1 VAL 1 N -0.0069 0.0117 -0.0091 2 VAL 1 CA -0.0049 0.0107 -0.0069 3 VAL 1 C -0.0062 0.0082 -0.0040 4 VAL 1 O -0.0091 0.0071 -0.0035 5 VAL 1 CB -0.0051 0.0104 -0.0067 6 VAL 1 CG1 -0.0026 0.0095 -0.0045 7 VAL 1 CG2 -0.0056 0.0122 -0.0094 8 LEU 2 N -0.0032 0.0079 -0.0024 9 LEU 2 CA -0.0045 0.0054 0.0006 10 LEU 2 C -0.0044 0.0035 0.0033 11 LEU 2 O -0.0014 0.0044 0.0032 12 LEU 2 CB -0.0014 0.0057 0.0014 13 LEU 2 CG -0.0015 0.0061 0.0008 14 LEU 2 CD1 -0.0046 0.0059 -0.0001 15 LEU 2 CD2 0.0024 0.0070 0.0009 16 SER 3 N -0.0070 0.0026 0.0037 17 SER 3 CA -0.0070 0.0007 0.0063 18 SER 3 C -0.0048 -0.0004 0.0087 19 SER 3 O -0.0038 -0.0008 0.0096 20 SER 3 CB -0.0108 -0.0006 0.0068 21 SER 3 OG -0.0121 -0.0020 0.0082 22 PRO 4 N -0.0060 -0.0067 0.0274 23 PRO 4 CA -0.0045 -0.0020 0.0300 24 PRO 4 C -0.0052 -0.0032 0.0274 25 PRO 4 O -0.0044 0.0011 0.0251 26 PRO 4 CB -0.0048 -0.0070 0.0376 27 PRO 4 CG -0.0050 -0.0089 0.0396 28 PRO 4 CD -0.0058 -0.0089 0.0334 29 ALA 5 N -0.0076 -0.0103 0.0224 30 ALA 5 CA -0.0083 -0.0113 0.0194 31 ALA 5 C -0.0081 -0.0064 0.0114 32 ALA 5 O -0.0077 -0.0038 0.0092 33 ALA 5 CB -0.0110 -0.0202 0.0158 34 ASP 6 N -0.0080 -0.0045 0.0079 35 ASP 6 CA -0.0073 0.0017 0.0021 36 ASP 6 C -0.0052 0.0081 0.0052 37 ASP 6 O -0.0051 0.0112 0.0003 38 ASP 6 CB -0.0073 0.0028 -0.0007 39 ASP 6 CG -0.0095 -0.0035 -0.0052 40 ASP 6 OD1 -0.0110 -0.0071 -0.0095 41 ASP 6 OD2 -0.0095 -0.0040 -0.0041 42 LYS 7 N -0.0043 0.0064 0.0070 43 LYS 7 CA -0.0029 0.0102 0.0083 44 LYS 7 C -0.0025 0.0108 0.0091 45 LYS 7 O -0.0019 0.0133 0.0077 46 LYS 7 CB -0.0019 0.0117 0.0116 47 LYS 7 CG -0.0021 0.0114 0.0108 48 LYS 7 CD -0.0012 0.0123 0.0150 49 LYS 7 CE -0.0018 0.0108 0.0142 50 LYS 7 NZ -0.0006 0.0126 0.0183 51 THR 8 N -0.0038 0.0064 0.0106 52 THR 8 CA -0.0038 0.0061 0.0109 53 THR 8 C -0.0040 0.0068 0.0077 54 THR 8 O -0.0037 0.0084 0.0068 55 THR 8 CB -0.0047 0.0020 0.0140 56 THR 8 OG1 -0.0041 0.0025 0.0174 57 THR 8 CG2 -0.0048 0.0015 0.0142 58 ASN 9 N -0.0052 0.0048 0.0042 59 ASN 9 CA -0.0058 0.0047 0.0003 60 ASN 9 C -0.0047 0.0091 -0.0020 61 ASN 9 O -0.0048 0.0098 -0.0042 62 ASN 9 CB -0.0071 0.0020 -0.0026 63 ASN 9 CG -0.0083 -0.0023 -0.0010 64 ASN 9 OD1 -0.0084 -0.0035 0.0009 65 ASN 9 ND2 -0.0093 -0.0048 -0.0027 66 VAL 10 N -0.0004 0.0054 -0.0024 67 VAL 10 CA 0.0007 0.0074 -0.0035 68 VAL 10 C 0.0009 0.0101 -0.0019 69 VAL 10 O 0.0020 0.0119 -0.0032 70 VAL 10 CB 0.0005 0.0068 -0.0034 71 VAL 10 CG1 0.0015 0.0090 -0.0042 72 VAL 10 CG2 0.0004 0.0046 -0.0047 73 LYS 11 N -0.0002 0.0100 0.0005 74 LYS 11 CA -0.0000 0.0127 0.0021 75 LYS 11 C 0.0004 0.0132 0.0015 76 LYS 11 O 0.0013 0.0156 0.0011 77 LYS 11 CB -0.0012 0.0125 0.0046 78 LYS 11 CG -0.0017 0.0123 0.0055 79 LYS 11 CD -0.0026 0.0127 0.0079 80 LYS 11 CE -0.0026 0.0131 0.0082 81 LYS 11 NZ -0.0039 0.0122 0.0104 82 ALA 12 N 0.0002 0.0114 0.0005 83 ALA 12 CA 0.0006 0.0127 0.0007 84 ALA 12 C 0.0016 0.0126 -0.0018 85 ALA 12 O 0.0027 0.0148 -0.0027 86 ALA 12 CB -0.0002 0.0102 0.0005 87 ALA 13 N 0.0015 0.0169 -0.0092 88 ALA 13 CA 0.0037 0.0166 -0.0079 89 ALA 13 C 0.0073 0.0148 -0.0080 90 ALA 13 O 0.0093 0.0150 -0.0061 91 ALA 13 CB 0.0031 0.0157 -0.0098 92 TRP 14 N 0.0070 0.0133 -0.0106 93 TRP 14 CA 0.0100 0.0117 -0.0109 94 TRP 14 C 0.0111 0.0125 -0.0087 95 TRP 14 O 0.0138 0.0118 -0.0076 96 TRP 14 CB 0.0096 0.0095 -0.0147 97 TRP 14 CG 0.0124 0.0083 -0.0144 98 TRP 14 CD1 0.0142 0.0071 -0.0150 99 TRP 14 CD2 0.0143 0.0069 -0.0153 100 TRP 14 NE1 0.0170 0.0053 -0.0157 101 TRP 14 CE2 0.0174 0.0050 -0.0159 102 TRP 14 CE3 0.0143 0.0069 -0.0153 103 TRP 14 CZ2 0.0193 0.0039 -0.0163 104 TRP 14 CZ3 0.0169 0.0053 -0.0158 105 TRP 14 CH2 0.0193 0.0039 -0.0163 106 GLY 15 N 0.0085 0.0142 -0.0080 107 GLY 15 CA 0.0096 0.0146 -0.0065 108 GLY 15 C 0.0108 0.0158 -0.0035 109 GLY 15 O 0.0137 0.0155 -0.0018 110 LYS 16 N 0.0090 0.0147 -0.0128 111 LYS 16 CA 0.0083 0.0149 -0.0080 112 LYS 16 C 0.0118 0.0119 -0.0064 113 LYS 16 O 0.0128 0.0108 -0.0027 114 LYS 16 CB 0.0044 0.0180 -0.0059 115 LYS 16 CG 0.0047 0.0174 0.0004 116 LYS 16 CD 0.0041 0.0178 0.0022 117 LYS 16 CE 0.0053 0.0164 0.0075 118 LYS 16 NZ 0.0029 0.0182 0.0104 119 VAL 17 N 0.0127 0.0115 -0.0110 120 VAL 17 CA 0.0147 0.0098 -0.0109 121 VAL 17 C 0.0199 0.0053 -0.0087 122 VAL 17 O 0.0203 0.0048 -0.0062 123 VAL 17 CB 0.0147 0.0100 -0.0144 124 VAL 17 CG1 0.0185 0.0069 -0.0153 125 VAL 17 CG2 0.0110 0.0132 -0.0153 126 GLY 18 N 0.0196 0.0058 -0.0127 127 GLY 18 CA 0.0228 0.0031 -0.0118 128 GLY 18 C 0.0271 -0.0005 -0.0120 129 GLY 18 O 0.0274 -0.0004 -0.0165 130 ALA 19 N 0.0325 -0.0121 -0.0105 131 ALA 19 CA 0.0384 -0.0165 -0.0105 132 ALA 19 C 0.0329 -0.0147 -0.0076 133 ALA 19 O 0.0360 -0.0165 -0.0082 134 ALA 19 CB 0.0416 -0.0235 -0.0046 135 HIS 20 N 0.0261 -0.0101 -0.0070 136 HIS 20 CA 0.0211 -0.0082 -0.0048 137 HIS 20 C 0.0220 -0.0028 -0.0124 138 HIS 20 O 0.0177 0.0001 -0.0121 139 HIS 20 CB 0.0140 -0.0055 -0.0016 140 HIS 20 CG 0.0111 -0.0089 0.0054 141 HIS 20 ND1 0.0135 -0.0156 0.0115 142 HIS 20 CD2 0.0127 -0.0116 0.0073 143 HIS 20 CE1 0.0111 -0.0174 0.0160 144 HIS 20 NE2 0.0102 -0.0162 0.0153 145 ALA 21 N 0.0263 -0.0017 -0.0178 146 ALA 21 CA 0.0260 0.0045 -0.0253 147 ALA 21 C 0.0247 0.0045 -0.0241 148 ALA 21 O 0.0223 0.0094 -0.0280 149 ALA 21 CB 0.0303 0.0061 -0.0312 150 GLY 22 N 0.0147 -0.0019 -0.0158 151 GLY 22 CA 0.0140 -0.0027 -0.0141 152 GLY 22 C 0.0118 -0.0021 -0.0114 153 GLY 22 O 0.0107 -0.0017 -0.0100 154 GLU 23 N 0.0103 -0.0037 -0.0079 155 GLU 23 CA 0.0077 -0.0032 -0.0044 156 GLU 23 C 0.0055 0.0014 -0.0048 157 GLU 23 O 0.0035 0.0025 -0.0028 158 GLU 23 CB 0.0073 -0.0052 -0.0022 159 GLU 23 CG 0.0048 -0.0054 0.0017 160 GLU 23 CD 0.0047 -0.0085 0.0042 161 GLU 23 OE1 0.0020 -0.0041 0.0047 162 GLU 23 OE2 0.0075 -0.0105 0.0018 163 TYR 24 N 0.0057 0.0033 -0.0067 164 TYR 24 CA 0.0037 0.0074 -0.0070 165 TYR 24 C 0.0044 0.0090 -0.0094 166 TYR 24 O 0.0022 0.0120 -0.0085 167 TYR 24 CB 0.0045 0.0093 -0.0098 168 TYR 24 CG 0.0031 0.0084 -0.0070 169 TYR 24 CD1 0.0033 0.0097 -0.0083 170 TYR 24 CD2 0.0022 0.0060 -0.0037 171 TYR 24 CE1 0.0024 0.0084 -0.0059 172 TYR 24 CE2 0.0013 0.0046 -0.0013 173 TYR 24 CZ 0.0014 0.0065 -0.0030 174 TYR 24 OH 0.0012 0.0046 -0.0012 175 GLY 25 N 0.0085 0.0024 -0.0063 176 GLY 25 CA 0.0087 0.0034 -0.0067 177 GLY 25 C 0.0071 0.0033 -0.0049 178 GLY 25 O 0.0063 0.0050 -0.0043 179 ALA 26 N 0.0064 0.0011 -0.0038 180 ALA 26 CA 0.0051 0.0007 -0.0023 181 ALA 26 C 0.0032 0.0023 -0.0004 182 ALA 26 O 0.0021 0.0033 0.0008 183 ALA 26 CB 0.0044 -0.0018 -0.0012 184 GLU 27 N 0.0030 0.0023 -0.0001 185 GLU 27 CA 0.0016 0.0039 0.0013 186 GLU 27 C 0.0017 0.0068 0.0008 187 GLU 27 O 0.0003 0.0078 0.0022 188 GLU 27 CB 0.0017 0.0031 0.0012 189 GLU 27 CG 0.0003 0.0047 0.0027 190 GLU 27 CD 0.0001 0.0042 0.0029 191 GLU 27 OE1 -0.0004 0.0060 0.0032 192 GLU 27 OE2 0.0008 0.0021 0.0024 193 ALA 28 N 0.0026 0.0033 0.0017 194 ALA 28 CA 0.0026 0.0035 0.0017 195 ALA 28 C 0.0026 0.0031 0.0022 196 ALA 28 O 0.0027 0.0032 0.0025 197 ALA 28 CB 0.0024 0.0037 0.0011 198 LEU 29 N 0.0024 0.0025 0.0019 199 LEU 29 CA 0.0025 0.0020 0.0024 200 LEU 29 C 0.0027 0.0020 0.0031 201 LEU 29 O 0.0028 0.0019 0.0034 202 LEU 29 CB 0.0022 0.0012 0.0021 203 LEU 29 CG 0.0020 0.0012 0.0014 204 LEU 29 CD1 0.0019 0.0006 0.0013 205 LEU 29 CD2 0.0020 0.0011 0.0015 206 GLU 30 N 0.0027 0.0020 0.0033 207 GLU 30 CA 0.0029 0.0020 0.0039 208 GLU 30 C 0.0032 0.0026 0.0042 209 GLU 30 O 0.0033 0.0025 0.0047 210 GLU 30 CB 0.0030 0.0020 0.0040 211 GLU 30 CG 0.0032 0.0021 0.0046 212 GLU 30 CD 0.0032 0.0019 0.0047 213 GLU 30 OE1 0.0030 0.0020 0.0042 214 GLU 30 OE2 0.0033 0.0016 0.0053 215 ARG 31 N 0.0019 0.0022 0.0036 216 ARG 31 CA 0.0009 0.0024 0.0034 217 ARG 31 C 0.0007 0.0021 0.0022 218 ARG 31 O 0.0004 0.0022 0.0020 219 ARG 31 CB -0.0001 0.0028 0.0038 220 ARG 31 CG 0.0000 0.0031 0.0051 221 ARG 31 CD -0.0009 0.0034 0.0055 222 ARG 31 NE -0.0011 0.0038 0.0068 223 ARG 31 CZ -0.0014 0.0039 0.0073 224 ARG 31 NH1 -0.0017 0.0039 0.0069 225 ARG 31 NH2 -0.0012 0.0042 0.0084 226 MET 32 N 0.0009 0.0019 0.0015 227 MET 32 CA 0.0007 0.0017 0.0004 228 MET 32 C 0.0015 0.0014 -0.0000 229 MET 32 O 0.0012 0.0013 -0.0007 230 MET 32 CB 0.0008 0.0015 -0.0002 231 MET 32 CG 0.0006 0.0012 -0.0014 232 MET 32 SD 0.0008 0.0010 -0.0020 233 MET 32 CE 0.0023 0.0007 -0.0018 234 PHE 33 N 0.0025 0.0012 0.0002 235 PHE 33 CA 0.0034 0.0010 -0.0001 236 PHE 33 C 0.0033 0.0010 0.0001 237 PHE 33 O 0.0034 0.0008 -0.0005 238 PHE 33 CB 0.0045 0.0008 0.0003 239 PHE 33 CG 0.0048 0.0006 -0.0002 240 PHE 33 CD1 0.0047 0.0004 -0.0011 241 PHE 33 CD2 0.0056 0.0007 0.0007 242 PHE 33 CE1 0.0052 0.0002 -0.0015 243 PHE 33 CE2 0.0058 0.0005 0.0002 244 PHE 33 CZ 0.0057 0.0003 -0.0007 245 LEU 34 N 0.0026 0.0012 0.0028 246 LEU 34 CA 0.0026 0.0012 0.0029 247 LEU 34 C 0.0019 0.0011 0.0025 248 LEU 34 O 0.0019 0.0010 0.0023 249 LEU 34 CB 0.0027 0.0015 0.0037 250 LEU 34 CG 0.0033 0.0017 0.0042 251 LEU 34 CD1 0.0033 0.0021 0.0050 252 LEU 34 CD2 0.0040 0.0015 0.0038 253 SER 35 N 0.0011 0.0011 0.0026 254 SER 35 CA 0.0005 0.0011 0.0024 255 SER 35 C 0.0003 0.0007 0.0016 256 SER 35 O -0.0001 0.0005 0.0012 257 SER 35 CB -0.0003 0.0012 0.0027 258 SER 35 OG -0.0004 0.0016 0.0034 259 PHE 36 N 0.0006 0.0006 0.0013 260 PHE 36 CA 0.0006 0.0002 0.0005 261 PHE 36 C 0.0014 0.0000 0.0002 262 PHE 36 O 0.0015 -0.0000 0.0001 263 PHE 36 CB -0.0000 0.0002 0.0004 264 PHE 36 CG -0.0009 0.0004 0.0008 265 PHE 36 CD1 -0.0010 0.0007 0.0015 266 PHE 36 CD2 -0.0014 0.0003 0.0004 267 PHE 36 CE1 -0.0018 0.0009 0.0018 268 PHE 36 CE2 -0.0021 0.0005 0.0008 269 PHE 36 CZ -0.0022 0.0008 0.0015 270 PRO 37 N 0.0093 -0.0047 -0.0092 271 PRO 37 CA 0.0101 -0.0032 -0.0097 272 PRO 37 C 0.0097 -0.0034 -0.0092 273 PRO 37 O 0.0100 -0.0020 -0.0091 274 PRO 37 CB 0.0112 -0.0032 -0.0116 275 PRO 37 CG 0.0111 -0.0048 -0.0121 276 PRO 37 CD 0.0098 -0.0055 -0.0104 277 THR 38 N 0.0090 -0.0052 -0.0089 278 THR 38 CA 0.0087 -0.0054 -0.0085 279 THR 38 C 0.0080 -0.0041 -0.0068 280 THR 38 O 0.0079 -0.0037 -0.0063 281 THR 38 CB 0.0079 -0.0076 -0.0082 282 THR 38 OG1 0.0070 -0.0083 -0.0072 283 THR 38 CG2 0.0087 -0.0086 -0.0101 284 THR 39 N 0.0075 -0.0035 -0.0056 285 THR 39 CA 0.0068 -0.0023 -0.0040 286 THR 39 C 0.0077 -0.0002 -0.0043 287 THR 39 O 0.0072 0.0007 -0.0031 288 THR 39 CB 0.0062 -0.0022 -0.0029 289 THR 39 OG1 0.0068 -0.0013 -0.0035 290 THR 39 CG2 0.0053 -0.0041 -0.0024 291 LYS 40 N 0.0091 0.0015 -0.0054 292 LYS 40 CA 0.0088 0.0018 -0.0055 293 LYS 40 C 0.0085 0.0019 -0.0052 294 LYS 40 O 0.0082 0.0021 -0.0052 295 LYS 40 CB 0.0088 0.0018 -0.0059 296 LYS 40 CG 0.0090 0.0018 -0.0063 297 LYS 40 CD 0.0090 0.0019 -0.0067 298 LYS 40 CE 0.0093 0.0018 -0.0067 299 LYS 40 NZ 0.0093 0.0018 -0.0071 300 THR 41 N 0.0087 0.0016 -0.0048 301 THR 41 CA 0.0085 0.0017 -0.0045 302 THR 41 C 0.0082 0.0018 -0.0043 303 THR 41 O 0.0080 0.0019 -0.0040 304 THR 41 CB 0.0087 0.0014 -0.0042 305 THR 41 OG1 0.0089 0.0012 -0.0040 306 THR 41 CG2 0.0090 0.0013 -0.0044 307 TYR 42 N 0.0082 0.0018 -0.0043 308 TYR 42 CA 0.0080 0.0019 -0.0041 309 TYR 42 C 0.0076 0.0023 -0.0044 310 TYR 42 O 0.0074 0.0024 -0.0042 311 TYR 42 CB 0.0081 0.0018 -0.0041 312 TYR 42 CG 0.0083 0.0016 -0.0037 313 TYR 42 CD1 0.0082 0.0015 -0.0033 314 TYR 42 CD2 0.0087 0.0013 -0.0039 315 TYR 42 CE1 0.0085 0.0013 -0.0030 316 TYR 42 CE2 0.0089 0.0011 -0.0036 317 TYR 42 CZ 0.0088 0.0010 -0.0031 318 TYR 42 OH 0.0090 0.0008 -0.0029 319 PHE 43 N 0.0031 0.0020 -0.0068 320 PHE 43 CA 0.0030 0.0027 -0.0071 321 PHE 43 C 0.0023 0.0043 -0.0087 322 PHE 43 O 0.0018 0.0041 -0.0096 323 PHE 43 CB 0.0029 0.0009 -0.0070 324 PHE 43 CG 0.0039 -0.0005 -0.0050 325 PHE 43 CD1 0.0038 -0.0022 -0.0049 326 PHE 43 CD2 0.0047 -0.0004 -0.0035 327 PHE 43 CE1 0.0046 -0.0034 -0.0032 328 PHE 43 CE2 0.0056 -0.0016 -0.0016 329 PHE 43 CZ 0.0054 -0.0033 -0.0018 330 PRO 44 N 0.0022 0.0058 -0.0091 331 PRO 44 CA 0.0013 0.0069 -0.0109 332 PRO 44 C 0.0016 0.0090 -0.0105 333 PRO 44 O 0.0010 0.0096 -0.0118 334 PRO 44 CB 0.0014 0.0083 -0.0109 335 PRO 44 CG 0.0024 0.0087 -0.0089 336 PRO 44 CD 0.0028 0.0064 -0.0080 337 HIS 45 N 0.0025 0.0091 -0.0088 338 HIS 45 CA 0.0029 0.0104 -0.0082 339 HIS 45 C 0.0028 0.0094 -0.0082 340 HIS 45 O 0.0032 0.0103 -0.0077 341 HIS 45 CB 0.0039 0.0112 -0.0064 342 HIS 45 CG 0.0049 0.0100 -0.0044 343 HIS 45 ND1 0.0045 0.0081 -0.0048 344 HIS 45 CD2 0.0056 0.0095 -0.0029 345 HIS 45 CE1 0.0054 0.0070 -0.0031 346 HIS 45 NE2 0.0060 0.0079 -0.0019 347 PHE 46 N -0.0003 -0.0020 -0.0053 348 PHE 46 CA -0.0003 -0.0028 -0.0050 349 PHE 46 C -0.0011 -0.0030 -0.0049 350 PHE 46 O -0.0018 -0.0026 -0.0050 351 PHE 46 CB -0.0003 -0.0029 -0.0050 352 PHE 46 CG 0.0005 -0.0031 -0.0050 353 PHE 46 CD1 0.0007 -0.0035 -0.0048 354 PHE 46 CD2 0.0011 -0.0029 -0.0051 355 PHE 46 CE1 0.0014 -0.0037 -0.0048 356 PHE 46 CE2 0.0020 -0.0030 -0.0051 357 PHE 46 CZ 0.0022 -0.0034 -0.0050 358 ASP 47 N -0.0011 -0.0037 -0.0046 359 ASP 47 CA -0.0019 -0.0041 -0.0044 360 ASP 47 C -0.0021 -0.0044 -0.0042 361 ASP 47 O -0.0016 -0.0049 -0.0041 362 ASP 47 CB -0.0016 -0.0048 -0.0041 363 ASP 47 CG -0.0025 -0.0052 -0.0039 364 ASP 47 OD1 -0.0031 -0.0051 -0.0039 365 ASP 47 OD2 -0.0023 -0.0058 -0.0037 366 LEU 48 N -0.0026 -0.0041 -0.0043 367 LEU 48 CA -0.0029 -0.0043 -0.0042 368 LEU 48 C -0.0037 -0.0048 -0.0040 369 LEU 48 O -0.0038 -0.0050 -0.0039 370 LEU 48 CB -0.0031 -0.0036 -0.0045 371 LEU 48 CG -0.0024 -0.0031 -0.0047 372 LEU 48 CD1 -0.0029 -0.0024 -0.0050 373 LEU 48 CD2 -0.0018 -0.0033 -0.0047 374 SER 49 N -0.0038 -0.0050 0.0012 375 SER 49 CA -0.0034 -0.0043 0.0027 376 SER 49 C -0.0039 -0.0031 0.0017 377 SER 49 O -0.0044 -0.0031 0.0002 378 SER 49 CB -0.0028 -0.0056 0.0036 379 SER 49 OG -0.0029 -0.0063 0.0030 380 HIS 50 N -0.0036 -0.0015 0.0028 381 HIS 50 CA -0.0042 -0.0006 0.0016 382 HIS 50 C -0.0044 -0.0011 0.0011 383 HIS 50 O -0.0038 -0.0021 0.0023 384 HIS 50 CB -0.0037 0.0009 0.0034 385 HIS 50 CG -0.0041 0.0019 0.0027 386 HIS 50 ND1 -0.0046 0.0034 0.0018 387 HIS 50 CD2 -0.0038 0.0028 0.0039 388 HIS 50 CE1 -0.0049 0.0042 0.0014 389 HIS 50 NE2 -0.0044 0.0036 0.0026 390 GLY 51 N -0.0048 -0.0010 0.0001 391 GLY 51 CA -0.0051 -0.0015 -0.0008 392 GLY 51 C -0.0052 -0.0033 -0.0016 393 GLY 51 O -0.0052 -0.0039 -0.0019 394 SER 52 N -0.0043 -0.0037 -0.0016 395 SER 52 CA -0.0034 -0.0039 -0.0021 396 SER 52 C -0.0038 -0.0038 -0.0018 397 SER 52 O -0.0047 -0.0038 -0.0018 398 SER 52 CB -0.0033 -0.0045 -0.0033 399 SER 52 OG -0.0041 -0.0047 -0.0039 400 ALA 53 N -0.0028 -0.0037 -0.0017 401 ALA 53 CA -0.0032 -0.0036 -0.0015 402 ALA 53 C -0.0038 -0.0041 -0.0024 403 ALA 53 O -0.0045 -0.0040 -0.0022 404 ALA 53 CB -0.0019 -0.0036 -0.0015 405 GLN 54 N -0.0037 -0.0046 -0.0035 406 GLN 54 CA -0.0043 -0.0050 -0.0044 407 GLN 54 C -0.0057 -0.0049 -0.0042 408 GLN 54 O -0.0063 -0.0051 -0.0045 409 GLN 54 CB -0.0038 -0.0054 -0.0055 410 GLN 54 CG -0.0027 -0.0056 -0.0058 411 GLN 54 CD -0.0021 -0.0059 -0.0066 412 GLN 54 OE1 -0.0016 -0.0058 -0.0065 413 GLN 54 NE2 -0.0013 -0.0062 -0.0074 414 VAL 55 N -0.0071 -0.0052 0.0000 415 VAL 55 CA -0.0054 -0.0048 -0.0003 416 VAL 55 C -0.0062 -0.0033 -0.0019 417 VAL 55 O -0.0065 -0.0033 -0.0020 418 VAL 55 CB -0.0024 -0.0047 -0.0004 419 VAL 55 CG1 -0.0006 -0.0041 -0.0010 420 VAL 55 CG2 -0.0016 -0.0066 0.0016 421 LYS 56 N -0.0068 -0.0016 -0.0037 422 LYS 56 CA -0.0081 -0.0002 -0.0052 423 LYS 56 C -0.0099 -0.0007 -0.0048 424 LYS 56 O -0.0107 -0.0000 -0.0055 425 LYS 56 CB -0.0082 0.0017 -0.0072 426 LYS 56 CG -0.0054 0.0020 -0.0074 427 LYS 56 CD -0.0068 0.0046 -0.0101 428 LYS 56 CE -0.0038 0.0054 -0.0109 429 LYS 56 NZ -0.0051 0.0073 -0.0129 430 GLY 57 N -0.0123 -0.0015 -0.0039 431 GLY 57 CA -0.0147 -0.0022 -0.0033 432 GLY 57 C -0.0143 -0.0036 -0.0018 433 GLY 57 O -0.0155 -0.0031 -0.0024 434 HIS 58 N -0.0162 -0.0037 0.0007 435 HIS 58 CA -0.0120 -0.0054 0.0060 436 HIS 58 C -0.0046 -0.0048 0.0019 437 HIS 58 O -0.0040 -0.0054 0.0043 438 HIS 58 CB -0.0099 -0.0069 0.0113 439 HIS 58 CG -0.0067 -0.0088 0.0180 440 HIS 58 ND1 -0.0103 -0.0095 0.0216 441 HIS 58 CD2 -0.0004 -0.0099 0.0207 442 HIS 58 CE1 -0.0047 -0.0108 0.0255 443 HIS 58 NE2 0.0004 -0.0112 0.0256 444 GLY 59 N -0.0022 -0.0039 -0.0023 445 GLY 59 CA 0.0039 -0.0032 -0.0065 446 GLY 59 C 0.0025 -0.0022 -0.0101 447 GLY 59 O 0.0057 -0.0025 -0.0098 448 LYS 60 N -0.0044 -0.0010 -0.0130 449 LYS 60 CA -0.0072 -0.0001 -0.0157 450 LYS 60 C -0.0081 -0.0010 -0.0119 451 LYS 60 O -0.0070 -0.0010 -0.0124 452 LYS 60 CB -0.0143 0.0016 -0.0208 453 LYS 60 CG -0.0173 0.0026 -0.0238 454 LYS 60 CD -0.0232 0.0040 -0.0279 455 LYS 60 CE -0.0268 0.0052 -0.0316 456 LYS 60 NZ -0.0353 0.0071 -0.0367 457 LYS 61 N -0.0190 -0.0034 -0.0050 458 LYS 61 CA -0.0195 -0.0043 0.0011 459 LYS 61 C -0.0090 -0.0047 0.0064 460 LYS 61 O -0.0086 -0.0045 0.0057 461 LYS 61 CB -0.0250 -0.0060 0.0112 462 LYS 61 CG -0.0371 -0.0063 0.0098 463 LYS 61 CD -0.0420 -0.0078 0.0184 464 LYS 61 CE -0.0478 -0.0080 0.0181 465 LYS 61 NZ -0.0553 -0.0096 0.0270 466 VAL 62 N -0.0039 -0.0045 0.0065 467 VAL 62 CA 0.0067 -0.0046 0.0100 468 VAL 62 C 0.0131 -0.0030 0.0012 469 VAL 62 O 0.0156 -0.0033 0.0039 470 VAL 62 CB 0.0120 -0.0046 0.0121 471 VAL 62 CG1 0.0225 -0.0047 0.0153 472 VAL 62 CG2 0.0081 -0.0063 0.0221 473 ALA 63 N 0.0102 -0.0020 -0.0064 474 ALA 63 CA 0.0151 -0.0005 -0.0147 475 ALA 63 C 0.0107 -0.0002 -0.0181 476 ALA 63 O 0.0159 0.0002 -0.0191 477 ALA 63 CB 0.0152 0.0007 -0.0231 478 ASP 64 N -0.0017 -0.0025 -0.0101 479 ASP 64 CA -0.0029 -0.0025 -0.0110 480 ASP 64 C -0.0019 -0.0029 -0.0077 481 ASP 64 O -0.0007 -0.0026 -0.0091 482 ASP 64 CB -0.0086 -0.0030 -0.0103 483 ASP 64 CG -0.0119 -0.0023 -0.0162 484 ASP 64 OD1 -0.0075 -0.0015 -0.0188 485 ASP 64 OD2 -0.0161 -0.0029 -0.0145 486 ALA 65 N -0.0015 -0.0038 -0.0027 487 ALA 65 CA 0.0011 -0.0040 0.0001 488 ALA 65 C 0.0066 -0.0035 -0.0007 489 ALA 65 O 0.0071 -0.0035 -0.0001 490 ALA 65 CB 0.0008 -0.0050 0.0056 491 LEU 66 N 0.0087 -0.0030 -0.0025 492 LEU 66 CA 0.0136 -0.0024 -0.0037 493 LEU 66 C 0.0135 -0.0016 -0.0081 494 LEU 66 O 0.0162 -0.0014 -0.0084 495 LEU 66 CB 0.0164 -0.0020 -0.0044 496 LEU 66 CG 0.0183 -0.0027 0.0001 497 LEU 66 CD1 0.0201 -0.0023 -0.0013 498 LEU 66 CD2 0.0210 -0.0030 0.0036 499 THR 67 N 0.0133 -0.0009 -0.0104 500 THR 67 CA 0.0117 0.0007 -0.0119 501 THR 67 C 0.0093 0.0002 -0.0098 502 THR 67 O 0.0096 -0.0000 -0.0097 503 THR 67 CB 0.0105 0.0030 -0.0144 504 THR 67 OG1 0.0121 0.0036 -0.0161 505 THR 67 CG2 0.0080 0.0044 -0.0150 506 ASN 68 N 0.0074 -0.0006 -0.0077 507 ASN 68 CA 0.0053 -0.0015 -0.0054 508 ASN 68 C 0.0070 -0.0034 -0.0037 509 ASN 68 O 0.0063 -0.0037 -0.0029 510 ASN 68 CB 0.0033 -0.0022 -0.0033 511 ASN 68 CG 0.0009 -0.0033 -0.0006 512 ASN 68 OD1 -0.0005 -0.0025 -0.0010 513 ASN 68 ND2 -0.0004 -0.0045 0.0018 514 ALA 69 N 0.0103 -0.0050 -0.0030 515 ALA 69 CA 0.0118 -0.0069 -0.0011 516 ALA 69 C 0.0137 -0.0062 -0.0031 517 ALA 69 O 0.0139 -0.0071 -0.0020 518 ALA 69 CB 0.0145 -0.0082 -0.0008 519 VAL 70 N 0.0098 -0.0024 -0.0029 520 VAL 70 CA 0.0100 -0.0019 -0.0033 521 VAL 70 C 0.0083 -0.0011 -0.0028 522 VAL 70 O 0.0081 -0.0015 -0.0024 523 VAL 70 CB 0.0110 -0.0008 -0.0045 524 VAL 70 CG1 0.0114 0.0001 -0.0053 525 VAL 70 CG2 0.0129 -0.0017 -0.0051 526 ALA 71 N 0.0071 -0.0002 -0.0027 527 ALA 71 CA 0.0053 0.0006 -0.0020 528 ALA 71 C 0.0048 -0.0006 -0.0011 529 ALA 71 O 0.0035 -0.0002 -0.0005 530 ALA 71 CB 0.0046 0.0016 -0.0023 531 HIS 72 N 0.0049 -0.0021 -0.0003 532 HIS 72 CA 0.0040 -0.0033 0.0009 533 HIS 72 C 0.0049 -0.0048 0.0013 534 HIS 72 O 0.0050 -0.0063 0.0021 535 HIS 72 CB 0.0030 -0.0038 0.0018 536 HIS 72 CG 0.0024 -0.0022 0.0012 537 HIS 72 ND1 0.0002 -0.0014 0.0020 538 HIS 72 CD2 0.0020 -0.0008 0.0007 539 HIS 72 CE1 -0.0003 0.0004 0.0013 540 HIS 72 NE2 0.0004 0.0007 0.0007 541 VAL 73 N 0.0073 -0.0028 0.0035 542 VAL 73 CA 0.0084 -0.0050 0.0031 543 VAL 73 C 0.0067 -0.0071 0.0033 544 VAL 73 O 0.0065 -0.0097 0.0032 545 VAL 73 CB 0.0096 -0.0033 0.0030 546 VAL 73 CG1 0.0079 -0.0011 0.0035 547 VAL 73 CG2 0.0122 -0.0044 0.0024 548 ASP 74 N 0.0036 -0.0061 0.0040 549 ASP 74 CA 0.0009 -0.0085 0.0044 550 ASP 74 C 0.0009 -0.0105 0.0043 551 ASP 74 O -0.0013 -0.0125 0.0046 552 ASP 74 CB -0.0020 -0.0068 0.0052 553 ASP 74 CG -0.0018 -0.0047 0.0053 554 ASP 74 OD1 -0.0011 -0.0052 0.0051 555 ASP 74 OD2 -0.0020 -0.0011 0.0055 556 ASP 75 N 0.0014 -0.0106 0.0042 557 ASP 75 CA 0.0012 -0.0131 0.0041 558 ASP 75 C 0.0041 -0.0127 0.0035 559 ASP 75 O 0.0039 -0.0129 0.0035 560 ASP 75 CB -0.0008 -0.0105 0.0047 561 ASP 75 CG -0.0017 -0.0117 0.0048 562 ASP 75 OD1 -0.0041 -0.0148 0.0051 563 ASP 75 OD2 -0.0022 -0.0109 0.0049 564 MET 76 N 0.0077 -0.0116 0.0026 565 MET 76 CA 0.0073 -0.0123 0.0037 566 MET 76 C 0.0068 -0.0131 0.0049 567 MET 76 O 0.0060 -0.0139 0.0052 568 MET 76 CB 0.0086 -0.0115 0.0046 569 MET 76 CG 0.0087 -0.0112 