1469 PHE 51 CZ 0.0116 0.0071 0.0117 1470 LEU 52 N 0.0113 0.0050 0.0054 1471 LEU 52 CA 0.0113 0.0044 0.0040 1472 LEU 52 C 0.0112 0.0050 0.0031 1473 LEU 52 O 0.0111 0.0063 0.0029 1474 LEU 52 CB 0.0112 0.0046 0.0034 1475 LEU 52 CG 0.0112 0.0045 0.0018 1476 LEU 52 CD1 0.0112 0.0030 0.0014 1477 LEU 52 CD2 0.0111 0.0048 0.0014 1478 GLN 53 N 0.0182 -0.0045 0.0025 1479 GLN 53 CA 0.0167 -0.0022 0.0024 1480 GLN 53 C 0.0141 -0.0024 0.0021 1481 GLN 53 O 0.0140 -0.0029 0.0021 1482 GLN 53 CB 0.0181 0.0003 0.0027 1483 GLN 53 CG 0.0164 0.0027 0.0027 1484 GLN 53 CD 0.0180 0.0052 0.0030 1485 GLN 53 NE2 0.0170 0.0071 0.0030 1486 GLN 53 OE1 0.0202 0.0053 0.0032 1487 ILE 54 N 0.0120 -0.0018 0.0019 1488 ILE 54 CA 0.0094 -0.0016 0.0016 1489 ILE 54 C 0.0085 0.0011 0.0017 1490 ILE 54 O 0.0085 0.0022 0.0017 1491 ILE 54 CB 0.0076 -0.0035 0.0013 1492 ILE 54 CG1 0.0084 -0.0063 0.0013 1493 ILE 54 CG2 0.0048 -0.0031 0.0010 1494 ILE 54 CD1 0.0063 -0.0083 0.0009 1495 LEU 55 N 0.0141 -0.0050 0.0005 1496 LEU 55 CA 0.0129 -0.0017 0.0014 1497 LEU 55 C 0.0097 -0.0018 0.0007 1498 LEU 55 O 0.0095 -0.0039 -0.0001 1499 LEU 55 CB 0.0154 -0.0000 0.0025 1500 LEU 55 CG 0.0182 0.0015 0.0037 1501 LEU 55 CD1 0.0212 0.0015 0.0043 1502 LEU 55 CD2 0.0170 0.0049 0.0047 1503 GLU 56 N 0.0074 0.0004 0.0010 1504 GLU 56 CA 0.0042 0.0007 0.0004 1505 GLU 56 C 0.0034 0.0041 0.0015 1506 GLU 56 O 0.0034 0.0062 0.0022 1507 GLU 56 CB 0.0015 -0.0006 -0.0006 1508 GLU 56 CG 0.0011 -0.0041 -0.0020 1509 GLU 56 CD -0.0008 -0.0056 -0.0029 1510 GLU 56 OE1 -0.0014 -0.0040 -0.0025 1511 GLU 56 OE2 -0.0016 -0.0084 -0.0041 1512 GLY 57 N 0.0017 0.0023 0.0016 1513 GLY 57 CA 0.0006 0.0057 0.0021 1514 GLY 57 C 0.0002 0.0057 0.0020 1515 GLY 57 O -0.0001 0.0030 0.0013 1516 SER 58 N 0.0002 0.0088 0.0027 1517 SER 58 CA -0.0002 0.0092 0.0027 1518 SER 58 C 0.0030 0.0077 0.0032 1519 SER 58 O 0.0058 0.0074 0.0038 1520 SER 58 CB -0.0008 0.0131 0.0033 1521 SER 58 OG 0.0021 0.0150 0.0045 1522 ARG 59 N -0.0018 0.0045 0.0051 1523 ARG 59 CA -0.0000 0.0037 0.0051 1524 ARG 59 C 0.0027 0.0059 0.0047 1525 ARG 59 O 0.0053 0.0049 0.0048 1526 ARG 59 CB -0.0023 0.0036 0.0052 1527 ARG 59 CG -0.0012 0.0016 0.0054 1528 ARG 59 CD -0.0036 0.0016 0.0055 1529 ARG 59 NE -0.0042 0.0048 0.0051 1530 ARG 59 CZ -0.0063 0.0055 0.0051 1531 ARG 59 NH1 -0.0082 0.0034 0.0055 1532 ARG 59 NH2 -0.0067 0.0085 0.0047 1533 GLN 60 N 0.0020 0.0090 0.0044 1534 GLN 60 CA 0.0044 0.0113 0.0040 1535 GLN 60 C 0.0072 0.0110 0.0039 1536 GLN 60 O 0.0099 0.0111 0.0038 1537 GLN 60 CB 0.0030 0.0146 0.0036 1538 GLN 60 CG 0.0054 0.0172 0.0032 1539 GLN 60 CD 0.0072 0.0174 0.0031 1540 GLN 60 NE2 0.0096 0.0193 0.0028 1541 GLN 60 OE1 0.0064 0.0158 0.0033 1542 ALA 61 N 0.0132 0.0055 0.0070 1543 ALA 61 CA 0.0138 0.0049 0.0066 1544 ALA 61 C 0.0149 0.0035 0.0056 1545 ALA 61 O 0.0161 0.0035 0.0051 1546 ALA 61 CB 0.0124 0.0043 0.0069 1547 ILE 62 N 0.0143 0.0024 0.0054 1548 ILE 62 CA 0.0153 0.0010 0.0046 1549 ILE 62 C 0.0169 0.0017 0.0041 1550 ILE 62 O 0.0182 0.0012 0.0034 1551 ILE 62 CB 0.0143 -0.0002 0.0045 1552 ILE 62 CG1 0.0130 -0.0013 0.0047 1553 ILE 62 CG2 0.0154 -0.0012 0.0037 1554 ILE 62 CD1 0.0122 -0.0028 0.0045 1555 SER 63 N 0.0130 0.0001 0.0038 1556 SER 63 CA 0.0121 0.0022 0.0019 1557 SER 63 C 0.0136 0.0023 -0.0017 1558 SER 63 O 0.0142 0.0026 -0.0034 1559 SER 63 CB 0.0095 0.0049 0.0024 1560 SER 63 OG 0.0081 0.0049 0.0057 1561 HIS 64 N 0.0144 0.0021 -0.0028 1562 HIS 64 CA 0.0159 0.0022 -0.0062 1563 HIS 64 C 0.0183 -0.0002 -0.0070 1564 HIS 64 O 0.0192 0.0001 -0.0095 1565 HIS 64 CB 0.0162 0.0023 -0.0071 1566 HIS 64 CG 0.0170 0.0032 -0.0106 