1 ALA 1 N -0.0173 -0.0020 0.0136 2 ALA 1 CA -0.0160 -0.0021 0.0109 3 ALA 1 C -0.0136 -0.0010 0.0095 4 ALA 1 O -0.0123 0.0004 0.0110 5 ALA 1 CB -0.0153 -0.0015 0.0114 6 THR 2 N -0.0129 -0.0017 0.0066 7 THR 2 CA -0.0106 -0.0007 0.0050 8 THR 2 C -0.0084 0.0005 0.0044 9 THR 2 O -0.0088 -0.0001 0.0035 10 THR 2 CB -0.0111 -0.0022 0.0022 11 THR 2 OG1 -0.0134 -0.0035 0.0028 12 THR 2 CG2 -0.0089 -0.0012 0.0008 13 LYS 3 N -0.0059 -0.0019 0.0039 14 LYS 3 CA -0.0047 -0.0003 0.0040 15 LYS 3 C -0.0038 0.0008 0.0023 16 LYS 3 O -0.0038 0.0007 0.0018 17 LYS 3 CB -0.0042 0.0006 0.0061 18 LYS 3 CG -0.0051 -0.0003 0.0078 19 LYS 3 CD -0.0048 0.0003 0.0099 20 LYS 3 CE -0.0059 -0.0009 0.0115 21 LYS 3 NZ -0.0058 -0.0005 0.0135 22 ALA 4 N -0.0029 0.0019 0.0015 23 ALA 4 CA -0.0019 0.0030 -0.0001 24 ALA 4 C -0.0007 0.0046 0.0004 25 ALA 4 O -0.0007 0.0049 0.0018 26 ALA 4 CB -0.0022 0.0023 -0.0022 27 VAL 5 N 0.0032 0.0045 0.0001 28 VAL 5 CA 0.0027 0.0050 0.0002 29 VAL 5 C 0.0017 0.0056 0.0003 30 VAL 5 O 0.0012 0.0054 -0.0001 31 VAL 5 CB 0.0026 0.0043 -0.0004 32 VAL 5 CG1 0.0019 0.0038 -0.0012 33 VAL 5 CG2 0.0023 0.0048 -0.0001 34 CYS 6 N 0.0013 0.0063 0.0007 35 CYS 6 CA 0.0003 0.0069 0.0008 36 CYS 6 C -0.0001 0.0073 0.0010 37 CYS 6 O 0.0003 0.0076 0.0015 38 CYS 6 CB 0.0005 0.0076 0.0015 39 CYS 6 SG -0.0007 0.0083 0.0016 40 VAL 7 N 0.0000 0.0064 0.0022 41 VAL 7 CA -0.0003 0.0063 0.0022 42 VAL 7 C -0.0007 0.0066 0.0026 43 VAL 7 O -0.0012 0.0067 0.0028 44 VAL 7 CB -0.0006 0.0058 0.0018 45 VAL 7 CG1 -0.0009 0.0056 0.0018 46 VAL 7 CG2 -0.0002 0.0054 0.0014 47 LEU 8 N -0.0007 0.0069 0.0029 48 LEU 8 CA -0.0010 0.0073 0.0033 49 LEU 8 C -0.0016 0.0071 0.0033 50 LEU 8 O -0.0015 0.0068 0.0030 51 LEU 8 CB -0.0006 0.0077 0.0035 52 LEU 8 CG -0.0001 0.0080 0.0036 53 LEU 8 CD1 0.0004 0.0083 0.0037 54 LEU 8 CD2 -0.0003 0.0084 0.0040 55 LYS 9 N -0.0029 0.0069 0.0026 56 LYS 9 CA -0.0028 0.0060 0.0029 57 LYS 9 C -0.0037 0.0068 0.0031 58 LYS 9 O -0.0046 0.0078 0.0033 59 LYS 9 CB -0.0033 0.0046 0.0037 60 LYS 9 CG -0.0022 0.0034 0.0035 61 LYS 9 CD -0.0024 0.0029 0.0039 62 LYS 9 CE -0.0018 0.0014 0.0041 63 LYS 9 NZ -0.0004 0.0011 0.0034 64 GLY 10 N -0.0034 0.0064 0.0031 65 GLY 10 CA -0.0041 0.0071 0.0033 66 GLY 10 C -0.0040 0.0061 0.0036 67 GLY 10 O -0.0037 0.0048 