0.0040 570 MET 76 SD 0.0099 -0.0105 0.0050 571 MET 76 CE 0.0110 -0.0095 0.0049 572 PRO 77 N 0.0071 -0.0130 0.0052 573 PRO 77 CA 0.0063 -0.0138 0.0057 574 PRO 77 C 0.0052 -0.0146 0.0054 575 PRO 77 O 0.0045 -0.0156 0.0063 576 PRO 77 CB 0.0068 -0.0135 0.0062 577 PRO 77 CG 0.0080 -0.0125 0.0060 578 PRO 77 CD 0.0081 -0.0121 0.0051 579 ASN 78 N 0.0047 -0.0146 0.0041 580 ASN 78 CA 0.0036 -0.0154 0.0036 581 ASN 78 C 0.0032 -0.0157 0.0033 582 ASN 78 O 0.0023 -0.0166 0.0038 583 ASN 78 CB 0.0030 -0.0154 0.0021 584 ASN 78 CG 0.0029 -0.0154 0.0021 585 ASN 78 OD1 0.0041 -0.0144 0.0020 586 ASN 78 ND2 0.0025 -0.0160 0.0027 587 ALA 79 N 0.0062 -0.0155 0.0063 588 ALA 79 CA 0.0057 -0.0167 0.0070 589 ALA 79 C 0.0048 -0.0166 0.0076 590 ALA 79 O 0.0048 -0.0176 0.0079 591 ALA 79 CB 0.0053 -0.0170 0.0074 592 LEU 80 N 0.0041 -0.0156 0.0077 593 LEU 80 CA 0.0031 -0.0152 0.0083 594 LEU 80 C 0.0036 -0.0146 0.0078 595 LEU 80 O 0.0028 -0.0141 0.0082 596 LEU 80 CB 0.0020 -0.0145 0.0088 597 LEU 80 CG 0.0016 -0.0152 0.0094 598 LEU 80 CD1 0.0006 -0.0144 0.0098 599 LEU 80 CD2 0.0013 -0.0165 0.0100 600 SER 81 N 0.0047 -0.0144 0.0070 601 SER 81 CA 0.0049 -0.0134 0.0066 602 SER 81 C 0.0046 -0.0139 0.0069 603 SER 81 O 0.0041 -0.0130 0.0070 604 SER 81 CB 0.0065 -0.0141 0.0056 605 SER 81 OG 0.0066 -0.0128 0.0052 606 ALA 82 N 0.0109 -0.0144 0.0084 607 ALA 82 CA 0.0120 -0.0160 0.0091 608 ALA 82 C 0.0068 -0.0140 0.0101 609 ALA 82 O 0.0057 -0.0123 0.0092 610 ALA 82 CB 0.0148 -0.0210 0.0120 611 LEU 83 N 0.0026 -0.0157 0.0135 612 LEU 83 CA -0.0027 -0.0144 0.0151 613 LEU 83 C -0.0059 -0.0097 0.0127 614 LEU 83 O -0.0089 -0.0075 0.0124 615 LEU 83 CB -0.0062 -0.0170 0.0191 616 LEU 83 CG -0.0086 -0.0197 0.0225 617 LEU 83 CD1 -0.0047 -0.0228 0.0232 618 LEU 83 CD2 -0.0088 -0.0246 0.0267 619 SER 84 N -0.0053 -0.0069 0.0101 620 SER 84 CA -0.0077 -0.0020 0.0072 621 SER 84 C -0.0054 0.0009 0.0036 622 SER 84 O -0.0085 0.0040 0.0025 623 SER 84 CB -0.0075 0.0017 0.0040 624 SER 84 OG -0.0042 -0.0014 0.0049 625 ASP 85 N -0.0011 0.0015 0.0020 626 ASP 85 CA 0.0001 0.0039 0.0001 627 ASP 85 C -0.0012 0.0038 0.0003 628 ASP 85 O -0.0024 0.0055 -0.0009 629 ASP 85 CB 0.0036 0.0031 0.0004 630 ASP 85 CG 0.0050 0.0040 -0.0004 631 ASP 85 OD1 0.0049 0.0052 -0.0013 632 ASP 85 OD2 0.0089 0.0027 0.0002 633 LEU 86 N -0.0019 0.0014 0.0022 634 LEU 86 CA -0.0032 0.0011 0.0025 635 LEU 86 C -0.0065 0.0023 0.0019 636 LEU 86 O -0.0077 0.0035 0.0011 637 LEU 86 CB -0.0030 -0.0019 0.0047 638 LEU 86 CG -0.0043 -0.0024 0.0052 639 LEU 86 CD1 -0.0023 -0.0020 0.0047 640 LEU 86 CD2 -0.0053 -0.0053 0.0074 641 HIS 87 N -0.0083 0.0016 0.0026 642 HIS 87 CA -0.0118 0.0026 0.0022 643 HIS 87 C -0.0120 0.0059 -0.0002 644 HIS 87 O -0.0140 0.0070 -0.0008 645 HIS 87 CB -0.0140 0.0015 0.0033 646 HIS 87 CG -0.0149 -0.0012 0.0053 647 HIS 87 ND1 -0.0125 -0.0034 0.0067 648 HIS 87 CD2 -0.0173 -0.0023 0.0064 649 HIS 87 CE1 -0.0138 -0.0053 0.0083 650 HIS 87 NE2 -0.0168 -0.0049 0.0082 651 ALA 88 N -0.0100 0.0067 -0.0024 652 ALA 88 CA -0.0100 0.0085 -0.0038 653 ALA 88 C -0.0093 0.0095 -0.0046 654 ALA 88 O -0.0100 0.0107 -0.0055 655 ALA 88 CB -0.0091 0.0089 -0.0042 656 HIS 89 N -0.0077 0.0087 -0.0043 657 HIS 89 CA -0.0067 0.0096 -0.0051 658 HIS 89 C -0.0070 0.0095 -0.0049 659 HIS 89 O -0.0070 0.0105 -0.0057 660 HIS 89 CB -0.0045 0.0096 -0.0053 661 HIS 89 CG -0.0040 0.0102 -0.0058 662 HIS 89 ND1 -0.0048 0.0116 -0.0068 663 HIS 89 CD2 -0.0028 0.0094 -0.0054 664 HIS 89 CE1 -0.0047 0.0119 -0.0071 665 HIS 89 NE2 -0.0033 0.0106 -0.0062 666 LYS 90 N -0.0076 0.0081 -0.0038 667 LYS 90 CA -0.0082 0.0076 -0.0034 668 LYS 90 C -0.0101 0.0074 -0.0029 669 LYS 90 O -0.0112 0.0082 -0.0035 670 LYS 90 CB -0.0066 0.0060 -0.0023 671 LYS 90 CG -0.0042 0.0066 -0.0031 672 LYS 90 CD -0.0036 0.0077 -0.0039 673 LYS 90 CE -0.0010 0.0068 -0.0036 674 LYS 90 NZ -0.0014 0.0098 -0.0059 675 LEU 91 N -0.0061 0.0036 -0.0051 676 LEU 91 CA -0.0059 0.0039 -0.0044 677 LEU 91 C -0.0061 0.0040 -0.0046 678 LEU 91 O -0.0057 0.0039 -0.0043 679 LEU 91 CB -0.0062 0.0047 -0.0038 680 LEU 91 CG -0.0059 0.0047 -0.0035 681 LEU 91 CD1 -0.0062 0.0053 -0.0031 682 LEU 91 CD2 -0.0051 0.0042 -0.0032 683 ARG 92 N -0.0068 0.0042 -0.0050 684 ARG 92 CA -0.0072 0.0042 -0.0054 685 ARG 92 C -0.0071 0.0046 -0.0048 686 ARG 92 O -0.0069 0.0045 -0.0048 687 ARG 92 CB -0.0068 0.0034 -0.0059 688 ARG 92 CG -0.0070 0.0031 -0.0066 689 ARG 92 CD -0.0060 0.0021 -0.0068 690 ARG 92 NE -0.0067 0.0023 -0.0072 691 ARG 92 CZ -0.0056 0.0011 -0.0076 692 ARG 92 NH1 -0.0050 0.0012 -0.0068 693 ARG 92 NH2 -0.0058 0.0010 -0.0080 694 VAL 93 N -0.0073 0.0052 -0.0043 695 VAL 93 CA -0.0074 0.0058 -0.0037 696 VAL 93 C -0.0079 0.0060 -0.0040 697 VAL 93 O -0.0086 0.0063 -0.0044 698 VAL 93 CB -0.0074 0.0063 -0.0031 699 VAL 93 CG1 -0.0075 0.0068 -0.0025 700 VAL 93 CG2 -0.0068 0.0060 -0.0028 701 ASP 94 N -0.0034 0.0071 -0.0062 702 ASP 94 CA -0.0047 0.0056 -0.0068 703 ASP 94 C -0.0063 0.0065 -0.0054 704 ASP 94 O -0.0056 0.0076 -0.0048 705 ASP 94 CB -0.0036 0.0049 -0.0078 706 ASP 94 CG -0.0051 0.0032 -0.0084 707 ASP 94 OD1 -0.0051 0.0018 -0.0095 708 ASP 94 OD2 -0.0062 0.0034 -0.0078 709 PRO 95 N -0.0080 0.0056 -0.0053 710 PRO 95 CA -0.0095 0.0063 -0.0040 711 PRO 95 C -0.0091 0.0066 -0.0041 712 PRO 95 O -0.0098 0.0077 -0.0028 713 PRO 95 CB -0.0113 0.0050 -0.0043 714 PRO 95 CG -0.0112 0.0043 -0.0049 715 PRO 95 CD -0.0091 0.0042 -0.0059 716 VAL 96 N -0.0080 0.0058 -0.0051 717 VAL 96 CA -0.0078 0.0062 -0.0049 718 VAL 96 C -0.0069 0.0079 -0.0040 719 VAL 96 O -0.0069 0.0087 -0.0033 720 VAL 96 CB -0.0066 0.0048 -0.0065 721 VAL 96 CG1 -0.0050 0.0050 -0.0071 722 VAL 96 CG2 -0.0070 0.0049 -0.0063 723 ASN 97 N -0.0052 -0.0000 -0.0037 724 ASN 97 CA -0.0036 0.0033 -0.0041 725 ASN 97 C -0.0055 0.0055 -0.0014 726 ASN 97 O -0.0044 0.0074 -0.0018 727 ASN 97 CB -0.0021 0.0058 -0.0047 728 ASN 97 CG -0.0001 0.0041 -0.0073 729 ASN 97 OD1 0.0019 0.0043 -0.0092 730 ASN 97 ND2 -0.0010 0.0022 -0.0071 731 PHE 98 N -0.0079 0.0044 0.0007 732 PHE 98 CA -0.0098 0.0060 0.0031 733 PHE 98 C -0.0099 0.0051 0.0029 734 PHE 98 O -0.0100 0.0075 0.0038 735 PHE 98 CB -0.0126 0.0053 0.0057 736 PHE 98 CG -0.0125 0.0066 0.0060 737 PHE 98 CD1 -0.0133 0.0096 0.0079 738 PHE 98 CD2 -0.0118 0.0051 0.0048 739 PHE 98 CE1 -0.0133 0.0110 0.0084 740 PHE 98 CE2 -0.0117 0.0070 0.0053 741 PHE 98 CZ -0.0124 0.0096 0.0070 742 LYS 99 N -0.0096 0.0021 0.0015 743 LYS 99 CA -0.0092 0.0013 0.0009 744 LYS 99 C -0.0070 0.0028 -0.0008 745 LYS 99 O -0.0073 0.0040 -0.0001 746 LYS 99 CB -0.0097 -0.0029 -0.0001 747 LYS 99 CG -0.0112 -0.0046 0.0008 748 LYS 99 CD -0.0121 -0.0071 0.0008 749 LYS 99 CE -0.0105 -0.0105 -0.0020 750 LYS 99 NZ -0.0140 -0.0148 -0.0001 751 LEU 100 N -0.0065 0.0014 -0.0017 752 LEU 100 CA -0.0059 0.0018 -0.0017 753 LEU 100 C -0.0056 0.0025 -0.0009 754 LEU 100 O -0.0056 0.0027 -0.0004 755 LEU 100 CB -0.0052 0.0017 -0.0025 756 LEU 100 CG -0.0055 0.0010 -0.0034 757 LEU 100 CD1 -0.0046 0.0010 -0.0043 758 LEU 100 CD2 -0.0058 0.0007 -0.0035 759 LEU 101 N -0.0053 0.0028 -0.0006 760 LEU 101 CA -0.0051 0.0035 0.0003 761 LEU 101 C -0.0058 0.0035 0.0011 762 LEU 101 O -0.0058 0.0039 0.0017 763 LEU 101 CB -0.0047 0.0037 0.0003 764 LEU 101 CG -0.0044 0.0045 0.0012 765 LEU 101 CD1 -0.0038 0.0050 0.0014 766 LEU 101 CD2 -0.0040 0.0047 0.0012 767 SER 102 N -0.0068 0.0030 0.0011 768 SER 102 CA -0.0076 0.0030 0.0018 769 SER 102 C -0.0077 0.0030 0.0019 770 SER 102 O -0.0079 0.0034 0.0027 771 SER 102 CB -0.0084 0.0024 0.0016 772 SER 102 OG -0.0083 0.0024 0.0016 773 HIS 103 N -0.0037 0.0027 0.0012 774 HIS 103 CA -0.0035 0.0030 0.0015 775 HIS 103 C -0.0034 0.0030 0.0016 776 HIS 103 O -0.0034 0.0033 0.0017 777 HIS 103 CB -0.0033 0.0029 0.0017 778 HIS 103 CG -0.0031 0.0032 0.0020 779 HIS 103 ND1 -0.0029 0.0031 0.0023 780 HIS 103 CD2 -0.0032 0.0036 0.0020 781 HIS 103 CE1 -0.0028 0.0035 0.0025 782 HIS 103 NE2 -0.0030 0.0038 0.0023 783 CYS 104 N -0.0033 0.0027 0.0017 784 CYS 104 CA -0.0032 0.0027 0.0019 785 CYS 104 C -0.0033 0.0028 0.0017 786 CYS 104 O -0.0032 0.0029 0.0018 787 CYS 104 CB -0.0030 0.0023 0.0021 788 CYS 104 SG -0.0028 0.0021 0.0024 789 LEU 105 N -0.0036 0.0027 0.0014 790 LEU 105 CA -0.0037 0.0029 0.0012 791 LEU 105 C -0.0038 0.0033 0.0012 792 LEU 105 O -0.0038 0.0035 0.0012 793 LEU 105 CB -0.0039 0.0026 0.0009 794 LEU 105 CG -0.0040 0.0023 0.0008 795 LEU 105 CD1 -0.0042 0.0021 0.0005 796 LEU 105 CD2 -0.0040 0.0023 0.0008 797 LEU 106 N -0.0050 0.0022 -0.0000 798 LEU 106 CA -0.0050 0.0029 0.0000 799 LEU 106 C -0.0041 0.0035 0.0002 800 LEU 106 O -0.0042 0.0046 0.0002 801 LEU 106 CB -0.0052 0.0023 -0.0000 802 LEU 106 CG -0.0059 0.0022 -0.0001 803 LEU 106 CD1 -0.0058 0.0015 -0.0002 804 LEU 106 CD2 -0.0069 0.0028 -0.0003 805 VAL 107 N -0.0032 0.0032 0.0003 806 VAL 107 CA -0.0023 0.0037 0.0004 807 VAL 107 C -0.0022 0.0045 0.0005 808 VAL 107 O -0.0019 0.0055 0.0005 809 VAL 107 CB -0.0013 0.0030 0.0005 810 VAL 107 CG1 -0.0004 0.0036 0.0007 811 VAL 107 CG2 -0.0011 0.0023 0.0005 812 THR 108 N -0.0027 0.0043 0.0004 813 THR 108 CA -0.0027 0.0051 0.0004 814 THR 108 C -0.0033 0.0059 0.0004 815 THR 108 O -0.0031 0.0068 0.0004 816 THR 108 CB -0.0030 0.0043 0.0003 817 THR 108 OG1 -0.0022 0.0036 0.0004 818 THR 108 CG2 -0.0030 0.0051 0.0004 819 LEU 109 N -0.0012 0.0056 -0.0030 820 LEU 109 CA -0.0013 0.0056 -0.0027 821 LEU 109 C -0.0022 0.0058 -0.0020 822 LEU 109 O -0.0022 0.0055 -0.0013 823 LEU 109 CB -0.0012 0.0059 -0.0035 824 LEU 109 CG -0.0003 0.0056 -0.0042 825 LEU 109 CD1 -0.0004 0.0060 -0.0050 826 LEU 109 CD2 0.0003 0.0051 -0.0038 827 ALA 110 N -0.0028 0.0063 -0.0022 828 ALA 110 CA -0.0036 0.0065 -0.0016 829 ALA 110 C -0.0037 0.0062 -0.0007 830 ALA 110 O -0.0040 0.0060 0.0000 831 ALA 110 CB -0.0043 0.0071 -0.0020 832 ALA 111 N -0.0033 0.0058 -0.0005 833 ALA 111 CA -0.0031 0.0054 0.0003 834 ALA 111 C -0.0027 0.0049 0.0009 835 ALA 111 O -0.0027 0.0046 0.0016 836 ALA 111 CB -0.0029 0.0052 0.0003 837 HIS 112 N -0.0048 0.0107 0.0006 838 HIS 112 CA -0.0045 0.0098 0.0005 839 HIS 112 C -0.0048 0.0108 -0.0005 840 HIS 112 O -0.0046 0.0100 -0.0002 841 HIS 112 CB -0.0038 0.0082 -0.0004 842 HIS 112 CG -0.0035 0.0073 0.0006 843 HIS 112 ND1 -0.0032 0.0064 0.0014 844 HIS 112 CD2 -0.0033 0.0068 0.0006 845 HIS 112 CE1 -0.0029 0.0054 0.0022 846 HIS 112 NE2 -0.0030 0.0058 0.0018 847 LEU 113 N -0.0052 0.0119 -0.0012 848 LEU 113 CA -0.0055 0.0126 -0.0022 849 LEU 113 C -0.0061 0.0141 -0.0016 850 LEU 113 O -0.0065 0.0151 -0.0026 851 LEU 113 CB -0.0055 0.0129 -0.0038 852 LEU 113 CG -0.0049 0.0114 -0.0049 853 LEU 113 CD1 -0.0049 0.0115 -0.0069 854 LEU 113 CD2 -0.0044 0.0102 -0.0045 855 PRO 114 N -0.0063 0.0144 -0.0002 856 PRO 114 CA -0.0069 0.0161 0.0006 857 PRO 114 C -0.0073 0.0170 -0.0006 858 PRO 114 O -0.0076 0.0180 -0.0010 859 PRO 114 CB -0.0068 0.0156 0.0020 860 PRO 114 CG -0.0062 0.0141 0.0021 861 PRO 114 CD -0.0059 0.0133 0.0008 862 ALA 115 N -0.0052 0.0179 -0.0028 863 ALA 115 CA -0.0072 0.0192 -0.0030 864 ALA 115 C -0.0093 0.0171 -0.0031 865 ALA 115 O -0.0104 0.0172 -0.0032 866 ALA 115 CB -0.0083 0.0214 -0.0030 867 GLU 116 N -0.0100 0.0155 -0.0032 868 GLU 116 CA -0.0125 0.0138 -0.0033 869 GLU 116 C -0.0118 0.0110 -0.0033 870 GLU 116 O -0.0137 0.0097 -0.0034 871 GLU 116 CB -0.0134 0.0132 -0.0034 872 GLU 116 CG -0.0147 0.0154 -0.0035 873 GLU 116 CD -0.0124 0.0169 -0.0033 874 GLU 116 OE1 -0.0100 0.0165 -0.0032 875 GLU 116 OE2 -0.0132 0.0192 -0.0033 876 PHE 117 N -0.0095 0.0102 -0.0031 877 PHE 117 CA -0.0086 0.0079 -0.0031 878 PHE 117 C -0.0084 0.0076 -0.0031 879 PHE 117 O -0.0064 0.0068 -0.0030 880 PHE 117 CB -0.0062 0.0067 -0.0030 881 PHE 117 CG -0.0057 0.0037 -0.0029 882 PHE 117 CD1 -0.0073 0.0022 -0.0030 883 PHE 117 CD2 -0.0038 0.0028 -0.0028 884 PHE 117 CE1 -0.0067 -0.0004 -0.0030 885 PHE 117 CE2 -0.0036 -0.0001 -0.0028 886 PHE 117 CZ -0.0050 -0.0014 -0.0029 887 THR 118 N -0.0087 0.0059 -0.0056 888 THR 118 CA -0.0089 0.0054 -0.0056 889 THR 118 C -0.0089 0.0041 -0.0058 890 THR 118 O -0.0092 0.0036 -0.0058 891 THR 118 CB -0.0101 0.0058 -0.0052 892 THR 118 OG1 -0.0111 0.0055 -0.0050 893 THR 118 CG2 -0.0101 0.0073 -0.0051 894 PRO 119 N -0.0091 0.0035 -0.0058 895 PRO 119 CA -0.0092 0.0021 -0.0060 896 PRO 119 C -0.0102 0.0017 -0.0058 897 PRO 119 O -0.0104 0.0008 -0.0058 898 PRO 119 CB -0.0092 0.0017 -0.0060 899 PRO 119 CG -0.0083 0.0026 -0.0062 900 PRO 119 CD -0.0086 0.0039 -0.0059 901 ALA 120 N -0.0112 0.0023 -0.0054 902 ALA 120 CA -0.0123 0.0020 -0.0051 903 ALA 120 C -0.0124 0.0022 -0.0050 904 ALA 120 O -0.0128 0.0014 -0.0050 905 ALA 120 CB -0.0135 0.0025 -0.0047 906 VAL 121 N -0.0079 0.0034 -0.0079 907 VAL 121 CA -0.0087 0.0028 -0.0079 908 VAL 121 C -0.0084 0.0019 -0.0071 909 VAL 121 O -0.0091 0.0012 -0.0069 910 VAL 121 CB -0.0088 0.0033 -0.0084 911 VAL 121 CG1 -0.0095 0.0027 -0.0083 912 VAL 121 CG2 -0.0093 0.0041 -0.0093 913 HIS 122 N -0.0075 0.0021 -0.0067 914 HIS 122 CA -0.0070 0.0012 -0.0057 915 HIS 122 C -0.0075 0.0006 -0.0055 916 HIS 122 O -0.0078 -0.0002 -0.0050 917 HIS 122 CB -0.0059 0.0017 -0.0055 918 HIS 122 CG -0.0054 0.0011 -0.0047 919 HIS 122 ND1 -0.0043 0.0015 -0.0044 920 HIS 122 CD2 -0.0056 0.0002 -0.0041 921 HIS 122 CE1 -0.0040 0.0006 -0.0035 922 HIS 122 NE2 -0.0047 -0.0001 -0.0034 923 ALA 123 N -0.0072 0.0009 -0.0056 924 ALA 123 CA -0.0075 0.0004 -0.0053 925 ALA 123 C -0.0086 -0.0002 -0.0055 926 ALA 123 O -0.0090 -0.0010 -0.0050 927 ALA 123 CB -0.0072 0.0009 -0.0055 928 SER 124 N -0.0040 0.0033 -0.0062 929 SER 124 CA -0.0048 0.0034 -0.0059 930 SER 124 C -0.0057 0.0035 -0.0057 931 SER 124 O -0.0062 0.0035 -0.0050 932 SER 124 CB -0.0051 0.0037 -0.0066 933 SER 124 OG -0.0044 0.0035 -0.0067 934 LEU 125 N -0.0057 0.0037 -0.0063 935 LEU 125 CA -0.0065 0.0039 -0.0061 936 LEU 125 C -0.0064 0.0036 -0.0054 937 LEU 125 O -0.0071 0.0036 -0.0049 938 LEU 125 CB -0.0065 0.0041 -0.0069 939 LEU 125 CG -0.0069 0.0045 -0.0079 940 LEU 125 CD1 -0.0067 0.0046 -0.0086 941 LEU 125 CD2 -0.0079 0.0047 -0.0077 942 ASP 126 N -0.0056 0.0033 -0.0051 943 ASP 126 CA -0.0054 0.0031 -0.0043 944 ASP 126 C -0.0058 0.0029 -0.0035 945 ASP 126 O -0.0062 0.0028 -0.0028 946 ASP 126 CB -0.0045 0.0028 -0.0043 947 ASP 126 CG -0.0042 0.0026 -0.0035 948 ASP 126 OD1 -0.0049 0.0027 -0.0034 949 ASP 126 OD2 -0.0038 0.0023 -0.0029 950 LYS 127 N -0.0073 0.0040 -0.0041 951 LYS 127 CA -0.0061 0.0047 -0.0048 952 LYS 127 C -0.0048 0.0044 -0.0049 953 LYS 127 O -0.0041 0.0054 -0.0056 954 LYS 127 CB -0.0060 0.0048 -0.0048 955 LYS 127 CG -0.0054 0.0051 -0.0051 956 LYS 127 CD -0.0060 0.0052 -0.0050 957 LYS 127 CE -0.0045 0.0056 -0.0056 958 LYS 127 NZ -0.0041 0.0054 -0.0056 959 PHE 128 N -0.0044 0.0032 -0.0043 960 PHE 128 CA -0.0031 0.0027 -0.0044 961 PHE 128 C -0.0034 0.0033 -0.0046 962 PHE 128 O -0.0023 0.0039 -0.0052 963 PHE 128 CB -0.0029 0.0012 -0.0036 964 PHE 128 CG -0.0017 0.0007 -0.0037 965 PHE 128 CD1 -0.0001 0.0008 -0.0041 966 PHE 128 CD2 -0.0022 0.0001 -0.0032 967 PHE 128 CE1 0.0008 0.0003 -0.0041 968 PHE 128 CE2 -0.0014 -0.0008 -0.0030 969 PHE 128 CZ 0.0001 -0.0005 -0.0035 970 LEU 129 N -0.0048 0.0033 -0.0043 971 LEU 129 CA -0.0050 0.0039 -0.0046 972 LEU 129 C -0.0051 0.0053 -0.0053 973 LEU 129 O -0.0045 0.0059 -0.0057 974 LEU 129 CB -0.0064 0.0034 -0.0040 975 LEU 129 CG -0.0065 0.0017 -0.0031 976 LEU 129 CD1 -0.0079 0.0013 -0.0026 977 LEU 129 CD2 -0.0052 0.0014 -0.0032 978 ALA 130 N -0.0085 0.0032 0.0045 979 ALA 130 CA -0.0080 0.0046 0.0054 980 ALA 130 C -0.0074 0.0046 0.0047 981 ALA 130 O -0.0076 0.0051 0.0053 982 ALA 130 CB -0.0069 0.0060 0.0055 983 SER 131 N -0.0065 0.0039 0.0032 984 SER 131 CA -0.0058 0.0038 0.0026 985 SER 131 C -0.0070 0.0026 0.0027 986 SER 131 O -0.0068 0.0031 0.0028 987 SER 131 CB -0.0046 0.0032 0.0009 988 SER 131 OG -0.0036 0.0043 0.0010 989 VAL 132 N -0.0079 0.0014 0.0024 990 VAL 132 CA -0.0090 0.0004 0.0025 991 VAL 132 C -0.0099 0.0012 0.0040 992 VAL 132 O -0.0101 0.0011 0.0042 993 VAL 132 CB -0.0100 -0.0009 0.0023 994 VAL 132 CG1 -0.0114 -0.0021 0.0026 995 VAL 132 CG2 -0.0093 -0.0020 0.0007 996 SER 133 N -0.0172 0.0019 0.0123 997 SER 133 CA -0.0184 0.0036 0.0137 998 SER 133 C -0.0169 0.0059 0.0131 999 SER 133 O -0.0174 0.0061 0.0136 1000 SER 133 CB -0.0199 0.0047 0.0152 1001 SER 133 OG -0.0216 0.0027 0.0160 1002 THR 134 N -0.0151 0.0071 0.0120 1003 THR 134 CA -0.0138 0.0090 0.0114 1004 THR 134 C -0.0127 0.0080 0.0103 1005 THR 134 O -0.0124 0.0091 0.0103 1006 THR 134 CB -0.0123 0.0103 0.0106 1007 THR 134 OG1 -0.0129 0.0118 0.0114 1008 THR 134 CG2 -0.0102 0.0122 0.0094 1009 VAL 135 N -0.0119 0.0056 0.0090 1010 VAL 135 CA -0.0108 0.0044 0.0078 1011 VAL 135 C -0.0126 0.0032 0.0089 1012 VAL 135 O -0.0120 0.0039 0.0086 1013 VAL 135 CB -0.0098 0.0018 0.0063 1014 VAL 135 CG1 -0.0093 -0.0000 0.0054 1015 VAL 135 CG2 -0.0080 0.0027 0.0051 1016 LEU 136 N -0.0140 0.0023 0.0093 1017 LEU 136 CA -0.0139 0.0018 0.0095 1018 LEU 136 C -0.0143 0.0044 0.0081 1019 LEU 136 O -0.0137 0.0040 0.0079 1020 LEU 136 CB -0.0154 -0.0001 0.0119 1021 LEU 136 CG -0.0142 -0.0033 0.0132 1022 LEU 136 CD1 -0.0165 -0.0043 0.0154 1023 LEU 136 CD2 -0.0113 -0.0046 0.0122 1024 THR 137 N -0.0158 0.0065 0.0077 1025 THR 137 CA -0.0170 0.0092 0.0065 1026 THR 137 C -0.0152 0.0107 0.0044 1027 THR 137 O -0.0157 0.0130 0.0031 1028 THR 137 CB -0.0204 0.0111 0.0075 1029 THR 137 OG1 -0.0213 0.0092 0.0094 1030 THR 137 CG2 -0.0206 0.0103 0.0083 1031 SER 138 N -0.0133 0.0100 0.0036 1032 SER 138 CA -0.0116 0.0114 0.0015 1033 SER 138 C -0.0098 0.0126 -0.0005 1034 SER 138 O -0.0099 0.0148 -0.0020 1035 SER 138 CB -0.0083 0.0088 0.0011 1036 SER 138 OG -0.0104 0.0106 0.0012 1037 LYS 139 N -0.0054 0.0082 -0.0038 1038 LYS 139 CA -0.0051 0.0091 -0.0035 1039 LYS 139 C -0.0059 0.0097 -0.0037 1040 LYS 139 O -0.0059 0.0104 -0.0036 1041 LYS 139 CB -0.0049 0.0090 -0.0034 1042 LYS 139 CG -0.0042 0.0084 -0.0032 1043 LYS 139 CD -0.0040 0.0081 -0.0032 1044 LYS 139 CE -0.0033 0.0077 -0.0029 1045 LYS 139 NZ -0.0034 0.0073 -0.0031 1046 TYR 140 N -0.0065 0.0096 -0.0040 1047 TYR 140 CA -0.0072 0.0102 -0.0042 1048 TYR 140 C -0.0071 0.0111 -0.0040 1049 TYR 140 O -0.0076 0.0118 -0.0040 1050 TYR 140 CB -0.0080 0.0098 -0.0046 1051 TYR 140 CG -0.0085 0.0093 -0.0049 1052 TYR 140 CD1 -0.0095 0.0093 -0.0053 1053 TYR 140 CD2 -0.0083 0.0086 -0.0049 1054 TYR 140 CE1 -0.0100 0.0088 -0.0056 1055 TYR 140 CE2 -0.0090 0.0081 -0.0053 1056 TYR 140 CZ -0.0098 0.0082 -0.0057 1057 TYR 140 OH -0.0103 0.0077 -0.0059 1058 ARG 141 N -0.0065 0.0112 -0.0037 1059 ARG 141 CA -0.0062 0.0120 -0.0034 1060 ARG 141 C -0.0052 0.0119 -0.0030 1061 ARG 141 O -0.0049 0.0112 -0.0030 1062 ARG 141 CB -0.0069 0.0123 -0.0036 1063 ARG 141 CG -0.0068 0.0116 -0.0037 1064 ARG 141 CD -0.0074 0.0121 -0.0039 1065 ARG 141 NE -0.0073 0.0114 -0.0040 1066 ARG 141 CZ -0.0076 0.0117 -0.0041 1067 ARG 141 NH1 -0.0081 0.0124 -0.0042 1068 ARG 141 NH2 -0.0075 0.0110 -0.0042 1069 ARG 141 OXT -0.0051 0.0127 -0.0028 1070 VAL 1 N 0.0063 0.0003 0.0004 1071 VAL 1 CA 0.0064 0.0026 0.0012 1072 VAL 1 C 0.0047 0.0037 -0.0006 1073 VAL 1 O 0.0036 0.0032 -0.0022 1074 VAL 1 CB 0.0078 0.0024 0.0028 1075 VAL 1 CG1 0.0086 0.0045 0.0045 1076 VAL 1 CG2 0.0080 0.0008 0.0026 1077 HIS 2 N 0.0049 0.0047 0.0000 1078 HIS 2 CA 0.0038 0.0051 -0.0013 1079 HIS 2 C 0.0042 0.0052 -0.0008 1080 HIS 2 O 0.0049 0.0065 0.0005 1081 HIS 2 CB 0.0037 0.0081 -0.0005 1082 HIS 2 CG 0.0033 0.0090 -0.0008 1083 HIS 2 ND1 0.0041 0.0102 0.0006 1084 HIS 2 CD2 0.0013 0.0090 -0.0033 1085 HIS 2 CE1 0.0021 0.0109 -0.0017 1086 HIS 2 NE2 0.0008 0.0099 -0.0036 1087 LEU 3 N 0.0038 0.0038 -0.0016 1088 LEU 3 CA 0.0038 0.0038 -0.0017 1089 LEU 3 C 0.0023 0.0038 -0.0035 1090 LEU 3 O 0.0014 0.0036 -0.0047 1091 LEU 3 CB 0.0045 0.0011 -0.0016 1092 LEU 3 CG 0.0060 0.0005 0.0001 1093 LEU 3 CD1 0.0064 -0.0015 -0.0000 1094 LEU 3 CD2 0.0067 0.0010 0.0010 1095 THR 4 N 0.0017 0.0033 -0.0025 1096 THR 4 CA -0.0012 0.0013 -0.0024 1097 THR 4 C -0.0025 -0.0011 -0.0023 1098 THR 4 O -0.0007 -0.0028 -0.0022 1099 THR 4 CB 0.0005 0.0012 -0.0024 1100 THR 4 OG1 0.0026 -0.0016 -0.0022 1101 THR 4 CG2 0.0022 0.0035 -0.0025 1102 PRO 5 N -0.0051 -0.0030 -0.0023 1103 PRO 5 CA -0.0069 -0.0050 -0.0022 1104 PRO 5 C -0.0042 -0.0084 -0.0019 1105 PRO 5 O -0.0043 -0.0104 -0.0018 1106 PRO 5 CB -0.0100 -0.0064 -0.0022 1107 PRO 5 CG -0.0106 -0.0031 -0.0024 1108 PRO 5 CD -0.0084 -0.0007 -0.0025 1109 GLU 6 N -0.0027 -0.0081 -0.0019 1110 GLU 6 CA -0.0012 -0.0109 -0.0017 1111 GLU 6 C 0.0023 -0.0107 -0.0016 1112 GLU 6 O 0.0036 -0.0139 -0.0014 1113 GLU 6 CB 0.0008 -0.0107 -0.0017 1114 GLU 6 CG 0.0015 -0.0089 -0.0018 1115 GLU 6 CD -0.0021 -0.0058 -0.0020 1116 GLU 6 OE1 -0.0055 -0.0079 -0.0020 1117 GLU 6 OE2 -0.0027 -0.0037 -0.0022 1118 GLU 7 N 0.0022 -0.0045 -0.0012 1119 GLU 7 CA 0.0035 -0.0048 0.0002 1120 GLU 