1567 HIS 64 CD2 0.0162 0.0055 -0.0129 1568 HIS 64 ND1 0.0190 0.0018 -0.0123 1569 HIS 64 CE1 0.0193 0.0031 -0.0153 1570 HIS 64 NE2 0.0176 0.0053 -0.0158 1571 THR 65 N 0.0187 -0.0024 -0.0074 1572 THR 65 CA 0.0206 -0.0038 -0.0074 1573 THR 65 C 0.0202 -0.0036 -0.0069 1574 THR 65 O 0.0213 -0.0041 -0.0080 1575 THR 65 CB 0.0218 -0.0053 -0.0056 1576 THR 65 CG2 0.0237 -0.0068 -0.0055 1577 THR 65 OG1 0.0225 -0.0056 -0.0065 1578 TYR 66 N 0.0185 -0.0030 -0.0052 1579 TYR 66 CA 0.0180 -0.0027 -0.0047 1580 TYR 66 C 0.0173 -0.0015 -0.0069 1581 TYR 66 O 0.0179 -0.0017 -0.0075 1582 TYR 66 CB 0.0162 -0.0022 -0.0025 1583 TYR 66 CG 0.0157 -0.0021 -0.0017 1584 TYR 66 CD1 0.0170 -0.0034 -0.0006 1585 TYR 66 CD2 0.0139 -0.0006 -0.0020 1586 TYR 66 CE1 0.0166 -0.0033 0.0001 1587 TYR 66 CE2 0.0134 -0.0005 -0.0012 1588 TYR 66 CZ 0.0148 -0.0019 -0.0002 1589 TYR 66 OH 0.0143 -0.0017 0.0005 1590 HIS 67 N 0.0151 -0.0044 -0.0106 1591 HIS 67 CA 0.0140 -0.0036 -0.0127 1592 HIS 67 C 0.0152 -0.0046 -0.0146 1593 HIS 67 O 0.0147 -0.0042 -0.0159 1594 HIS 67 CB 0.0130 -0.0028 -0.0135 1595 HIS 67 CG 0.0121 -0.0022 -0.0158 1596 HIS 67 CD2 0.0111 -0.0014 -0.0168 1597 HIS 67 ND1 0.0121 -0.0022 -0.0174 1598 HIS 67 CE1 0.0112 -0.0016 -0.0194 1599 HIS 67 NE2 0.0106 -0.0010 -0.0190 1600 ARG 68 N 0.0168 -0.0059 -0.0149 1601 ARG 68 CA 0.0181 -0.0070 -0.0167 1602 ARG 68 C 0.0188 -0.0075 -0.0161 1603 ARG 68 O 0.0191 -0.0078 -0.0176 1604 ARG 68 CB 0.0197 -0.0083 -0.0170 1605 ARG 68 CG 0.0210 -0.0094 -0.0189 1606 ARG 68 CD 0.0226 -0.0106 -0.0191 1607 ARG 68 NE 0.0224 -0.0104 -0.0177 1608 ARG 68 CZ 0.0238 -0.0115 -0.0167 1609 ARG 68 NH1 0.0255 -0.0129 -0.0169 1610 ARG 68 NH2 0.0234 -0.0112 -0.0155 1611 ILE 69 N 0.0175 -0.0107 -0.0178 1612 ILE 69 CA 0.0177 -0.0095 -0.0158 1613 ILE 69 C 0.0137 -0.0078 -0.0156 1614 ILE 69 O 0.0129 -0.0076 -0.0158 1615 ILE 69 CB 0.0201 -0.0082 -0.0122 1616 ILE 69 CG1 0.0243 -0.0099 -0.0123 1617 ILE 69 CG2 0.0189 -0.0061 -0.0096 1618 ILE 69 CD1 0.0269 -0.0087 -0.0089 1619 LEU 70 N 0.0112 -0.0065 -0.0151 1620 LEU 70 CA 0.0074 -0.0047 -0.0146 1621 LEU 70 C 0.0051 -0.0058 -0.0176 1622 LEU 70 O 0.0026 -0.0044 -0.0171 1623 LEU 70 CB 0.0052 -0.0034 -0.0139 1624 LEU 70 CG 0.0053 -0.0010 -0.0101 1625 LEU 70 CD1 0.0031 0.0001 -0.0097 1626 LEU 70 CD2 0.0036 0.0006 -0.0086 1627 GLN 71 N 0.0009 -0.0091 -0.0232 1628 GLN 71 CA -0.0016 -0.0103 -0.0260 1629 GLN 71 C -0.0015 -0.0108 -0.0266 1630 GLN 71 O -0.0040 -0.0114 -0.0285 1631 GLN 71 CB -0.0008 -0.0130 -0.0285 1632 GLN 71 CG -0.0001 -0.0129 -0.0279 1633 GLN 71 CD -0.0032 -0.0109 -0.0276 1634 GLN 71 NE2 -0.0049 -0.0120 -0.0297 1635 GLN 71 OE1 -0.0040 -0.0084 -0.0253 1636 ASP 72 N 0.0011 -0.0107 -0.0249 1637 ASP 72 CA 0.0017 -0.0116 -0.0255 1638 ASP 72 C -0.0010 -0.0094 -0.0247 1639 ASP 72 O -0.0012 -0.0070 -0.0223 1640 ASP 72 CB 0.0053 -0.0119 -0.0238 1641 ASP 72 CG 0.0067 -0.0142 -0.0254 1642 ASP 72 OD1 0.0049 -0.0140 -0.0263 1643 ASP 72 OD2 0.0095 -0.0161 -0.0258 1644 PRO 73 N -0.0048 -0.0101 -0.0112 1645 PRO 73 CA -0.0040 -0.0111 -0.0061 1646 PRO 73 C -0.0029 -0.0082 -0.0047 1647 PRO 73 O -0.0023 -0.0092 -0.0008 1648 PRO 73 CB -0.0030 -0.0098 -0.0030 1649 PRO 73 CG -0.0035 -0.0094 -0.0062 1650 PRO 73 CD -0.0044 -0.0093 -0.0104 1651 ARG 74 N -0.0024 -0.0043 -0.0076 1652 ARG 74 CA -0.0013 -0.0012 -0.0065 1653 ARG 74 C -0.0021 -0.0038 -0.0069 1654 ARG 74 O -0.0012 -0.0022 -0.0048 1655 ARG 74 CB -0.0007 0.0034 -0.0099 1656 ARG 74 CG 0.0003 0.0068 -0.0096 1657 ARG 74 CD 0.0016 0.0122 -0.0107 1658 ARG 74 NE 0.0010 0.0132 -0.0148 1659 ARG 74 CZ 0.0012 0.0135 -0.0143 1660 ARG 74 NH1 0.0020 