0.0039 68 ASP 11 N -0.0053 0.0065 0.0023 69 ASP 11 CA -0.0060 0.0067 0.0023 70 ASP 11 C -0.0040 0.0076 0.0024 71 ASP 11 O -0.0043 0.0078 0.0024 72 ASP 11 CB -0.0081 0.0083 0.0020 73 ASP 11 CG -0.0100 0.0078 0.0019 74 ASP 11 OD1 -0.0103 0.0057 0.0019 75 ASP 11 OD2 -0.0114 0.0094 0.0017 76 GLY 12 N -0.0019 0.0081 0.0026 77 GLY 12 CA 0.0001 0.0090 0.0027 78 GLY 12 C 0.0022 0.0074 0.0030 79 GLY 12 O 0.0021 0.0053 0.0030 80 PRO 13 N 0.0043 0.0053 0.0036 81 PRO 13 CA 0.0045 0.0051 0.0043 82 PRO 13 C 0.0035 0.0050 0.0045 83 PRO 13 O 0.0035 0.0048 0.0051 84 PRO 13 CB 0.0055 0.0054 0.0038 85 PRO 13 CG 0.0052 0.0057 0.0025 86 PRO 13 CD 0.0049 0.0057 0.0025 87 VAL 14 N 0.0025 0.0050 0.0038 88 VAL 14 CA 0.0015 0.0049 0.0038 89 VAL 14 C 0.0008 0.0045 0.0049 90 VAL 14 O 0.0003 0.0044 0.0051 91 VAL 14 CB 0.0008 0.0051 0.0028 92 VAL 14 CG1 -0.0003 0.0050 0.0028 93 VAL 14 CG2 0.0015 0.0055 0.0017 94 GLN 15 N 0.0025 0.0051 0.0048 95 GLN 15 CA 0.0022 0.0054 0.0054 96 GLN 15 C 0.0018 0.0057 0.0050 97 GLN 15 O 0.0019 0.0057 0.0043 98 GLN 15 CB 0.0026 0.0050 0.0059 99 GLN 15 CG 0.0032 0.0045 0.0056 100 GLN 15 CD 0.0036 0.0041 0.0061 101 GLN 15 OE1 0.0034 0.0042 0.0067 102 GLN 15 NE2 0.0041 0.0036 0.0061 103 GLY 16 N 0.0013 0.0062 0.0054 104 GLY 16 CA 0.0009 0.0065 0.0050 105 GLY 16 C 0.0004 0.0069 0.0056 106 GLY 16 O 0.0004 0.0069 0.0063 107 ILE 17 N 0.0006 0.0085 0.0042 108 ILE 17 CA 0.0001 0.0081 0.0046 109 ILE 17 C -0.0003 0.0080 0.0044 110 ILE 17 O -0.0001 0.0081 0.0044 111 ILE 17 CB 0.0004 0.0079 0.0053 112 ILE 17 CG1 -0.0002 0.0075 0.0057 113 ILE 17 CG2 0.0009 0.0081 0.0055 114 ILE 17 CD1 -0.0006 0.0074 0.0057 115 ILE 18 N -0.0010 0.0078 0.0042 116 ILE 18 CA -0.0015 0.0078 0.0040 117 ILE 18 C -0.0020 0.0074 0.0044 118 ILE 18 O -0.0023 0.0072 0.0045 119 ILE 18 CB -0.0017 0.0080 0.0032 120 ILE 18 CG1 -0.0011 0.0084 0.0028 121 ILE 18 CG2 -0.0023 0.0078 0.0030 122 ILE 18 CD1 -0.0009 0.0085 0.0028 123 ASN 19 N -0.0032 0.0081 0.0040 124 ASN 19 CA -0.0037 0.0074 0.0044 125 ASN 19 C -0.0041 0.0062 0.0038 126 ASN 19 O -0.0041 0.0060 0.0033 127 ASN 19 CB -0.0040 0.0074 0.0057 128 ASN 19 CG -0.0036 0.0086 0.0063 129 ASN 19 OD1 -0.0034 0.0090 0.0065 130 ASN 19 ND2 -0.0034 0.0091 0.0067 131 PHE 20 N -0.0046 0.0055 0.0038 132 PHE 20 CA -0.0051 