7 C 0.0036 -0.0065 -0.0005 1121 GLU 7 O 0.0045 -0.0075 0.0001 1122 GLU 7 CB 0.0036 -0.0039 0.0007 1123 GLU 7 CG 0.0038 -0.0022 0.0016 1124 GLU 7 CD 0.0043 -0.0014 0.0025 1125 GLU 7 OE1 0.0049 -0.0007 0.0035 1126 GLU 7 OE2 0.0038 -0.0008 0.0023 1127 LYS 8 N 0.0030 -0.0065 -0.0011 1128 LYS 8 CA 0.0031 -0.0078 -0.0015 1129 LYS 8 C 0.0031 -0.0091 -0.0021 1130 LYS 8 O 0.0038 -0.0107 -0.0020 1131 LYS 8 CB 0.0021 -0.0074 -0.0025 1132 LYS 8 CG 0.0021 -0.0083 -0.0029 1133 LYS 8 CD 0.0013 -0.0091 -0.0040 1134 LYS 8 CE 0.0014 -0.0105 -0.0046 1135 LYS 8 NZ -0.0003 -0.0109 -0.0065 1136 SER 9 N 0.0023 -0.0091 -0.0030 1137 SER 9 CA 0.0022 -0.0100 -0.0035 1138 SER 9 C 0.0033 -0.0110 -0.0027 1139 SER 9 O 0.0037 -0.0123 -0.0028 1140 SER 9 CB 0.0008 -0.0100 -0.0050 1141 SER 9 OG 0.0014 -0.0096 -0.0042 1142 ALA 10 N -0.0013 -0.0067 0.0004 1143 ALA 10 CA -0.0008 -0.0071 0.0008 1144 ALA 10 C 0.0005 -0.0080 0.0017 1145 ALA 10 O 0.0011 -0.0089 0.0017 1146 ALA 10 CB -0.0008 -0.0060 0.0019 1147 VAL 11 N 0.0008 -0.0079 0.0023 1148 VAL 11 CA 0.0018 -0.0087 0.0029 1149 VAL 11 C 0.0021 -0.0100 0.0019 1150 VAL 11 O 0.0029 -0.0109 0.0022 1151 VAL 11 CB 0.0018 -0.0082 0.0035 1152 VAL 11 CG1 0.0028 -0.0091 0.0039 1153 VAL 11 CG2 0.0019 -0.0071 0.0047 1154 THR 12 N 0.0015 -0.0100 0.0010 1155 THR 12 CA 0.0016 -0.0112 -0.0000 1156 THR 12 C 0.0017 -0.0119 -0.0006 1157 THR 12 O 0.0023 -0.0130 -0.0008 1158 THR 12 CB 0.0007 -0.0110 -0.0012 1159 THR 12 OG1 0.0009 -0.0107 -0.0005 1160 THR 12 CG2 0.0004 -0.0111 -0.0015 1161 ALA 13 N -0.0006 -0.0098 0.0004 1162 ALA 13 CA -0.0008 -0.0099 -0.0010 1163 ALA 13 C -0.0002 -0.0102 -0.0011 1164 ALA 13 O 0.0008 -0.0108 -0.0021 1165 ALA 13 CB -0.0029 -0.0090 -0.0015 1166 LEU 14 N -0.0004 -0.0098 0.0005 1167 LEU 14 CA 0.0006 -0.0103 0.0008 1168 LEU 14 C 0.0024 -0.0111 0.0008 1169 LEU 14 O 0.0034 -0.0116 0.0005 1170 LEU 14 CB -0.0003 -0.0095 0.0026 1171 LEU 14 CG -0.0000 -0.0096 0.0028 1172 LEU 14 CD1 -0.0006 -0.0096 0.0013 1173 LEU 14 CD2 0.0000 -0.0093 0.0049 1174 TRP 15 N 0.0030 -0.0112 0.0021 1175 TRP 15 CA 0.0049 -0.0120 0.0024 1176 TRP 15 C 0.0058 -0.0127 0.0005 1177 TRP 15 O 0.0073 -0.0133 0.0007 1178 TRP 15 CB 0.0052 -0.0119 0.0037 1179 TRP 15 CG 0.0072 -0.0127 0.0045 1180 TRP 15 CD1 0.0085 -0.0133 0.0042 1181 TRP 15 CD2 0.0077 -0.0126 0.0060 1182 TRP 15 NE1 0.0099 -0.0138 0.0052 1183 TRP 15 CE2 0.0096 -0.0134 0.0064 1184 TRP 15 CE3 0.0069 -0.0121 0.0070 1185 TRP 15 CZ2 0.0105 -0.0136 0.0078 1186 TRP 15 CZ3 0.0079 -0.0124 0.0083 1187 TRP 15 CH2 0.0096 -0.0131 0.0087 1188 GLY 16 N 0.0050 -0.0138 -0.0015 1189 GLY 16 CA 0.0061 -0.0148 -0.0044 1190 GLY 16 C 0.0066 -0.0151 -0.0055 1191 GLY 16 O 0.0082 -0.0162 -0.0074 1192 LYS 17 N 0.0056 -0.0146 -0.0046 1193 LYS 17 CA 0.0059 -0.0148 -0.0055 1194 LYS 17 C 0.0076 -0.0154 -0.0038 1195 LYS 17 O 0.0084 -0.0159 -0.0046 1196 LYS 17 CB 0.0037 -0.0138 -0.0055 1197 LYS 17 CG 0.0015 -0.0130 -0.0074 1198 LYS 17 CD -0.0006 -0.0120 -0.0078 1199 LYS 17 CE -0.0032 -0.0110 -0.0093 1200 LYS 17 NZ -0.0044 -0.0105 -0.0096 1201 VAL 18 N 0.0090 -0.0158 -0.0017 1202 VAL 18 CA 0.0106 -0.0162 0.0004 1203 VAL 18 C 0.0134 -0.0177 -0.0005 1204 VAL 18 O 0.0145 -0.0183 -0.0011 1205 VAL 18 CB 0.0107 -0.0159 0.0031 1206 VAL 18 CG1 0.0126 -0.0166 0.0049 1207 VAL 18 CG2 0.0080 -0.0145 0.0041 1208 ASN 19 N 0.0083 -0.0256 0.0128 1209 ASN 19 CA 0.0067 -0.0237 0.0131 1210 ASN 19 C 0.0068 -0.0214 0.0107 1211 ASN 19 O 0.0084 -0.0214 0.0086 1212 ASN 19 CB 0.0076 -0.0244 0.0126 1213 ASN 19 CG 0.0063 -0.0223 0.0121 1214 ASN 19 OD1 0.0051 -0.0204 0.0119 1215 ASN 19 ND2 0.0065 -0.0236 0.0132 1216 VAL 20 N 0.0052 -0.0198 0.0112 1217 VAL 20 CA 0.0051 -0.0177 0.0092 1218 VAL 20 C 0.0052 -0.0164 0.0078 1219 VAL 20 O 0.0065 -0.0155 0.0053 1220 VAL 20 CB 0.0030 -0.0163 0.0105 1221 VAL 20 CG1 0.0031 -0.0142 0.0084 1222 VAL 20 CG2 0.0033 -0.0178 0.0117 1223 ASP 21 N 0.0046 -0.0160 0.0081 1224 ASP 21 CA 0.0046 -0.0144 0.0066 1225 ASP 21 C 0.0067 -0.0158 0.0054 1226 ASP 21 O 0.0076 -0.0147 0.0031 1227 ASP 21 CB 0.0031 -0.0142 0.0083 1228 ASP 21 CG 0.0003 -0.0119 0.0097 1229 ASP 21 OD1 0.0004 -0.0107 0.0084 1230 ASP 21 OD2 -0.0005 -0.0115 0.0103 1231 GLU 22 N 0.0055 -0.0180 0.0021 1232 GLU 22 CA 0.0081 -0.0191 0.0015 1233 GLU 22 C 0.0091 -0.0175 0.0010 1234 GLU 22 O 0.0110 -0.0167 0.0004 1235 GLU 22 CB 0.0075 -0.0215 0.0019 1236 GLU 22 CG 0.0094 -0.0225 0.0014 1237 GLU 22 CD 0.0106 -0.0249 0.0013 1238 GLU 22 OE1 0.0079 -0.0254 0.0021 1239 GLU 22 OE2 0.0086 -0.0271 0.0020 1240 VAL 23 N 0.0075 -0.0172 0.0015 1241 VAL 23 CA 0.0082 -0.0158 0.0012 1242 VAL 23 C 0.0086 -0.0130 0.0008 1243 VAL 23 O 0.0104 -0.0119 0.0002 1244 VAL 23 CB 0.0063 -0.0159 0.0017 1245 VAL 23 CG1 0.0068 -0.0140 0.0014 1246 VAL 23 CG2 0.0066 -0.0187 0.0018 1247 GLY 24 N 0.0073 -0.0121 0.0011 1248 GLY 24 CA 0.0078 -0.0098 0.0008 1249 GLY 24 C 0.0101 -0.0093 0.0001 1250 GLY 24 O 0.0116 -0.0078 -0.0005 1251 GLY 25 N 0.0065 -0.0085 -0.0013 1252 GLY 25 CA 0.0067 -0.0087 -0.0010 1253 GLY 25 C 0.0064 -0.0083 -0.0006 1254 GLY 25 O 0.0065 -0.0083 -0.0001 1255 GLU 26 N 0.0061 -0.0079 -0.0008 1256 GLU 26 CA 0.0058 -0.0076 -0.0006 1257 GLU 26 C 0.0057 -0.0073 -0.0001 1258 GLU 26 O 0.0057 -0.0072 0.0003 1259 GLU 26 CB 0.0056 -0.0073 -0.0010 1260 GLU 26 CG 0.0054 -0.0070 -0.0007 1261 GLU 26 CD 0.0052 -0.0068 -0.0005 1262 GLU 26 OE1 0.0046 -0.0060 -0.0009 1263 GLU 26 OE2 0.0051 -0.0068 -0.0014 1264 ALA 27 N 0.0057 -0.0073 -0.0003 1265 ALA 27 CA 0.0055 -0.0070 0.0001 1266 ALA 27 C 0.0057 -0.0073 0.0006 1267 ALA 27 O 0.0057 -0.0071 0.0010 1268 ALA 27 CB 0.0054 -0.0069 -0.0002 1269 LEU 28 N 0.0008 -0.0042 -0.0049 1270 LEU 28 CA 0.0005 -0.0047 -0.0048 1271 LEU 28 C -0.0001 -0.0046 -0.0045 1272 LEU 28 O -0.0005 -0.0050 -0.0043 1273 LEU 28 CB 0.0007 -0.0051 -0.0050 1274 LEU 28 CG 0.0003 -0.0058 -0.0049 1275 LEU 28 CD1 0.0005 -0.0062 -0.0052 1276 LEU 28 CD2 0.0005 -0.0060 -0.0051 1277 GLY 29 N -0.0003 -0.0041 -0.0043 1278 GLY 29 CA -0.0009 -0.0040 -0.0039 1279 GLY 29 C -0.0011 -0.0038 -0.0038 1280 GLY 29 O -0.0016 -0.0041 -0.0036 1281 ARG 30 N -0.0008 -0.0034 -0.0039 1282 ARG 30 CA -0.0010 -0.0033 -0.0037 1283 ARG 30 C -0.0010 -0.0040 -0.0038 1284 ARG 30 O -0.0014 -0.0040 -0.0036 1285 ARG 30 CB -0.0006 -0.0028 -0.0038 1286 ARG 30 CG -0.0008 -0.0020 -0.0036 1287 ARG 30 CD -0.0003 -0.0016 -0.0038 1288 ARG 30 NE -0.0003 -0.0010 -0.0037 1289 ARG 30 CZ -0.0006 -0.0005 -0.0034 1290 ARG 30 NH1 -0.0008 -0.0005 -0.0033 1291 ARG 30 NH2 -0.0006 0.0001 -0.0033 1292 LEU 31 N -0.0009 -0.0020 0.0013 1293 LEU 31 CA -0.0009 -0.0020 0.0016 1294 LEU 31 C -0.0008 -0.0017 0.0009 1295 LEU 31 O -0.0009 -0.0019 0.0007 1296 LEU 31 CB -0.0007 -0.0018 0.0024 1297 LEU 31 CG -0.0006 -0.0017 0.0027 1298 LEU 31 CD1 -0.0009 -0.0025 0.0029 1299 LEU 31 CD2 -0.0003 -0.0012 0.0034 1300 LEU 32 N -0.0005 -0.0011 0.0007 1301 LEU 32 CA -0.0003 -0.0006 0.0003 1302 LEU 32 C -0.0005 -0.0009 -0.0006 1303 LEU 32 O -0.0005 -0.0007 -0.0011 1304 LEU 32 CB 0.0001 0.0002 0.0002 1305 LEU 32 CG 0.0003 0.0006 0.0008 1306 LEU 32 CD1 0.0003 0.0004 0.0015 1307 LEU 32 CD2 0.0006 0.0013 0.0008 1308 VAL 33 N -0.0007 -0.0012 -0.0009 1309 VAL 33 CA -0.0009 -0.0015 -0.0016 1310 VAL 33 C -0.0013 -0.0023 -0.0016 1311 VAL 33 O -0.0014 -0.0024 -0.0022 1312 VAL 33 CB -0.0010 -0.0017 -0.0019 1313 VAL 33 CG1 -0.0013 -0.0021 -0.0027 1314 VAL 33 CG2 -0.0007 -0.0010 -0.0021 1315 VAL 34 N 0.0026 -0.0015 -0.0011 1316 VAL 34 CA 0.0017 -0.0012 -0.0005 1317 VAL 34 C 0.0020 0.0002 0.0009 1318 VAL 34 O 0.0022 0.0005 0.0011 1319 VAL 34 CB -0.0002 -0.0016 -0.0005 1320 VAL 34 CG1 -0.0013 -0.0013 0.0000 1321 VAL 34 CG2 -0.0005 -0.0029 -0.0018 1322 TYR 35 N 0.0024 0.0009 0.0016 1323 TYR 35 CA 0.0027 0.0023 0.0030 1324 TYR 35 C 0.0045 0.0028 0.0031 1325 TYR 35 O 0.0043 0.0032 0.0036 1326 TYR 35 CB 0.0013 0.0028 0.0039 1327 TYR 35 CG -0.0004 0.0022 0.0038 1328 TYR 35 CD1 -0.0010 0.0024 0.0041 1329 TYR 35 CD2 -0.0018 0.0015 0.0033 1330 TYR 35 CE1 -0.0026 0.0019 0.0039 1331 TYR 35 CE2 -0.0031 0.0009 0.0030 1332 TYR 35 CZ -0.0037 0.0011 0.0034 1333 TYR 35 OH -0.0053 0.0004 0.0030 1334 PRO 36 N 0.0058 0.0026 0.0026 1335 PRO 36 CA 0.0075 0.0028 0.0024 1336 PRO 36 C 0.0080 0.0041 0.0037 1337 PRO 36 O 0.0091 0.0044 0.0036 1338 PRO 36 CB 0.0089 0.0025 0.0017 1339 PRO 36 CG 0.0081 0.0022 0.0015 1340 PRO 36 CD 0.0062 0.0022 0.0020 1341 TRP 37 N 0.0074 0.0054 0.0044 1342 TRP 37 CA 0.0068 0.0065 0.0040 1343 TRP 37 C 0.0053 0.0066 0.0042 1344 TRP 37 O 0.0046 0.0075 0.0039 1345 TRP 37 CB 0.0074 0.0074 0.0034 1346 TRP 37 CG 0.0073 0.0072 0.0035 1347 TRP 37 CD1 0.0063 0.0078 0.0034 1348 TRP 37 CD2 0.0082 0.0066 0.0036 1349 TRP 37 NE1 0.0066 0.0073 0.0036 1350 TRP 37 CE2 0.0077 0.0067 0.0037 1351 TRP 37 CE3 0.0094 0.0057 0.0038 1352 TRP 37 CZ2 0.0083 0.0061 0.0039 1353 TRP 37 CZ3 0.0099 0.0054 0.0039 1354 TRP 37 CH2 0.0094 0.0055 0.0039 1355 THR 38 N 0.0047 0.0058 0.0048 1356 THR 38 CA 0.0033 0.0056 0.0051 1357 THR 38 C 0.0028 0.0055 0.0053 1358 THR 38 O 0.0015 0.0055 0.0055 1359 THR 38 CB 0.0027 0.0048 0.0057 1360 THR 38 OG1 0.0034 0.0037 0.0060 1361 THR 38 CG2 0.0033 0.0051 0.0054 1362 GLN 39 N 0.0036 0.0050 0.0054 1363 GLN 39 CA 0.0034 0.0047 0.0055 1364 GLN 39 C 0.0029 0.0058 0.0051 1365 GLN 39 O 0.0022 0.0057 0.0053 1366 GLN 39 CB 0.0045 0.0040 0.0057 1367 GLN 39 CG 0.0049 0.0029 0.0062 1368 GLN 39 CD 0.0061 0.0022 0.0063 1369 GLN 39 OE1 0.0063 0.0026 0.0060 1370 GLN 39 NE2 0.0067 0.0012 0.0066 1371 ARG 40 N -0.0038 0.0049 0.0017 1372 ARG 40 CA -0.0039 0.0050 0.0015 1373 ARG 40 C -0.0050 0.0043 0.0007 1374 ARG 40 O -0.0049 0.0040 0.0008 1375 ARG 40 CB -0.0038 0.0063 0.0013 1376 ARG 40 CG -0.0046 0.0069 0.0004 1377 ARG 40 CD -0.0043 0.0084 0.0004 1378 ARG 40 NE -0.0040 0.0087 0.0005 1379 ARG 40 CZ -0.0045 0.0088 -0.0000 1380 ARG 40 NH1 -0.0053 0.0087 -0.0007 1381 ARG 40 NH2 -0.0038 0.0093 0.0005 1382 PHE 41 N -0.0056 0.0041 0.0002 1383 PHE 41 CA -0.0065 0.0037 -0.0006 1384 PHE 41 C -0.0067 0.0021 -0.0003 1385 PHE 41 O -0.0074 0.0018 -0.0009 1386 PHE 41 CB -0.0072 0.0041 -0.0012 1387 PHE 41 CG -0.0071 0.0054 -0.0015 1388 PHE 41 CD1 -0.0066 0.0061 -0.0012 1389 PHE 41 CD2 -0.0075 0.0060 -0.0020 1390 PHE 41 CE1 -0.0066 0.0074 -0.0015 1391 PHE 41 CE2 -0.0073 0.0073 -0.0021 1392 PHE 41 CZ -0.0068 0.0079 -0.0018 1393 PHE 42 N -0.0061 0.0018 0.0003 1394 PHE 42 CA -0.0062 0.0007 0.0005 1395 PHE 42 C -0.0056 -0.0002 0.0012 1396 PHE 42 O -0.0055 -0.0011 0.0016 1397 PHE 42 CB -0.0061 0.0006 0.0006 1398 PHE 42 CG -0.0068 0.0012 -0.0002 1399 PHE 42 CD1 -0.0065 0.0024 -0.0002 1400 PHE 42 CD2 -0.0078 0.0009 -0.0010 1401 PHE 42 CE1 -0.0073 0.0029 -0.0011 1402 PHE 42 CE2 -0.0084 0.0016 -0.0017 1403 PHE 42 CZ -0.0081 0.0027 -0.0017 1404 GLU 43 N -0.0158 -0.0012 0.0022 1405 GLU 43 CA -0.0168 -0.0017 0.0037 1406 GLU 43 C -0.0155 -0.0036 0.0031 1407 GLU 43 O -0.0156 -0.0032 0.0030 1408 GLU 43 CB -0.0174 -0.0031 0.0052 1409 GLU 43 CG -0.0168 -0.0060 0.0059 1410 GLU 43 CD -0.0193 -0.0072 0.0097 1411 GLU 43 OE1 -0.0201 -0.0059 0.0100 1412 GLU 43 OE2 -0.0175 -0.0094 0.0086 1413 SER 44 N -0.0136 -0.0042 0.0010 1414 SER 44 CA -0.0122 -0.0050 -0.0003 1415 SER 44 C -0.0130 -0.0030 -0.0004 1416 SER 44 O -0.0114 -0.0028 -0.0025 1417 SER 44 CB -0.0105 -0.0059 -0.0019 1418 SER 44 OG -0.0093 -0.0055 -0.0036 1419 PHE 45 N -0.0131 -0.0003 -0.0016 1420 PHE 45 CA -0.0131 0.0020 -0.0029 1421 PHE 45 C -0.0144 0.0026 -0.0016 1422 PHE 45 O -0.0145 0.0047 -0.0026 1423 PHE 45 CB -0.0135 0.0040 -0.0035 1424 PHE 45 CG -0.0117 0.0039 -0.0056 1425 PHE 45 CD1 -0.0121 0.0061 -0.0064 1426 PHE 45 CD2 -0.0106 0.0024 -0.0062 1427 PHE 45 CE1 -0.0104 0.0058 -0.0083 1428 PHE 45 CE2 -0.0090 0.0016 -0.0077 1429 PHE 45 CZ -0.0094 0.0040 -0.0086 1430 GLY 46 N -0.0096 0.0035 0.0009 1431 GLY 46 CA -0.0056 -0.0007 0.0023 1432 GLY 46 C -0.0012 -0.0000 0.0039 1433 GLY 46 O 0.0001 0.0062 0.0044 1434 ASP 47 N -0.0003 -0.0041 0.0041 1435 ASP 47 CA 0.0053 -0.0034 0.0061 1436 ASP 47 C 0.0026 -0.0017 0.0052 1437 ASP 47 O -0.0021 -0.0038 0.0035 1438 ASP 47 CB 0.0058 -0.0103 0.0063 1439 ASP 47 CG 0.0112 -0.0108 0.0082 1440 ASP 47 OD1 0.0127 -0.0153 0.0087 1441 ASP 47 OD2 0.0147 -0.0045 0.0095 1442 LEU 48 N 0.0047 0.0046 0.0060 1443 LEU 48 CA 0.0034 0.0086 0.0056 1444 LEU 48 C 0.0090 0.0091 0.0076 1445 LEU 48 O 0.0091 0.0131 0.0076 1446 LEU 48 CB -0.0000 0.0133 0.0044 1447 LEU 48 CG -0.0057 0.0122 0.0024 1448 LEU 48 CD1 -0.0086 0.0185 0.0014 1449 LEU 48 CD2 -0.0097 0.0090 0.0009 1450 SER 49 N 0.0234 0.0099 0.0184 1451 SER 49 CA 0.0244 0.0139 0.0246 1452 SER 49 C 0.0224 0.0103 0.0184 1453 SER 49 O 0.0188 0.0162 0.0247 1454 SER 49 CB 0.0367 0.0085 0.0241 1455 SER 49 OG 0.0358 0.0015 0.0136 1456 THR 50 N 0.0150 0.0092 0.0125 1457 THR 50 CA 0.0082 0.0091 0.0084 1458 THR 50 C -0.0015 0.0093 0.0030 1459 THR 50 O -0.0006 0.0076 0.0012 1460 THR 50 CB 0.0134 0.0041 0.0044 1461 THR 50 OG1 0.0129 -0.0018 -0.0043 1462 THR 50 CG2 0.0226 0.0019 0.0066 1463 PRO 51 N -0.0082 0.0100 0.0000 1464 PRO 51 CA -0.0169 0.0109 -0.0037 1465 PRO 51 C -0.0160 0.0049 -0.0117 1466 PRO 51 O -0.0185 0.0035 -0.0151 1467 PRO 51 CB -0.0236 0.0125 -0.0054 1468 PRO 51 CG -0.0203 0.0167 0.0025 1469 PRO 51 CD -0.0104 0.0137 0.0041 1470 ASP 52 N -0.0098 0.0003 -0.0167 1471 ASP 52 CA -0.0083 -0.0014 -0.0206 1472 ASP 52 C -0.0047 -0.0007 -0.0191 1473 ASP 52 O -0.0044 -0.0013 -0.0206 1474 ASP 52 CB -0.0060 -0.0029 -0.0243 1475 ASP 52 CG -0.0108 -0.0047 -0.0283 1476 ASP 52 OD1 -0.0145 -0.0043 -0.0275 1477 ASP 52 OD2 -0.0105 -0.0047 -0.0283 1478 ALA 53 N -0.0011 0.0006 -0.0160 1479 ALA 53 CA 0.0029 0.0014 -0.0142 1480 ALA 53 C 0.0010 0.0024 -0.0120 1481 ALA 53 O 0.0016 0.0025 -0.0116 1482 ALA 53 CB 0.0063 0.0026 -0.0115 1483 VAL 54 N -0.0032 0.0037 -0.0089 1484 VAL 54 CA -0.0061 0.0048 -0.0063 1485 VAL 54 C -0.0085 0.0036 -0.0091 1486 VAL 54 O -0.0084 0.0038 -0.0087 1487 VAL 54 CB -0.0097 0.0065 -0.0023 1488 VAL 54 CG1 -0.0131 0.0073 -0.0006 1489 VAL 54 CG2 -0.0072 0.0078 0.0007 1490 MET 55 N -0.0100 0.0019 -0.0101 1491 MET 55 CA -0.0090 0.0022 -0.0091 1492 MET 55 C -0.0094 0.0033 -0.0081 1493 MET 55 O -0.0085 0.0034 -0.0074 1494 MET 55 CB -0.0083 0.0021 -0.0086 1495 MET 55 CG -0.0077 0.0010 -0.0094 1496 MET 55 SD -0.0065 -0.0000 -0.0097 1497 MET 55 CE -0.0053 0.0002 -0.0085 1498 GLY 56 N -0.0106 0.0039 -0.0083 1499 GLY 56 CA -0.0110 0.0050 -0.0074 1500 GLY 56 C -0.0120 0.0052 -0.0079 1501 GLY 56 O -0.0123 0.0060 -0.0072 1502 ASN 57 N -0.0119 0.0045 -0.0086 1503 ASN 57 CA -0.0126 0.0045 -0.0091 1504 ASN 57 C -0.0119 0.0046 -0.0085 1505 ASN 57 O -0.0107 0.0040 -0.0083 1506 ASN 57 CB -0.0129 0.0036 -0.0103 1507 ASN 57 CG -0.0135 0.0036 -0.0108 1508 ASN 57 OD1 -0.0133 0.0038 -0.0105 1509 ASN 57 ND2 -0.0145 0.0035 -0.0117 1510 PRO 58 N -0.0141 0.0101 -0.0053 1511 PRO 58 CA -0.0127 0.0102 -0.0050 1512 PRO 58 C -0.0116 0.0086 -0.0057 1513 PRO 58 O -0.0100 0.0087 -0.0054 1514 PRO 58 CB -0.0137 0.0116 -0.0044 1515 PRO 58 CG -0.0153 0.0115 -0.0046 1516 PRO 58 CD -0.0163 0.0111 -0.0050 1517 LYS 59 N -0.0129 0.0074 -0.0066 1518 LYS 59 CA -0.0122 0.0057 -0.0074 1519 LYS 59 C -0.0109 0.0047 -0.0078 1520 LYS 59 O -0.0092 0.0041 -0.0079 1521 LYS 59 CB -0.0136 0.0048 -0.0081 1522 LYS 59 CG -0.0143 0.0052 -0.0080 1523 LYS 59 CD -0.0157 0.0057 -0.0079 1524 LYS 59 CE -0.0159 0.0062 -0.0076 1525 LYS 59 NZ -0.0183 0.0053 -0.0084 1526 VAL 60 N -0.0114 0.0051 -0.0076 1527 VAL 60 CA -0.0103 0.0044 -0.0079 1528 VAL 60 C -0.0084 0.0050 -0.0073 1529 VAL 60 O -0.0066 0.0044 -0.0074 1530 VAL 60 CB -0.0111 0.0044 -0.0080 1531 VAL 60 CG1 -0.0096 0.0043 -0.0079 1532 VAL 60 CG2 -0.0129 0.0035 -0.0087 1533 LYS 61 N -0.0070 0.0050 -0.0081 1534 LYS 61 CA -0.0059 0.0046 -0.0053 1535 LYS 61 C -0.0061 0.0056 -0.0034 1536 LYS 61 O -0.0048 0.0044 -0.0021 1537 LYS 61 CB -0.0066 0.0061 -0.0037 1538 LYS 61 CG -0.0062 0.0053 -0.0044 1539 LYS 61 CD -0.0075 0.0074 -0.0031 1540 LYS 61 CE -0.0057 0.0053 -0.0027 1541 LYS 61 NZ -0.0071 0.0074 -0.0018 1542 ALA 62 N -0.0077 0.0074 -0.0039 1543 ALA 62 CA -0.0079 0.0082 -0.0024 1544 ALA 62 C -0.0069 0.0065 -0.0035 1545 ALA 62 O -0.0063 0.0064 -0.0020 1546 ALA 62 CB -0.0100 0.0106 -0.0032 1547 HIS 63 N -0.0075 0.0062 -0.0063 1548 HIS 63 CA -0.0064 0.0045 -0.0074 1549 HIS 63 C -0.0042 0.0020 -0.0063 1550 HIS 63 O -0.0033 0.0013 -0.0052 1551 HIS 63 CB -0.0069 0.0041 -0.0103 1552 HIS 63 CG -0.0066 0.0031 -0.0118 1553 HIS 63 ND1 -0.0069 0.0040 -0.0104 1554 HIS 63 CD2 -0.0051 0.0007 -0.0130 1555 HIS 63 CE1 -0.0059 0.0021 -0.0121 1556 HIS 63 NE2 -0.0051 0.0005 -0.0134 1557 GLY 64 N 0.0012 0.0005 -0.0090 1558 GLY 64 CA 0.0034 -0.0046 -0.0068 1559 GLY 64 C 0.0039 -0.0055 -0.0012 1560 GLY 64 O 0.0049 -0.0079 0.0016 1561 LYS 65 N 0.0023 -0.0018 0.0015 1562 LYS 65 CA 0.0021 -0.0011 0.0068 1563 LYS 65 C 0.0017 -0.0001 0.0092 1564 LYS 65 O 0.0024 -0.0017 0.0132 1565 LYS 65 CB 0.0004 0.0030 0.0098 1566 LYS 65 CG -0.0004 0.0048 0.0095 1567 LYS 65 CD -0.0024 0.0097 0.0138 1568 LYS 65 CE -0.0026 0.0104 0.0177 1569 LYS 65 NZ -0.0061 0.0185 0.0191 1570 LYS 66 N 0.0004 0.0028 0.0063 1571 LYS 66 CA -0.0001 0.0040 0.0080 1572 LYS 66 C 0.0017 -0.0003 0.0070 1573 LYS 66 O 0.0021 -0.0010 0.0105 1574 LYS 66 CB -0.0020 0.0085 0.0046 1575 LYS 66 CG -0.0027 0.0102 0.0051 1576 LYS 66 CD -0.0048 0.0150 0.0020 1577 LYS 66 CE -0.0063 0.0187 0.0101 1578 LYS 66 NZ -0.0082 0.0231 0.0067 1579 VAL 67 N 0.0013 -0.0025 0.0031 1580 VAL 67 CA 0.0028 -0.0042 0.0023 1581 VAL 67 C 0.0040 -0.0059 0.0042 1582 VAL 67 O 0.0044 -0.0066 0.0050 1583 VAL 67 CB 0.0035 -0.0047 -0.0004 1584 VAL 67 CG1 0.0053 -0.0068 -0.0010 1585 VAL 67 CG2 0.0023 -0.0030 -0.0022 1586 LEU 68 N 0.0044 -0.0066 0.0052 1587 LEU 68 CA 0.0056 -0.0082 0.0071 1588 LEU 68 C 0.0050 -0.0078 0.0096 1589 LEU 68 O 0.0060 -0.0092 0.0111 1590 LEU 68 CB 0.0064 -0.0092 0.0075 1591 LEU 68 CG 0.0082 -0.0114 0.0071 1592 LEU 68 CD1 0.0082 -0.0117 0.0098 1593 LEU 68 CD2 0.0091 -0.0121 0.0053 1594 GLY 69 N 0.0034 -0.0061 0.0105 1595 GLY 69 CA 0.0028 -0.0056 0.0125 1596 GLY 69 C 0.0028 -0.0056 0.0126 1597 GLY 69 O 0.0033 -0.0064 0.0140 1598 ALA 70 N -0.0001 -0.0024 0.0083 1599 ALA 70 CA -0.0000 -0.0021 0.0076 1600 ALA 70 C 0.0011 -0.0026 0.0075 1601 ALA 70 O 0.0012 -0.0027 0.0075 1602 ALA 70 CB -0.0002 -0.0016 0.0065 1603 PHE 71 N 0.0020 -0.0030 0.0073 1604 PHE 71 CA 0.0031 -0.0035 0.0073 1605 PHE 71 C 0.0031 -0.0041 0.0085 1606 PHE 71 O 0.0034 -0.0042 0.0084 1607 PHE 71 CB 0.0039 -0.0039 0.0072 1608 PHE 71 CG 0.0050 -0.0044 0.0071 1609 PHE 71 CD1 0.0057 -0.0043 0.0062 1610 PHE 71 CD2 0.0056 -0.0051 0.0082 1611 PHE 71 CE1 0.0069 -0.0048 0.0060 1612 PHE 71 CE2 0.0066 -0.0055 0.0079 1613 PHE 71 CZ 0.0073 -0.0054 0.0068 1614 SER 72 N 0.0027 -0.0042 0.0093 1615 SER 72 CA 0.0025 -0.0047 0.0106 1616 SER 72 C 0.0021 -0.0044 0.0105 1617 SER 72 O 0.0024 -0.0048 0.0109 1618 SER 72 CB 0.0022 -0.0049 0.0115 1619 SER 72 OG 0.0022 -0.0054 0.0126 1620 ASP 73 N 0.0005 -0.0029 0.0112 1621 ASP 73 CA -0.0013 -0.0023 0.0099 1622 ASP 73 C 0.0001 -0.0015 0.0082 1623 ASP 73 O -0.0000 -0.0011 0.0071 1624 ASP 73 CB -0.0044 -0.0020 0.0093 1625 ASP 73 CG -0.0062 -0.0031 0.0120 1626 ASP 73 OD1 -0.0053 -0.0043 0.0147 1627 ASP 73 OD2 -0.0079 -0.0029 0.0116 1628 GLY 74 N 0.0017 -0.0007 0.0062 1629 GLY 74 CA 0.0034 -0.0000 0.0045 1630 GLY 74 C 0.0054 -0.0001 0.0048 1631 GLY 74 O 0.0068 0.0003 0.0038 1632 LEU 75 N 0.0068 -0.0014 0.0077 1633 LEU 75 CA 0.0089 -0.0018 0.0085 1634 LEU 75 C 0.0077 -0.0019 0.0089 1635 LEU 75 O 0.0093 -0.0020 0.0090 1636 LEU 75 CB 0.0101 -0.0030 0.0112 1637 LEU 75 CG 0.0110 -0.0029 0.0112 1638 LEU 75 CD1 0.0125 -0.0041 0.0138 1639 LEU 75 CD2 0.0136 -0.0022 0.0094 1640 ALA 76 N 0.0093 0.0008 0.0072 1641 ALA 76 CA 0.0089 0.0009 0.0065 1642 ALA 76 C 0.0087 0.0014 0.0040 1643 ALA 76 O 0.0088 0.0016 0.0033 1644 ALA 76 CB 0.0065 -0.0001 0.0068 1645 HIS 77 N 0.0092 0.0020 0.0025 1646 HIS 77 CA 0.0089 0.0026 -0.0000 1647 HIS 77 C 0.0111 0.0035 -0.0005 1648 HIS 77 O 0.0110 0.0039 -0.0022 1649 HIS 77 CB 0.0072 0.0021 -0.0006 1650 HIS 77 CG 0.0050 0.0011 0.0002 1651 HIS 77 ND1 0.0035 0.0002 0.0019 1652 HIS 77 CD2 0.0045 0.0013 -0.0012 1653 HIS 77 CE1 0.0024 -0.0001 0.0015 1654 HIS 77 NE2 0.0026 0.0004 0.0001 1655 LEU 78 N 0.0129 0.0038 0.0004 1656 LEU 78 CA 0.0149 0.0046 0.0002 1657 LEU 78 C 0.0158 0.0055 -0.0022 1658 LEU 78 O 0.0163 0.0059 -0.0032 1659 LEU 78 CB 0.0170 0.0049 0.0016 1660 LEU 78 CG 0.0169 0.0043 0.0038 1661 LEU 78 CD1 0.0181 0.0042 0.0059 1662 LEU 78 CD2 0.0169 0.0043 0.0040 1663 ASP 79 N 0.0199 0.0078 -0.0042 1664 ASP 79 CA 0.0225 0.0063 -0.0071 1665 ASP 79 C 0.0195 0.0046 -0.0097 1666 ASP 79 O 0.0198 0.0035 -0.0118 1667 ASP 79 CB 0.0230 0.0068 -0.0063 1668 ASP 79 CG 0.0251 0.0081 -0.0044 1669 ASP 79 OD1 0.0262 0.0087 -0.0035 