0.0129 -0.0099 1661 ARG 74 NH2 0.0006 0.0143 -0.0183 1662 HIS 75 N 0.0025 -0.0041 -0.0034 1663 HIS 75 CA 0.0016 -0.0029 0.0001 1664 HIS 75 C -0.0036 -0.0058 0.0001 1665 HIS 75 O -0.0061 -0.0088 -0.0030 1666 HIS 75 CB 0.0059 -0.0012 -0.0014 1667 HIS 75 CG 0.0062 -0.0036 -0.0067 1668 HIS 75 CD2 0.0101 -0.0035 -0.0109 1669 HIS 75 ND1 0.0021 -0.0066 -0.0081 1670 HIS 75 CE1 0.0035 -0.0082 -0.0129 1671 HIS 75 NE2 0.0083 -0.0063 -0.0147 1672 HIS 76 N -0.0052 -0.0050 0.0037 1673 HIS 76 CA -0.0102 -0.0076 0.0043 1674 HIS 76 C -0.0102 -0.0065 0.0066 1675 HIS 76 O -0.0067 -0.0035 0.0085 1676 HIS 76 CB -0.0142 -0.0082 0.0078 1677 HIS 76 CG -0.0138 -0.0052 0.0134 1678 HIS 76 CD2 -0.0174 -0.0050 0.0179 1679 HIS 76 ND1 -0.0094 -0.0019 0.0149 1680 HIS 76 CE1 -0.0102 0.0002 0.0201 1681 HIS 76 NE2 -0.0150 -0.0016 0.0220 1682 SER 77 N -0.0089 -0.0066 0.0034 1683 SER 77 CA -0.0081 -0.0046 0.0046 1684 SER 77 C -0.0031 -0.0034 0.0030 1685 SER 77 O -0.0012 -0.0000 0.0047 1686 SER 77 CB -0.0100 -0.0009 0.0085 1687 SER 77 OG -0.0147 -0.0021 0.0101 1688 ALA 78 N -0.0010 -0.0062 -0.0004 1689 ALA 78 CA 0.0037 -0.0055 -0.0022 1690 ALA 78 C 0.0041 -0.0049 -0.0019 1691 ALA 78 O 0.0010 -0.0067 -0.0018 1692 ALA 78 CB 0.0056 -0.0089 -0.0059 1693 GLU 79 N 0.0097 -0.0047 -0.0031 1694 GLU 79 CA 0.0092 -0.0041 -0.0019 1695 GLU 79 C 0.0098 -0.0044 -0.0013 1696 GLU 79 O 0.0108 -0.0051 -0.0012 1697 GLU 79 CB 0.0093 -0.0040 -0.0010 1698 GLU 79 CG 0.0083 -0.0032 -0.0002 1699 GLU 79 CD 0.0083 -0.0030 0.0007 1700 GLU 79 OE1 0.0084 -0.0032 0.0002 1701 GLU 79 OE2 0.0083 -0.0028 0.0019 1702 ILE 80 N 0.0092 -0.0039 -0.0009 1703 ILE 80 CA 0.0097 -0.0041 -0.0003 1704 ILE 80 C 0.0097 -0.0039 0.0011 1705 ILE 80 O 0.0089 -0.0033 0.0017 1706 ILE 80 CB 0.0090 -0.0037 -0.0007 1707 ILE 80 CG1 0.0087 -0.0038 -0.0022 1708 ILE 80 CG2 0.0095 -0.0040 -0.0002 1709 ILE 80 CD1 0.0078 -0.0033 -0.0027 1710 ILE 81 N 0.0108 -0.0088 0.0008 1711 ILE 81 CA 0.0107 -0.0090 0.0020 1712 ILE 81 C 0.0101 -0.0089 0.0017 1713 ILE 81 O 0.0092 -0.0091 0.0024 1714 ILE 81 CB 0.0121 -0.0090 0.0026 1715 ILE 81 CG1 0.0124 -0.0092 0.0033 1716 ILE 81 CG2 0.0122 -0.0092 0.0034 1717 ILE 81 CD1 0.0138 -0.0092 0.0038 1718 ALA 82 N 0.0105 -0.0088 0.0008 1719 ALA 82 CA 0.0099 -0.0087 0.0005 1720 ALA 82 C 0.0102 -0.0085 -0.0008 1721 ALA 82 O 0.0110 -0.0084 -0.0015 1722 ALA 82 CB 0.0105 -0.0089 0.0015 1723 PHE 83 N 0.0064 -0.0182 -0.0003 1724 PHE 83 CA 0.0047 -0.0146 0.0007 1725 PHE 83 C 0.0009 -0.0149 0.0009 1726 PHE 83 O 0.0008 -0.0149 0.0009 1727 PHE 83 CB 0.0072 -0.0118 0.0012 1728 PHE 83 CG 0.0057 -0.0080 0.0023 1729 PHE 83 CD1 0.0031 -0.0068 0.0028 1730 PHE 83 CD2 0.0071 -0.0056 0.0028 1731 PHE 83 CE1 0.0018 -0.0033 0.0038 1732 PHE 83 CE2 0.0057 -0.0022 0.0038 1733 PHE 83 CZ 0.0031 -0.0010 0.0043 1734 ASP 84 N -0.0021 -0.0152 0.0011 1735 ASP 84 CA -0.0057 -0.0158 0.0012 1736 ASP 84 C -0.0086 -0.0135 0.0020 1737 ASP 84 O -0.0082 -0.0127 0.0022 1738 ASP 84 CB -0.0069 -0.0198 0.0003 1739 ASP 84 CG -0.0072 -0.0211 -0.0001 1740 ASP 84 OD1 -0.0043 -0.0214 -0.0004 1741 ASP 84 OD2 -0.0104 -0.0219 -0.0000 1742 PRO 85 N -0.0214 -0.0156 -0.0027 1743 PRO 85 CA -0.0243 -0.0118 -0.0043 1744 PRO 85 C -0.0259 -0.0140 -0.0044 1745 PRO 85 O -0.0267 -0.0188 -0.0037 1746 PRO 85 CB -0.0290 -0.0109 -0.0059 1747 PRO 85 CG -0.0290 -0.0150 -0.0051 1748 PRO 85 CD -0.0246 -0.0185 -0.0032 1749 VAL 86 N -0.0264 -0.0103 -0.0053 1750 VAL 86 CA -0.0275 -0.0117 -0.0053 1751 VAL 86 C -0.0317 -0.0083 -0.0073 1752 VAL 86 O -0.0326 -0.0040 -0.0084 1753 VAL 86 CB -0.0226 -0.0111 -0.0040 1754 VAL 86 CG1 -0.0194 -0.0159 -0.0021 