0.0044 0.0035 133 PHE 20 C -0.0057 0.0038 0.0043 134 PHE 20 O -0.0056 0.0041 0.0047 135 PHE 20 CB -0.0049 0.0040 0.0022 136 PHE 20 CG -0.0044 0.0045 0.0013 137 PHE 20 CD1 -0.0037 0.0055 0.0011 138 PHE 20 CD2 -0.0045 0.0041 0.0008 139 PHE 20 CE1 -0.0032 0.0061 0.0003 140 PHE 20 CE2 -0.0039 0.0046 -0.0001 141 PHE 20 CZ -0.0033 0.0056 -0.0003 142 GLU 21 N -0.0086 0.0026 0.0060 143 GLU 21 CA -0.0097 0.0018 0.0072 144 GLU 21 C -0.0109 0.0005 0.0064 145 GLU 21 O -0.0110 0.0003 0.0059 146 GLU 21 CB -0.0096 0.0021 0.0089 147 GLU 21 CG -0.0106 0.0015 0.0103 148 GLU 21 CD -0.0103 0.0021 0.0121 149 GLU 21 OE1 -0.0092 0.0031 0.0122 150 GLU 21 OE2 -0.0111 0.0015 0.0133 151 GLN 22 N -0.0118 -0.0003 0.0063 152 GLN 22 CA -0.0130 -0.0016 0.0058 153 GLN 22 C -0.0140 -0.0023 0.0072 154 GLN 22 O -0.0140 -0.0022 0.0077 155 GLN 22 CB -0.0132 -0.0020 0.0041 156 GLN 22 CG -0.0142 -0.0032 0.0032 157 GLN 22 CD -0.0144 -0.0036 0.0016 158 GLN 22 OE1 -0.0139 -0.0032 0.0014 159 GLN 22 NE2 -0.0149 -0.0043 0.0004 160 LYS 23 N -0.0162 -0.0072 0.0125 161 LYS 23 CA -0.0179 -0.0085 0.0153 162 LYS 23 C -0.0202 -0.0109 0.0143 163 LYS 23 O -0.0215 -0.0118 0.0163 164 LYS 23 CB -0.0184 -0.0087 0.0173 165 LYS 23 CG -0.0162 -0.0064 0.0185 166 LYS 23 CD -0.0167 -0.0063 0.0220 167 LYS 23 CE -0.0190 -0.0085 0.0225 168 LYS 23 NZ -0.0192 -0.0082 0.0257 169 GLU 24 N -0.0208 -0.0119 0.0113 170 GLU 24 CA -0.0230 -0.0141 0.0101 171 GLU 24 C -0.0224 -0.0141 0.0067 172 GLU 24 O -0.0207 -0.0127 0.0049 173 GLU 24 CB -0.0248 -0.0159 0.0100 174 GLU 24 CG -0.0259 -0.0165 0.0134 175 GLU 24 CD -0.0276 -0.0181 0.0133 176 GLU 24 OE1 -0.0271 -0.0180 0.0112 177 GLU 24 OE2 -0.0293 -0.0195 0.0154 178 SER 25 N -0.0277 -0.0123 0.0118 179 SER 25 CA -0.0272 -0.0120 0.0067 180 SER 25 C -0.0268 -0.0118 0.0017 181 SER 25 O -0.0244 -0.0094 -0.0020 182 SER 25 CB -0.0305 -0.0154 0.0061 183 SER 25 OG -0.0318 -0.0166 0.0112 184 ASN 26 N -0.0292 -0.0143 0.0015 185 ASN 26 CA -0.0290 -0.0142 -0.0028 186 ASN 26 C -0.0272 -0.0122 -0.0009 187 ASN 26 O -0.0276 -0.0127 -0.0036 188 ASN 26 CB -0.0330 -0.0184 -0.0050 189 ASN 26 CG -0.0362 -0.0215 -0.0006 190 ASN 26 OD1 -0.0357 -0.0208 0.0041 191 ASN 26 ND2 -0.0394 -0.0248 -0.0020 192 GLY 27 N -0.0221 -0.0087 0.0024 193 GLY 27 CA -0.0207 -0.0076 0.0037 