1670 ASP 79 OD2 0.0285 0.0083 -0.0044 1671 ASN 80 N 0.0157 0.0048 -0.0088 1672 ASN 80 CA 0.0127 0.0031 -0.0115 1673 ASN 80 C 0.0091 0.0037 -0.0100 1674 ASN 80 O 0.0067 0.0035 -0.0101 1675 ASN 80 CB 0.0125 0.0031 -0.0114 1676 ASN 80 CG 0.0101 0.0012 -0.0145 1677 ASN 80 OD1 0.0094 0.0001 -0.0164 1678 ASN 80 ND2 0.0078 0.0021 -0.0127 1679 LEU 81 N 0.0095 0.0037 -0.0100 1680 LEU 81 CA 0.0053 0.0036 -0.0095 1681 LEU 81 C 0.0029 0.0022 -0.0117 1682 LEU 81 O -0.0002 0.0021 -0.0116 1683 LEU 81 CB 0.0067 0.0043 -0.0085 1684 LEU 81 CG 0.0085 0.0060 -0.0057 1685 LEU 81 CD1 0.0099 0.0063 -0.0055 1686 LEU 81 CD2 0.0064 0.0076 -0.0027 1687 LYS 82 N 0.0022 0.0028 -0.0115 1688 LYS 82 CA 0.0014 0.0016 -0.0117 1689 LYS 82 C 0.0021 0.0018 -0.0116 1690 LYS 82 O 0.0015 0.0018 -0.0117 1691 LYS 82 CB 0.0021 -0.0001 -0.0118 1692 LYS 82 CG 0.0006 -0.0009 -0.0121 1693 LYS 82 CD 0.0012 -0.0029 -0.0122 1694 LYS 82 CE 0.0010 -0.0034 -0.0122 1695 LYS 82 NZ 0.0025 -0.0061 -0.0122 1696 GLY 83 N 0.0039 0.0023 -0.0113 1697 GLY 83 CA 0.0046 0.0026 -0.0112 1698 GLY 83 C 0.0041 0.0042 -0.0111 1699 GLY 83 O 0.0040 0.0043 -0.0111 1700 THR 84 N 0.0040 0.0056 -0.0110 1701 THR 84 CA 0.0033 0.0075 -0.0110 1702 THR 84 C 0.0017 0.0072 -0.0112 1703 THR 84 O 0.0011 0.0080 -0.0112 1704 THR 84 CB 0.0030 0.0089 -0.0109 1705 THR 84 OG1 0.0050 0.0090 -0.0105 1706 THR 84 CG2 0.0027 0.0104 -0.0108 1707 PHE 85 N 0.0041 0.0056 -0.0075 1708 PHE 85 CA 0.0025 0.0055 -0.0081 1709 PHE 85 C 0.0031 0.0042 -0.0068 1710 PHE 85 O 0.0018 0.0039 -0.0072 1711 PHE 85 CB -0.0003 0.0056 -0.0093 1712 PHE 85 CG -0.0007 0.0074 -0.0108 1713 PHE 85 CD1 -0.0015 0.0074 -0.0112 1714 PHE 85 CD2 -0.0002 0.0092 -0.0120 1715 PHE 85 CE1 -0.0017 0.0095 -0.0128 1716 PHE 85 CE2 -0.0008 0.0110 -0.0136 1717 PHE 85 CZ -0.0014 0.0114 -0.0141 1718 ALA 86 N 0.0047 0.0030 -0.0053 1719 ALA 86 CA 0.0051 0.0013 -0.0038 1720 ALA 86 C 0.0057 0.0021 -0.0042 1721 ALA 86 O 0.0046 0.0013 -0.0040 1722 ALA 86 CB 0.0071 0.0001 -0.0021 1723 THR 87 N 0.0075 0.0038 -0.0047 1724 THR 87 CA 0.0080 0.0044 -0.0050 1725 THR 87 C 0.0060 0.0056 -0.0067 1726 THR 87 O 0.0054 0.0051 -0.0066 1727 THR 87 CB 0.0105 0.0071 -0.0061 1728 THR 87 OG1 0.0122 0.0060 -0.0045 1729 THR 87 CG2 0.0118 0.0066 -0.0052 1730 LEU 88 N 0.0032 0.0092 -0.0077 1731 LEU 88 CA -0.0001 0.0100 -0.0097 1732 LEU 88 C -0.0039 0.0072 -0.0080 1733 LEU 88 O -0.0058 0.0075 -0.0089 1734 LEU 88 CB -0.0020 0.0127 -0.0131 1735 LEU 88 CG 0.0013 0.0163 -0.0158 1736 LEU 88 CD1 -0.0018 0.0180 -0.0185 1737 LEU 88 CD2 0.0011 0.0176 -0.0172 1738 SER 89 N -0.0050 0.0045 -0.0056 1739 SER 89 CA -0.0086 0.0015 -0.0036 1740 SER 89 C -0.0074 0.0001 -0.0017 1741 SER 89 O -0.0097 -0.0005 -0.0018 1742 SER 89 CB -0.0090 -0.0007 -0.0015 1743 SER 89 OG -0.0127 -0.0038 0.0006 1744 GLU 90 N -0.0030 -0.0006 0.0004 1745 GLU 90 CA -0.0009 -0.0010 0.0016 1746 GLU 90 C -0.0005 0.0003 0.0004 1747 GLU 90 O -0.0023 -0.0008 0.0009 1748 GLU 90 CB 0.0047 -0.0022 0.0047 1749 GLU 90 CG 0.0035 -0.0042 0.0064 1750 GLU 90 CD 0.0093 -0.0060 0.0102 1751 GLU 90 OE1 0.0104 -0.0061 0.0107 1752 GLU 90 OE2 0.0113 -0.0042 0.0090 1753 LEU 91 N -0.0015 0.0029 -0.0016 1754 LEU 91 CA -0.0014 0.0040 -0.0029 1755 LEU 91 C -0.0041 0.0038 -0.0033 1756 LEU 91 O -0.0044 0.0038 -0.0033 1757 LEU 91 CB 0.0001 0.0058 -0.0050 1758 LEU 91 CG 0.0002 0.0071 -0.0066 1759 LEU 91 CD1 0.0031 0.0069 -0.0057 1760 LEU 91 CD2 0.0003 0.0088 -0.0089 1761 HIS 92 N -0.0064 0.0041 -0.0041 1762 HIS 92 CA -0.0089 0.0042 -0.0048 1763 HIS 92 C -0.0106 0.0022 -0.0026 1764 HIS 92 O -0.0120 0.0022 -0.0028 1765 HIS 92 CB -0.0114 0.0047 -0.0059 1766 HIS 92 CG -0.0111 0.0068 -0.0086 1767 HIS 92 ND1 -0.0090 0.0077 -0.0093 1768 HIS 92 CD2 -0.0126 0.0082 -0.0107 1769 HIS 92 CE1 -0.0094 0.0097 -0.0119 1770 HIS 92 NE2 -0.0116 0.0097 -0.0124 1771 CYS 93 N -0.0100 0.0007 -0.0005 1772 CYS 93 CA -0.0109 -0.0010 0.0015 1773 CYS 93 C -0.0087 -0.0013 0.0023 1774 CYS 93 O -0.0098 -0.0016 0.0026 1775 CYS 93 CB -0.0109 -0.0023 0.0032 1776 CYS 93 SG -0.0118 -0.0048 0.0063 1777 ASP 94 N -0.0052 -0.0025 0.0050 1778 ASP 94 CA -0.0035 -0.0033 0.0064 1779 ASP 94 C -0.0027 -0.0014 0.0045 1780 ASP 94 O -0.0023 -0.0018 0.0051 1781 ASP 94 CB -0.0003 -0.0037 0.0078 1782 ASP 94 CG -0.0001 -0.0059 0.0104 1783 ASP 94 OD1 -0.0026 -0.0070 0.0108 1784 ASP 94 OD2 0.0019 -0.0054 0.0104 1785 LYS 95 N -0.0021 0.0008 0.0022 1786 LYS 95 CA -0.0017 0.0023 0.0007 1787 LYS 95 C -0.0036 0.0037 -0.0014 1788 LYS 95 O -0.0043 0.0041 -0.0021 1789 LYS 95 CB 0.0017 0.0042 -0.0003 1790 LYS 95 CG 0.0048 0.0032 0.0018 1791 LYS 95 CD 0.0053 0.0022 0.0031 1792 LYS 95 CE 0.0087 0.0017 0.0047 1793 LYS 95 NZ 0.0095 0.0006 0.0062 1794 LEU 96 N -0.0058 0.0043 -0.0027 1795 LEU 96 CA -0.0084 0.0053 -0.0047 1796 LEU 96 C -0.0118 0.0041 -0.0043 1797 LEU 96 O -0.0136 0.0049 -0.0058 1798 LEU 96 CB -0.0083 0.0072 -0.0067 1799 LEU 96 CG -0.0049 0.0087 -0.0074 1800 LEU 96 CD1 -0.0059 0.0101 -0.0092 1801 LEU 96 CD2 -0.0041 0.0103 -0.0088 1802 HIS 97 N -0.0103 0.0005 -0.0012 1803 HIS 97 CA -0.0098 0.0007 -0.0014 1804 HIS 97 C -0.0092 0.0008 -0.0009 1805 HIS 97 O -0.0088 0.0008 -0.0008 1806 HIS 97 CB -0.0100 0.0007 -0.0015 1807 HIS 97 CG -0.0107 0.0006 -0.0019 1808 HIS 97 ND1 -0.0108 0.0008 -0.0025 1809 HIS 97 CD2 -0.0113 0.0004 -0.0016 1810 HIS 97 CE1 -0.0115 0.0007 -0.0026 1811 HIS 97 NE2 -0.0117 0.0004 -0.0022 1812 VAL 98 N -0.0090 0.0008 -0.0008 1813 VAL 98 CA -0.0084 0.0008 -0.0003 1814 VAL 98 C -0.0078 0.0011 -0.0007 1815 VAL 98 O -0.0077 0.0012 -0.0010 1816 VAL 98 CB -0.0084 0.0006 0.0002 1817 VAL 98 CG1 -0.0079 0.0006 0.0006 1818 VAL 98 CG2 -0.0090 0.0003 0.0006 1819 ASP 99 N -0.0073 0.0012 -0.0007 1820 ASP 99 CA -0.0067 0.0015 -0.0011 1821 ASP 99 C -0.0064 0.0014 -0.0007 1822 ASP 99 O -0.0063 0.0013 -0.0001 1823 ASP 99 CB -0.0063 0.0015 -0.0008 1824 ASP 99 CG -0.0055 0.0018 -0.0011 1825 ASP 99 OD1 -0.0053 0.0018 -0.0010 1826 ASP 99 OD2 -0.0054 0.0019 -0.0013 1827 PRO 100 N -0.0059 0.0016 -0.0009 1828 PRO 100 CA -0.0058 0.0013 -0.0004 1829 PRO 100 C -0.0039 0.0014 0.0004 1830 PRO 100 O -0.0038 0.0008 0.0012 1831 PRO 100 CB -0.0061 0.0022 -0.0018 1832 PRO 100 CG -0.0067 0.0028 -0.0030 1833 PRO 100 CD -0.0064 0.0026 -0.0025 1834 GLU 101 N -0.0028 0.0016 0.0006 1835 GLU 101 CA -0.0011 0.0015 0.0016 1836 GLU 101 C -0.0012 0.0003 0.0031 1837 GLU 101 O -0.0007 -0.0001 0.0040 1838 GLU 101 CB 0.0002 0.0021 0.0014 1839 GLU 101 CG 0.0019 0.0019 0.0024 1840 GLU 101 CD 0.0030 0.0029 0.0016 1841 GLU 101 OE1 0.0023 0.0035 0.0004 1842 GLU 101 OE2 0.0038 0.0023 0.0029 1843 ASN 102 N -0.0028 -0.0005 0.0035 1844 ASN 102 CA -0.0031 -0.0017 0.0049 1845 ASN 102 C -0.0036 -0.0020 0.0052 1846 ASN 102 O -0.0032 -0.0029 0.0066 1847 ASN 102 CB -0.0047 -0.0022 0.0050 1848 ASN 102 CG -0.0040 -0.0021 0.0052 1849 ASN 102 OD1 -0.0033 -0.0025 0.0060 1850 ASN 102 ND2 -0.0049 -0.0015 0.0038 1851 PHE 103 N -0.0073 -0.0012 0.0015 1852 PHE 103 CA -0.0080 -0.0015 0.0014 1853 PHE 103 C -0.0053 -0.0009 0.0025 1854 PHE 103 O -0.0052 -0.0016 0.0036 1855 PHE 103 CB -0.0096 -0.0008 -0.0008 1856 PHE 103 CG -0.0122 -0.0012 -0.0019 1857 PHE 103 CD1 -0.0135 -0.0030 -0.0004 1858 PHE 103 CD2 -0.0128 0.0001 -0.0042 1859 PHE 103 CE1 -0.0156 -0.0034 -0.0014 1860 PHE 103 CE2 -0.0152 -0.0005 -0.0051 1861 PHE 103 CZ -0.0165 -0.0024 -0.0034 1862 ARG 104 N -0.0033 0.0008 0.0015 1863 ARG 104 CA -0.0010 0.0015 0.0022 1864 ARG 104 C 0.0004 0.0005 0.0047 1865 ARG 104 O 0.0017 0.0001 0.0061 1866 ARG 104 CB 0.0008 0.0036 0.0005 1867 ARG 104 CG -0.0001 0.0049 -0.0020 1868 ARG 104 CD 0.0012 0.0072 -0.0042 1869 ARG 104 NE -0.0015 0.0074 -0.0065 1870 ARG 104 CZ 0.0018 0.0101 -0.0079 1871 ARG 104 NH1 0.0041 0.0109 -0.0074 1872 ARG 104 NH2 0.0011 0.0115 -0.0104 1873 LEU 105 N 0.0004 -0.0001 0.0055 1874 LEU 105 CA 0.0016 -0.0013 0.0080 1875 LEU 105 C 0.0001 -0.0032 0.0096 1876 LEU 105 O 0.0014 -0.0038 0.0114 1877 LEU 105 CB 0.0012 -0.0018 0.0084 1878 LEU 105 CG 0.0031 -0.0001 0.0073 1879 LEU 105 CD1 0.0022 -0.0009 0.0078 1880 LEU 105 CD2 0.0060 0.0006 0.0085 1881 LEU 106 N -0.0001 -0.0038 0.0061 1882 LEU 106 CA -0.0005 -0.0044 0.0061 1883 LEU 106 C -0.0003 -0.0037 0.0057 1884 LEU 106 O -0.0001 -0.0038 0.0061 1885 LEU 106 CB -0.0011 -0.0052 0.0056 1886 LEU 106 CG -0.0015 -0.0059 0.0056 1887 LEU 106 CD1 -0.0013 -0.0062 0.0067 1888 LEU 106 CD2 -0.0021 -0.0064 0.0050 1889 GLY 107 N -0.0002 -0.0030 0.0049 1890 GLY 107 CA -0.0000 -0.0025 0.0044 1891 GLY 107 C 0.0006 -0.0019 0.0052 1892 GLY 107 O 0.0007 -0.0018 0.0053 1893 ASN 108 N 0.0010 -0.0015 0.0059 1894 ASN 108 CA 0.0016 -0.0009 0.0065 1895 ASN 108 C 0.0016 -0.0016 0.0075 1896 ASN 108 O 0.0019 -0.0013 0.0078 1897 ASN 108 CB 0.0020 -0.0005 0.0070 1898 ASN 108 CG 0.0023 0.0006 0.0060 1899 ASN 108 OD1 0.0022 0.0008 0.0054 1900 ASN 108 ND2 0.0025 0.0006 0.0065 1901 VAL 109 N 0.0012 -0.0043 0.0059 1902 VAL 109 CA 0.0012 -0.0038 0.0055 1903 VAL 109 C 0.0017 -0.0035 0.0050 1904 VAL 109 O 0.0015 -0.0029 0.0046 1905 VAL 109 CB 0.0015 -0.0041 0.0056 1906 VAL 109 CG1 0.0015 -0.0036 0.0051 1907 VAL 109 CG2 0.0009 -0.0044 0.0060 1908 LEU 110 N 0.0024 -0.0037 0.0051 1909 LEU 110 CA 0.0028 -0.0034 0.0046 1910 LEU 110 C 0.0024 -0.0030 0.0044 1911 LEU 110 O 0.0025 -0.0025 0.0039 1912 LEU 110 CB 0.0035 -0.0037 0.0048 1913 LEU 110 CG 0.0041 -0.0034 0.0043 1914 LEU 110 CD1 0.0043 -0.0030 0.0039 1915 LEU 110 CD2 0.0047 -0.0037 0.0044 1916 VAL 111 N 0.0020 -0.0032 0.0047 1917 VAL 111 CA 0.0016 -0.0029 0.0045 1918 VAL 111 C 0.0011 -0.0024 0.0042 1919 VAL 111 O 0.0010 -0.0019 0.0038 1920 VAL 111 CB 0.0013 -0.0033 0.0050 1921 VAL 111 CG1 0.0007 -0.0029 0.0048 1922 VAL 111 CG2 0.0019 -0.0036 0.0051 1923 CYS 112 N 0.0017 -0.0047 0.0039 1924 CYS 112 CA 0.0012 -0.0045 0.0028 1925 CYS 112 C 0.0019 -0.0039 0.0019 1926 CYS 112 O 0.0014 -0.0038 0.0010 1927 CYS 112 CB 0.0011 -0.0045 0.0026 1928 CYS 112 SG 0.0000 -0.0053 0.0036 1929 VAL 113 N 0.0030 -0.0036 0.0022 1930 VAL 113 CA 0.0037 -0.0030 0.0013 1931 VAL 113 C 0.0036 -0.0030 0.0012 1932 VAL 113 O 0.0035 -0.0026 -0.0000 1933 VAL 113 CB 0.0051 -0.0026 0.0016 1934 VAL 113 CG1 0.0058 -0.0020 0.0009 1935 VAL 113 CG2 0.0053 -0.0025 0.0015 1936 LEU 114 N 0.0035 -0.0033 0.0019 1937 LEU 114 CA 0.0032 -0.0033 0.0017 1938 LEU 114 C 0.0021 -0.0035 0.0009 1939 LEU 114 O 0.0020 -0.0033 0.0002 1940 LEU 114 CB 0.0035 -0.0036 0.0028 1941 LEU 114 CG 0.0046 -0.0034 0.0035 1942 LEU 114 CD1 0.0046 -0.0039 0.0047 1943 LEU 114 CD2 0.0055 -0.0029 0.0029 1944 ALA 115 N 0.0012 -0.0003 -0.0005 1945 ALA 115 CA 0.0002 0.0008 -0.0007 1946 ALA 115 C 0.0003 0.0008 -0.0011 1947 ALA 115 O -0.0002 0.0016 -0.0019 1948 ALA 115 CB -0.0005 0.0010 0.0008 1949 HIS 116 N 0.0009 0.0000 -0.0004 1950 HIS 116 CA 0.0009 0.0001 -0.0006 1951 HIS 116 C 0.0014 0.0000 -0.0022 1952 HIS 116 O 0.0012 0.0006 -0.0029 1953 HIS 116 CB 0.0015 -0.0008 0.0003 1954 HIS 116 CG 0.0016 -0.0009 0.0003 1955 HIS 116 ND1 0.0026 -0.0018 0.0000 1956 HIS 116 CD2 0.0009 -0.0002 0.0004 1957 HIS 116 CE1 0.0023 -0.0016 0.0003 1958 HIS 116 NE2 0.0013 -0.0006 0.0003 1959 HIS 117 N 0.0024 -0.0007 -0.0027 1960 HIS 117 CA 0.0029 -0.0008 -0.0042 1961 HIS 117 C 0.0024 0.0001 -0.0053 1962 HIS 117 O 0.0025 0.0003 -0.0064 1963 HIS 117 CB 0.0040 -0.0017 -0.0046 1964 HIS 117 CG 0.0049 -0.0025 -0.0050 1965 HIS 117 ND1 0.0047 -0.0029 -0.0030 1966 HIS 117 CD2 0.0059 -0.0031 -0.0063 1967 HIS 117 CE1 0.0060 -0.0041 -0.0032 1968 HIS 117 NE2 0.0067 -0.0044 -0.0045 1969 PHE 118 N 0.0073 -0.0061 -0.0035 1970 PHE 118 CA 0.0008 -0.0062 -0.0056 1971 PHE 118 C -0.0024 -0.0063 -0.0067 1972 PHE 118 O -0.0075 -0.0074 -0.0099 1973 PHE 118 CB -0.0022 -0.0036 -0.0031 1974 PHE 118 CG -0.0002 -0.0048 -0.0040 1975 PHE 118 CD1 0.0037 -0.0027 0.0000 1976 PHE 118 CD2 -0.0001 -0.0087 -0.0093 1977 PHE 118 CE1 0.0058 -0.0036 -0.0005 1978 PHE 118 CE2 0.0005 -0.0085 -0.0089 1979 PHE 118 CZ 0.0056 -0.0077 -0.0062 1980 GLY 119 N 0.0000 -0.0049 -0.0040 1981 GLY 119 CA -0.0031 -0.0050 -0.0052 1982 GLY 119 C -0.0096 -0.0027 -0.0040 1983 GLY 119 O -0.0118 0.0006 -0.0002 1984 LYS 120 N -0.0137 -0.0043 -0.0076 1985 LYS 120 CA -0.0206 -0.0021 -0.0066 1986 LYS 120 C -0.0246 -0.0014 -0.0068 1987 LYS 120 O -0.0295 0.0016 -0.0043 1988 LYS 120 CB -0.0251 -0.0048 -0.0116 1989 LYS 120 CG -0.0263 -0.0078 -0.0162 1990 LYS 120 CD -0.0306 -0.0101 -0.0207 1991 LYS 120 CE -0.0314 -0.0133 -0.0253 1992 LYS 120 NZ -0.0356 -0.0155 -0.0296 1993 GLU 121 N -0.0085 -0.0063 -0.0040 1994 GLU 121 CA -0.0091 -0.0060 -0.0039 1995 GLU 121 C -0.0087 -0.0048 -0.0015 1996 GLU 121 O -0.0099 -0.0042 -0.0012 1997 GLU 121 CB -0.0079 -0.0074 -0.0055 1998 GLU 121 CG -0.0090 -0.0074 -0.0062 1999 GLU 121 CD -0.0067 -0.0091 -0.0076 2000 GLU 121 OE1 -0.0083 -0.0084 -0.0074 2001 GLU 121 OE2 -0.0071 -0.0097 -0.0089 2002 PHE 122 N -0.0073 -0.0045 -0.0001 2003 PHE 122 CA -0.0069 -0.0034 0.0020 2004 PHE 122 C -0.0087 -0.0022 0.0031 2005 PHE 122 O -0.0083 -0.0017 0.0042 2006 PHE 122 CB -0.0044 -0.0038 0.0030 2007 PHE 122 CG -0.0037 -0.0030 0.0049 2008 PHE 122 CD1 -0.0036 -0.0031 0.0048 2009 PHE 122 CD2 -0.0033 -0.0021 0.0066 2010 PHE 122 CE1 -0.0027 -0.0024 0.0066 2011 PHE 122 CE2 -0.0026 -0.0013 0.0086 2012 PHE 122 CZ -0.0025 -0.0015 0.0083 2013 THR 123 N -0.0106 -0.0018 0.0025 2014 THR 123 CA -0.0126 -0.0006 0.0032 2015 THR 123 C -0.0123 0.0008 0.0058 2016 THR 123 O -0.0114 0.0007 0.0063 2017 THR 123 CB -0.0147 -0.0004 0.0022 2018 THR 123 OG1 -0.0150 -0.0003 0.0023 2019 THR 123 CG2 -0.0152 -0.0017 -0.0002 2020 PRO 124 N -0.0054 -0.0004 0.0069 2021 PRO 124 CA -0.0055 0.0004 0.0079 2022 PRO 124 C -0.0059 0.0005 0.0075 2023 PRO 124 O -0.0054 0.0005 0.0082 2024 PRO 124 CB -0.0060 0.0013 0.0083 2025 PRO 124 CG -0.0059 0.0009 0.0079 2026 PRO 124 CD -0.0059 -0.0000 0.0068 2027 PRO 125 N -0.0066 0.0005 0.0067 2028 PRO 125 CA -0.0069 0.0006 0.0063 2029 PRO 125 C -0.0063 -0.0002 0.0061 2030 PRO 125 O -0.0062 -0.0001 0.0064 2031 PRO 125 CB -0.0078 0.0008 0.0054 2032 PRO 125 CG -0.0081 0.0011 0.0054 2033 PRO 125 CD -0.0074 0.0007 0.0058 2034 VAL 126 N -0.0058 -0.0010 0.0057 2035 VAL 126 CA -0.0051 -0.0018 0.0056 2036 VAL 126 C -0.0043 -0.0019 0.0065 2037 VAL 126 O -0.0039 -0.0021 0.0068 2038 VAL 126 CB -0.0048 -0.0027 0.0048 2039 VAL 126 CG1 -0.0041 -0.0036 0.0047 2040 VAL 126 CG2 -0.0055 -0.0028 0.0037 2041 GLN 127 N -0.0024 0.0012 0.0060 2042 GLN 127 CA -0.0025 0.0009 0.0064 2043 GLN 127 C -0.0023 0.0004 0.0069 2044 GLN 127 O -0.0020 0.0000 0.0073 2045 GLN 127 CB -0.0032 0.0010 0.0064 2046 GLN 127 CG -0.0033 0.0005 0.0070 2047 GLN 127 CD -0.0041 0.0006 0.0071 2048 GLN 127 OE1 -0.0046 0.0009 0.0067 2049 GLN 127 NE2 -0.0042 0.0003 0.0075 2050 ALA 128 N -0.0027 0.0003 0.0071 2051 ALA 128 CA -0.0026 -0.0001 0.0077 2052 ALA 128 C -0.0018 -0.0004 0.0078 2053 ALA 128 O -0.0015 -0.0008 0.0082 2054 ALA 128 CB -0.0031 -0.0001 0.0077 2055 ALA 129 N -0.0013 -0.0001 0.0074 2056 ALA 129 CA -0.0006 -0.0002 0.0074 2057 ALA 129 C -0.0002 -0.0003 0.0074 2058 ALA 129 O 0.0003 -0.0007 0.0078 2059 ALA 129 CB -0.0003 0.0002 0.0068 2060 TYR 130 N 0.0012 -0.0019 0.0065 2061 TYR 130 CA 0.0013 -0.0024 0.0067 2062 TYR 130 C 0.0018 -0.0018 0.0069 2063 TYR 130 O 0.0017 -0.0020 0.0069 2064 TYR 130 CB 0.0017 -0.0032 0.0072 2065 TYR 130 CG 0.0012 -0.0041 0.0070 2066 TYR 130 CD1 0.0009 -0.0047 0.0070 2067 TYR 130 CD2 0.0010 -0.0043 0.0069 2068 TYR 130 CE1 0.0004 -0.0054 0.0067 2069 TYR 130 CE2 0.0003 -0.0051 0.0066 2070 TYR 130 CZ 0.0002 -0.0057 0.0067 2071 TYR 130 OH -0.0003 -0.0065 0.0064 2072 GLN 131 N 0.0023 -0.0011 0.0072 2073 GLN 131 CA 0.0026 -0.0005 0.0072 2074 GLN 131 C 0.0021 0.0001 0.0067 2075 GLN 131 O 0.0022 0.0000 0.0068 2076 GLN 131 CB 0.0031 0.0003 0.0075 2077 GLN 131 CG 0.0038 -0.0002 0.0082 2078 GLN 131 CD 0.0044 -0.0004 0.0087 2079 GLN 131 OE1 0.0049 -0.0007 0.0092 2080 GLN 131 NE2 0.0045 -0.0002 0.0087 2081 LYS 132 N 0.0015 0.0003 0.0062 2082 LYS 132 CA 0.0010 0.0007 0.0056 2083 LYS 132 C 0.0006 0.0001 0.0055 2084 LYS 132 O 0.0005 0.0002 0.0053 2085 LYS 132 CB 0.0005 0.0010 0.0051 2086 LYS 132 CG 0.0008 0.0019 0.0052 2087 LYS 132 CD 0.0002 0.0021 0.0046 2088 LYS 132 CE 0.0008 0.0029 0.0049 2089 LYS 132 NZ -0.0001 0.0030 0.0041 2090 VAL 133 N 0.0031 0.0015 0.0065 2091 VAL 133 CA 0.0011 0.0012 0.0067 2092 VAL 133 C -0.0002 0.0011 0.0063 2093 VAL 133 O -0.0016 0.0009 0.0051 2094 VAL 133 CB 0.0007 0.0011 0.0086 2095 VAL 133 CG1 -0.0012 0.0008 0.0089 2096 VAL 133 CG2 0.0018 0.0013 0.0088 2097 VAL 134 N 0.0002 0.0011 0.0071 2098 VAL 134 CA -0.0008 0.0010 0.0069 2099 VAL 134 C -0.0008 0.0010 0.0049 2100 VAL 134 O -0.0023 0.0008 0.0040 2101 VAL 134 CB -0.0009 0.0009 0.0079 2102 VAL 134 CG1 -0.0012 0.0008 0.0099 2103 VAL 134 CG2 0.0011 0.0012 0.0080 2104 ALA 135 N 0.0008 0.0013 0.0039 2105 ALA 135 CA 0.0009 0.0014 0.0018 2106 ALA 135 C -0.0003 0.0013 0.0006 2107 ALA 135 O -0.0012 0.0012 -0.0008 2108 ALA 135 CB 0.0028 0.0017 0.0013 2109 GLY 136 N -0.0042 0.0045 -0.0029 2110 GLY 136 CA -0.0035 0.0038 -0.0037 2111 GLY 136 C -0.0057 0.0038 -0.0036 2112 GLY 136 O -0.0063 0.0027 -0.0048 2113 VAL 137 N -0.0070 0.0054 -0.0019 2114 VAL 137 CA -0.0091 0.0055 -0.0017 2115 VAL 137 C -0.0111 0.0044 -0.0028 2116 VAL 137 O -0.0123 0.0034 -0.0039 2117 VAL 137 CB -0.0100 0.0073 0.0003 2118 VAL 137 CG1 -0.0123 0.0073 0.0004 2119 VAL 137 CG2 -0.0080 0.0083 0.0013 2120 ALA 138 N -0.0116 0.0041 -0.0031 2121 ALA 138 CA -0.0134 0.0029 -0.0043 2122 ALA 138 C -0.0131 0.0012 -0.0062 2123 ALA 138 O -0.0145 0.0001 -0.0073 2124 ALA 138 CB -0.0136 0.0031 -0.0041 2125 ASN 139 N -0.0159 0.0026 -0.0071 2126 ASN 139 CA -0.0153 0.0012 -0.0074 2127 ASN 139 C -0.0143 0.0006 -0.0078 2128 ASN 139 O -0.0145 -0.0005 -0.0079 2129 ASN 139 CB -0.0142 0.0013 -0.0077 2130 ASN 139 CG -0.0146 0.0011 -0.0076 2131 ASN 139 OD1 -0.0160 0.0012 -0.0073 2132 ASN 139 ND2 -0.0146 0.0021 -0.0075 2133 ALA 140 N -0.0137 0.0016 -0.0078 2134 ALA 140 CA -0.0129 0.0011 -0.0081 2135 ALA 140 C -0.0138 0.0008 -0.0079 2136 ALA 140 O -0.0135 -0.0003 -0.0081 2137 ALA 140 CB -0.0119 0.0024 -0.0082 2138 LEU 141 N -0.0148 0.0013 -0.0075 2139 LEU 141 CA -0.0158 0.0010 -0.0073 2140 LEU 141 C -0.0163 -0.0004 -0.0074 2141 LEU 141 O -0.0170 -0.0011 -0.0073 2142 LEU 141 CB -0.0166 0.0021 -0.0070 2143 LEU 141 CG -0.0161 0.0031 -0.0069 2144 LEU 141 CD1 -0.0171 0.0041 -0.0065 2145 LEU 141 CD2 -0.0159 0.0027 -0.0071 2146 ALA 142 N -0.0213 -0.0015 -0.0045 2147 ALA 142 CA -0.0235 -0.0045 -0.0034 2148 ALA 142 C -0.0201 -0.0081 0.0007 2149 ALA 142 O -0.0218 -0.0107 0.0018 2150 ALA 142 CB -0.0282 -0.0067 -0.0040 2151 HIS 143 N -0.0174 -0.0076 0.0016 2152 HIS 143 CA -0.0151 -0.0108 0.0049 2153 HIS 143 C -0.0128 -0.0122 0.0070 2154 HIS 143 O -0.0126 -0.0157 0.0096 2155 HIS 143 CB -0.0120 -0.0094 0.0054 2156 HIS 143 CG -0.0099 -0.0134 0.0091 2157 HIS 143 ND1 -0.0048 -0.0109 0.0098 2158 HIS 143 CD2 -0.0127 -0.0161 0.0098 2159 HIS 143 CE1 -0.0057 -0.0160 0.0130 2160 HIS 143 NE2 -0.0103 -0.0189 0.0129 2161 LYS 144 N -0.0111 -0.0094 0.0058 2162 LYS 144 CA -0.0085 -0.0105 0.0078 2163 LYS 144 C -0.0112 -0.0113 0.0071 2164 LYS 144 O -0.0093 -0.0116 0.0082 2165 LYS 144 CB -0.0047 -0.0068 0.0070 2166 LYS 144 CG -0.0011 -0.0069 0.0087 2167 LYS 144 CD 0.0020 -0.0091 0.0117 2168 LYS 144 CE 0.0074 -0.0112 0.0156 2169 LYS 144 NZ 0.0122 -0.0064 0.0144 2170 TYR 145 N -0.0140 -0.0061 0.0101 2171 TYR 145 CA -0.0146 -0.0062 0.0092 2172 TYR 145 C -0.0142 -0.0070 0.0124 2173 TYR 145 O -0.0155 -0.0085 0.0142 2174 TYR 145 CB -0.0162 -0.0066 0.0069 2175 TYR 145 CG -0.0158 -0.0051 0.0034 2176 TYR 145 CD1 -0.0155 -0.0043 0.0017 2177 TYR 145 CD2 -0.0153 -0.0047 0.0030 2178 TYR 145 CE1 -0.0149 -0.0030 -0.0010 2179 TYR 145 CE2 -0.0144 -0.0029 -0.0002 2180 TYR 145 CZ -0.0142 -0.0022 -0.0023 2181 TYR 145 OH -0.0140 -0.0011 -0.0052 2182 HIS 146 N -0.0133 -0.0064 0.0127 2183 HIS 146 CA -0.0128 -0.0070 0.0155 2184 HIS 146 C -0.0123 -0.0063 0.0145 2185 HIS 146 O -0.0117 -0.0050 0.0119 2186 HIS 146 CB -0.0109 -0.0064 0.0180 2187 HIS 146 CG -0.0075 -0.0037 0.0171 2188 HIS 146 ND1 -0.0063 -0.0033 0.0188 2189 HIS 146 CD2 -0.0071 -0.0026 0.0150 2190 HIS 146 CE1 -0.0031 -0.0006 0.0176 2191 HIS 146 NE2 -0.0047 -0.0009 0.0149 2192 HIS 146 OXT -0.0125 -0.0070 0.0163 2193 VAL 1 N 0.0107 0.0182 0.0059 2194 VAL 1 CA 0.0065 0.0188 0.0060 2195 VAL 1 C 0.0067 0.0153 0.0043 2196 VAL 1 O 0.0087 0.0137 0.0036 2197 VAL 1 CB 0.0086 0.0195 0.0065 2198 VAL 1 CG1 0.0050 0.0188 0.0059 2199 VAL 1 CG2 0.0047 0.0226 0.0078 2200 LEU 2 N 0.0045 0.0142 0.0037 2201 LEU 2 CA 0.0042 0.0116 0.0024 2202 LEU 2 C 0.0031 0.0102 0.0017 2203 LEU 2 O 0.0005 0.0114 0.0021 2204 LEU 2 CB 0.0022 0.0110 0.0020 2205 LEU 2 CG 0.0037 0.0108 0.0019 2206 LEU 2 CD1 0.0019 0.0107 0.0018 2207 LEU 2 CD2 0.0062 0.0100 0.0017 2208 