1755 VAL 86 CG2 -0.0194 -0.0061 -0.0040 1756 LEU 87 N -0.0485 0.0073 0.0042 1757 LEU 87 CA -0.0210 -0.0024 -0.0032 1758 LEU 87 C -0.0087 -0.0160 -0.0153 1759 LEU 87 O 0.0015 -0.0336 -0.0313 1760 LEU 87 CB -0.0001 0.0142 0.0138 1761 LEU 87 CG 0.0300 0.0071 0.0089 1762 LEU 87 CD1 0.0296 -0.0119 -0.0091 1763 LEU 87 CD2 0.0448 0.0246 0.0263 1764 GLN 88 N -0.0095 -0.0082 -0.0080 1765 GLN 88 CA 0.0024 -0.0199 -0.0183 1766 GLN 88 C -0.0147 -0.0145 -0.0142 1767 GLN 88 O -0.0286 0.0022 0.0007 1768 GLN 88 CB 0.0339 -0.0155 -0.0123 1769 GLN 88 CG 0.0406 0.0073 0.0097 1770 GLN 88 CD 0.0719 0.0109 0.0150 1771 GLN 88 NE2 0.0819 0.0055 0.0105 1772 GLN 88 OE1 0.0870 0.0184 0.0231 1773 ARG 89 N -0.0133 0.0004 -0.0076 1774 ARG 89 CA -0.0126 0.0007 -0.0062 1775 ARG 89 C -0.0129 0.0011 -0.0064 1776 ARG 89 O -0.0136 0.0015 -0.0076 1777 ARG 89 CB -0.0125 0.0021 -0.0052 1778 ARG 89 CG -0.0124 0.0019 -0.0051 1779 ARG 89 CD -0.0119 0.0029 -0.0037 1780 ARG 89 NE -0.0120 0.0032 -0.0038 1781 ARG 89 CZ -0.0114 0.0034 -0.0026 1782 ARG 89 NH1 -0.0107 0.0034 -0.0013 1783 ARG 89 NH2 -0.0116 0.0036 -0.0028 1784 GLU 90 N -0.0123 0.0010 -0.0053 1785 GLU 90 CA -0.0124 0.0016 -0.0053 1786 GLU 90 C -0.0120 0.0028 -0.0040 1787 GLU 90 O -0.0122 0.0035 -0.0040 1788 GLU 90 CB -0.0120 0.0001 -0.0053 1789 GLU 90 CG -0.0124 -0.0011 -0.0066 1790 GLU 90 CD -0.0129 -0.0012 -0.0075 1791 GLU 90 OE1 -0.0132 0.0000 -0.0076 1792 GLU 90 OE2 -0.0128 -0.0026 -0.0081 1793 PHE 91 N -0.0144 0.0070 -0.0055 1794 PHE 91 CA -0.0118 0.0089 -0.0044 1795 PHE 91 C -0.0126 0.0128 -0.0044 1796 PHE 91 O -0.0103 0.0148 -0.0035 1797 PHE 91 CB -0.0084 0.0080 -0.0033 1798 PHE 91 CG -0.0077 0.0041 -0.0033 1799 PHE 91 CD1 -0.0066 0.0022 -0.0030 1800 PHE 91 CD2 -0.0081 0.0024 -0.0035 1801 PHE 91 CE1 -0.0059 -0.0014 -0.0030 1802 PHE 91 CE2 -0.0075 -0.0011 -0.0035 1803 PHE 91 CZ -0.0064 -0.0030 -0.0033 1804 VAL 92 N -0.0157 0.0139 -0.0055 1805 VAL 92 CA -0.0167 0.0175 -0.0056 1806 VAL 92 C -0.0150 0.0200 -0.0048 1807 VAL 92 O -0.0142 0.0230 -0.0043 1808 VAL 92 CB -0.0205 0.0178 -0.0069 1809 VAL 92 CG1 -0.0217 0.0159 -0.0075 1810 VAL 92 CG2 -0.0217 0.0216 -0.0071 1811 GLN 93 N -0.0190 0.0210 -0.0077 1812 GLN 93 CA -0.0170 0.0253 -0.0066 1813 GLN 93 C -0.0103 0.0280 -0.0045 1814 GLN 93 O -0.0093 0.0339 -0.0035 1815 GLN 93 CB -0.0171 0.0214 -0.0072 1816 GLN 93 CG -0.0221 0.0161 -0.0092 1817 GLN 93 CD -0.0193 0.0093 -0.0093 1818 GLN 93 NE2 -0.0234 0.0044 -0.0110 1819 GLN 93 OE1 -0.0134 0.0084 -0.0079 1820 TRP 94 N -0.0057 0.0240 -0.0038 1821 TRP 94 CA 0.0010 0.0259 -0.0018 1822 TRP 94 C 0.0026 0.0280 -0.0011 1823 TRP 94 O 0.0014 0.0243 -0.0019 1824 TRP 94 CB 0.0056 0.0201 -0.0014 1825 TRP 94 CG 0.0040 0.0170 -0.0022 1826 TRP 94 CD1 0.0016 0.0109 -0.0036 1827 TRP 94 CD2 0.0047 0.0200 -0.0016 1828 TRP 94 CE2 0.0027 0.0153 -0.0028 1829 TRP 94 CE3 0.0069 0.0261 -0.0003 1830 TRP 94 NE1 0.0008 0.0098 -0.0040 1831 TRP 94 CZ2 0.0027 0.0166 -0.0026 1832 TRP 94 CZ3 0.0070 0.0273 -0.0001 1833 TRP 94 CH2 0.0049 0.0226 -0.0012 1834 SER 95 N 0.0124 0.0162 0.0033 1835 SER 95 CA 0.0127 0.0154 0.0038 1836 SER 95 C 0.0127 0.0152 0.0042 1837 SER 95 O 0.0131 0.0145 0.0042 1838 SER 95 CB 0.0125 0.0154 0.0045 1839 SER 95 OG 0.0127 0.0152 0.0041 1840 MET 96 N 0.0123 0.0157 0.0046 1841 MET 96 CA 0.0122 0.0157 0.0049 1842 MET 96 C 0.0117 0.0165 0.0050 1843 MET 96 O 0.0114 0.0170 0.0054 1844 MET 96 CB 0.0123 0.0151 0.0058 1845 MET 96 CG 0.0126 0.0146 0.0058 1846 MET 96 SD 0.0132 0.0138 0.0050 1847 MET 96 CE 0.0134 0.0132 0.0054 1848 LYS 97 N 0.0123 0.0102 -0.0017 1849 LYS 97 CA 0.0126 0.0131 0.0000 