SER 3 N 0.0047 0.0090 0.0011 2209 SER 3 CA 0.0036 0.0078 0.0005 2210 SER 3 C 0.0014 0.0060 -0.0005 2211 SER 3 O 0.0011 0.0047 -0.0011 2212 SER 3 CB 0.0061 0.0070 0.0002 2213 SER 3 OG 0.0071 0.0046 -0.0009 2214 PRO 4 N -0.0029 -0.0015 -0.0147 2215 PRO 4 CA -0.0046 -0.0019 -0.0177 2216 PRO 4 C -0.0026 -0.0049 -0.0141 2217 PRO 4 O -0.0029 -0.0025 -0.0146 2218 PRO 4 CB -0.0077 -0.0067 -0.0230 2219 PRO 4 CG -0.0079 -0.0055 -0.0235 2220 PRO 4 CD -0.0044 -0.0035 -0.0174 2221 ALA 5 N -0.0008 -0.0088 -0.0110 2222 ALA 5 CA 0.0015 -0.0117 -0.0070 2223 ALA 5 C 0.0037 -0.0059 -0.0032 2224 ALA 5 O 0.0047 -0.0061 -0.0014 2225 ALA 5 CB 0.0035 -0.0175 -0.0035 2226 ASP 6 N 0.0052 -0.0031 -0.0006 2227 ASP 6 CA 0.0073 0.0024 0.0031 2228 ASP 6 C 0.0056 0.0067 0.0002 2229 ASP 6 O 0.0072 0.0093 0.0029 2230 ASP 6 CB 0.0085 0.0065 0.0051 2231 ASP 6 CG 0.0109 0.0026 0.0094 2232 ASP 6 OD1 0.0132 -0.0014 0.0134 2233 ASP 6 OD2 0.0109 0.0042 0.0094 2234 LYS 7 N 0.0031 0.0080 -0.0028 2235 LYS 7 CA 0.0006 0.0109 -0.0057 2236 LYS 7 C 0.0003 0.0096 -0.0063 2237 LYS 7 O 0.0003 0.0108 -0.0061 2238 LYS 7 CB -0.0016 0.0127 -0.0084 2239 LYS 7 CG -0.0009 0.0147 -0.0070 2240 LYS 7 CD -0.0040 0.0192 -0.0103 2241 LYS 7 CE -0.0038 0.0182 -0.0103 2242 LYS 7 NZ -0.0048 0.0189 -0.0115 2243 THR 8 N 0.0001 0.0045 -0.0076 2244 THR 8 CA 0.0000 0.0016 -0.0083 2245 THR 8 C 0.0019 0.0014 -0.0057 2246 THR 8 O 0.0016 0.0018 -0.0061 2247 THR 8 CB -0.0007 -0.0041 -0.0104 2248 THR 8 OG1 -0.0032 -0.0027 -0.0136 2249 THR 8 CG2 -0.0014 -0.0062 -0.0118 2250 ASN 9 N 0.0046 0.0006 -0.0021 2251 ASN 9 CA 0.0074 0.0004 0.0016 2252 ASN 9 C 0.0076 0.0046 0.0028 2253 ASN 9 O 0.0082 0.0046 0.0035 2254 ASN 9 CB 0.0100 -0.0015 0.0048 2255 ASN 9 CG 0.0107 -0.0067 0.0048 2256 ASN 9 OD1 0.0093 -0.0090 0.0025 2257 ASN 9 ND2 0.0118 -0.0075 0.0061 2258 VAL 10 N 0.0038 0.0041 0.0020 2259 VAL 10 CA 0.0021 0.0067 0.0029 2260 VAL 10 C 0.0001 0.0088 0.0001 2261 VAL 10 O -0.0007 0.0101 0.0007 2262 VAL 10 CB 0.0017 0.0078 0.0047 2263 VAL 10 CG1 -0.0003 0.0108 0.0059 2264 VAL 10 CG2 0.0030 0.0066 0.0077 2265 LYS 11 N 0.0002 0.0081 -0.0022 2266 LYS 11 CA -0.0010 0.0092 -0.0050 2267 LYS 11 C -0.0010 0.0088 -0.0062 2268 LYS 11 O -0.0021 0.0103 -0.0068 2269 LYS 11 CB -0.0011 0.0089 -0.0068 2270 LYS 11 CG -0.0015 0.0096 -0.0060 2271 LYS 11 CD -0.0016 0.0091 -0.0088 2272 LYS 11 CE -0.0020 0.0098 -0.0083 2273 LYS 11 NZ -0.0002 0.0071 -0.0085 2274 ALA 12 N 0.0008 0.0064 -0.0061 2275 ALA 12 CA 0.0008 0.0061 -0.0068 2276 ALA 12 C 0.0001 0.0073 -0.0058 2277 ALA 12 O -0.0010 0.0087 -0.0064 2278 ALA 12 CB 0.0025 0.0037 -0.0072 2279 ALA 13 N -0.0003 0.0111 -0.0013 2280 ALA 13 CA -0.0028 0.0118 -0.0003 2281 ALA 13 C -0.0062 0.0131 -0.0003 2282 ALA 13 O -0.0086 0.0145 -0.0020 2283 ALA 13 CB -0.0020 0.0107 0.0027 2284 TRP 14 N -0.0071 0.0128 0.0019 2285 TRP 14 CA -0.0106 0.0139 0.0026 2286 TRP 14 C -0.0113 0.0151 -0.0006 2287 TRP 14 O -0.0144 0.0167 -0.0021 2288 TRP 14 CB -0.0106 0.0133 0.0050 2289 TRP 14 CG -0.0140 0.0141 0.0068 2290 TRP 14 CD1 -0.0161 0.0152 0.0056 2291 TRP 14 CD2 -0.0158 0.0141 0.0092 2292 TRP 14 NE1 -0.0190 0.0155 0.0082 2293 TRP 14 CE2 -0.0194 0.0153 0.0098 2294 TRP 14 CE3 -0.0151 0.0135 0.0104 2295 TRP 14 CZ2 -0.0217 0.0156 0.0116 2296 TRP 14 CZ3 -0.0173 0.0137 0.0126 2297 TRP 14 CH2 -0.0213 0.0151 0.0128 2298 GLY 15 N -0.0097 0.0152 -0.0031 2299 GLY 15 CA -0.0090 0.0160 -0.0068 2300 GLY 15 C -0.0105 0.0171 -0.0089 2301 GLY 15 O -0.0141 0.0189 -0.0103 2302 LYS 16 N -0.0101 0.0150 -0.0037 2303 LYS 16 CA -0.0082 0.0135 -0.0060 2304 LYS 16 C -0.0123 0.0160 -0.0035 2305 LYS 16 O -0.0143 0.0164 -0.0056 2306 LYS 16 CB -0.0038 0.0112 -0.0068 2307 LYS 16 CG -0.0025 0.0089 -0.0137 2308 LYS 16 CD -0.0031 0.0095 -0.0123 2309 LYS 16 CE -0.0041 0.0081 -0.0200 2310 LYS 16 NZ -0.0064 0.0098 -0.0172 2311 VAL 17 N -0.0138 0.0178 0.0010 2312 VAL 17 CA -0.0169 0.0200 0.0038 2313 VAL 17 C -0.0210 0.0210 0.0004 2314 VAL 17 O -0.0244 0.0222 -0.0012 2315 VAL 17 CB -0.0167 0.0214 0.0100 2316 VAL 17 CG1 -0.0208 0.0236 0.0112 2317 VAL 17 CG2 -0.0115 0.0196 0.0122 2318 GLY 18 N -0.0225 0.0218 0.0009 2319 GLY 18 CA -0.0272 0.0231 -0.0026 2320 GLY 18 C -0.0314 0.0255 -0.0010 2321 GLY 18 O -0.0324 0.0272 0.0041 2322 ALA 19 N -0.0337 0.0177 -0.0018 2323 ALA 19 CA -0.0384 0.0194 -0.0005 2324 ALA 19 C -0.0370 0.0199 0.0010 2325 ALA 19 O -0.0408 0.0220 0.0033 2326 ALA 19 CB -0.0425 0.0177 -0.0057 2327 HIS 20 N -0.0310 0.0188 0.0016 2328 HIS 20 CA -0.0288 0.0195 0.0039 2329 HIS 20 C -0.0277 0.0229 0.0109 2330 HIS 20 O -0.0253 0.0237 0.0133 2331 HIS 20 CB -0.0227 0.0173 0.0023 2332 HIS 20 CG -0.0217 0.0133 -0.0049 2333 HIS 20 ND1 -0.0263 0.0135 -0.0065 2334 HIS 20 CD2 -0.0218 0.0113 -0.0088 2335 HIS 20 CE1 -0.0270 0.0098 -0.0140 2336 HIS 20 NE2 -0.0226 0.0091 -0.0133 2337 ALA 21 N -0.0280 0.0243 0.0134 2338 ALA 21 CA -0.0267 0.0275 0.0199 2339 ALA 21 C -0.0299 0.0301 0.0235 2340 ALA 21 O -0.0255 0.0307 0.0266 2341 ALA 21 CB -0.0289 0.0284 0.0207 2342 GLY 22 N -0.0128 0.0169 0.0127 2343 GLY 22 CA -0.0144 0.0175 0.0137 2344 GLY 22 C -0.0148 0.0177 0.0138 2345 GLY 22 O -0.0153 0.0176 0.0155 2346 GLU 23 N -0.0147 0.0180 0.0126 2347 GLU 23 CA -0.0150 0.0182 0.0127 2348 GLU 23 C -0.0138 0.0170 0.0143 2349 GLU 23 O -0.0144 0.0170 0.0154 2350 GLU 23 CB -0.0145 0.0184 0.0107 2351 GLU 23 CG -0.0155 0.0189 0.0109 2352 GLU 23 CD -0.0151 0.0196 0.0078 2353 GLU 23 OE1 -0.0130 0.0181 0.0088 2354 GLU 23 OE2 -0.0144 0.0192 0.0077 2355 TYR 24 N -0.0122 0.0162 0.0138 2356 TYR 24 CA -0.0110 0.0152 0.0150 2357 TYR 24 C -0.0115 0.0148 0.0173 2358 TYR 24 O -0.0112 0.0143 0.0186 2359 TYR 24 CB -0.0092 0.0144 0.0143 2360 TYR 24 CG -0.0084 0.0145 0.0123 2361 TYR 24 CD1 -0.0066 0.0136 0.0116 2362 TYR 24 CD2 -0.0095 0.0153 0.0115 2363 TYR 24 CE1 -0.0062 0.0140 0.0096 2364 TYR 24 CE2 -0.0088 0.0155 0.0095 2365 TYR 24 CZ -0.0072 0.0147 0.0091 2366 TYR 24 OH -0.0066 0.0149 0.0070 2367 GLY 25 N -0.0165 0.0059 0.0089 2368 GLY 25 CA -0.0161 0.0078 0.0084 2369 GLY 25 C -0.0141 0.0077 0.0081 2370 GLY 25 O -0.0124 0.0091 0.0074 2371 ALA 26 N -0.0130 0.0062 0.0082 2372 ALA 26 CA -0.0109 0.0059 0.0079 2373 ALA 26 C -0.0092 0.0060 0.0076 2374 ALA 26 O -0.0075 0.0066 0.0071 2375 ALA 26 CB -0.0106 0.0040 0.0083 2376 GLU 27 N -0.0098 0.0044 0.0080 2377 GLU 27 CA -0.0081 0.0039 0.0078 2378 GLU 27 C -0.0080 0.0060 0.0074 2379 GLU 27 O -0.0061 0.0066 0.0069 2380 GLU 27 CB -0.0092 0.0025 0.0084 2381 GLU 27 CG -0.0076 0.0020 0.0082 2382 GLU 27 CD -0.0083 0.0003 0.0087 2383 GLU 27 OE1 -0.0083 0.0006 0.0086 2384 GLU 27 OE2 -0.0096 -0.0012 0.0093 2385 ALA 28 N -0.0080 -0.0013 0.0051 2386 ALA 28 CA -0.0084 -0.0003 0.0043 2387 ALA 28 C -0.0078 -0.0008 0.0031 2388 ALA 28 O -0.0079 -0.0003 0.0022 2389 ALA 28 CB -0.0088 0.0001 0.0051 2390 LEU 29 N -0.0074 -0.0018 0.0035 2391 LEU 29 CA -0.0068 -0.0022 0.0023 2392 LEU 29 C -0.0065 -0.0024 0.0014 2393 LEU 29 O -0.0063 -0.0023 0.0003 2394 LEU 29 CB -0.0064 -0.0033 0.0029 2395 LEU 29 CG -0.0066 -0.0031 0.0035 2396 LEU 29 CD1 -0.0062 -0.0041 0.0041 2397 LEU 29 CD2 -0.0068 -0.0024 0.0028 2398 GLU 30 N -0.0062 -0.0030 0.0017 2399 GLU 30 CA -0.0059 -0.0033 0.0011 2400 GLU 30 C -0.0063 -0.0023 0.0003 2401 GLU 30 O -0.0060 -0.0023 -0.0008 2402 GLU 30 CB -0.0057 -0.0040 0.0017 2403 GLU 30 CG -0.0053 -0.0043 0.0009 2404 GLU 30 CD -0.0049 -0.0053 0.0015 2405 GLU 30 OE1 -0.0051 -0.0054 0.0026 2406 GLU 30 OE2 -0.0046 -0.0055 0.0009 2407 ARG 31 N -0.0027 -0.0039 0.0017 2408 ARG 31 CA -0.0029 -0.0034 0.0014 2409 ARG 31 C -0.0030 -0.0034 0.0010 2410 ARG 31 O -0.0031 -0.0033 0.0005 2411 ARG 31 CB -0.0029 -0.0029 0.0018 2412 ARG 31 CG -0.0030 -0.0027 0.0020 2413 ARG 31 CD -0.0030 -0.0022 0.0024 2414 ARG 31 NE -0.0030 -0.0019 0.0026 2415 ARG 31 CZ -0.0032 -0.0016 0.0024 2416 ARG 31 NH1 -0.0033 -0.0015 0.0018 2417 ARG 31 NH2 -0.0031 -0.0016 0.0026 2418 MET 32 N -0.0029 -0.0036 0.0013 2419 MET 32 CA -0.0029 -0.0038 0.0010 2420 MET 32 C -0.0029 -0.0042 0.0005 2421 MET 32 O -0.0031 -0.0041 0.0000 2422 MET 32 CB -0.0027 -0.0039 0.0014 2423 MET 32 CG -0.0028 -0.0040 0.0012 2424 MET 32 SD -0.0026 -0.0043 0.0016 2425 MET 32 CE -0.0023 -0.0050 0.0017 2426 PHE 33 N -0.0027 -0.0047 0.0006 2427 PHE 33 CA -0.0027 -0.0051 0.0001 2428 PHE 33 C -0.0029 -0.0049 -0.0004 2429 PHE 33 O -0.0030 -0.0051 -0.0009 2430 PHE 33 CB -0.0025 -0.0056 0.0003 2431 PHE 33 CG -0.0023 -0.0059 0.0008 2432 PHE 33 CD1 -0.0023 -0.0060 0.0007 2433 PHE 33 CD2 -0.0021 -0.0061 0.0012 2434 PHE 33 CE1 -0.0021 -0.0062 0.0011 2435 PHE 33 CE2 -0.0020 -0.0063 0.0016 2436 PHE 33 CZ -0.0020 -0.0064 0.0015 2437 LEU 34 N -0.0010 -0.0064 -0.0015 2438 LEU 34 CA -0.0012 -0.0061 -0.0020 2439 LEU 34 C -0.0014 -0.0057 -0.0023 2440 LEU 34 O -0.0016 -0.0056 -0.0028 2441 LEU 34 CB -0.0013 -0.0059 -0.0019 2442 LEU 34 CG -0.0011 -0.0063 -0.0017 2443 LEU 34 CD1 -0.0011 -0.0061 -0.0015 2444 LEU 34 CD2 -0.0011 -0.0069 -0.0022 2445 SER 35 N -0.0014 -0.0052 -0.0019 2446 SER 35 CA -0.0016 -0.0048 -0.0022 2447 SER 35 C -0.0017 -0.0049 -0.0024 2448 SER 35 O -0.0018 -0.0046 -0.0028 2449 SER 35 CB -0.0016 -0.0043 -0.0017 2450 SER 35 OG -0.0016 -0.0040 -0.0015 2451 PHE 36 N -0.0015 -0.0054 -0.0022 2452 PHE 36 CA -0.0015 -0.0056 -0.0023 2453 PHE 36 C -0.0013 -0.0063 -0.0024 2454 PHE 36 O -0.0011 -0.0066 -0.0020 2455 PHE 36 CB -0.0013 -0.0054 -0.0018 2456 PHE 36 CG -0.0015 -0.0047 -0.0016 2457 PHE 36 CD1 -0.0013 -0.0045 -0.0011 2458 PHE 36 CD2 -0.0017 -0.0042 -0.0021 2459 PHE 36 CE1 -0.0014 -0.0038 -0.0010 2460 PHE 36 CE2 -0.0018 -0.0037 -0.0019 2461 PHE 36 CZ -0.0016 -0.0035 -0.0013 2462 PRO 37 N -0.0046 -0.0056 0.0026 2463 PRO 37 CA -0.0046 -0.0045 0.0027 2464 PRO 37 C -0.0044 -0.0044 0.0022 2465 PRO 37 O -0.0042 -0.0034 0.0019 2466 PRO 37 CB -0.0049 -0.0041 0.0041 2467 PRO 37 CG -0.0052 -0.0050 0.0046 2468 PRO 37 CD -0.0050 -0.0058 0.0036 2469 THR 38 N -0.0045 -0.0054 0.0021 2470 THR 38 CA -0.0043 -0.0054 0.0014 2471 THR 38 C -0.0039 -0.0049 0.0003 2472 THR 38 O -0.0038 -0.0045 -0.0001 2473 THR 38 CB -0.0046 -0.0068 0.0019 2474 THR 38 OG1 -0.0043 -0.0075 0.0008 2475 THR 38 CG2 -0.0047 -0.0074 0.0020 2476 THR 39 N -0.0038 -0.0051 -0.0003 2477 THR 39 CA -0.0034 -0.0046 -0.0014 2478 THR 39 C -0.0032 -0.0032 -0.0015 2479 THR 39 O -0.0029 -0.0027 -0.0024 2480 THR 39 CB -0.0032 -0.0050 -0.0021 2481 THR 39 OG1 -0.0033 -0.0045 -0.0015 2482 THR 39 CG2 -0.0034 -0.0064 -0.0020 2483 LYS 40 N -0.0014 0.0001 -0.0021 2484 LYS 40 CA -0.0021 0.0006 -0.0023 2485 LYS 40 C -0.0024 0.0016 -0.0017 2486 LYS 40 O -0.0031 0.0021 -0.0019 2487 LYS 40 CB -0.0016 0.0004 -0.0020 2488 LYS 40 CG -0.0013 -0.0005 -0.0026 2489 LYS 40 CD -0.0007 -0.0006 -0.0021 2490 LYS 40 CE -0.0006 -0.0010 -0.0024 2491 LYS 40 NZ 0.0000 -0.0008 -0.0016 2492 THR 41 N -0.0020 0.0018 -0.0011 2493 THR 41 CA -0.0023 0.0028 -0.0004 2494 THR 41 C -0.0031 0.0030 -0.0010 2495 THR 41 O -0.0036 0.0039 -0.0006 2496 THR 41 CB -0.0017 0.0029 0.0002 2497 THR 41 OG1 -0.0016 0.0026 -0.0000 2498 THR 41 CG2 -0.0008 0.0026 0.0007 2499 TYR 42 N -0.0035 0.0027 -0.0017 2500 TYR 42 CA -0.0043 0.0030 -0.0021 2501 TYR 42 C -0.0050 0.0031 -0.0027 2502 TYR 42 O -0.0058 0.0034 -0.0031 2503 TYR 42 CB -0.0043 0.0024 -0.0027 2504 TYR 42 CG -0.0037 0.0025 -0.0021 2505 TYR 42 CD1 -0.0040 0.0032 -0.0017 2506 TYR 42 CD2 -0.0028 0.0018 -0.0019 2507 TYR 42 CE1 -0.0034 0.0032 -0.0011 2508 TYR 42 CE2 -0.0023 0.0018 -0.0013 2509 TYR 42 CZ -0.0026 0.0026 -0.0009 2510 TYR 42 OH -0.0020 0.0026 -0.0004 2511 PHE 43 N -0.0013 0.0024 -0.0047 2512 PHE 43 CA -0.0018 0.0028 -0.0053 2513 PHE 43 C -0.0005 0.0041 -0.0036 2514 PHE 43 O -0.0002 0.0033 -0.0032 2515 PHE 43 CB -0.0022 0.0000 -0.0060 2516 PHE 43 CG -0.0033 -0.0014 -0.0075 2517 PHE 43 CD1 -0.0028 -0.0031 -0.0070 2518 PHE 43 CD2 -0.0049 -0.0013 -0.0095 2519 PHE 43 CE1 -0.0040 -0.0044 -0.0086 2520 PHE 43 CE2 -0.0059 -0.0026 -0.0109 2521 PHE 43 CZ -0.0057 -0.0043 -0.0107 2522 PRO 44 N -0.0001 0.0065 -0.0029 2523 PRO 44 CA 0.0012 0.0076 -0.0011 2524 PRO 44 C 0.0002 0.0091 -0.0023 2525 PRO 44 O 0.0012 0.0095 -0.0011 2526 PRO 44 CB 0.0015 0.0098 -0.0006 2527 PRO 44 CG 0.0001 0.0101 -0.0024 2528 PRO 44 CD -0.0007 0.0076 -0.0036 2529 HIS 45 N -0.0010 0.0092 -0.0039 2530 HIS 45 CA -0.0020 0.0102 -0.0051 2531 HIS 45 C -0.0023 0.0082 -0.0056 2532 HIS 45 O -0.0032 0.0092 -0.0067 2533 HIS 45 CB -0.0035 0.0112 -0.0069 2534 HIS 45 CG -0.0049 0.0101 -0.0087 2535 HIS 45 ND1 -0.0040 0.0087 -0.0077 2536 HIS 45 CD2 -0.0063 0.0093 -0.0105 2537 HIS 45 CE1 -0.0052 0.0078 -0.0092 2538 HIS 45 NE2 -0.0067 0.0079 -0.0111 2539 PHE 46 N -0.0011 -0.0039 -0.0076 2540 PHE 46 CA -0.0014 -0.0048 -0.0070 2541 PHE 46 C -0.0005 -0.0052 -0.0059 2542 PHE 46 O 0.0001 -0.0053 -0.0054 2543 PHE 46 CB -0.0026 -0.0059 -0.0070 2544 PHE 46 CG -0.0035 -0.0058 -0.0078 2545 PHE 46 CD1 -0.0046 -0.0068 -0.0078 2546 PHE 46 CD2 -0.0039 -0.0049 -0.0089 2547 PHE 46 CE1 -0.0057 -0.0068 -0.0087 2548 PHE 46 CE2 -0.0046 -0.0051 -0.0093 2549 PHE 46 CZ -0.0060 -0.0060 -0.0096 2550 ASP 47 N -0.0003 -0.0060 -0.0051 2551 ASP 47 CA 0.0002 -0.0067 -0.0040 2552 ASP 47 C -0.0007 -0.0081 -0.0036 2553 ASP 47 O -0.0017 -0.0083 -0.0041 2554 ASP 47 CB 0.0006 -0.0070 -0.0035 2555 ASP 47 CG 0.0015 -0.0076 -0.0022 2556 ASP 47 OD1 0.0010 -0.0082 -0.0020 2557 ASP 47 OD2 0.0018 -0.0077 -0.0018 2558 LEU 48 N -0.0005 -0.0081 -0.0033 2559 LEU 48 CA -0.0016 -0.0093 -0.0032 2560 LEU 48 C -0.0013 -0.0101 -0.0022 2561 LEU 48 O -0.0019 -0.0112 -0.0017 2562 LEU 48 CB -0.0016 -0.0089 -0.0035 2563 LEU 48 CG -0.0020 -0.0082 -0.0045 2564 LEU 48 CD1 -0.0021 -0.0078 -0.0049 2565 LEU 48 CD2 -0.0033 -0.0083 -0.0055 2566 SER 49 N -0.0029 -0.0097 -0.0022 2567 SER 49 CA -0.0032 -0.0087 -0.0004 2568 SER 49 C -0.0033 -0.0087 -0.0003 2569 SER 49 O -0.0026 -0.0087 -0.0010 2570 SER 49 CB -0.0023 -0.0076 0.0005 2571 SER 49 OG -0.0011 -0.0073 -0.0002 2572 HIS 50 N -0.0045 -0.0083 0.0013 2573 HIS 50 CA -0.0046 -0.0081 0.0018 2574 HIS 50 C -0.0028 -0.0070 0.0019 2575 HIS 50 O -0.0023 -0.0063 0.0025 2576 HIS 50 CB -0.0061 -0.0078 0.0035 2577 HIS 50 CG -0.0062 -0.0078 0.0036 2578 HIS 50 ND1 -0.0056 -0.0065 0.0052 2579 HIS 50 CD2 -0.0064 -0.0083 0.0032 2580 HIS 50 CE1 -0.0057 -0.0066 0.0051 2581 HIS 50 NE2 -0.0062 -0.0077 0.0038 2582 GLY 51 N -0.0024 -0.0072 0.0012 2583 GLY 51 CA -0.0011 -0.0064 0.0012 2584 GLY 51 C 0.0004 -0.0063 0.0001 2585 GLY 51 O 0.0018 -0.0057 -0.0003 2586 SER 52 N -0.0001 -0.0055 -0.0038 2587 SER 52 CA 0.0002 -0.0063 -0.0037 2588 SER 52 C 0.0005 -0.0064 -0.0031 2589 SER 52 O 0.0006 -0.0058 -0.0027 2590 SER 52 CB 0.0000 -0.0065 -0.0042 2591 SER 52 OG 0.0003 -0.0071 -0.0040 2592 ALA 53 N 0.0009 -0.0068 -0.0026 2593 ALA 53 CA 0.0013 -0.0070 -0.0020 2594 ALA 53 C 0.0014 -0.0070 -0.0019 2595 ALA 53 O 0.0016 -0.0069 -0.0014 2596 ALA 53 CB 0.0016 -0.0074 -0.0017 2597 GLN 54 N 0.0012 -0.0074 -0.0026 2598 GLN 54 CA 0.0012 -0.0077 -0.0026 2599 GLN 54 C 0.0011 -0.0069 -0.0025 2600 GLN 54 O 0.0012 -0.0068 -0.0021 2601 GLN 54 CB 0.0011 -0.0081 -0.0032 2602 GLN 54 CG 0.0013 -0.0088 -0.0032 2603 GLN 54 CD 0.0011 -0.0094 -0.0039 2604 GLN 54 OE1 0.0008 -0.0092 -0.0045 2605 GLN 54 NE2 0.0013 -0.0099 -0.0039 2606 VAL 55 N 0.0027 -0.0044 -0.0016 2607 VAL 55 CA -0.0010 -0.0043 -0.0019 2608 VAL 55 C 0.0007 -0.0026 0.0004 2609 VAL 55 O -0.0002 -0.0029 -0.0001 2610 VAL 55 CB -0.0049 -0.0032 -0.0010 2611 VAL 55 CG1 -0.0080 -0.0026 -0.0006 2612 VAL 55 CG2 -0.0061 -0.0052 -0.0035 2613 LYS 56 N 0.0026 -0.0002 0.0034 2614 LYS 56 CA 0.0040 0.0015 0.0056 2615 LYS 56 C 0.0066 0.0003 0.0045 2616 LYS 56 O 0.0069 0.0002 0.0044 2617 LYS 56 CB 0.0061 0.0038 0.0086 2618 LYS 56 CG 0.0026 0.0058 0.0106 2619 LYS 56 CD 0.0061 0.0092 0.0151 2620 LYS 56 CE 0.0012 0.0106 0.0162 2621 LYS 56 NZ 0.0052 0.0126 0.0191 2622 GLY 57 N 0.0096 -0.0017 0.0024 2623 GLY 57 CA 0.0127 -0.0032 0.0010 2624 GLY 57 C 0.0112 -0.0052 -0.0016 2625 GLY 57 O 0.0127 -0.0057 -0.0021 2626 HIS 58 N 0.0118 -0.0033 -0.0046 2627 HIS 58 CA 0.0069 -0.0059 -0.0104 2628 HIS 58 C 0.0008 -0.0025 -0.0063 2629 HIS 58 O -0.0004 -0.0041 -0.0094 2630 HIS 58 CB 0.0029 -0.0081 -0.0155 2631 HIS 58 CG -0.0009 -0.0111 -0.0216 2632 HIS 58 ND1 0.0042 -0.0141 -0.0255 2633 HIS 58 CD2 -0.0078 -0.0115 -0.0242 2634 HIS 58 CE1 -0.0024 -0.0158 -0.0303 2635 HIS 58 NE2 -0.0102 -0.0144 -0.0299 2636 GLY 59 N -0.0027 0.0007 -0.0017 2637 GLY 59 CA -0.0078 0.0032 0.0014 2638 GLY 59 C -0.0051 0.0048 0.0050 2639 GLY 59 O -0.0088 0.0049 0.0040 2640 LYS 60 N 0.0025 0.0054 0.0080 2641 LYS 60 CA 0.0070 0.0059 0.0101 2642 LYS 60 C 0.0083 0.0027 0.0050 2643 LYS 60 O 0.0073 0.0031 0.0052 2644 LYS 60 CB 0.0145 0.0076 0.0152 2645 LYS 60 CG 0.0175 0.0084 0.0173 2646 LYS 60 CD 0.0240 0.0110 0.0236 2647 LYS 60 CE 0.0240 0.0127 0.0267 2648 LYS 60 NZ 0.0321 0.0077 0.0202 2649 LYS 61 N 0.0162 -0.0028 -0.0021 2650 LYS 61 CA 0.0176 -0.0067 -0.0098 2651 LYS 61 C 0.0052 -0.0059 -0.0144 2652 LYS 61 O 0.0052 -0.0066 -0.0157 2653 LYS 61 CB 0.0215 -0.0122 -0.0194 2654 LYS 61 CG 0.0323 -0.0136 -0.0169 2655 LYS 61 CD 0.0380 -0.0185 -0.0244 2656 LYS 61 CE 0.0524 -0.0196 -0.0193 2657 LYS 61 NZ 0.0509 -0.0253 -0.0323 2658 VAL 62 N -0.0036 -0.0045 -0.0158 2659 VAL 62 CA -0.0144 -0.0032 -0.0185 2660 VAL 62 C -0.0194 0.0012 -0.0119 2661 VAL 62 O -0.0224 0.0010 -0.0138 2662 VAL 62 CB -0.0223 -0.0025 -0.0212 2663 VAL 62 CG1 -0.0337 -0.0003 -0.0222 2664 VAL 62 CG2 -0.0186 -0.0078 -0.0305 2665 ALA 63 N -0.0160 0.0050 -0.0020 2666 ALA 63 CA -0.0198 0.0103 0.0073 2667 ALA 63 C -0.0154 0.0092 0.0073 2668 ALA 63 O -0.0186 0.0108 0.0091 2669 ALA 63 CB -0.0187 0.0148 0.0176 2670 ASP 64 N -0.0026 0.0032 0.0018 2671 ASP 64 CA 0.0005 0.0027 0.0024 2672 ASP 64 C -0.0005 0.0008 -0.0010 2673 ASP 64 O -0.0004 0.0011 -0.0005 2674 ASP 64 CB 0.0061 0.0018 0.0031 2675 ASP 64 CG 0.0090 0.0038 0.0073 2676 ASP 64 OD1 0.0063 0.0060 0.0097 2677 ASP 64 OD2 0.0118 0.0023 0.0060 2678 ALA 65 N -0.0018 -0.0013 -0.0049 2679 ALA 65 CA -0.0032 -0.0032 -0.0084 2680 ALA 65 C -0.0078 -0.0017 -0.0078 2681 ALA 65 O -0.0085 -0.0018 -0.0083 2682 ALA 65 CB -0.0050 -0.0052 -0.0123 2683 LEU 66 N -0.0114 0.0007 -0.0055 2684 LEU 66 CA -0.0159 0.0025 -0.0044 2685 LEU 66 C -0.0146 0.0043 -0.0011 2686 LEU 66 O -0.0163 0.0047 -0.0011 2687 LEU 66 CB -0.0196 0.0042 -0.0033 2688 LEU 66 CG -0.0222 0.0022 -0.0074 2689 LEU 66 CD1 -0.0241 0.0037 -0.0058 2690 LEU 66 CD2 -0.0254 0.0013 -0.0101 2691 THR 67 N -0.0147 0.0066 0.0009 2692 THR 67 CA -0.0120 0.0086 0.0020 2693 THR 67 C -0.0094 0.0062 0.0010 2694 THR 67 O -0.0084 0.0067 0.0013 2695 THR 67 CB -0.0104 0.0106 0.0031 2696 THR 67 OG1 -0.0128 0.0129 0.0041 2697 THR 67 CG2 -0.0071 0.0123 0.0041 2698 ASN 68 N -0.0080 0.0036 -0.0002 2699 ASN 68 CA -0.0060 0.0015 -0.0012 2700 ASN 68 C -0.0076 -0.0003 -0.0021 2701 ASN 68 O -0.0054 -0.0012 -0.0025 2702 ASN 68 CB -0.0046 -0.0008 -0.0022 2703 ASN 68 CG -0.0020 -0.0036 -0.0035 2704 ASN 68 OD1 -0.0003 -0.0035 -0.0033 2705 ASN 68 ND2 -0.0025 -0.0071 -0.0052 2706 ALA 69 N -0.0108 -0.0010 -0.0027 2707 ALA 69 CA -0.0128 -0.0026 -0.0036 2708 ALA 69 C -0.0124 -0.0001 -0.0024 2709 ALA 69 O -0.0123 -0.0017 -0.0031 2710 ALA 69 CB -0.0163 -0.0035 -0.0043 2711 VAL 70 N -0.0107 0.0026 -0.0015 2712 VAL 70 CA -0.0099 0.0042 -0.0012 2713 VAL 70 C -0.0070 0.0041 -0.0014 2714 VAL 70 O -0.0068 0.0038 -0.0015 2715 VAL 70 CB -0.0109 0.0063 -0.0008 2716 VAL 70 CG1 -0.0102 0.0076 -0.0006 2717 VAL 70 CG2 -0.0134 0.0063 -0.0007 2718 ALA 71 N -0.0062 0.0043 -0.0014 2719 ALA 71 CA -0.0034 0.0043 -0.0015 2720 ALA 71 C -0.0030 0.0026 -0.0018 2721 ALA 71 O -0.0010 0.0022 -0.0020 2722 ALA 71 CB -0.0027 0.0050 -0.0014 2723 HIS 72 N -0.0037 0.0006 -0.0021 2724 HIS 72 CA -0.0036 -0.0014 -0.0025 2725 HIS 72 C -0.0044 -0.0026 -0.0026 2726 HIS 72 O -0.0051 -0.0049 -0.0030 2727 HIS 72 CB -0.0030 -0.0033 -0.0028 2728 HIS 72 CG -0.0018 -0.0025 -0.0028 2729 HIS 72 ND1 0.0012 -0.0028 -0.0030 2730 HIS 72 CD2 -0.0015 -0.0005 -0.0024 2731 HIS 72 CE1 0.0016 -0.0019 -0.0028 2732 HIS 72 NE2 0.0006 -0.0003 -0.0025 2733 VAL 73 N -0.0050 0.0013 -0.0018 2734 VAL 73 CA -0.0071 0.0012 -0.0028 2735 VAL 73 C -0.0059 -0.0010 -0.0024 2736 VAL 73 O -0.0082 -0.0021 -0.0036 2737 VAL 73 CB -0.0091 0.0053 -0.0034 2738 VAL 73 CG1 -0.0063 0.0068 -0.0019 2739 VAL 73 CG2 -0.0120 0.0044 -0.0048 2740 ASP 74 N -0.0028 -0.0010 -0.0009 2741 ASP 74 CA -0.0016 -0.0031 -0.0005 2742 ASP 74 C -0.0013 -0.0071 -0.0007 2743 ASP 74 O -0.0002 -0.0080 -0.0002 2744 ASP 74 CB 0.0014 -0.0011 0.0011 2745 ASP 74 CG 0.0018 0.0023 0.0016 2746 ASP 74 OD1 -0.0006 0.0044 0.0006 2747 ASP 74 OD2 0.0029 0.0047 0.0023 2748 ASP 75 N -0.0017 -0.0077 -0.0009 2749 ASP 75 CA -0.0012 -0.0120 -0.0011 2750 ASP 75 C -0.0034 -0.0121 -0.0021 2751 ASP 75 O -0.0028 -0.0144 -0.0020 2752 ASP 75 CB 0.0023 -0.0122 0.0006 2753 ASP 75 CG 0.0043 -0.0153 0.0013 2754 ASP 75 OD1 0.0036 -0.0176 0.0008 2755 ASP 75 OD2 0.0050 -0.0144 0.0017 2756 MET 76 N -0.0068 -0.0093 -0.0019 2757 MET 76 CA -0.0076 -0.0112 -0.0037 2758 MET 76 C -0.0079 -0.0127 -0.0036 2759 MET 76 O -0.0084 -0.0147 -0.0041 2760 MET 76 CB -0.0076 -0.0095 -0.0060 2761 MET 76 CG -0.0074 -0.0086 -0.0064 2762 MET 76 SD -0.0078 -0.0075 -0.0098 2763 MET 76 CE -0.0073 -0.0053 -0.0095 2764 PRO 77 N -0.0076 -0.0120 -0.0030 2765 PRO 77 CA -0.0080 -0.0140 -0.0027 2766 PRO 77 C -0.0083 -0.0162 -0.0016 2767 PRO 77 O -0.0089 -0.0182 -0.0022 2768 PRO 77 CB -0.0076 -0.0125 -0.0020 2769 PRO 77 CG -0.0070 -0.0100 -0.0023 2770 PRO 77 CD -0.0070 -0.0099 -0.0021 2771 ASN 78 N -0.0080 -0.0162 0.0005 2772 ASN 78 CA -0.0082 -0.0181 0.0018 2773 ASN 78 C -0.0086 -0.0195 0.0011 2774 ASN 78 O -0.0091 -0.0215 0.0008 2775 ASN 78 CB -0.0075 -0.0175 0.0047 2776 ASN 78 CG -0.0078 -0.0201 0.0065 2777 ASN 78 OD1 -0.0082 -0.0216 0.0062 2778 ASN 78 ND2 -0.0078 -0.0205 0.0071 2779 ALA 79 N -0.0120 -0.0172 -0.0048 2780 ALA 79 CA -0.0127 -0.0190 -0.0063 2781 ALA 79 C -0.0122 -0.0197 -0.0074 2782 ALA 79 O -0.0133 -0.0212 -0.0082 2783 ALA 79 CB -0.0115 -0.0199 -0.0082 2784 LEU 80 N -0.0103 -0.0184 -0.0075 2785 LEU 80 CA -0.0096 -0.0188 -0.0085 2786 LEU 80 C -0.0098 -0.0175 -0.0069 2787 LEU 80 O -0.0092 -0.0176 -0.0076 2788 LEU 80 CB -0.0073 -0.0181 -0.0096 2789 LEU 80 CG -0.0063 -0.0190 -0.0113 2790 LEU 80 CD1 -0.0040 -0.0183 -0.0124 2791 LEU 80 CD2 -0.0075 -0.0209 -0.0124 2792 SER 81 N -0.0114 -0.0169 -0.0050 2793 SER 81 CA -0.0117 -0.0157 -0.0035 2794 SER 81 C -0.0125 -0.0168 -0.0040 2795 SER 81 O -0.0117 -0.0160 -0.0038 2796 SER 81 CB -0.0137 -0.0157 -0.0018 2797 SER 81 OG -0.0134 -0.0140 -0.0002 2798 ALA 82 N -0.0247 -0.0139 -0.0067 2799 ALA 82 CA -0.0259 -0.0135 -0.0063 2800 ALA 82 C -0.0193 -0.0146 -0.0081 2801 ALA 82 O -0.0171 -0.0134 -0.0075 2802 ALA 82 CB -0.0335 -0.0182 -0.0088 2803 LEU 83 N -0.0132 -0.0201 -0.0133 2804 LEU 83 CA -0.0069 -0.0215 -0.0152 2805 LEU 83 C 0.0003 -0.0160 -0.0121 2806 LEU 83 O 0.0050 -0.0147 -0.0118 2807 LEU 83 CB -0.0030 -0.0271 -0.0202 2808 LEU 83 CG -0.0070 -0.0338 -0.0248 2809 LEU 83 CD1 -0.0018 -0.0392 -0.0298 2810 LEU 83 CD2 -0.0076 -0.0343 -0.0251 2811 SER 84 N 0.0006 -0.0124 -0.0093 2812 SER 84 CA 0.0062 -0.0063 -0.0054 2813 SER 84 C 0.0043 -0.0012 -0.0012 2814 SER 84 O 0.0089 0.0022 0.0008 2815 SER 84 CB 0.0080 -0.0004 -0.0011 2816 SER 84 OG 0.0069 -0.0051 -0.0046 2817 ASP 85 N -0.0014 0.0030 -0.0014 2818 ASP 85 CA -0.0019 0.0070 0.0004 2819 ASP 85 C 0.0002 0.0069 0.0009 2820 ASP 85 O 0.0023 0.0095 0.0027 2821 ASP 85 CB -0.0068 0.0081 -0.0003 2822 ASP 85 CG -0.0092 0.0098 -0.0000 2823 ASP 85 OD1 -0.0079 0.0109 0.0008 2824 ASP 85 OD2 -0.0139 0.0096 -0.0013 2825 LEU 86 N 0.0000 0.0028 -0.0011 2826 LEU 86 CA 0.0017 0.0023 -0.0009 2827 LEU 86 C 0.0068 0.0026 0.0005 2828 LEU 86 O 0.0089 0.0045 0.0020 2829 LEU 86 CB 0.0004 -0.0020 -0.0033 2830 LEU 86 CG 0.0011 -0.0030 -0.0036 2831 LEU 86 CD1 -0.0013 0.0006 -0.0025 2832 LEU 86 CD2 0.0003 -0.0073 -0.0058 2833 HIS 87 N 0.0090 0.0002 -0.0000 2834 HIS 87 CA 0.0140 -0.0005 0.0009 2835 HIS 87 C 0.0164 0.0044 0.0038 2836 HIS 87 O 0.0195 0.0055 0.0051 2837 HIS 87 CB 0.0168 -0.0041 -0.0001 2838 HIS 87 CG 0.0161 -0.0085 -0.0024 2839 HIS 87 ND1 0.0120 -0.0102 -0.0043 2840 HIS 87 CD2 0.0191 -0.0113 -0.0030 2841 HIS 87 CE1 0.0127 -0.0142 -0.0060 2842 HIS 87 NE2 0.0166 -0.0146 -0.0052 2843 ALA 88 N 0.0144 0.0073 0.0042 2844 ALA 88 CA 0.0150 0.0088 0.0053 2845 ALA 88 C 0.0153 0.0124 0.0068 2846 ALA 88 O 0.0166 0.0133 0.0085 2847 ALA 88 CB 0.0137 0.0086 0.0039 2848 HIS 89 N 0.0133 0.0140 0.0052 2849 HIS 89 CA 0.0127 0.0174 0.0057 2850 HIS 89 C 0.0134 0.0184 0.0068 2851 HIS 89 O 0.0138 0.0211 0.0081 2852 HIS 89 CB 0.0103 0.0187 0.0036 2853 HIS 89 CG 0.0102 0.0176 0.0031 2854 HIS 89 ND1 0.0115 0.0180 0.0046 2855 HIS 89 CD2 0.0086 0.0163 0.0010 2856 HIS 89 CE1 0.0106 0.0164 0.0031 2857 HIS 89 NE2 0.0089 0.0155 0.0010 2858 LYS 90 N 0.0138 0.0169 0.0067 2859 LYS 90 CA 0.0138 0.0177 0.0070 2860 LYS 90 C 0.0162 0.0162 0.0091 2861 LYS 90 O 0.0178 0.0175 0.0112 2862 LYS 90 CB 0.0120 0.0183 0.0052 2863 LYS 90 CG 0.0132 0.0191 0.0068 2864 LYS 90 CD 0.0105 0.0191 0.0040 2865 LYS 90 CE 0.0116 0.0214 0.0058 2866 LYS 90 NZ 0.0083 0.0240 0.0033 2867 LEU 91 N 0.0108 0.0073 0.0059 2868 LEU 91 CA 0.0115 0.0068 0.0062 2869 LEU 91 C 0.0120 0.0071 0.0063 2870 LEU 91 O 0.0127 0.0070 0.0065 2871 LEU 91 CB 0.0111 0.0059 0.0061 2872 LEU 91 CG 0.0106 0.0058 0.0059 2873 LEU 91 CD1 0.0102 0.0049 0.0059 2874 LEU 91 CD2 0.0111 0.0057 0.0061 2875 ARG 92 N 0.0116 0.0072 0.0062 2876 ARG 92 CA 0.0120 0.0076 0.0063 2877 ARG 92 C 0.0127 0.0070 0.0066 2878 ARG 92 O 0.0133 0.0072 0.0067 2879 ARG 92 CB 0.0123 0.0084 0.0063 2880 ARG 92 CG 0.0116 0.0090 0.0060 2881 ARG 92 CD 0.0118 0.0099 0.0060 2882 ARG 92 NE 0.0114 0.0102 0.0058 2883 ARG 92 CZ 0.0119 0.0113 0.0059 2884 ARG 92 NH1 0.0120 0.0104 0.0060 2885 ARG 92 NH2 0.0116 0.0113 0.0058 2886 VAL 93 N 0.0124 0.0062 0.0065 2887 VAL 93 CA 0.0130 0.0056 0.0068 2888 VAL 93 C 0.0130 0.0056 0.0068 2889 VAL 93 O 0.0124 0.0056 0.0066 2890 VAL 93 CB 0.0125 0.0047 0.0067 2891 VAL 93 CG1 0.0130 0.0040 0.0069 2892 VAL 93 CG2 0.0124 0.0047 0.0067 2893 ASP 94 N 0.0095 0.0043 0.0063 2894 ASP 94 CA 0.0101 0.0032 0.0067 2895 ASP 94 C 0.0112 0.0032 0.0058 2896 ASP 94 O 0.0111 0.0041 0.0052 2897 ASP 94 CB 0.0092 0.0029 0.0077 2898 ASP 94 CG 0.0097 0.0015 0.0084 2899 ASP 94 OD1 0.0095 0.0008 0.0092 2900 ASP 94 OD2 0.0105 0.0013 0.0080 2901 PRO 95 N 0.0122 0.0021 0.0059 2902 PRO 95 CA 0.0135 0.0021 0.0050 2903 PRO 95 C 0.0132 0.0023 0.0051 2904 PRO 95 O 0.0139 0.0029 0.0040 2905 PRO 95 CB 0.0143 0.0008 0.0054 2906 PRO 95 CG 0.0139 0.0006 0.0059 2907 PRO 95 CD 0.0125 0.0010 0.0066 2908 VAL 96 N 0.0123 0.0023 0.0058 2909 VAL 96 CA 0.0121 0.0025 0.0057 2910 VAL 96 C 0.0118 0.0039 0.0048 2911 VAL 96 O 0.0122 0.0043 0.0042 2912 VAL 96 CB 0.0110 0.0022 0.0068 2913 VAL 96 CG1 0.0114 0.0009 0.0076 2914 VAL 96 CG2 0.0098 0.0029 0.0072 2915 ASN 97 N 0.0087 -0.0030 0.0054 2916 ASN 97 CA 0.0090 -0.0001 0.0058 2917 ASN 97 C 0.0104 0.0006 0.0043 2918 ASN 97 O 0.0104 0.0030 0.0049 2919 ASN 97 CB 0.0094 0.0018 0.0058 2920 ASN 97 CG 0.0076 0.0017 0.0077 2921 ASN 97 OD1 0.0058 0.0025 0.0099 2922 ASN 97 ND2 0.0078 0.0002 0.0071 2923 PHE 98 N 0.0119 -0.0009 0.0023 2924 PHE 98 CA 0.0136 -0.0006 0.0006 2925 PHE 98 C 0.0126 -0.0010 0.0016 2926 PHE 98 O 0.0133 0.0008 0.0013 2927 PHE 98 CB 0.0154 -0.0022 -0.0017 2928 PHE 98 CG 0.0166 -0.0012 -0.0028 2929 PHE 98 CD1 0.0184 0.0010 -0.0043 2930 PHE 98 CD2 0.0159 -0.0019 -0.0022 2931 PHE 98 CE1 0.0196 0.0023 -0.0053 2932 PHE 98 CE2 0.0174 -0.0003 -0.0034 2933 PHE 98 CZ 0.0192 0.0015 -0.0050 2934 LYS 99 N 0.0110 -0.0032 0.0029 2935 LYS 99 CA 0.0099 -0.0037 0.0039 2936 LYS 99 C 0.0091 -0.0011 0.0053 2937 LYS 99 O 0.0088 -0.0007 0.0059 2938 LYS 99 CB 0.0084 -0.0070 0.0047 2939 LYS 99 CG 0.0073 -0.0074 0.0058 2940 LYS 99 CD 0.0056 -0.0110 0.0068 2941 LYS 99 CE 0.0028 -0.0086 0.0104 2942 LYS 99 NZ 0.0008 -0.0105 0.0122 2943 LEU 100 N 0.0087 -0.0020 0.0074 2944 LEU 100 CA 0.0080 -0.0019 0.0064 2945 LEU 100 C 0.0081 -0.0018 0.0064 2946 LEU 100 O 0.0081 -0.0011 0.0057 2947 LEU 100 CB 0.0071 -0.0027 0.0060 2948 LEU 100 CG 0.0070 -0.0029 0.0061 2949 LEU 100 CD1 0.0060 -0.0037 0.0057 2950 LEU 100 CD2 0.0072 -0.0020 0.0056 2951 LEU 101 N 0.0082 -0.0024 0.0072 2952 LEU 101 CA 0.0082 -0.0023 0.0071 2953 LEU 101 C 0.0091 -0.0013 0.0073 2954 LEU 101 O 0.0091 -0.0008 0.0068 2955 LEU 101 CB 0.0082 -0.0032 0.0080 2956 LEU 101 CG 0.0083 -0.0031 0.0081 2957 LEU 101 CD1 0.0077 -0.0029 0.0070 2958 LEU 101 CD2 0.0081 -0.0040 0.0088 2959 SER 102 N 0.0098 -0.0010 0.0079 2960 SER 102 CA 0.0107 -0.0002 0.0082 2961 SER 102 C 0.0106 0.0007 0.0071 2962 SER 102 O 0.0110 0.0014 0.0070 2963 SER 102 CB 0.0113 -0.0001 0.0089 2964 SER 102 OG 0.0114 -0.0008 0.0099 2965 HIS 103 N 0.0064 -0.0003 0.0077 2966 HIS 103 CA 0.0062 0.0006 0.0070 2967 HIS 103 C 0.0061 0.0002 0.0068 2968 HIS 103 O 0.0061 0.0010 0.0067 2969 HIS 103 CB 0.0058 0.0005 0.0059 2970 HIS 103 CG 0.0055 0.0013 0.0050 2971 HIS 103 ND1 0.0050 0.0007 0.0040 2972 HIS 103 CD2 0.0056 0.0024 0.0049 2973 HIS 103 CE1 0.0049 0.0018 0.0035 2974 HIS 103 NE2 0.0052 0.0028 0.0039 2975 CYS 104 N 0.0059 -0.0008 0.0065 2976 CYS 104 CA 0.0057 -0.0013 0.0063 2977 CYS 104 C 0.0062 -0.0011 0.0073 2978 CYS 104 O 0.0061 -0.0008 0.0071 2979 CYS 104 CB 0.0054 -0.0025 0.0059 2980 CYS 104 SG 0.0049 -0.0026 0.0046 2981 LEU 105 N 0.0065 -0.0013 0.0083 2982 LEU 105 CA 0.0069 -0.0010 0.0091 2983 LEU 105 C 0.0070 0.0003 0.0091 2984 LEU 105 O 0.0072 0.0007 0.0094 2985 LEU 105 CB 0.0073 -0.0013 0.0101 2986 LEU 105 CG 0.0076 -0.0016 0.0111 2987 LEU 105 CD1 0.0074 -0.0030 0.0110 2988 LEU 105 CD2 0.0078 -0.0024 0.0118 2989 LEU 106 N 0.0086 0.0000 0.0119 2990 LEU 106 CA 0.0090 0.0007 0.0115 2991 LEU 106 C 0.0086 0.0012 0.0109 2992 LEU 106 O 0.0090 0.0018 0.0106 2993 LEU 106 CB 0.0095 0.0006 0.0118 2994 LEU 106 CG 0.0101 0.0003 0.0124 2995 LEU 106 CD1 0.0102 0.0001 0.0125 2996 LEU 106 CD2 0.0109 0.0006 0.0124 2997 VAL 107 N 0.0079 0.0011 0.0107 2998 VAL 107 CA 0.0073 0.0015 0.0101 2999 VAL 107 C 0.0072 0.0019 0.0098 3000 VAL 107 O 0.0074 0.0025 0.0093 3001 VAL 107 CB 0.0064 0.0012 0.0100 3002 VAL 107 CG1 0.0059 0.0016 0.0094 3003 VAL 107 CG2 0.0066 0.0010 0.0102 3004 THR 108 N 0.0072 0.0015 0.0101 3005 THR 108 CA 0.0071 0.0018 0.0098 3006 THR 108 C 0.0079 0.0023 0.0098 3007 THR 108 O 0.0079 0.0028 0.0093 3008 THR 108 CB 0.0069 0.0011 0.0102 3009 THR 108 OG1 0.0062 0.0006 0.0103 3010 THR 108 CG2 0.0068 0.0013 0.0100 3011 LEU 109 N 0.0080 0.0040 0.0163 3012 LEU 109 CA 0.0079 0.0031 0.0151 3013 LEU 109 C 0.0094 0.0018 0.0141 3014 LEU 109 O 0.0092 0.0008 0.0128 3015 LEU 109 CB 0.0076 0.0040 0.0162 3016 LEU 109 CG 0.0056 0.0050 0.0168 3017 LEU 109 CD1 0.0060 0.0060 0.0181 3018 LEU 109 CD2 0.0040 0.0045 0.0157 3019 ALA 110 N 0.0115 0.0021 0.0151 3020 ALA 110 CA 0.0135 0.0010 0.0144 3021 ALA 110 C 0.0130 0.0000 0.0130 3022 ALA 110 O 0.0137 -0.0014 0.0116 3023 ALA 110 CB 0.0153 0.0016 0.0157 3024 ALA 111 N 0.0122 0.0004 0.0132 3025 ALA 111 CA 0.0120 -0.0004 0.0121 3026 ALA 111 C 0.0104 -0.0014 0.0105 3027 ALA 111 O 0.0104 -0.0023 0.0094 3028 ALA 111 CB 0.0114 0.0004 0.0130 3029 HIS 112 N 0.0104 0.0023 0.0150 3030 HIS 112 CA 0.0088 0.0021 0.0130 3031 HIS 112 C 0.0098 0.0012 0.0119 3032 HIS 112 O 0.0087 0.0008 0.0099 3033 HIS 112 CB 0.0064 0.0034 0.0137 3034 HIS 112 CG 0.0054 0.0040 0.0140 3035 HIS 112 ND1 0.0051 0.0053 0.0167 3036 HIS 112 CD2 0.0039 0.0042 0.0129 3037 HIS 112 CE1 0.0039 0.0057 0.0164 3038 HIS 112 NE2 0.0030 0.0050 0.0141 3039 LEU 113 N 0.0112 0.0009 0.0124 3040 LEU 113 CA 0.0123 0.0001 0.0116 3041 LEU 113 C 0.0150 -0.0011 0.0115 3042 LEU 113 O 0.0158 -0.0012 0.0121 3043 LEU 113 CB 0.0120 0.0008 0.0129 3044 LEU 113 CG 0.0097 0.0016 0.0127 3045 LEU 113 CD1 0.0106 0.0021 0.0145 3046 LEU 113 CD2 0.0081 0.0016 0.0111 3047 PRO 114 N 0.0157 -0.0020 0.0100 3048 PRO 114 CA 0.0182 -0.0033 0.0097 3049 PRO 114 C 0.0193 -0.0042 0.0086 3050 PRO 114 O 0.0205 -0.0039 0.0104 3051 PRO 114 CB 0.0175 -0.0033 0.0089 3052 PRO 114 CG 0.0156 -0.0034 0.0068 3053 PRO 114 CD 0.0137 -0.0019 0.0085 3054 ALA 115 N 0.0163 -0.0057 0.0099 3055 ALA 115 CA 0.0163 -0.0058 0.0099 3056 ALA 115 C 0.0162 -0.0053 0.0103 3057 ALA 115 O 0.0165 -0.0052 0.0105 3058 ALA 115 CB 0.0158 -0.0063 0.0092 3059 GLU 116 N 0.0157 -0.0049 0.0108 3060 GLU 116 CA 0.0153 -0.0044 0.0113 3061 GLU 116 C 0.0158 -0.0038 0.0119 3062 GLU 116 O 0.0159 -0.0035 0.0122 3063 GLU 116 CB 0.0145 -0.0041 0.0115 3064 GLU 116 CG 0.0139 -0.0049 0.0107 3065 GLU 116 CD 0.0136 -0.0051 0.0105 3066 GLU 116 OE1 0.0137 -0.0050 0.0106 3067 GLU 116 OE2 0.0135 -0.0056 0.0099 3068 PHE 117 N 0.0162 -0.0038 0.0119 3069 PHE 117 CA 0.0168 -0.0033 0.0124 3070 PHE 117 C 0.0177 -0.0033 0.0125 3071 PHE 117 O 0.0183 -0.0033 0.0125 3072 PHE 117 CB 0.0169 -0.0032 0.0125 3073 PHE 117 CG 0.0171 -0.0027 0.0131 3074 PHE 117 CD1 0.0165 -0.0022 0.0136 3075 PHE 117 CD2 0.0179 -0.0025 0.0133 3076 PHE 117 CE1 0.0167 -0.0015 0.0143 3077 PHE 117 CE2 0.0182 -0.0019 0.0139 3078 PHE 117 CZ 0.0175 -0.0015 0.0143 3079 THR 118 N 0.0169 -0.0015 0.0136 3080 THR 118 CA 0.0143 -0.0002 0.0132 3081 THR 118 C 0.0134 0.0000 0.0100 3082 THR 118 O 0.0152 -0.0010 0.0086 3083 THR 118 CB 0.0131 0.0006 0.0148 3084 THR 118 OG1 0.0137 0.0005 0.0177 3085 THR 118 CG2 0.0134 0.0004 0.0142 3086 PRO 119 N 0.0115 0.0010 0.0095 3087 PRO 119 CA 0.0105 0.0012 0.0066 3088 PRO 119 C 0.0112 0.0008 0.0060 3089 PRO 119 O 0.0118 0.0003 0.0036 3090 PRO 119 CB 0.0080 0.0026 0.0063 3091 PRO 119 CG 0.0077 0.0029 0.0085 3092 PRO 119 CD 0.0096 0.0021 0.0110 3093 ALA 120 N 0.0103 0.0014 0.0077 3094 ALA 120 CA 0.0105 0.0013 0.0071 3095 ALA 120 C 0.0132 -0.0002 0.0069 3096 ALA 120 O 0.0138 -0.0006 0.0051 3097 ALA 120 CB 0.0094 0.0021 0.0093 3098 VAL 121 N 0.0104 0.0001 0.0131 3099 VAL 121 CA 0.0115 -0.0007 0.0132 3100 VAL 121 C 0.0120 -0.0009 0.0119 3101 VAL 121 O 0.0124 -0.0012 0.0116 3102 VAL 121 CB 0.0119 -0.0012 0.0143 3103 VAL 121 CG1 0.0129 -0.0020 0.0142 3104 VAL 121 CG2 0.0113 -0.0009 0.0154 3105 HIS 122 N 0.0119 -0.0008 0.0114 3106 HIS 122 CA 0.0124 -0.0009 0.0101 3107 HIS 122 C 0.0121 -0.0006 0.0093 3108 HIS 122 O 0.0127 -0.0010 0.0086 3109 HIS 122 CB 0.0122 -0.0007 0.0099 3110 HIS 122 CG 0.0124 -0.0007 0.0087 3111 HIS 122 ND1 0.0123 -0.0006 0.0083 3112 HIS 122 CD2 0.0130 -0.0010 0.0077 3113 HIS 122 CE1 0.0127 -0.0007 0.0072 3114 HIS 122 NE2 0.0132 -0.0011 0.0068 3115 ALA 123 N 0.0112 0.0002 0.0093 3116 ALA 123 CA 0.0108 0.0005 0.0084 3117 ALA 123 C 0.0112 0.0002 0.0086 3118 ALA 123 O 0.0116 0.0000 0.0078 3119 ALA 123 CB 0.0097 0.0014 0.0086 3120 SER 124 N 0.0083 0.0035 0.0102 3121 SER 124 CA 0.0090 0.0033 0.0098 3122 SER 124 C 0.0104 0.0030 0.0097 3123 SER 124 O 0.0108 0.0028 0.0089 3124 SER 124 CB 0.0091 0.0034 0.0110 3125 SER 124 OG 0.0080 0.0037 0.0114 3126 LEU 125 N 0.0107 0.0030 0.0104 3127 LEU 125 CA 0.0119 0.0028 0.0101 3128 LEU 125 C 0.0121 0.0026 0.0089 3129 LEU 125 O 0.0128 0.0023 0.0082 3130 LEU 125 CB 0.0123 0.0028 0.0111 3131 LEU 125 CG 0.0128 0.0029 0.0122 3132 LEU 125 CD1 0.0128 0.0030 0.0132 3133 LEU 125 CD2 0.0139 0.0026 0.0121 3134 ASP 126 N 0.0111 0.0027 0.0085 3135 ASP 126 CA 0.0111 0.0026 0.0073 3136 ASP 126 C 0.0111 0.0024 0.0065 3137 ASP 126 O 0.0116 0.0022 0.0055 3138 ASP 126 CB 0.0101 0.0027 0.0073 3139 ASP 126 CG 0.0101 0.0026 0.0062 3140 ASP 126 OD1 0.0111 0.0024 0.0061 3141 ASP 126 OD2 0.0094 0.0026 0.0054 3142 LYS 127 N 0.0130 0.0043 0.0048 3143 LYS 127 CA 0.0118 0.0063 0.0053 3144 LYS 127 C 0.0103 0.0058 0.0057 3145 LYS 127 O 0.0098 0.0077 0.0060 3146 LYS 127 CB 0.0104 0.0065 0.0057 3147 LYS 127 CG 0.0118 0.0072 0.0054 3148 LYS 127 CD 0.0104 0.0075 0.0058 3149 LYS 127 CE 0.0087 0.0091 0.0065 3150 LYS 127 NZ 0.0076 0.0095 0.0069 3151 PHE 128 N 0.0095 0.0040 0.0057 3152 PHE 128 CA 0.0080 0.0037 0.0061 3153 PHE 128 C 0.0091 0.0039 0.0058 3154 PHE 128 O 0.0080 0.0052 0.0063 3155 PHE 128 CB 0.0069 0.0015 0.0062 3156 PHE 128 CG 0.0056 0.0007 0.0065 3157 PHE 128 CD1 0.0037 0.0017 0.0071 3158 PHE 128 CD2 0.0067 -0.0007 0.0060 3159 PHE 128 CE1 0.0029 0.0007 0.0072 3160 PHE 128 CE2 0.0055 -0.0013 0.0063 3161 PHE 128 CZ 0.0037 -0.0007 0.0069 3162 LEU 129 N 0.0109 0.0030 0.0052 3163 LEU 129 CA 0.0119 0.0033 0.0050 3164 LEU 129 C 0.0126 0.0057 0.0050 3165 LEU 129 O 0.0125 0.0067 0.0052 3166 LEU 129 CB 0.0138 0.0022 0.0043 3167 LEU 129 CG 0.0132 -0.0001 0.0042 3168 LEU 129 CD1 0.0148 -0.0016 0.0036 3169 LEU 129 CD2 0.0121 -0.0009 0.0045 3170 ALA 130 N 0.0148 -0.0006 -0.0053 3171 ALA 130 CA 0.0147 0.0003 -0.0060 3172 ALA 130 C 0.0144 0.0003 -0.0052 3173 ALA 130 O 0.0146 0.0003 -0.0058 3174 ALA 130 CB 0.0143 0.0018 -0.0065 3175 SER 131 N 0.0137 0.0005 -0.0038 3176 SER 131 CA 0.0133 0.0006 -0.0029 3177 SER 131 C 0.0139 -0.0013 -0.0025 3178 SER 131 O 0.0139 -0.0010 -0.0027 3179 SER 131 CB 0.0125 0.0008 -0.0011 3180 SER 131 OG 0.0120 0.0023 -0.0014 3181 VAL 132 N 0.0143 -0.0023 -0.0024 3182 VAL 132 CA 0.0148 -0.0038 -0.0023 3183 VAL 132 C 0.0155 -0.0039 -0.0038 3184 VAL 132 O 0.0157 -0.0045 -0.0038 3185 VAL 132 CB 0.0152 -0.0050 -0.0021 3186 VAL 132 CG1 0.0159 -0.0065 -0.0024 3187 VAL 132 CG2 0.0146 -0.0052 -0.0003 3188 SER 133 N 0.0228 -0.0087 -0.0123 3189 SER 133 CA 0.0242 -0.0077 -0.0129 3190 SER 133 C 0.0236 -0.0054 -0.0119 3191 SER 133 O 0.0237 -0.0050 -0.0118 3192 SER 133 CB 0.0263 -0.0072 -0.0142 3193 SER 133 OG 0.0266 -0.0095 -0.0150 3194 THR 134 N 0.0233 -0.0041 -0.0113 3195 THR 134 CA 0.0227 -0.0018 -0.0103 3196 THR 134 C 0.0208 -0.0020 -0.0091 3197 THR 134 O 0.0207 -0.0009 -0.0087 3198 THR 134 CB 0.0225 -0.0006 -0.0098 3199 THR 134 OG1 0.0242 -0.0000 -0.0108 3200 THR 134 CG2 0.0217 0.0016 -0.0087 3201 VAL 135 N 0.0195 -0.0036 -0.0087 3202 VAL 135 CA 0.0176 -0.0038 -0.0075 3203 VAL 135 C 0.0182 -0.0044 -0.0081 3204 VAL 135 O 0.0172 -0.0037 -0.0073 3205 VAL 135 CB 0.0159 -0.0056 -0.0070 3206 VAL 135 CG1 0.0141 -0.0063 -0.0060 3207 VAL 135 CG2 0.0154 -0.0046 -0.0064 3208 LEU 136 N 0.0176 -0.0074 -0.0087 3209 LEU 136 CA 0.0161 -0.0077 -0.0086 3210 LEU 136 C 0.0179 -0.0046 -0.0064 3211 LEU 136 O 0.0163 -0.0042 -0.0056 3212 LEU 136 CB 0.0174 -0.0104 -0.0113 3213 LEU 136 CG 0.0150 -0.0134 -0.0133 3214 LEU 136 CD1 0.0160 -0.0159 -0.0158 3215 LEU 136 CD2 0.0107 -0.0135 -0.0124 3216 THR 137 N 0.0212 -0.0029 -0.0056 3217 THR 137 CA 0.0232 -0.0003 -0.0039 3218 THR 137 C 0.0222 0.0031 -0.0007 3219 THR 137 O 0.0236 0.0053 0.0009 3220 THR 137 CB 0.0280 -0.0003 -0.0050 3221 THR 137 OG1 0.0293 0.0001 -0.0050 3222 THR 137 CG2 0.0284 -0.0028 -0.0073 3223 SER 138 N 0.0201 0.0028 -0.0004 3224 SER 138 CA 0.0193 0.0056 0.0021 3225 SER 138 C 0.0172 0.0080 0.0048 3226 SER 138 O 0.0175 0.0103 0.0067 3227 SER 138 CB 0.0142 0.0033 0.0014 3228 SER 138 OG 0.0175 0.0045 0.0017 3229 LYS 139 N 0.0108 0.0060 0.0061 3230 LYS 139 CA 0.0110 0.0065 0.0056 3231 LYS 139 C 0.0118 0.0067 0.0055 3232 LYS 139 O 0.0122 0.0071 0.0052 3233 LYS 139 CB 0.0112 0.0063 0.0058 3234 LYS 139 CG 0.0104 0.0062 0.0057 3235 LYS 139 CD 0.0106 0.0061 0.0059 3236 LYS 139 CE 0.0096 0.0060 0.0057 3237 LYS 139 NZ 0.0102 0.0057 0.0063 3238 TYR 140 N 0.0119 0.0065 0.0058 3239 TYR 140 CA 0.0126 0.0067 0.0057 3240 TYR 140 C 0.0127 0.0073 0.0051 3241 TYR 140 O 0.0134 0.0075 0.0050 3242 TYR 140 CB 0.0127 0.0064 0.0061 3243 TYR 140 CG 0.0132 0.0060 0.0067 3244 TYR 140 CD1 0.0137 0.0059 0.0070 3245 TYR 140 CD2 0.0130 0.0057 0.0071 3246 TYR 140 CE1 0.0141 0.0056 0.0075 3247 TYR 140 CE2 0.0134 0.0053 0.0076 3248 TYR 140 CZ 0.0139 0.0052 0.0079 3249 TYR 140 OH 0.0143 0.0049 0.0084 3250 ARG 141 N 0.0120 0.0074 0.0048 3251 ARG 141 CA 0.0120 0.0078 0.0042 3252 ARG 141 C 0.0113 0.0080 0.0038 3253 ARG 141 O 0.0108 0.0077 0.0041 3254 ARG 141 CB 0.0123 0.0079 0.0042 3255 ARG 141 CG 0.0118 0.0076 0.0044 3256 ARG 141 CD 0.0122 0.0078 0.0043 3257 ARG 141 NE 0.0117 0.0075 0.0046 3258 ARG 141 CZ 0.0117 0.0076 0.0044 3259 ARG 141 NH1 0.0122 0.0079 0.0042 3260 ARG 141 NH2 0.0112 0.0072 0.0048 3261 ARG 141 OXT 0.0113 0.0085 0.0033 3262 VAL 1 N -0.0049 0.0052 -0.0035 3263 VAL 1 CA -0.0062 0.0107 -0.0076 3264 VAL 1 C -0.0003 0.0122 -0.0032 3265 VAL 1 O 0.0005 0.0067 0.0003 3266 VAL 1 CB -0.0113 0.0082 -0.0107 3267 VAL 1 CG1 -0.0169 0.0081 -0.0155 3268 VAL 1 CG2 -0.0124 0.0030 -0.0089 3269 HIS 2 N -0.0024 0.0156 -0.0068 3270 HIS 2 CA 0.0003 0.0174 -0.0055 3271 HIS 2 C -0.0013 0.0146 -0.0053 3272 HIS 2 O -0.0035 0.0197 -0.0100 3273 HIS 2 CB 0.0071 0.0254 -0.0037 3274 HIS 2 CG 0.0101 0.0254 -0.0011 3275 HIS 2 ND1 0.0070 0.0312 -0.0069 3276 HIS 2 CD2 0.0151 0.0237 0.0042 3277 HIS 2 CE1 0.0100 0.0306 -0.0040 3278 HIS 2 NE2 0.0136 0.0258 0.0018 3279 LEU 3 N 0.0013 0.0104 -0.0009 3280 LEU 3 CA -0.0020 0.0077 -0.0023 3281 LEU 3 C 0.0028 0.0125 -0.0006 3282 LEU 3 O 0.0069 0.0077 0.0055 3283 LEU 3 CB -0.0044 0.0009 -0.0008 3284 LEU 3 CG -0.0097 0.0001 -0.0050 3285 LEU 3 CD1 -0.0127 -0.0065 -0.0042 3286 LEU 3 CD2 -0.0136 0.0019 -0.0093 3287 THR 4 N 0.0022 0.0101 -0.0043 3288 THR 4 CA 0.0055 0.0074 -0.0028 3289 THR 4 C 0.0068 0.0022 0.0005 3290 THR 4 O 0.0016 0.0017 0.0011 3291 THR 4 CB 0.0049 0.0069 -0.0024 3292 THR 4 OG1 0.0007 0.0039 -0.0002 3293 THR 4 CG2 0.0051 0.0108 -0.0049 3294 PRO 5 N 0.0100 0.0002 0.0015 3295 PRO 5 CA 0.0077 -0.0047 0.0048 3296 PRO 5 C 0.0046 -0.0082 0.0072 3297 PRO 5 O 0.0018 -0.0110 0.0092 3298 PRO 5 CB 0.0155 -0.0077 0.0062 3299 PRO 5 CG 0.0181 -0.0049 0.0042 3300 PRO 5 CD 0.0164 0.0006 0.0008 3301 GLU 6 N 0.0034 -0.0071 0.0066 3302 GLU 6 CA 0.0010 -0.0102 0.0087 3303 GLU 6 C -0.0078 -0.0073 0.0075 3304 GLU 6 O -0.0098 -0.0103 0.0095 3305 GLU 6 CB -0.0006 -0.0095 0.0084 3306 GLU 6 CG 0.0015 -0.0073 0.0068 3307 GLU 6 CD 0.0096 -0.0071 0.0062 3308 GLU 6 OE1 0.0115 -0.0055 0.0050 3309 GLU 6 OE2 0.0090 0.0012 0.0010 3310 GLU 7 N -0.0048 -0.0020 0.0031 3311 GLU 7 CA -0.0080 -0.0016 0.0018 3312 GLU 7 C -0.0107 -0.0022 0.0033 3313 GLU 7 O -0.0129 -0.0025 0.0043 3314 GLU 7 CB -0.0082 -0.0006 -0.0017 3315 GLU 7 CG -0.0058 -0.0001 -0.0032 3316 GLU 7 CD -0.0055 0.0008 -0.0061 3317 GLU 7 OE1 -0.0060 0.0012 -0.0075 3318 GLU 7 OE2 -0.0062 0.0013 -0.0080 3319 LYS 8 N -0.0098 -0.0021 0.0032 3320 LYS 8 CA -0.0127 -0.0026 0.0045 3321 LYS 8 C -0.0133 -0.0034 0.0075 3322 LYS 8 O -0.0157 -0.0039 0.0089 3323 LYS 8 CB -0.0102 -0.0023 0.0038 3324 LYS 8 CG -0.0140 -0.0026 0.0046 3325 LYS 8 CD -0.0134 -0.0024 0.0038 3326 LYS 8 CE -0.0168 -0.0031 0.0061 3327 LYS 8 NZ -0.0165 -0.0027 0.0046 3328 SER 9 N -0.0108 -0.0040 0.0094 3329 SER 9 CA -0.0118 -0.0049 0.0123 3330 SER 9 C -0.0133 -0.0050 0.0127 3331 SER 9 O -0.0148 -0.0058 0.0152 3332 SER 9 CB -0.0087 -0.0054 0.0143 3333 SER 9 OG -0.0072 -0.0058 0.0159 3334 ALA 10 N -0.0087 -0.0027 0.0062 3335 ALA 10 CA -0.0073 -0.0022 0.0064 3336 ALA 10 C -0.0100 -0.0036 0.0055 3337 ALA 10 O -0.0102 -0.0028 0.0066 3338 ALA 10 CB -0.0057 -0.0034 0.0040 3339 VAL 11 N -0.0118 -0.0050 0.0040 3340 VAL 11 CA -0.0143 -0.0062 0.0031 3341 VAL 11 C -0.0165 -0.0053 0.0053 3342 VAL 11 O -0.0171 -0.0052 0.0056 3343 VAL 11 CB -0.0156 -0.0078 0.0011 3344 VAL 11 CG1 -0.0179 -0.0086 0.0008 3345 VAL 11 CG2 -0.0132 -0.0090 -0.0015 3346 THR 12 N -0.0172 -0.0047 0.0065 3347 THR 12 CA -0.0200 -0.0038 0.0089 3348 THR 12 C -0.0190 -0.0023 0.0107 3349 THR 12 O -0.0205 -0.0018 0.0120 3350 THR 12 CB -0.0204 -0.0031 0.0101 3351 THR 12 OG1 -0.0222 -0.0050 0.0079 3352 THR 12 CG2 -0.0219 -0.0020 0.0123 3353 ALA 13 N -0.0154 0.0002 0.0069 3354 ALA 13 CA -0.0136 0.0031 0.0073 3355 ALA 13 C -0.0117 0.0027 0.0060 3356 ALA 13 O -0.0118 0.0035 0.0065 3357 ALA 13 CB -0.0121 0.0053 0.0075 3358 LEU 14 N -0.0098 0.0001 0.0037 3359 LEU 14 CA -0.0082 -0.0006 0.0024 3360 LEU 14 C -0.0101 -0.0027 0.0025 3361 LEU 14 O -0.0091 -0.0020 0.0022 3362 LEU 14 CB -0.0055 -0.0025 -0.0001 3363 LEU 14 CG -0.0031 -0.0032 -0.0018 3364 LEU 14 CD1 -0.0005 0.0000 -0.0016 3365 LEU 14 CD2 -0.0016 -0.0054 -0.0037 3366 TRP 15 N -0.0127 -0.0046 0.0030 3367 TRP 15 CA -0.0143 -0.0071 0.0027 3368 TRP 15 C -0.0163 -0.0051 0.0048 3369 TRP 15 O -0.0166 -0.0058 0.0046 3370 TRP 15 CB -0.0167 -0.0095 0.0028 3371 TRP 15 CG -0.0181 -0.0123 0.0022 3372 TRP 15 CD1 -0.0209 -0.0131 0.0035 3373 TRP 15 CD2 -0.0161 -0.0148 -0.0001 3374 TRP 15 NE1 -0.0214 -0.0159 0.0024 3375 TRP 15 CE2 -0.0185 -0.0173 0.0000 3376 TRP 15 CE3 -0.0133 -0.0155 -0.0020 3377 TRP 15 CZ2 -0.0175 -0.0199 -0.0018 3378 TRP 15 CZ3 -0.0125 -0.0185 -0.0039 3379 TRP 15 CH2 -0.0150 -0.0205 -0.0035 3380 GLY 16 N -0.0226 0.0005 0.0131 3381 GLY 16 CA -0.0242 0.0026 0.0149 3382 GLY 16 C -0.0206 0.0040 0.0123 3383 GLY 16 O -0.0218 0.0047 0.0135 3384 LYS 17 N -0.0162 0.0049 0.0088 3385 LYS 17 CA -0.0124 0.0068 0.0061 3386 LYS 17 C -0.0105 0.0027 0.0034 3387 LYS 17 O -0.0073 0.0005 0.0003 3388 LYS 17 CB -0.0082 0.0106 0.0035 3389 LYS 17 CG -0.0099 0.0150 0.0060 3390 LYS 17 CD -0.0057 0.0177 0.0032 3391 LYS 17 CE -0.0041 0.0211 0.0027 3392 LYS 17 NZ 0.0008 0.0252 -0.0004 3393 VAL 18 N -0.0122 -0.0036 0.0033 3394 VAL 18 CA -0.0103 -0.0098 0.0002 3395 VAL 18 C -0.0125 -0.0115 0.0016 3396 VAL 18 O -0.0165 -0.0114 0.0050 3397 VAL 18 CB -0.0113 -0.0135 0.0001 3398 VAL 18 CG1 -0.0109 -0.0188 -0.0016 3399 VAL 18 CG2 -0.0086 -0.0118 -0.0018 3400 ASN 19 N -0.0108 -0.0337 -0.0125 3401 ASN 19 CA -0.0093 -0.0333 -0.0125 3402 ASN 19 C -0.0078 -0.0301 -0.0113 3403 ASN 19 O -0.0111 -0.0281 -0.0102 3404 ASN 19 CB -0.0115 -0.0359 -0.0134 3405 ASN 19 CG -0.0079 -0.0374 -0.0142 3406 ASN 19 OD1 -0.0076 -0.0341 -0.0129 3407 ASN 19 ND2 -0.0110 -0.0390 -0.0147 3408 VAL 20 N -0.0048 -0.0286 -0.0109 3409 VAL 20 CA -0.0041 -0.0242 -0.0092 3410 VAL 20 C -0.0057 -0.0230 -0.0085 3411 VAL 20 O -0.0071 -0.0202 -0.0073 3412 VAL 20 CB 0.0012 -0.0223 -0.0088 3413 VAL 20 CG1 0.0005 -0.0237 -0.0093 3414 VAL 20 CG2 0.0010 -0.0209 -0.0082 3415 ASP 21 N -0.0045 -0.0253 -0.0096 3416 ASP 21 CA -0.0070 -0.0250 -0.0093 3417 ASP 21 C -0.0098 -0.0249 -0.0090 3418 ASP 21 O -0.0116 -0.0215 -0.0075 3419 ASP 21 CB -0.0052 -0.0279 -0.0106 3420 ASP 21 CG 0.0000 -0.0284 -0.0112 3421 ASP 21 OD1 0.0033 -0.0253 -0.0101 3422 ASP 21 OD2 0.0011 -0.0295 -0.0117 3423 GLU 22 N -0.0064 -0.0266 -0.0013 3424 GLU 22 CA -0.0113 -0.0270 -0.0006 3425 GLU 22 C -0.0116 -0.0214 -0.0012 3426 GLU 22 O -0.0157 -0.0199 -0.0009 3427 GLU 22 CB -0.0118 -0.0323 0.0001 3428 GLU 22 CG -0.0128 -0.0320 0.0001 3429 GLU 22 CD -0.0183 -0.0380 0.0016 3430 GLU 22 OE1 -0.0156 -0.0411 0.0016 3431 GLU 22 OE2 -0.0198 -0.0394 0.0019 3432 VAL 23 N -0.0086 -0.0221 -0.0016 3433 VAL 23 CA -0.0086 -0.0182 -0.0020 3434 VAL 23 C -0.0083 -0.0128 -0.0027 3435 VAL 23 O -0.0109 -0.0094 -0.0028 3436 VAL 23 CB -0.0041 -0.0192 -0.0025 3437 VAL 23 CG1 -0.0037 -0.0149 -0.0030 3438 VAL 23 CG2 -0.0062 -0.0241 -0.0016 3439 GLY 24 N -0.0053 -0.0119 -0.0032 3440 GLY 24 CA -0.0045 -0.0073 -0.0038 3441 GLY 24 C -0.0093 -0.0057 -0.0034 3442 GLY 24 O -0.0116 -0.0014 -0.0036 3443 GLY 25 N -0.0105 -0.0023 -0.0002 3444 GLY 25 CA -0.0122 -0.0017 0.0005 3445 GLY 25 C -0.0115 -0.0021 0.0007 3446 GLY 25 O -0.0124 -0.0014 -0.0001 3447 GLU 26 N -0.0100 -0.0033 0.0016 3448 GLU 26 CA -0.0093 -0.0037 0.0020 3449 GLU 26 C -0.0084 -0.0034 -0.0003 3450 GLU 26 O -0.0089 -0.0031 -0.0004 3451 GLU 26 CB -0.0077 -0.0051 0.0034 3452 GLU 26 CG -0.0092 -0.0053 0.0062 3453 GLU 26 CD -0.0072 -0.0056 0.0041 3454 GLU 26 OE1 -0.0079 -0.0058 0.0059 3455 GLU 26 OE2 -0.0060 -0.0069 0.0061 3456 ALA 27 N -0.0073 -0.0036 -0.0014 3457 ALA 27 CA -0.0064 -0.0033 -0.0036 3458 ALA 27 C -0.0078 -0.0021 -0.0048 3459 ALA 27 O -0.0078 -0.0018 -0.0057 3460 ALA 27 CB -0.0049 -0.0038 -0.0046 3461 LEU 28 N -0.0037 0.0031 0.0004 3462 LEU 28 CA -0.0055 0.0037 -0.0012 3463 LEU 28 C -0.0061 0.0038 -0.0008 3464 LEU 28 O -0.0067 0.0041 -0.0024 3465 LEU 28 CB -0.0076 0.0042 -0.0011 3466 LEU 28 CG -0.0094 0.0049 -0.0033 3467 LEU 28 CD1 -0.0081 0.0046 -0.0056 3468 LEU 28 CD2 -0.0112 0.0053 -0.0029 3469 GLY 29 N -0.0067 0.0038 0.0016 3470 GLY 29 CA -0.0072 0.0040 0.0023 3471 GLY 29 C -0.0055 0.0035 0.0013 3472 GLY 29 O -0.0063 0.0038 0.0005 3473 ARG 30 N -0.0034 0.0029 0.0018 3474 ARG 30 CA -0.0017 0.0025 0.0010 3475 ARG 30 C -0.0015 0.0026 -0.0017 3476 ARG 30 O -0.0012 0.0026 -0.0025 3477 ARG 30 CB 0.0007 0.0018 0.0023 3478 ARG 30 CG 0.0011 0.0015 0.0049 3479 ARG 30 CD 0.0031 0.0009 0.0059 3480 ARG 30 NE 0.0035 0.0007 0.0080 3481 ARG 30 CZ 0.0043 0.0004 0.0093 3482 ARG 30 NH1 0.0047 0.0001 0.0116 3483 ARG 30 NH2 0.0059 -0.0000 0.0082 3484 LEU 31 N -0.0027 0.0060 -0.0037 3485 LEU 31 CA -0.0028 0.0062 -0.0042 3486 LEU 31 C -0.0032 0.0064 -0.0043 3487 LEU 31 O -0.0032 0.0065 -0.0046 3488 LEU 31 CB -0.0027 0.0062 -0.0046 3489 LEU 31 CG -0.0027 0.0064 -0.0051 3490 LEU 31 CD1 -0.0022 0.0063 -0.0054 3491 LEU 31 CD2 -0.0029 0.0065 -0.0053 3492 LEU 32 N -0.0037 0.0065 -0.0041 3493 LEU 32 CA -0.0041 0.0067 -0.0042 3494 LEU 32 C -0.0042 0.0066 -0.0040 3495 LEU 32 O -0.0045 0.0068 -0.0042 3496 LEU 32 CB -0.0045 0.0068 -0.0040 3497 LEU 32 CG -0.0045 0.0069 -0.0043 3498 LEU 32 CD1 -0.0050 0.0070 -0.0040 3499 LEU 32 CD2 -0.0045 0.0070 -0.0048 3500 VAL 33 N -0.0039 0.0064 -0.0036 3501 VAL 33 CA -0.0039 0.0063 -0.0033 3502 VAL 33 C -0.0036 0.0063 -0.0037 3503 VAL 33 O -0.0037 0.0064 -0.0037 3504 VAL 33 CB -0.0038 0.0061 -0.0028 3505 VAL 33 CG1 -0.0038 0.0061 -0.0026 3506 VAL 33 CG2 -0.0043 0.0062 -0.0025 3507 VAL 34 N -0.0026 0.0049 -0.0006 3508 VAL 34 CA -0.0013 0.0045 -0.0012 3509 VAL 34 C -0.0015 0.0050 -0.0030 3510 VAL 34 O -0.0008 0.0048 -0.0037 3511 VAL 34 CB 0.0005 0.0036 -0.0009 3512 VAL 34 CG1 0.0019 0.0032 -0.0018 3513 VAL 34 CG2 0.0006 0.0031 0.0010 3514 TYR 35 N -0.0020 0.0055 -0.0041 3515 TYR 35 CA -0.0021 0.0060 -0.0061 3516 TYR 35 C -0.0040 0.0069 -0.0062 3517 TYR 35 O -0.0043 0.0073 -0.0070 3518 TYR 35 CB -0.0011 0.0058 -0.0071 3519 TYR 35 CG 0.0006 0.0049 -0.0067 3520 TYR 35 CD1 0.0015 0.0046 -0.0072 3521 TYR 35 CD2 0.0014 0.0044 -0.0059 3522 TYR 35 CE1 0.0033 0.0038 -0.0070 3523 TYR 35 CE2 0.0030 0.0036 -0.0056 3524 TYR 35 CZ 0.0039 0.0033 -0.0062 3525 TYR 35 OH 0.0055 0.0024 -0.0055 3526 PRO 36 N -0.0050 0.0073 -0.0058 3527 PRO 36 CA -0.0069 0.0081 -0.0057 3528 PRO 36 C -0.0076 0.0088 -0.0074 3529 PRO 36 O -0.0089 0.0094 -0.0074 3530 PRO 36 CB -0.0076 0.0082 -0.0047 3531 PRO 36 CG -0.0062 0.0076 -0.0049 3532 PRO 36 CD -0.0048 0.0070 -0.0052 3533 TRP 37 N -0.0053 0.0063 -0.0074 3534 TRP 37 CA -0.0049 0.0060 -0.0066 3535 TRP 37 C -0.0043 0.0057 -0.0057 3536 TRP 37 O -0.0038 0.0051 -0.0050 3537 TRP 37 CB -0.0051 0.0071 -0.0062 3538 TRP 37 CG -0.0053 0.0081 -0.0059 3539 TRP 37 CD1 -0.0050 0.0085 -0.0049 3540 TRP 37 CD2 -0.0059 0.0090 -0.0065 3541 TRP 37 NE1 -0.0054 0.0095 -0.0048 3542 TRP 37 CE2 -0.0059 0.0097 -0.0059 3543 TRP 37 CE3 -0.0064 0.0090 -0.0076 3544 TRP 37 CZ2 -0.0065 0.0108 -0.0062 3545 TRP 37 CZ3 -0.0070 0.0099 -0.0081 3546 TRP 37 CH2 -0.0069 0.0107 -0.0073 3547 THR 38 N -0.0043 0.0058 -0.0056 3548 THR 38 CA -0.0038 0.0054 -0.0048 3549 THR 38 C -0.0034 0.0041 -0.0049 3550 THR 38 O -0.0028 0.0036 -0.0042 3551 THR 38 CB -0.0039 0.0058 -0.0048 3552 THR 38 OG1 -0.0042 0.0054 -0.0057 3553 THR 38 CG2 -0.0042 0.0069 -0.0044 3554 GLN 39 N -0.0036 0.0036 -0.0060 3555 GLN 39 CA -0.0032 0.0024 -0.0061 3556 GLN 39 C -0.0028 0.0019 -0.0055 3557 GLN 39 O -0.0024 0.0010 -0.0054 3558 GLN 39 CB -0.0036 0.0021 -0.0073 3559 GLN 39 CG -0.0040 0.0025 -0.0080 3560 GLN 39 CD -0.0044 0.0021 -0.0091 3561 GLN 39 OE1 -0.0043 0.0015 -0.0095 3562 GLN 39 NE2 -0.0049 0.0026 -0.0098 3563 ARG 40 N 0.0026 -0.0031 0.0000 3564 ARG 40 CA 0.0024 -0.0041 0.0003 3565 ARG 40 C 0.0024 -0.0051 0.0024 3566 ARG 40 O 0.0021 -0.0070 0.0030 3567 ARG 40 CB 0.0028 -0.0024 0.0006 3568 ARG 40 CG 0.0032 -0.0013 0.0022 3569 ARG 40 CD 0.0034 0.0002 0.0013 3570 ARG 40 NE 0.0032 -0.0005 0.0008 3571 ARG 40 CZ 0.0031 -0.0019 0.0024 3572 ARG 40 NH1 0.0035 -0.0013 0.0042 3573 ARG 40 NH2 0.0029 -0.0023 0.0011 3574 PHE 41 N 0.0027 -0.0045 0.0042 3575 PHE 41 CA 0.0028 -0.0054 0.0065 3576 PHE 41 C 0.0024 -0.0074 0.0067 3577 PHE 41 O 0.0025 -0.0079 0.0087 3578 PHE 41 CB 0.0034 -0.0038 0.0084 3579 PHE 41 CG 0.0038 -0.0019 0.0082 3580 PHE 41 CD1 0.0041 0.0001 0.0069 3581 PHE 41 CD2 0.0038 -0.0023 0.0089 3582 PHE 41 CE1 0.0044 0.0012 0.0072 3583 PHE 41 CE2 0.0041 -0.0009 0.0087 3584 PHE 41 CZ 0.0044 0.0011 0.0077 3585 PHE 42 N 0.0022 -0.0075 0.0049 3586 PHE 42 CA 0.0020 -0.0086 0.0055 3587 PHE 42 C 0.0014 -0.0106 0.0042 3588 PHE 42 O 0.0011 -0.0112 0.0030 3589 PHE 42 CB 0.0022 -0.0074 0.0053 3590 PHE 42 CG 0.0028 -0.0058 0.0073 3591 PHE 42 CD1 0.0033 -0.0033 0.0062 3592 PHE 42 CD2 0.0030 -0.0062 0.0095 3593 PHE 42 CE1 0.0038 -0.0020 0.0083 3594 PHE 42 CE2 0.0035 -0.0048 0.0110 3595 PHE 42 CZ 0.0039 -0.0024 0.0102 3596 GLU 43 N 0.0130 -0.0285 0.0018 3597 GLU 43 CA 0.0196 -0.0317 -0.0026 3598 GLU 43 C 0.0189 -0.0312 -0.0022 3599 GLU 43 O 0.0239 -0.0316 -0.0054 3600 GLU 43 CB 0.0191 -0.0391 -0.0026 3601 GLU 43 CG 0.0181 -0.0439 -0.0021 3602 GLU 43 CD 0.0242 -0.0456 -0.0061 3603 GLU 43 OE1 0.0322 -0.0435 -0.0113 3604 GLU 43 OE2 0.0270 -0.0522 -0.0083 3605 SER 44 N 0.0118 -0.0299 0.0026 3606 SER 44 CA 0.0087 -0.0291 0.0047 3607 SER 44 C 0.0110 -0.0213 0.0034 3608 SER 44 O 0.0100 -0.0174 0.0042 3609 SER 44 CB 0.0016 -0.0297 0.0093 3610 SER 44 OG -0.0027 -0.0245 0.0123 3611 PHE 45 N 0.0141 -0.0139 0.0017 3612 PHE 45 CA 0.0151 -0.0048 0.0013 3613 PHE 45 C 0.0230 -0.0033 -0.0038 3614 PHE 45 O 0.0222 0.0051 -0.0030 3615 PHE 45 CB 0.0149 -0.0001 0.0017 3616 PHE 45 CG 0.0075 0.0020 0.0066 3617 PHE 45 CD1 0.0068 0.0093 0.0073 3618 PHE 45 CD2 0.0017 -0.0013 0.0103 3619 PHE 45 CE1 -0.0012 0.0112 0.0126 3620 PHE 45 CE2 -0.0049 -0.0002 0.0147 3621 PHE 45 CZ -0.0070 0.0065 0.0163 3622 GLY 46 N 0.0258 -0.0018 -0.0032 3623 GLY 46 CA 0.0226 -0.0049 -0.0067 3624 GLY 46 C 0.0153 -0.0025 -0.0098 3625 GLY 46 O 0.0156 0.0030 -0.0067 3626 ASP 47 N 0.0128 -0.0057 -0.0130 3627 ASP 47 CA 0.0068 -0.0013 -0.0142 3628 ASP 47 C 0.0048 0.0014 -0.0139 3629 ASP 47 O 0.0062 -0.0028 -0.0153 3630 ASP 47 CB 0.0051 -0.0080 -0.0187 3631 ASP 47 CG -0.0019 -0.0056 -0.0216 3632 ASP 47 OD1 -0.0032 -0.0102 -0.0248 3633 ASP 47 OD2 -0.0034 -0.0012 -0.0202 3634 LEU 48 N 0.0032 0.0058 -0.0126 3635 LEU 48 CA 0.0014 0.0101 -0.0113 3636 LEU 48 C -0.0053 0.0127 -0.0139 3637 LEU 48 O -0.0070 0.0178 -0.0122 3638 LEU 48 CB 0.0039 0.0142 -0.0077 3639 LEU 48 CG 0.0097 0.0111 -0.0059 3640 LEU 48 CD1 0.0129 0.0166 -0.0011 3641 LEU 48 CD2 0.0107 0.0076 -0.0071 3642 SER 49 N -0.0243 0.0187 -0.0233 3643 SER 49 CA -0.0279 0.0236 -0.0300 3644 SER 49 C -0.0277 0.0221 -0.0283 3645 SER 49 O -0.0247 0.0276 -0.0328 3646 SER 49 CB -0.0379 0.0208 -0.0313 3647 SER 49 OG -0.0406 0.0146 -0.0258 3648 THR 50 N -0.0252 0.0169 -0.0218 3649 THR 50 CA -0.0196 0.0196 -0.0223 3650 THR 50 C -0.0127 0.0153 -0.0148 3651 THR 50 O -0.0111 0.0126 -0.0113 3652 THR 50 CB -0.0278 0.0114 -0.0171 3653 THR 50 OG1 -0.0283 0.0048 -0.0102 3654 THR 50 CG2 -0.0358 0.0131 -0.0222 3655 PRO 51 N -0.0086 0.0157 -0.0136 3656 PRO 51 CA -0.0017 0.0136 -0.0084 3657 PRO 51 C -0.0016 0.0077 -0.0021 3658 PRO 51 O 0.0037 0.0052 0.0028 3659 PRO 51 CB 0.0010 0.0149 -0.0087 3660 PRO 51 CG -0.0015 0.0203 -0.0155 3661 PRO 51 CD -0.0110 0.0196 -0.0187 3662 ASP 52 N -0.0105 0.0080 -0.0048 3663 ASP 52 CA -0.0091 0.0043 -0.0045 3664 ASP 52 C -0.0072 0.0054 -0.0046 3665 ASP 52 O -0.0055 0.0033 -0.0043 3666 ASP 52 CB -0.0124 0.0033 -0.0045 3667 ASP 52 CG -0.0151 0.0020 -0.0044 3668 ASP 52 OD1 -0.0133 0.0020 -0.0044 3669 ASP 52 OD2 -0.0171 0.0074 -0.0049 3670 ALA 53 N -0.0085 0.0075 -0.0048 3671 ALA 53 CA -0.0072 0.0084 -0.0048 3672 ALA 53 C -0.0031 0.0093 -0.0048 3673 ALA 53 O -0.0013 0.0084 -0.0047 3674 ALA 53 CB -0.0080 0.0109 -0.0050 3675 VAL 54 N -0.0029 0.0119 -0.0050 3676 VAL 54 CA 0.0007 0.0126 -0.0050 3677 VAL 54 C 0.0022 0.0098 -0.0048 3678 VAL 54 O 0.0052 0.0089 -0.0046 3679 VAL 54 CB 0.0002 0.0152 -0.0053 3680 VAL 54 CG1 0.0040 0.0155 -0.0052 3681 VAL 54 CG2 -0.0011 0.0178 -0.0055 3682 MET 55 N 0.0023 0.0077 0.0011 3683 MET 55 CA 0.0012 0.0077 -0.0009 3684 MET 55 C 0.0026 0.0093 -0.0030 3685 MET 55 O 0.0016 0.0092 -0.0043 3686 MET 55 CB 0.0001 0.0070 -0.0010 3687 MET 55 CG -0.0010 0.0059 0.0002 3688 MET 55 SD -0.0028 0.0046 0.0007 3689 MET 55 CE -0.0039 0.0046 -0.0016 3690 GLY 56 N 0.0041 0.0099 -0.0017 3691 GLY 56 CA 0.0047 0.0110 -0.0037 3692 GLY 56 C 0.0058 0.0117 -0.0038 3693 GLY 56 O 0.0071 0.0128 -0.0046 3694 ASN 57 N 0.0062 0.0114 -0.0022 3695 ASN 57 CA 0.0072 0.0119 -0.0020 3696 ASN 57 C 0.0064 0.0120 -0.0038 3697 ASN 57 O 0.0050 0.0114 -0.0046 3698 ASN 57 CB 0.0071 0.0112 -0.0000 3699 ASN 57 CG 0.0081 0.0117 0.0001 3700 ASN 57 OD1 0.0081 0.0121 -0.0010 3701 ASN 57 ND2 0.0089 0.0117 0.0018 3702 PRO 58 N 0.0102 0.0210 -0.0054 3703 PRO 58 CA 0.0074 0.0225 -0.0072 3704 PRO 58 C 0.0050 0.0198 -0.0056 3705 PRO 58 O 0.0014 0.0205 -0.0070 3706 PRO 58 CB 0.0094 0.0247 -0.0086 3707 PRO 58 CG 0.0133 0.0229 -0.0062 3708 PRO 58 CD 0.0138 0.0227 -0.0060 3709 LYS 59 N 0.0061 0.0177 -0.0037 3710 LYS 59 CA 0.0041 0.0156 -0.0025 3711 LYS 59 C 0.0007 0.0134 -0.0015 3712 LYS 59 O -0.0023 0.0128 -0.0017 3713 LYS 59 CB 0.0059 0.0137 -0.0006 3714 LYS 59 CG 0.0079 0.0149 -0.0011 3715 LYS 59 CD 0.0100 0.0139 0.0002 3716 LYS 59 CE 0.0108 0.0131 0.0010 3717 LYS 59 NZ 0.0146 0.0153 0.0001 3718 VAL 60 N 0.0024 0.0134 -0.0012 3719 VAL 60 CA -0.0007 0.0120 -0.0008 3720 VAL 60 C -0.0036 0.0135 -0.0026 3721 VAL 60 O -0.0070 0.0126 -0.0027 3722 VAL 60 CB 0.0016 0.0109 0.0006 3723 VAL 60 CG1 -0.0017 0.0104 0.0004 3724 VAL 60 CG2 0.0043 0.0092 0.0027 3725 LYS 61 N -0.0029 0.0124 0.0009 3726 LYS 61 CA -0.0042 0.0119 -0.0027 3727 LYS 61 C -0.0039 0.0123 -0.0049 3728 LYS 61 O -0.0057 0.0110 -0.0064 3729 LYS 61 CB -0.0035 0.0126 -0.0046 3730 LYS 61 CG -0.0041 0.0119 -0.0025 3731 LYS 61 CD -0.0028 0.0130 -0.0040 3732 LYS 61 CE -0.0040 0.0121 -0.0036 3733 LYS 61 NZ -0.0028 0.0132 -0.0051 3734 ALA 62 N -0.0014 0.0143 -0.0048 3735 ALA 62 CA -0.0008 0.0150 -0.0069 3736 ALA 62 C -0.0024 0.0137 -0.0062 3737 ALA 62 O -0.0036 0.0129 -0.0082 3738 ALA 62 CB 0.0022 0.0173 -0.0066 3739 HIS 63 N -0.0023 0.0133 -0.0026 3740 HIS 63 CA -0.0037 0.0121 -0.0015 3741 HIS 63 C -0.0068 0.0096 -0.0018 3742 HIS 63 O -0.0081 0.0088 -0.0026 3743 HIS 63 CB -0.0030 0.0123 0.0016 3744 HIS 63 CG -0.0034 0.0117 0.0039 3745 HIS 63 ND1 -0.0027 0.0125 0.0023 3746 HIS 63 CD2 -0.0058 0.0096 0.0060 3747 HIS 63 CE1 -0.0047 0.0107 0.0042 3748 HIS 63 NE2 -0.0051 0.0101 0.0066 3749 GLY 64 N -0.0074 0.0085 0.0023 3750 GLY 64 CA -0.0105 0.0035 0.0012 3751 GLY 64 C -0.0090 -0.0009 -0.0046 3752 GLY 64 O -0.0089 -0.0028 -0.0065 3753 LYS 65 N -0.0055 -0.0004 -0.0081 3754 LYS 65 CA -0.0029 -0.0035 -0.0140 3755 LYS 65 C 0.0011 -0.0009 -0.0161 3756 LYS 65 O 0.0013 -0.0042 -0.0195 3757 LYS 65 CB -0.0005 -0.0031 -0.0163 3758 LYS 65 CG 0.0020 -0.0062 -0.0220 3759 LYS 65 CD 0.0055 -0.0032 -0.0232 3760 LYS 65 CE 0.0103 -0.0057 -0.0310 3761 LYS 65 NZ 0.0113 -0.0068 -0.0332 3762 LYS 66 N 0.0036 0.0046 -0.0140 3763 LYS 66 CA 0.0076 0.0078 -0.0157 3764 LYS 66 C 0.0046 0.0050 -0.0148 3765 LYS 66 O 0.0067 0.0044 -0.0176 3766 LYS 66 CB 0.0100 0.0135 -0.0131 3767 LYS 66 CG 0.0129 0.0175 -0.0127 3768 LYS 66 CD 0.0183 0.0237 -0.0132 3769 LYS 66 CE 0.0239 0.0247 -0.0187 3770 LYS 66 NZ 0.0277 0.0326 -0.0158 3771 VAL 67 N -0.0031 -0.0011 -0.0070 3772 VAL 67 CA -0.0033 -0.0015 -0.0070 3773 VAL 67 C -0.0037 -0.0041 -0.0078 3774 VAL 67 O -0.0029 -0.0047 -0.0088 3775 VAL 67 CB -0.0054 -0.0001 -0.0042 3776 VAL 67 CG1 -0.0065 -0.0017 -0.0039 3777 VAL 67 CG2 -0.0049 0.0028 -0.0033 3778 LEU 68 N -0.0048 -0.0062 -0.0077 3779 LEU 68 CA -0.0053 -0.0089 -0.0085 3780 LEU 68 C -0.0033 -0.0101 -0.0109 3781 LEU 68 O -0.0028 -0.0117 -0.0122 3782 LEU 68 CB -0.0070 -0.0112 -0.0078 3783 LEU 68 CG -0.0088 -0.0128 -0.0068 3784 LEU 68 CD1 -0.0092 -0.0127 -0.0064 3785 LEU 68 CD2 -0.0103 -0.0144 -0.0061 3786 GLY 69 N -0.0019 -0.0087 -0.0117 3787 GLY 69 CA 0.0002 -0.0090 -0.0139 3788 GLY 69 C 0.0017 -0.0083 -0.0151 3789 GLY 69 O 0.0024 -0.0098 -0.0165 3790 ALA 70 N -0.0031 -0.0076 -0.0081 3791 ALA 70 CA -0.0022 -0.0065 -0.0077 3792 ALA 70 C -0.0036 -0.0069 -0.0074 3793 ALA 70 O -0.0031 -0.0070 -0.0076 3794 ALA 70 CB -0.0019 -0.0046 -0.0064 3795 PHE 71 N -0.0057 -0.0073 -0.0068 3796 PHE 71 CA -0.0075 -0.0079 -0.0065 3797 PHE 71 C -0.0071 -0.0098 -0.0080 3798 PHE 71 O -0.0070 -0.0098 -0.0081 3799 PHE 71 CB -0.0096 -0.0080 -0.0057 3800 PHE 71 CG -0.0114 -0.0087 -0.0054 3801 PHE 71 CD1 -0.0122 -0.0071 -0.0040 3802 PHE 71 CD2 -0.0119 -0.0107 -0.0066 3803 PHE 71 CE1 -0.0137 -0.0079 -0.0039 3804 PHE 71 CE2 -0.0135 -0.0109 -0.0062 3805 PHE 71 CZ -0.0143 -0.0095 -0.0048 3806 SER 72 N -0.0066 -0.0109 -0.0090 3807 SER 72 CA -0.0061 -0.0126 -0.0104 3808 SER 72 C -0.0048 -0.0125 -0.0109 3809 SER 72 O -0.0047 -0.0134 -0.0116 3810 SER 72 CB -0.0062 -0.0146 -0.0119 3811 SER 72 OG -0.0075 -0.0143 -0.0111 3812 ASP 73 N -0.0001 -0.0128 -0.0099 3813 ASP 73 CA 0.0021 -0.0117 -0.0079 3814 ASP 73 C 0.0009 -0.0105 -0.0058 3815 ASP 73 O -0.0000 -0.0104 -0.0057 3816 ASP 73 CB 0.0086 -0.0112 -0.0066 3817 ASP 73 CG 0.0090 -0.0134 -0.0105 3818 ASP 73 OD1 0.0101 -0.0156 -0.0144 3819 ASP 73 OD2 0.0150 -0.0126 -0.0087 3820 GLY 74 N -0.0030 -0.0085 -0.0025 3821 GLY 74 CA -0.0055 -0.0070 0.0002 3822 GLY 74 C -0.0102 -0.0075 -0.0010 3823 GLY 74 O -0.0121 -0.0067 0.0003 3824 LEU 75 N -0.0117 -0.0096 -0.0049 3825 LEU 75 CA -0.0153 -0.0106 -0.0070 3826 LEU 75 C -0.0142 -0.0113 -0.0082 3827 LEU 75 O -0.0174 -0.0119 -0.0095 3828 LEU 75 CB -0.0178 -0.0124 -0.0103 3829 LEU 75 CG -0.0213 -0.0117 -0.0093 3830 LEU 75 CD1 -0.0227 -0.0094 -0.0051 3831 LEU 75 CD2 -0.0219 -0.0123 -0.0105 3832 ALA 76 N -0.0089 -0.0131 -0.0083 3833 ALA 76 CA -0.0048 -0.0142 -0.0065 3834 ALA 76 C -0.0046 -0.0118 -0.0043 3835 ALA 76 O -0.0029 -0.0111 -0.0026 3836 ALA 76 CB -0.0035 -0.0169 -0.0082 3837 HIS 77 N -0.0059 -0.0085 -0.0022 3838 HIS 77 CA -0.0045 -0.0063 0.0008 3839 HIS 77 C -0.0069 -0.0025 0.0026 3840 HIS 77 O -0.0067 -0.0001 0.0049 3841 HIS 77 CB -0.0009 -0.0060 0.0034 3842 HIS 77 CG 0.0023 -0.0090 0.0028 3843 HIS 77 ND1 0.0021 -0.0114 0.0005 3844 HIS 77 CD2 0.0054 -0.0092 0.0047 3845 HIS 77 CE1 0.0063 -0.0151 -0.0000 3846 HIS 77 