1850 LYS 97 C 0.0105 0.0136 0.0026 1851 LYS 97 O 0.0096 0.0126 0.0027 1852 LYS 97 CB 0.0150 0.0154 -0.0010 1853 LYS 97 CG 0.0159 0.0182 0.0001 1854 LYS 97 CD 0.0154 0.0177 0.0002 1855 LYS 97 CE 0.0170 0.0203 0.0003 1856 LYS 97 NZ 0.0165 0.0198 0.0005 1857 LEU 98 N 0.0096 0.0152 0.0046 1858 LEU 98 CA 0.0076 0.0159 0.0072 1859 LEU 98 C 0.0085 0.0191 0.0084 1860 LEU 98 O 0.0099 0.0209 0.0082 1861 LEU 98 CB 0.0056 0.0149 0.0087 1862 LEU 98 CG 0.0031 0.0151 0.0113 1863 LEU 98 CD1 0.0024 0.0143 0.0115 1864 LEU 98 CD2 0.0012 0.0131 0.0121 1865 VAL 99 N 0.0004 0.0133 0.0076 1866 VAL 99 CA -0.0015 0.0157 0.0046 1867 VAL 99 C -0.0007 0.0147 0.0059 1868 VAL 99 O 0.0021 0.0118 0.0051 1869 VAL 99 CB -0.0006 0.0156 -0.0007 1870 VAL 99 CG1 0.0032 0.0119 -0.0021 1871 VAL 99 CG2 -0.0023 0.0178 -0.0037 1872 GLN 100 N -0.0032 0.0170 0.0080 1873 GLN 100 CA -0.0028 0.0164 0.0092 1874 GLN 100 C -0.0036 0.0178 0.0051 1875 GLN 100 O -0.0053 0.0200 0.0019 1876 GLN 100 CB -0.0052 0.0181 0.0137 1877 GLN 100 CG -0.0038 0.0160 0.0184 1878 GLN 100 CD -0.0065 0.0183 0.0220 1879 GLN 100 NE2 -0.0062 0.0173 0.0266 1880 GLN 100 OE1 -0.0088 0.0208 0.0208 1881 ILE 101 N -0.0086 0.0068 -0.0013 1882 ILE 101 CA -0.0089 0.0089 -0.0043 1883 ILE 101 C -0.0138 0.0056 -0.0171 1884 ILE 101 O -0.0141 0.0109 -0.0230 1885 ILE 101 CB -0.0046 0.0220 -0.0025 1886 ILE 101 CG1 -0.0047 0.0308 -0.0113 1887 ILE 101 CG2 0.0002 0.0248 0.0104 1888 ILE 101 CD1 -0.0021 0.0427 -0.0142 1889 ASP 102 N -0.0177 -0.0032 -0.0214 1890 ASP 102 CA -0.0226 -0.0068 -0.0337 1891 ASP 102 C -0.0244 -0.0104 -0.0363 1892 ASP 102 O -0.0245 -0.0037 -0.0428 1893 ASP 102 CB -0.0263 -0.0173 -0.0359 1894 ASP 102 CG -0.0261 -0.0272 -0.0257 1895 ASP 102 OD1 -0.0246 -0.0288 -0.0194 1896 ASP 102 OD2 -0.0274 -0.0336 -0.0240 1897 SER 105 N -0.0127 -0.0217 -0.0178 1898 SER 105 CA -0.0061 -0.0213 -0.0152 1899 SER 105 C 0.0010 -0.0150 -0.0052 1900 SER 105 O -0.0030 -0.0089 0.0011 1901 SER 105 CB -0.0145 -0.0198 -0.0159 1902 SER 105 OG -0.0191 -0.0116 -0.0073 1903 PRO 106 N 0.0116 -0.0165 -0.0037 1904 PRO 106 CA 0.0187 -0.0106 0.0058 1905 PRO 106 C 0.0124 -0.0032 0.0130 1906 PRO 106 O 0.0051 -0.0034 0.0104 1907 PRO 106 CB 0.0302 -0.0147 0.0044 1908 PRO 106 CG 0.0273 -0.0215 -0.0049 1909 PRO 106 CD 0.0178 -0.0239 -0.0109 1910 GLU 107 N 0.0183 0.0019 0.0231 1911 GLU 107 CA 0.0102 0.0033 0.0315 1912 GLU 107 C 0.0080 0.0028 0.0297 1913 GLU 107 O 0.0001 0.0035 0.0352 1914 GLU 107 CB 0.0147 0.0063 0.0434 1915 GLU 107 CG 0.0260 0.0077 0.0460 1916 GLU 107 CD 0.0241 0.0089 0.0520 1917 GLU 107 OE1 0.0164 0.0101 0.0594 1918 GLU 107 OE2 0.0304 0.0087 0.0491 1919 LYS 108 N 0.0147 0.0015 0.0224 1920 LYS 108 CA 0.0125 0.0008 0.0199 1921 LYS 108 C 0.0008 -0.0012 0.0142 1922 LYS 108 O -0.0053 -0.0011 0.0166 1923 LYS 108 CB 0.0223 -0.0002 0.0125 1924 LYS 108 CG 0.0207 -0.0011 0.0091 1925 LYS 108 CD 0.0209 -0.0040 -0.0037 1926 LYS 108 CE 0.0205 -0.0047 -0.0069 1927 LYS 108 NZ 0.0246 -0.0072 -0.0187 1928 MET 109 N -0.0055 0.0016 0.0083 1929 MET 109 CA -0.0097 -0.0009 0.0066 1930 MET 109 C -0.0136 -0.0008 0.0103 1931 MET 109 O -0.0165 -0.0023 0.0096 1932 MET 109 CB -0.0109 -0.0025 0.0043 1933 MET 109 CG -0.0095 -0.0043 -0.0007 1934 MET 109 SD -0.0113 -0.0064 -0.0035 1935 MET 109 CE -0.0063 -0.0062 -0.0075 1936 ARG 110 N -0.0137 0.0010 0.0142 1937 ARG 110 CA -0.0171 0.0014 0.0180 1938 ARG 110 C -0.0163 0.0025 0.0195 1939 ARG 110 O -0.0196 0.0018 0.0209 1940 ARG 110 CB -0.0170 0.0033 0.0219 1941 ARG 110 CG -0.0187 0.0022 0.0210 1942 ARG 110 CD -0.0174 0.0043 0.0243 1943 ARG 110 NE -0.0145 0.0044 0.0221 1944 ARG 110 CZ -0.0110 0.0066 0.0236 1945 ARG 110 NH1 -0.0098 0.0089 0.0273 1946 ARG 110 NH2 -0.0086 0.0065 0.0213 1947 ARG 111 N -0.0073 -0.0010 0.0186 1948 ARG 111 CA -0.0073 -0.0000 0.0234 1949 ARG 111 C -0.0119 -0.0005 0.0200 1950 ARG 111 O -0.0161 0.0005 0.0239 1951 ARG 111 CB 0.0007 -0.0001 0.0249 1952 ARG 111 CG 0.0015 0.0010 0.0306 1953 ARG 111 CD 0.0002 0.0027 0.0382 1954 ARG 111 NE 0.0072 0.0030 0.0418 1955 ARG 111 CZ 0.0121 0.0034 0.0448 1956 ARG 111 NH1 0.0110 0.0035 0.0447 1957 ARG 111 NH2 0.0183 0.0037 0.0479 1958 LEU 112 N -0.0111 -0.0020 0.0129 1959 LEU 112 CA -0.0156 -0.0026 0.0092 1960 LEU 112 C -0.0239 -0.0021 0.0092 1961 LEU 112 O -0.0287 -0.0017 0.0102 1962 LEU 112 CB -0.0128 -0.0043 0.0015 1963 LEU 112 CG -0.0047 -0.0049 0.0009 1964 LEU 112 CD1 -0.0035 -0.0064 -0.0064 1965 LEU 112 CD2 -0.0027 -0.0037 0.0071 1966 TYR 113 N -0.0191 -0.0002 0.0089 1967 TYR 113 CA -0.0187 0.0009 0.0082 1968 TYR 113 C -0.0194 -0.0002 0.0091 1969 TYR 113 O -0.0203 0.0009 0.0094 1970 TYR 113 CB -0.0167 0.0007 0.0066 1971 TYR 113 CG -0.0160 0.0026 0.0054 1972 TYR 113 CD1 -0.0168 0.0048 0.0054 1973 TYR 113 CD2 -0.0145 0.0023 0.0044 1974 TYR 113 CE1 -0.0162 0.0065 0.0044 1975 TYR 113 CE2 -0.0139 0.0040 0.0033 1976 TYR 113 CZ -0.0148 0.0061 0.0033 1977 TYR 113 OH -0.0142 0.0079 0.0022 1978 LEU 114 N -0.0189 -0.0024 0.0094 1979 LEU 114 CA -0.0195 -0.0035 0.0102 1980 LEU 114 C -0.0215 -0.0033 0.0118 1981 LEU 114 O -0.0223 -0.0033 0.0124 1982 LEU 114 CB -0.0186 -0.0060 0.0103 1983 LEU 114 CG -0.0184 -0.0073 0.0106 1984 LEU 114 CD1 -0.0168 -0.0068 0.0092 1985 LEU 114 CD2 -0.0182 -0.0097 0.0112 1986 LYS 115 N -0.0118 -0.0067 0.0042 1987 LYS 115 CA -0.0131 -0.0068 0.0039 1988 LYS 115 C -0.0147 -0.0067 0.0032 1989 LYS 115 O -0.0161 -0.0073 0.0036 1990 LYS 115 CB -0.0124 -0.0061 0.0030 1991 LYS 115 CG -0.0133 -0.0064 0.0031 1992 LYS 115 CD -0.0132 -0.0055 0.0017 1993 LYS 115 CE -0.0120 -0.0054 0.0019 1994 LYS 115 NZ -0.0122 -0.0047 0.0007 1995 TYR 116 N -0.0146 -0.0061 0.0021 1996 TYR 116 CA -0.0161 -0.0059 0.0012 1997 TYR 116 C -0.0165 -0.0062 0.0015 1998 TYR 116 O -0.0172 -0.0058 0.0004 1999 TYR 116 CB -0.0160 -0.0049 -0.0005 2000 TYR 116 CG -0.0158 -0.0046 -0.0010 2001 TYR 116 CD1 -0.0171 -0.0049 -0.0010 2002 TYR 116 CD2 -0.0143 -0.0040 -0.0014 2003 TYR 116 CE1 -0.0170 -0.0046 -0.0015 2004 TYR 116 CE2 -0.0141 -0.0037 -0.0018 2005 TYR 116 CZ -0.0154 -0.0040 -0.0019 2006 TYR 116 OH -0.0152 -0.0037 -0.0023 2007 SER 117 N -0.0118 0.0048 0.0076 2008 SER 117 CA -0.0088 0.0098 0.0020 2009 SER 117 C -0.0086 0.0111 -0.0054 2010 SER 117 O -0.0114 0.0073 -0.0069 2011 SER 117 CB -0.0106 0.0076 -0.0008 2012 SER 117 OG -0.0148 0.0023 -0.0063 2013 GLY 118 N -0.0052 0.0167 -0.0100 2014 GLY 118 CA -0.0047 0.0184 -0.0176 2015 GLY 118 C -0.0062 0.0171 -0.0253 2016 GLY 118 O -0.0055 0.0190 -0.0320 2017 GLU 119 N 0.0030 0.0220 -0.0319 2018 GLU 119 CA 0.0014 0.0217 -0.0338 2019 GLU 119 C -0.0071 0.0193 -0.0322 2020 GLU 119 O -0.0108 0.0181 -0.0268 2021 GLU 119 CB 0.0068 0.0229 -0.0289 2022 GLU 119 CG 0.0152 0.0251 -0.0284 2023 GLU 119 CD 0.0207 0.0268 -0.0336 2024 GLU 119 OE1 0.0180 0.0264 -0.0401 2025 GLU 119 OE2 0.0276 0.0286 -0.0313 2026 VAL 120 N -0.0103 0.0186 -0.0370 2027 VAL 120 CA -0.0186 0.0164 -0.0364 2028 VAL 120 C -0.0203 0.0156 -0.0285 2029 VAL 120 O -0.0260 0.0139 -0.0244 2030 VAL 120 CB -0.0213 0.0160 -0.0439 2031 VAL 120 CG1 -0.0226 0.0159 -0.0510 2032 VAL 120 CG2 -0.0151 0.0177 -0.0460 2033 ALA 121 N -0.0048 0.0233 -0.0161 2034 ALA 121 CA -0.0061 0.0218 -0.0100 2035 ALA 121 C -0.0028 0.0191 -0.0090 2036 ALA 121 O 0.0012 