NE2 0.0065 -0.0137 0.0013 3847 LEU 78 N -0.0105 -0.0019 0.0007 3848 LEU 78 CA -0.0130 0.0009 0.0016 3849 LEU 78 C -0.0137 0.0042 0.0041 3850 LEU 78 O -0.0152 0.0066 0.0053 3851 LEU 78 CB -0.0174 0.0004 -0.0018 3852 LEU 78 CG -0.0200 -0.0003 -0.0041 3853 LEU 78 CD1 -0.0221 -0.0020 -0.0070 3854 LEU 78 CD2 -0.0207 0.0000 -0.0043 3855 ASP 79 N -0.0099 0.0075 0.0049 3856 ASP 79 CA -0.0110 0.0097 0.0081 3857 ASP 79 C -0.0079 0.0087 0.0122 3858 ASP 79 O -0.0083 0.0101 0.0150 3859 ASP 79 CB -0.0099 0.0092 0.0092 3860 ASP 79 CG -0.0112 0.0091 0.0065 3861 ASP 79 OD1 -0.0120 0.0104 0.0080 3862 ASP 79 OD2 -0.0152 0.0129 0.0074 3863 ASN 80 N -0.0061 0.0063 0.0099 3864 ASN 80 CA -0.0038 0.0057 0.0133 3865 ASN 80 C -0.0017 0.0031 0.0110 3866 ASN 80 O 0.0007 0.0016 0.0121 3867 ASN 80 CB -0.0017 0.0046 0.0149 3868 ASN 80 CG 0.0006 0.0033 0.0165 3869 ASN 80 OD1 0.0022 0.0035 0.0204 3870 ASN 80 ND2 0.0007 0.0021 0.0137 3871 LEU 81 N -0.0041 0.0047 0.0102 3872 LEU 81 CA -0.0029 0.0030 0.0084 3873 LEU 81 C -0.0005 0.0022 0.0112 3874 LEU 81 O 0.0018 -0.0000 0.0104 3875 LEU 81 CB -0.0056 0.0047 0.0067 3876 LEU 81 CG -0.0074 0.0046 0.0029 3877 LEU 81 CD1 -0.0099 0.0063 0.0018 3878 LEU 81 CD2 -0.0059 0.0024 0.0002 3879 LYS 82 N 0.0030 0.0008 0.0086 3880 LYS 82 CA 0.0023 0.0005 0.0079 3881 LYS 82 C 0.0010 0.0014 0.0076 3882 LYS 82 O 0.0004 0.0019 0.0075 3883 LYS 82 CB 0.0023 -0.0010 0.0069 3884 LYS 82 CG 0.0034 -0.0018 0.0070 3885 LYS 82 CD 0.0034 -0.0035 0.0058 3886 LYS 82 CE 0.0057 -0.0037 0.0072 3887 LYS 82 NZ 0.0050 -0.0046 0.0061 3888 GLY 83 N 0.0000 0.0019 0.0073 3889 GLY 83 CA -0.0013 0.0026 0.0068 3890 GLY 83 C -0.0014 0.0039 0.0077 3891 GLY 83 O -0.0021 0.0046 0.0078 3892 THR 84 N -0.0003 0.0044 0.0089 3893 THR 84 CA -0.0004 0.0056 0.0097 3894 THR 84 C -0.0004 0.0057 0.0098 3895 THR 84 O -0.0007 0.0068 0.0104 3896 THR 84 CB 0.0007 0.0061 0.0108 3897 THR 84 OG1 0.0004 0.0060 0.0105 3898 THR 84 CG2 0.0009 0.0073 0.0119 3899 PHE 85 N -0.0052 0.0062 0.0059 3900 PHE 85 CA -0.0041 0.0074 0.0080 3901 PHE 85 C -0.0056 0.0069 0.0058 3902 PHE 85 O -0.0050 0.0071 0.0066 3903 PHE 85 CB -0.0013 0.0052 0.0097 3904 PHE 85 CG -0.0001 0.0071 0.0124 3905 PHE 85 CD1 0.0012 0.0052 0.0127 3906 PHE 85 CD2 0.0001 0.0098 0.0145 3907 PHE 85 CE1 0.0026 0.0066 0.0153 3908 PHE 85 CE2 0.0012 0.0113 0.0168 3909 PHE 85 CZ 0.0025 0.0100 0.0174 3910 ALA 86 N -0.0074 0.0056 0.0028 3911 ALA 86 CA -0.0084 0.0043 0.0007 3912 ALA 86 C -0.0098 0.0076 0.0014 3913 ALA 86 O -0.0092 0.0069 0.0016 3914 ALA 86 CB -0.0111 0.0040 -0.0027 3915 THR 87 N -0.0111 0.0104 0.0018 3916 THR 87 CA -0.0121 0.0131 0.0023 3917 THR 87 C -0.0100 0.0138 0.0052 3918 THR 87 O -0.0102 0.0141 0.0053 3919 THR 87 CB -0.0140 0.0165 0.0025 3920 THR 87 OG1 -0.0160 0.0158 -0.0003 3921 THR 87 CG2 -0.0154 0.0189 0.0024 3922 LEU 88 N -0.0056 0.0177 0.0090 3923 LEU 88 CA -0.0001 0.0183 0.0112 3924 LEU 88 C 0.0045 0.0121 0.0098 3925 LEU 88 O 0.0076 0.0110 0.0103 3926 LEU 88 CB 0.0042 0.0223 0.0147 3927 LEU 88 CG 0.0016 0.0289 0.0170 3928 LEU 88 CD1 0.0050 0.0316 0.0196 3929 LEU 88 CD2 0.0012 0.0305 0.0177 3930 SER 89 N 0.0040 0.0079 0.0075 3931 SER 89 CA 0.0071 0.0017 0.0056 3932 SER 89 C 0.0057 -0.0011 0.0037 3933 SER 89 O 0.0085 -0.0039 0.0033 3934 SER 89 CB 0.0063 -0.0025 0.0032 3935 SER 89 OG 0.0100 -0.0081 0.0018 3936 GLU 90 N -0.0010 -0.0012 0.0012 3937 GLU 90 CA -0.0041 -0.0026 -0.0005 3938 GLU 90 C -0.0027 0.0004 0.0014 3939 GLU 90 O -0.0014 -0.0023 0.0006 3940 GLU 90 CB -0.0112 -0.0023 -0.0029 3941 GLU 90 CG -0.0130 -0.0063 -0.0055 3942 GLU 90 CD -0.0232 -0.0060 -0.0091 3943 GLU 90 OE1 -0.0245 -0.0019 -0.0075 3944 GLU 90 OE2 -0.0224 -0.0025 -0.0070 3945 LEU 91 N -0.0019 0.0045 0.0039 3946 LEU 91 CA -0.0006 0.0057 0.0048 3947 LEU 91 C 0.0043 0.0044 0.0049 3948 LEU 91 O 0.0056 0.0037 0.0047 3949 LEU 91 CB -0.0013 0.0109 0.0073 3950 LEU 91 CG 0.0004 0.0138 0.0091 3951 LEU 91 CD1 -0.0029 0.0131 0.0082 3952 LEU 91 CD2 0.0008 0.0184 0.0116 3953 HIS 92 N 0.0080 0.0049 0.0057 3954 HIS 92 CA 0.0131 0.0045 0.0063 3955 HIS 92 C 0.0138 -0.0012 0.0035 3956 HIS 92 O 0.0166 -0.0021 0.0035 3957 HIS 92 CB 0.0158 0.0049 0.0070 3958 HIS 92 CG 0.0174 0.0097 0.0097 3959 HIS 92 ND1 0.0134 0.0130 0.0108 3960 HIS 92 CD2 0.0206 0.0126 0.0118 3961 HIS 92 CE1 0.0160 0.0167 0.0131 3962 HIS 92 NE2 0.0196 0.0171 0.0139 3963 CYS 93 N 0.0108 -0.0037 0.0017 3964 CYS 93 CA 0.0112 -0.0086 -0.0008 3965 CYS 93 C 0.0088 -0.0092 -0.0015 3966 CYS 93 O 0.0110 -0.0109 -0.0020 3967 CYS 93 CB 0.0096 -0.0104 -0.0020 3968 CYS 93 SG 0.0100 -0.0167 -0.0052 3969 ASP 94 N 0.0035 -0.0110 -0.0030 3970 ASP 94 CA -0.0003 -0.0141 -0.0048 3971 ASP 94 C 0.0003 -0.0114 -0.0033 3972 ASP 94 O -0.0005 -0.0137 -0.0045 3973 ASP 94 CB -0.0059 -0.0136 -0.0047 3974 ASP 94 CG -0.0076 -0.0174 -0.0067 3975 ASP 94 OD1 -0.0036 -0.0192 -0.0075 3976 ASP 94 OD2 -0.0129 -0.0147 -0.0055 3977 LYS 95 N 0.0008 -0.0066 -0.0008 3978 LYS 95 CA 0.0009 -0.0038 0.0007 3979 LYS 95 C 0.0062 -0.0032 0.0012 3980 LYS 95 O 0.0087 -0.0036 0.0011 3981 LYS 95 CB -0.0027 0.0009 0.0030 3982 LYS 95 CG -0.0086 0.0006 0.0026 3983 LYS 95 CD -0.0116 -0.0043 -0.0001 3984 LYS 95 CE -0.0169 -0.0067 -0.0015 3985 LYS 95 NZ -0.0169 -0.0107 -0.0036 3986 LEU 96 N 0.0107 -0.0010 0.0025 3987 LEU 96 CA 0.0161 0.0006 0.0036 3988 LEU 96 C 0.0210 -0.0037 0.0015 3989 LEU 96 O 0.0252 -0.0026 0.0022 3990 LEU 96 CB 0.0173 0.0055 0.0062 3991 LEU 96 CG 0.0132 0.0099 0.0083 3992 LEU 96 CD1 0.0150 0.0143 0.0107 3993 LEU 96 CD2 0.0127 0.0114 0.0091 3994 HIS 97 N 0.0166 -0.0086 0.0036 3995 HIS 97 CA 0.0166 -0.0083 0.0032 3996 HIS 97 C 0.0164 -0.0071 0.0020 3997 HIS 97 O 0.0166 -0.0071 0.0009 3998 HIS 97 CB 0.0171 -0.0095 0.0027 3999 HIS 97 CG 0.0174 -0.0109 0.0040 4000 HIS 97 ND1 0.0170 -0.0107 0.0054 4001 HIS 97 CD2 0.0179 -0.0121 0.0036 4002 HIS 97 CE1 0.0173 -0.0122 0.0063 4003 HIS 97 NE2 0.0178 -0.0127 0.0051 4004 VAL 98 N 0.0160 -0.0059 0.0021 4005 VAL 98 CA 0.0158 -0.0048 0.0009 4006 VAL 98 C 0.0153 -0.0036 0.0013 4007 VAL 98 O 0.0148 -0.0030 0.0024 4008 VAL 98 CB 0.0156 -0.0041 0.0008 4009 VAL 98 CG1 0.0153 -0.0028 -0.0002 4010 VAL 98 CG2 0.0162 -0.0054 0.0002 4011 ASP 99 N 0.0154 -0.0032 0.0004 4012 ASP 99 CA 0.0148 -0.0019 0.0006 4013 ASP 99 C 0.0143 -0.0007 0.0007 4014 ASP 99 O 0.0145 -0.0004 -0.0005 4015 ASP 99 CB 0.0151 -0.0019 -0.0007 4016 ASP 99 CG 0.0146 -0.0006 -0.0007 4017 ASP 99 OD1 0.0149 -0.0008 -0.0018 4018 ASP 99 OD2 0.0141 0.0002 0.0004 4019 PRO 100 N 0.0130 -0.0007 0.0015 4020 PRO 100 CA 0.0126 -0.0008 0.0012 4021 PRO 100 C 0.0109 -0.0007 0.0002 4022 PRO 100 O 0.0108 -0.0012 -0.0003 4023 PRO 100 CB 0.0136 -0.0003 0.0023 4024 PRO 100 CG 0.0139 0.0008 0.0033 4025 PRO 100 CD 0.0137 0.0004 0.0028 4026 GLU 101 N 0.0099 0.0001 0.0003 4027 GLU 101 CA 0.0084 0.0002 -0.0005 4028 GLU 101 C 0.0081 -0.0012 -0.0019 4029 GLU 101 O 0.0072 -0.0015 -0.0027 4030 GLU 101 CB 0.0075 0.0011 -0.0004 4031 GLU 101 CG 0.0057 0.0011 -0.0015 4032 GLU 101 CD 0.0046 0.0021 -0.0014 4033 GLU 101 OE1 0.0055 0.0029 -0.0002 4034 GLU 101 OE2 0.0035 0.0015 -0.0025 4035 ASN 102 N 0.0092 -0.0022 -0.0020 4036 ASN 102 CA 0.0092 -0.0037 -0.0033 4037 ASN 102 C 0.0096 -0.0043 -0.0035 4038 ASN 102 O 0.0088 -0.0051 -0.0048 4039 ASN 102 CB 0.0104 -0.0045 -0.0032 4040 ASN 102 CG 0.0099 -0.0042 -0.0033 4041 ASN 102 OD1 0.0090 -0.0044 -0.0040 4042 ASN 102 ND2 0.0108 -0.0035 -0.0022 4043 PHE 103 N 0.0123 -0.0028 -0.0015 4044 PHE 103 CA 0.0125 -0.0031 -0.0017 4045 PHE 103 C 0.0096 -0.0018 -0.0031 4046 PHE 103 O 0.0090 -0.0025 -0.0048 4047 PHE 103 CB 0.0137 -0.0023 0.0006 4048 PHE 103 CG 0.0163 -0.0035 0.0020 4049 PHE 103 CD1 0.0179 -0.0059 0.0005 4050 PHE 103 CD2 0.0174 -0.0024 0.0047 4051 PHE 103 CE1 0.0202 -0.0071 0.0016 4052 PHE 103 CE2 0.0198 -0.0036 0.0057 4053 PHE 103 CZ 0.0213 -0.0059 0.0043 4054 ARG 104 N 0.0080 0.0002 -0.0023 4055 ARG 104 CA 0.0055 0.0018 -0.0031 4056 ARG 104 C 0.0041 0.0006 -0.0061 4057 ARG 104 O 0.0027 0.0007 -0.0075 4058 ARG 104 CB 0.0041 0.0042 -0.0013 4059 ARG 104 CG 0.0053 0.0050 0.0010 4060 ARG 104 CD 0.0042 0.0075 0.0032 4061 ARG 104 NE 0.0062 0.0077 0.0056 4062 ARG 104 CZ 0.0056 0.0107 0.0089 4063 ARG 104 NH1 0.0039 0.0106 0.0069 4064 ARG 104 NH2 0.0049 0.0116 0.0094 4065 LEU 105 N 0.0046 -0.0001 -0.0065 4066 LEU 105 CA 0.0035 -0.0012 -0.0091 4067 LEU 105 C 0.0042 -0.0032 -0.0110 4068 LEU 105 O 0.0027 -0.0033 -0.0129 4069 LEU 105 CB 0.0041 -0.0017 -0.0091 4070 LEU 105 CG 0.0033 -0.0001 -0.0080 4071 LEU 105 CD1 0.0040 -0.0007 -0.0079 4072 LEU 105 CD2 0.0006 0.0017 -0.0085 4073 LEU 106 N 0.0036 -0.0007 -0.0076 4074 LEU 106 CA 0.0036 -0.0009 -0.0074 4075 LEU 106 C 0.0039 -0.0012 -0.0074 4076 LEU 106 O 0.0039 -0.0014 -0.0072 4077 LEU 106 CB 0.0037 -0.0008 -0.0075 4078 LEU 106 CG 0.0037 -0.0011 -0.0073 4079 LEU 106 CD1 0.0034 -0.0012 -0.0071 4080 LEU 106 CD2 0.0038 -0.0010 -0.0075 4081 GLY 107 N 0.0042 -0.0011 -0.0075 4082 GLY 107 CA 0.0045 -0.0013 -0.0075 4083 GLY 107 C 0.0044 -0.0015 -0.0074 4084 GLY 107 O 0.0045 -0.0018 -0.0072 4085 ASN 108 N 0.0042 -0.0014 -0.0074 4086 ASN 108 CA 0.0041 -0.0015 -0.0072 4087 ASN 108 C 0.0039 -0.0017 -0.0070 4088 ASN 108 O 0.0039 -0.0019 -0.0068 4089 ASN 108 CB 0.0040 -0.0013 -0.0073 4090 ASN 108 CG 0.0043 -0.0012 -0.0076 4091 ASN 108 OD1 0.0046 -0.0014 -0.0075 4092 ASN 108 ND2 0.0042 -0.0010 -0.0076 4093 VAL 109 N 0.0028 -0.0047 -0.0069 4094 VAL 109 CA 0.0026 -0.0041 -0.0057 4095 VAL 109 C 0.0024 -0.0036 -0.0049 4096 VAL 109 O 0.0029 -0.0033 -0.0039 4097 VAL 109 CB 0.0014 -0.0037 -0.0060 4098 VAL 109 CG1 0.0010 -0.0030 -0.0048 4099 VAL 109 CG2 0.0018 -0.0041 -0.0065 4100 LEU 110 N 0.0017 -0.0035 -0.0053 4101 LEU 110 CA 0.0015 -0.0031 -0.0046 4102 LEU 110 C 0.0027 -0.0032 -0.0039 4103 LEU 110 O 0.0030 -0.0029 -0.0029 4104 LEU 110 CB 0.0007 -0.0031 -0.0052 4105 LEU 110 CG 0.0005 -0.0028 -0.0046 4106 LEU 110 CD1 -0.0000 -0.0021 -0.0035 4107 LEU 110 CD2 -0.0003 -0.0028 -0.0054 4108 VAL 111 N 0.0036 -0.0040 -0.0047 4109 VAL 111 CA 0.0049 -0.0042 -0.0042 4110 VAL 111 C 0.0055 -0.0040 -0.0032 4111 VAL 111 O 0.0061 -0.0038 -0.0023 4112 VAL 111 CB 0.0057 -0.0050 -0.0053 4113 VAL 111 CG1 0.0070 -0.0052 -0.0047 4114 VAL 111 CG2 0.0051 -0.0051 -0.0060 4115 CYS 112 N 0.0076 -0.0065 0.0007 4116 CYS 112 CA 0.0080 -0.0063 0.0024 4117 CYS 112 C 0.0077 -0.0053 0.0035 4118 CYS 112 O 0.0082 -0.0054 0.0047 4119 CYS 112 CB 0.0079 -0.0058 0.0029 4120 CYS 112 SG 0.0088 -0.0073 0.0025 4121 VAL 113 N 0.0067 -0.0042 0.0027 4122 VAL 113 CA 0.0061 -0.0028 0.0034 4123 VAL 113 C 0.0063 -0.0032 0.0034 4124 VAL 113 O 0.0066 -0.0030 0.0046 4125 VAL 113 CB 0.0050 -0.0016 0.0025 4126 VAL 113 CG1 0.0045 -0.0005 0.0031 4127 VAL 113 CG2 0.0047 -0.0008 0.0031 4128 LEU 114 N 0.0065 -0.0041 0.0021 4129 LEU 114 CA 0.0068 -0.0046 0.0020 4130 LEU 114 C 0.0078 -0.0055 0.0033 4131 LEU 114 O 0.0081 -0.0055 0.0041 4132 LEU 114 CB 0.0067 -0.0053 0.0003 4133 LEU 114 CG 0.0056 -0.0044 -0.0010 4134 LEU 114 CD1 0.0056 -0.0053 -0.0027 4135 LEU 114 CD2 0.0050 -0.0032 -0.0006 4136 ALA 115 N 0.0130 -0.0041 0.0091 4137 ALA 115 CA 0.0122 -0.0048 0.0095 4138 ALA 115 C 0.0124 -0.0046 0.0095 4139 ALA 115 O 0.0119 -0.0051 0.0092 4140 ALA 115 CB 0.0117 -0.0051 0.0108 4141 HIS 116 N 0.0131 -0.0038 0.0102 4142 HIS 116 CA 0.0134 -0.0034 0.0103 4143 HIS 116 C 0.0137 -0.0034 0.0090 4144 HIS 116 O 0.0134 -0.0037 0.0088 4145 HIS 116 CB 0.0142 -0.0025 0.0110 4146 HIS 116 CG 0.0145 -0.0022 0.0113 4147 HIS 116 ND1 0.0153 -0.0014 0.0111 4148 HIS 116 CD2 0.0139 -0.0026 0.0119 4149 HIS 116 CE1 0.0154 -0.0011 0.0116 4150 HIS 116 NE2 0.0145 -0.0020 0.0120 4151 HIS 117 N 0.0142 -0.0030 0.0082 4152 HIS 117 CA 0.0146 -0.0029 0.0070 4153 HIS 117 C 0.0138 -0.0038 0.0062 4154 HIS 117 O 0.0137 -0.0040 0.0054 4155 HIS 117 CB 0.0153 -0.0022 0.0064 4156 HIS 117 CG 0.0157 -0.0020 0.0054 4157 HIS 117 ND1 0.0165 -0.0012 0.0054 4158 HIS 117 CD2 0.0156 -0.0023 0.0039 4159 HIS 117 CE1 0.0166 -0.0013 0.0038 4160 HIS 117 NE2 0.0163 -0.0018 0.0033 4161 PHE 118 N 0.0079 0.0002 0.0089 4162 PHE 118 CA 0.0091 -0.0006 0.0093 4163 PHE 118 C 0.0110 -0.0016 0.0102 4164 PHE 118 O 0.0122 -0.0023 0.0109 4165 PHE 118 CB 0.0091 -0.0013 0.0073 4166 PHE 118 CG 0.0071 -0.0000 0.0066 4167 PHE 118 CD1 0.0056 0.0005 0.0051 4168 PHE 118 CD2 0.0068 0.0006 0.0080 4169 PHE 118 CE1 0.0039 0.0015 0.0043 4170 PHE 118 CE2 0.0049 0.0018 0.0074 4171 PHE 118 CZ 0.0035 0.0023 0.0061 4172 GLY 119 N 0.0117 -0.0022 0.0102 4173 GLY 119 CA 0.0136 -0.0031 0.0114 4174 GLY 119 C 0.0149 -0.0045 0.0100 4175 GLY 119 O 0.0149 -0.0051 0.0082 4176 LYS 120 N 0.0164 -0.0050 0.0116 4177 LYS 120 CA 0.0179 -0.0064 0.0108 4178 LYS 120 C 0.0175 -0.0064 0.0098 4179 LYS 120 O 0.0184 -0.0076 0.0083 4180 LYS 120 CB 0.0195 -0.0068 0.0130 4181 LYS 120 CG 0.0194 -0.0066 0.0134 4182 LYS 120 CD 0.0206 -0.0069 0.0152 4183 LYS 120 CE 0.0193 -0.0055 0.0165 4184 LYS 120 NZ 0.0210 -0.0062 0.0179 4185 GLU 121 N 0.0084 -0.0038 0.0097 4186 GLU 121 CA 0.0074 -0.0038 0.0082 4187 GLU 121 C 0.0066 -0.0047 0.0062 4188 GLU 121 O 0.0060 -0.0053 0.0047 4189 GLU 121 CB 0.0057 -0.0016 0.0081 4190 GLU 121 CG 0.0050 -0.0017 0.0070 4191 GLU 121 CD 0.0036 0.0006 0.0073 4192 GLU 121 OE1 0.0023 0.0004 0.0053 4193 GLU 121 OE2 0.0034 0.0016 0.0081 4194 PHE 122 N 0.0068 -0.0046 0.0066 4195 PHE 122 CA 0.0063 -0.0055 0.0049 4196 PHE 122 C 0.0077 -0.0076 0.0047 4197 PHE 122 O 0.0084 -0.0083 0.0051 4198 PHE 122 CB 0.0060 -0.0046 0.0055 4199 PHE 122 CG 0.0050 -0.0048 0.0037 4200 PHE 122 CD1 0.0037 -0.0044 0.0023 4201 PHE 122 CD2 0.0055 -0.0060 0.0032 4202 PHE 122 CE1 0.0026 -0.0046 0.0006 4203 PHE 122 CE2 0.0048 -0.0066 0.0016 4204 PHE 122 CZ 0.0034 -0.0057 0.0005 4205 THR 123 N 0.0078 -0.0085 0.0041 4206 THR 123 CA 0.0092 -0.0105 0.0040 4207 THR 123 C 0.0089 -0.0115 0.0025 4208 THR 123 O 0.0078 -0.0111 0.0013 4209 THR 123 CB 0.0094 -0.0112 0.0035 4210 THR 123 OG1 0.0081 -0.0110 0.0019 4211 THR 123 CG2 0.0096 -0.0098 0.0052 4212 PRO 124 N 0.0026 -0.0091 0.0030 4213 PRO 124 CA 0.0029 -0.0088 0.0013 4214 PRO 124 C 0.0032 -0.0087 -0.0001 4215 PRO 124 O 0.0026 -0.0079 -0.0013 4216 PRO 124 CB 0.0039 -0.0096 0.0015 4217 PRO 124 CG 0.0036 -0.0100 0.0033 4218 PRO 124 CD 0.0033 -0.0100 0.0041 4219 PRO 125 N 0.0041 -0.0093 -0.0001 4220 PRO 125 CA 0.0044 -0.0091 -0.0013 4221 PRO 125 C 0.0033 -0.0082 -0.0017 4222 PRO 125 O 0.0030 -0.0076 -0.0031 4223 PRO 125 CB 0.0056 -0.0101 -0.0008 4224 PRO 125 CG 0.0062 -0.0109 0.0002 4225 PRO 125 CD 0.0054 -0.0106 0.0011 4226 VAL 126 N 0.0024 -0.0080 -0.0002 4227 VAL 126 CA 0.0011 -0.0071 -0.0004 4228 VAL 126 C -0.0000 -0.0060 -0.0014 4229 VAL 126 O -0.0006 -0.0053 -0.0023 4230 VAL 126 CB 0.0003 -0.0071 0.0017 4231 VAL 126 CG1 -0.0008 -0.0062 0.0014 4232 VAL 126 CG2 0.0015 -0.0081 0.0020 4233 GLN 127 N 0.0003 -0.0034 -0.0010 4234 GLN 127 CA -0.0000 -0.0035 -0.0018 4235 GLN 127 C -0.0005 -0.0044 -0.0039 4236 GLN 127 O -0.0017 -0.0038 -0.0050 4237 GLN 127 CB 0.0012 -0.0039 -0.0004 4238 GLN 127 CG 0.0008 -0.0040 -0.0013 4239 GLN 127 CD 0.0023 -0.0050 -0.0004 4240 GLN 127 OE1 0.0034 -0.0051 0.0012 4241 GLN 127 NE2 0.0019 -0.0050 -0.0011 4242 ALA 128 N 0.0005 -0.0059 -0.0046 4243 ALA 128 CA 0.0004 -0.0071 -0.0066 4244 ALA 128 C -0.0013 -0.0064 -0.0081 4245 ALA 128 O -0.0021 -0.0065 -0.0095 4246 ALA 128 CB 0.0017 -0.0087 -0.0069 4247 ALA 129 N -0.0017 -0.0054 -0.0073 4248 ALA 129 CA -0.0033 -0.0046 -0.0085 4249 ALA 129 C -0.0047 -0.0032 -0.0087 4250 ALA 129 O -0.0059 -0.0030 -0.0103 4251 ALA 129 CB -0.0035 -0.0039 -0.0078 4252 TYR 130 N -0.0049 -0.0038 -0.0059 4253 TYR 130 CA -0.0062 -0.0040 -0.0061 4254 TYR 130 C -0.0065 -0.0034 -0.0073 4255 TYR 130 O -0.0071 -0.0033 -0.0076 4256 TYR 130 CB -0.0070 -0.0045 -0.0057 4257 TYR 130 CG -0.0071 -0.0053 -0.0047 4258 TYR 130 CD1 -0.0078 -0.0056 -0.0045 4259 TYR 130 CD2 -0.0065 -0.0056 -0.0038 4260 TYR 130 CE1 -0.0080 -0.0063 -0.0035 4261 TYR 130 CE2 -0.0066 -0.0064 -0.0027 4262 TYR 130 CZ -0.0072 -0.0067 -0.0026 4263 TYR 130 OH -0.0074 -0.0073 -0.0017 4264 GLN 131 N -0.0061 -0.0028 -0.0079 4265 GLN 131 CA -0.0063 -0.0022 -0.0090 4266 GLN 131 C -0.0059 -0.0018 -0.0094 4267 GLN 131 O -0.0064 -0.0016 -0.0099 4268 GLN 131 CB -0.0061 -0.0016 -0.0097 4269 GLN 131 CG -0.0066 -0.0019 -0.0095 4270 GLN 131 CD -0.0081 -0.0019 -0.0103 4271 GLN 131 OE1 -0.0084 -0.0022 -0.0099 4272 GLN 131 NE2 -0.0084 -0.0017 -0.0108 4273 LYS 132 N -0.0048 -0.0018 -0.0088 4274 LYS 132 CA -0.0042 -0.0014 -0.0092 4275 LYS 132 C -0.0048 -0.0018 -0.0088 4276 LYS 132 O -0.0051 -0.0016 -0.0093 4277 LYS 132 CB -0.0030 -0.0014 -0.0086 4278 LYS 132 CG -0.0021 -0.0008 -0.0091 4279 LYS 132 CD -0.0008 -0.0009 -0.0083 4280 LYS 132 CE -0.0004 -0.0007 -0.0084 4281 LYS 132 NZ 0.0014 -0.0004 -0.0079 4282 VAL 133 N -0.0088 -0.0002 -0.0108 4283 VAL 133 CA -0.0072 -0.0010 -0.0107 4284 VAL 133 C -0.0060 -0.0016 -0.0103 4285 VAL 133 O -0.0048 -0.0021 -0.0092 4286 VAL 133 CB -0.0069 -0.0014 -0.0126 4287 VAL 133 CG1 -0.0051 -0.0024 -0.0128 4288 VAL 133 CG2 -0.0080 -0.0008 -0.0128 4289 VAL 134 N -0.0061 -0.0017 -0.0112 4290 VAL 134 CA -0.0048 -0.0023 -0.0109 4291 VAL 134 C -0.0047 -0.0021 -0.0089 4292 VAL 134 O -0.0035 -0.0027 -0.0081 4293 VAL 134 CB -0.0048 -0.0025 -0.0124 4294 VAL 134 CG1 -0.0047 -0.0028 -0.0142 4295 VAL 134 CG2 -0.0062 -0.0017 -0.0122 4296 ALA 135 N -0.0061 -0.0013 -0.0083 4297 ALA 135 CA -0.0064 -0.0009 -0.0065 4298 ALA 135 C -0.0054 -0.0012 -0.0051 4299 ALA 135 O -0.0047 -0.0014 -0.0037 4300 ALA 135 CB -0.0080 0.0000 -0.0059 4301 GLY 136 N 0.0013 0.0021 -0.0006 4302 GLY 136 CA 0.0009 0.0020 -0.0001 4303 GLY 136 C 0.0036 0.0012 0.0001 4304 GLY 136 O 0.0044 0.0003 0.0020 4305 VAL 137 N 0.0052 0.0017 -0.0019 4306 VAL 137 CA 0.0077 0.0012 -0.0022 4307 VAL 137 C 0.0099 0.0001 -0.0008 4308 VAL 137 O 0.0108 -0.0008 0.0008 4309 VAL 137 CB 0.0094 0.0020 -0.0052 4310 VAL 137 CG1 0.0125 0.0013 -0.0053 4311 VAL 137 CG2 0.0076 0.0030 -0.0067 4312 ALA 138 N 0.0097 -0.0002 -0.0000 4313 ALA 138 CA 0.0113 -0.0013 0.0019 4314 ALA 138 C 0.0106 -0.0022 0.0045 4315 ALA 138 O 0.0120 -0.0031 0.0059 4316 ALA 138 CB 0.0109 -0.0013 0.0021 4317 ASN 139 N 0.0155 -0.0029 0.0075 4318 ASN 139 CA 0.0147 -0.0041 0.0078 4319 ASN 139 C 0.0138 -0.0039 0.0077 4320 ASN 139 O 0.0134 -0.0048 0.0079 4321 ASN 139 CB 0.0137 -0.0041 0.0077 4322 ASN 139 CG 0.0136 -0.0051 0.0081 4323 ASN 139 OD1 0.0124 -0.0058 0.0082 4324 ASN 139 ND2 0.0152 -0.0054 0.0083 4325 ALA 140 N 0.0133 -0.0027 0.0072 4326 ALA 140 CA 0.0124 -0.0022 0.0069 4327 ALA 140 C 0.0134 -0.0023 0.0071 4328 ALA 140 O 0.0128 -0.0029 0.0072 4329 ALA 140 CB 0.0120 -0.0009 0.0064 4330 LEU 141 N 0.0146 -0.0020 0.0071 4331 LEU 141 CA 0.0155 -0.0021 0.0072 4332 LEU 141 C 0.0158 -0.0036 0.0078 4333 LEU 141 O 0.0163 -0.0040 0.0080 4334 LEU 141 CB 0.0169 -0.0012 0.0070 4335 LEU 141 CG 0.0167 0.0002 0.0065 4336 LEU 141 CD1 0.0182 0.0006 0.0065 4337 LEU 141 CD2 0.0165 0.0001 0.0065 4338 ALA 142 N 0.0230 -0.0057 0.0057 4339 ALA 142 CA 0.0234 -0.0105 0.0044 4340 ALA 142 C 0.0193 -0.0137 0.0013 4341 ALA 142 O 0.0195 -0.0171 0.0003 4342 ALA 142 CB 0.0280 -0.0137 0.0058 4343 HIS 143 N 0.0157 -0.0125 -0.0002 4344 HIS 143 CA 0.0116 -0.0153 -0.0032 4345 HIS 143 C 0.0085 -0.0165 -0.0051 4346 HIS 143 O 0.0074 -0.0210 -0.0071 4347 HIS 143 CB 0.0090 -0.0135 -0.0039 4348 HIS 143 CG 0.0054 -0.0162 -0.0066 4349 HIS 143 ND1 0.0010 -0.0147 -0.0084 4350 HIS 143 CD2 0.0075 -0.0226 -0.0076 4351 HIS 143 CE1 -0.0005 -0.0203 -0.0109 4352 HIS 143 NE2 0.0030 -0.0233 -0.0101 4353 LYS 144 N 0.0076 -0.0129 -0.0044 4354 LYS 144 CA 0.0045 -0.0123 -0.0059 4355 LYS 144 C 0.0066 -0.0153 -0.0057 4356 LYS 144 O 0.0046 -0.0149 -0.0066 4357 LYS 144 CB 0.0004 -0.0091 -0.0069 4358 LYS 144 CG -0.0027 -0.0070 -0.0079 4359 LYS 144 CD -0.0070 -0.0089 -0.0107 4360 LYS 144 CE -0.0103 -0.0085 -0.0122 4361 LYS 144 NZ -0.0181 -0.0079 -0.0160 4362 TYR 145 N 0.0164 -0.0129 -0.0100 4363 TYR 145 CA 0.0163 -0.0128 -0.0099 4364 TYR 145 C 0.0161 -0.0142 -0.0133 4365 TYR 145 O 0.0175 -0.0164 -0.0150 4366 TYR 145 CB 0.0186 -0.0137 -0.0066 4367 TYR 145 CG 0.0181 -0.0115 -0.0031 4368 TYR 145 CD1 0.0176 -0.0101 -0.0010 4369 TYR 145 CD2 0.0181 -0.0109 -0.0017 4370 TYR 145 CE1 0.0172 -0.0082 0.0021 4371 TYR 145 CE2 0.0176 -0.0087 0.0019 4372 TYR 145 CZ 0.0172 -0.0075 0.0036 4373 TYR 145 OH 0.0168 -0.0055 0.0069 4374 HIS 146 N 0.0144 -0.0128 -0.0143 4375 HIS 146 CA 0.0140 -0.0140 -0.0177 4376 HIS 146 C 0.0127 -0.0122 -0.0169 4377 HIS 146 O 0.0126 -0.0109 -0.0143 4378 HIS 146 CB 0.0118 -0.0130 -0.0207 4379 HIS 146 CG 0.0096 -0.0100 -0.0192 4380 HIS 146 ND1 0.0066 -0.0077 -0.0214 4381 HIS 146 CD2 0.0084 -0.0077 -0.0170 4382 HIS 146 CE1 0.0055 -0.0064 -0.0208 4383 HIS 146 NE2 0.0054 -0.0045 -0.0169 4384 HIS 146 OXT 0.0128 -0.0137 -0.0197