0.0176 -0.0126 2037 ALA 121 CB -0.0055 0.0197 -0.0058 2038 PHE 122 N -0.0044 0.0183 -0.0040 2039 PHE 122 CA -0.0015 0.0156 -0.0025 2040 PHE 122 C 0.0035 0.0115 -0.0009 2041 PHE 122 O 0.0034 0.0098 0.0035 2042 PHE 122 CB -0.0048 0.0159 0.0026 2043 PHE 122 CG -0.0022 0.0135 0.0041 2044 PHE 122 CD1 0.0012 0.0128 -0.0002 2045 PHE 122 CD2 -0.0033 0.0121 0.0098 2046 PHE 122 CE1 0.0035 0.0106 0.0012 2047 PHE 122 CE2 -0.0010 0.0099 0.0112 2048 PHE 122 CZ 0.0025 0.0092 0.0069 2049 MET 123 N 0.0063 0.0062 0.0018 2050 MET 123 CA 0.0103 0.0035 0.0024 2051 MET 123 C 0.0123 0.0023 0.0009 2052 MET 123 O 0.0137 0.0019 -0.0030 2053 MET 123 CB 0.0118 0.0028 -0.0001 2054 MET 123 CG 0.0140 0.0009 0.0026 2055 MET 123 SD 0.0161 -0.0001 -0.0007 2056 MET 123 CE 0.0120 0.0030 -0.0028 2057 PRO 124 N 0.0126 0.0017 0.0038 2058 PRO 124 CA 0.0142 0.0008 0.0024 2059 PRO 124 C 0.0184 -0.0020 0.0022 2060 PRO 124 O 0.0200 -0.0028 0.0002 2061 PRO 124 CB 0.0125 0.0015 0.0060 2062 PRO 124 CG 0.0107 0.0021 0.0097 2063 PRO 124 CD 0.0114 0.0018 0.0086 2064 GLU 125 N 0.0194 -0.0047 0.0053 2065 GLU 125 CA 0.0229 -0.0075 0.0051 2066 GLU 125 C 0.0239 -0.0096 0.0005 2067 GLU 125 O 0.0265 -0.0120 -0.0004 2068 GLU 125 CB 0.0259 -0.0088 0.0085 2069 GLU 125 CG 0.0270 -0.0100 0.0074 2070 GLU 125 CD 0.0250 -0.0078 0.0095 2071 GLU 125 OE1 0.0234 -0.0056 0.0126 2072 GLU 125 OE2 0.0250 -0.0082 0.0081 2073 THR 126 N 0.0218 -0.0089 -0.0024 2074 THR 126 CA 0.0223 -0.0106 -0.0070 2075 THR 126 C 0.0198 -0.0096 -0.0101 2076 THR 126 O 0.0197 -0.0107 -0.0141 2077 THR 126 CB 0.0216 -0.0106 -0.0086 2078 THR 126 CG2 0.0241 -0.0116 -0.0056 2079 THR 126 OG1 0.0179 -0.0077 -0.0085 2080 MET 127 N 0.0084 -0.0143 -0.0007 2081 MET 127 CA 0.0052 -0.0129 -0.0036 2082 MET 127 C 0.0067 -0.0143 -0.0042 2083 MET 127 O 0.0092 -0.0149 -0.0007 2084 MET 127 CB 0.0014 -0.0090 -0.0013 2085 MET 127 CG -0.0018 -0.0071 -0.0029 2086 MET 127 SD -0.0060 -0.0026 0.0001 2087 MET 127 CE -0.0084 -0.0011 -0.0009 2088 THR 128 N 0.0053 -0.0147 -0.0085 2089 THR 128 CA 0.0060 -0.0156 -0.0092 2090 THR 128 C 0.0032 -0.0124 -0.0069 2091 THR 128 O -0.0000 -0.0096 -0.0060 2092 THR 128 CB 0.0053 -0.0171 -0.0147 2093 THR 128 CG2 0.0071 -0.0194 -0.0174 2094 THR 128 OG1 0.0010 -0.0144 -0.0168 2095 PRO 129 N 0.0062 -0.0166 -0.0066 2096 PRO 129 CA 0.0035 -0.0140 -0.0039 2097 PRO 129 C -0.0010 -0.0134 -0.0058 2098 PRO 129 O -0.0037 -0.0113 -0.0039 2099 PRO 129 CB 0.0052 -0.0139 -0.0025 2100 PRO 129 CG 0.0085 -0.0164 -0.0047 2101 PRO 129 CD 0.0099 -0.0178 -0.0063 2102 ALA 130 N -0.0019 -0.0151 -0.0093 2103 ALA 130 CA -0.0062 -0.0145 -0.0112 2104 ALA 130 C -0.0082 -0.0140 -0.0117 2105 ALA 130 O -0.0117 -0.0123 -0.0110 2106 ALA 130 CB -0.0064 -0.0166 -0.0151 2107 GLN 131 N -0.0071 -0.0118 -0.0088 2108 GLN 131 CA -0.0073 -0.0124 -0.0093 2109 GLN 131 C -0.0070 -0.0105 -0.0076 2110 GLN 131 O -0.0085 -0.0102 -0.0075 2111 GLN 131 CB -0.0052 -0.0141 -0.0106 2112 GLN 131 CG -0.0058 -0.0161 -0.0125 2113 GLN 131 CD -0.0034 -0.0177 -0.0137 2114 GLN 131 NE2 -0.0037 -0.0196 -0.0154 2115 GLN 131 OE1 -0.0012 -0.0172 -0.0130 2116 CYS 132 N -0.0052 -0.0092 -0.0062 2117 CYS 132 CA -0.0049 -0.0073 -0.0045 2118 CYS 132 C -0.0075 -0.0060 -0.0036 2119 CYS 132 O -0.0084 -0.0052 -0.0029 2120 CYS 132 CB -0.0025 -0.0062 -0.0033 2121 CYS 132 SG 0.0008 -0.0073 -0.0039 2122 LEU 133 N -0.0067 -0.0096 -0.0053 2123 LEU 133 CA -0.0089 -0.0078 -0.0054 2124 LEU 133 C -0.0112 -0.0069 -0.0068 2125 LEU 133 O -0.0128 -0.0049 -0.0059 2126 LEU 133 CB -0.0091 -0.0086 -0.0066 2127 LEU 133 CG -0.0115 -0.0069 -0.0070 2128 LEU 133 CD1 -0.0117 -0.0048 -0.0045 2129 LEU 133 CD2 -0.0114 -0.0079 -0.0084 2130 GLN 134 N -0.0113 -0.0084 -0.0090 2131 GLN 134 CA -0.0135 -0.0077 -0.0105 2132 GLN 134 C -0.0137 -0.0064 -0.0090 2133 GLN 134 O -0.0157 -0.0047 -0.0090 2134 GLN 134 CB -0.0133 -0.0097 -0.0131 2135 GLN 134 CG -0.0143 -0.0104 -0.0153 2136 GLN 134 CD -0.0170 -0.0085 -0.0159 2137 GLN 134 NE2 -0.0176 -0.0085 -0.0167 2138 GLN 134 OE1 -0.0184 -0.0071 -0.0157 2139 PHE 135 N -0.0104 -0.0026 -0.0083 2140 PHE 135 CA -0.0103 -0.0017 -0.0070 2141 PHE 135 C -0.0103 -0.0008 -0.0067 2142 PHE 135 O -0.0104 0.0005 -0.0063 2143 PHE 135 CB -0.0099 -0.0027 -0.0058 2144 PHE 135 CG -0.0098 -0.0018 -0.0044 2145 PHE 135 CD1 -0.0099 -0.0006 -0.0043 2146 PHE 135 CD2 -0.0095 -0.0023 -0.0032 2147 PHE 135 CE1 -0.0098 0.0001 -0.0030 2148 PHE 135 CE2 -0.0094 -0.0016 -0.0019 2149 PHE 135 CZ -0.0095 -0.0004 -0.0018 2150 MET 136 N -0.0102 -0.0014 -0.0067 2151 MET 136 CA -0.0103 -0.0006 -0.0063 2152 MET 136 C -0.0106 0.0005 -0.0074 2153 MET 136 O -0.0107 0.0015 -0.0071 2154 MET 136 CB -0.0101 -0.0017 -0.0060 2155 MET 136 CG -0.0097 -0.0024 -0.0045 2156 MET 136 SD -0.0096 -0.0014 -0.0031 2157 MET 136 CE -0.0098 -0.0009 -0.0038 2158 ILE 137 N -0.0112 -0.0015 -0.0082 2159 ILE 137 CA -0.0122 -0.0024 -0.0069 2160 ILE 137 C -0.0123 -0.0045 -0.0074 2161 ILE 137 O -0.0126 -0.0053 -0.0071 2162 ILE 137 CB -0.0131 -0.0020 -0.0054 2163 ILE 137 CG1 -0.0134 -0.0001 -0.0046 2164 ILE 137 CG2 -0.0141 -0.0036 -0.0044 2165 ILE 137 CD1 -0.0141 0.0005 -0.0033 2166 ASP 138 N -0.0120 -0.0054 -0.0081 2167 ASP 138 CA -0.0121 -0.0074 -0.0084 2168 ASP 138 C -0.0114 -0.0082 -0.0096 2169 ASP 138 O -0.0117 -0.0099 -0.0097 2170 ASP 138 CB -0.0119 -0.0081 -0.0089 2171 ASP 138 CG -0.0127 -0.0079 -0.0076 2172 ASP 138 OD1 -0.0135 -0.0072 -0.0062 2173 ASP 138 OD2 -0.0127 -0.0084 -0.0078 2174 ILE 139 N -0.0065 -0.0054 -0.0052 2175 ILE 139 CA -0.0045 -0.0074 -0.0089 2176 ILE 139 C -0.0041 -0.0071 -0.0107 2177 ILE 139 O -0.0028 -0.0079 -0.0143 2178 ILE 139 CB -0.0044 -0.0058 -0.0121 2179 ILE 139 CG1 -0.0059 -0.0018 -0.0142 2180 ILE 139 CG2 -0.0050 -0.0057 -0.0102 2181 ILE 139 CD1 -0.0053 -0.0008 -0.0182 2182 ASP 140 N -0.0053 -0.0061 -0.0084 2183 ASP 140 CA -0.0050 -0.0059 -0.0099 2184 ASP 140 C -0.0028 -0.0100 -0.0104 2185 ASP 140 O -0.0023 -0.0125 -0.0075 2186 ASP 140 CB -0.0067 -0.0041 -0.0069 2187 ASP 140 CG -0.0069 -0.0027 -0.0088 2188 ASP 140 OD1 -0.0056 -0.0035 -0.0123 2189 ASP 140 OD2 -0.0085 -0.0007 -0.0067 2190 PRO 141 N 0.0028 -0.0103 -0.0084 2191 PRO 141 CA 0.0085 -0.0142 -0.0094 2192 PRO 141 C 0.0046 -0.0145 -0.0066 2193 PRO 141 O 0.0079 -0.0198 -0.0050 2194 PRO 141 CB 0.0142 -0.0094 -0.0169 2195 PRO 141 CG 0.0132 -0.0049 -0.0194 2196 PRO 141 CD 0.0057 -0.0050 -0.0142 2197 ALA 142 N -0.0024 -0.0089 -0.0058 2198 ALA 142 CA -0.0066 -0.0088 -0.0030 2199 ALA 142 C -0.0113 -0.0146 0.0044 2200 ALA 142 O -0.0163 -0.0141 0.0075 2201 ALA 142 CB -0.0124 -0.0005 -0.0051 2202 ARG 143 N -0.0051 -0.0343 0.0033 2203 ARG 143 CA -0.0123 -0.0441 0.0086 2204 ARG 143 C -0.0086 -0.0584 0.0062 2205 ARG 143 O -0.0146 -0.0677 0.0106 2206 ARG 143 CB -0.0134 -0.0419 0.0093 2207 ARG 143 CG -0.0219 -0.0314 0.0152 2208 ARG 143 CD -0.0227 -0.0294 0.0157 2209 ARG 143 NE -0.0317 -0.0205 0.0220 2210 ARG 143 CZ -0.0312 -0.0073 0.0214 2211 ARG 143 NH1 -0.0221 -0.0010 0.0148 2212 ARG 143 NH2 -0.0399 -0.0003 0.0275 2213 SER 144 N 0.0009 -0.0605 -0.0006 2214 SER 144 CA 0.0054 -0.0738 -0.0035 2215 SER 144 C 0.0048 -0.0833 -0.0030 2216 SER 144 O 0.0002 -0.0941 0.0005 2217 SER 144 CB -0.0005 -0.0798 0.0008 2218 SER 144 OG -0.0120 -0.0786 0.0089