194 GLY 27 C -0.0185 -0.0051 0.0025 195 GLY 27 O -0.0180 -0.0041 0.0006 196 PRO 28 N -0.0172 -0.0040 0.0036 197 PRO 28 CA -0.0150 -0.0015 0.0026 198 PRO 28 C -0.0134 -0.0001 0.0039 199 PRO 28 O -0.0135 -0.0008 0.0064 200 PRO 28 CB -0.0143 -0.0011 0.0038 201 PRO 28 CG -0.0153 -0.0028 0.0066 202 PRO 28 CD -0.0176 -0.0049 0.0058 203 VAL 29 N -0.0123 0.0004 0.0022 204 VAL 29 CA -0.0115 0.0013 0.0025 205 VAL 29 C -0.0110 0.0021 0.0029 206 VAL 29 O -0.0107 0.0021 0.0022 207 VAL 29 CB -0.0110 0.0016 0.0014 208 VAL 29 CG1 -0.0102 0.0026 0.0018 209 VAL 29 CG2 -0.0115 0.0009 0.0010 210 LYS 30 N -0.0108 0.0026 0.0041 211 LYS 30 CA -0.0102 0.0034 0.0045 212 LYS 30 C -0.0093 0.0044 0.0042 213 LYS 30 O -0.0091 0.0046 0.0043 214 LYS 30 CB -0.0105 0.0035 0.0059 215 LYS 30 CG -0.0102 0.0040 0.0064 216 LYS 30 CD -0.0104 0.0041 0.0079 217 LYS 30 CE -0.0098 0.0051 0.0085 218 LYS 30 NZ -0.0102 0.0049 0.0095 219 VAL 31 N -0.0098 0.0043 0.0037 220 VAL 31 CA -0.0087 0.0050 0.0034 221 VAL 31 C -0.0082 0.0057 0.0040 222 VAL 31 O -0.0084 0.0055 0.0038 223 VAL 31 CB -0.0083 0.0049 0.0020 224 VAL 31 CG1 -0.0072 0.0057 0.0017 225 VAL 31 CG2 -0.0089 0.0041 0.0014 226 TRP 32 N -0.0076 0.0064 0.0047 227 TRP 32 CA -0.0071 0.0071 0.0053 228 TRP 32 CA -0.0071 0.0071 0.0053 229 TRP 32 C -0.0061 0.0080 0.0055 230 TRP 32 O -0.0060 0.0081 0.0055 231 TRP 32 CB -0.0078 0.0070 0.0066 232 TRP 32 CB -0.0078 0.0070 0.0066 233 TRP 32 CG -0.0078 0.0073 0.0075 234 TRP 32 CG -0.0081 0.0070 0.0074 235 TRP 32 CD1 -0.0073 0.0080 0.0085 236 TRP 32 CD1 -0.0088 0.0064 0.0073 237 TRP 32 CD2 -0.0085 0.0068 0.0077 238 TRP 32 CD2 -0.0077 0.0077 0.0084 239 TRP 32 NE1 -0.0076 0.0081 0.0092 240 TRP 32 NE1 -0.0089 0.0067 0.0083 241 TRP 32 CE2 -0.0083 0.0073 0.0088 242 TRP 32 CE2 -0.0082 0.0075 0.0089 243 TRP 32 CE3 -0.0092 0.0060 0.0071 244 TRP 32 CE3 -0.0069 0.0086 0.0089 245 TRP 32 CZ2 -0.0089 0.0070 0.0092 246 TRP 32 CZ2 -0.0080 0.0081 0.0100 247 TRP 32 CZ3 -0.0097 0.0057 0.0076 248 TRP 32 CZ3 -0.0067 0.0091 0.0100 249 TRP 32 CH2 -0.0095 0.0062 0.0086 250 TRP 32 CH2 -0.0072 0.0089 0.0105 251 GLY 33 N -0.0066 0.0085 0.0057 252 GLY 33 CA -0.0055 0.0087 0.0062 253 GLY 33 C -0.0049 0.0082 0.0056 254 GLY 33 O -0.0053 0.0078 0.0049 255 SER 34 N -0.0038 0.0082 0.0059 256 SER 34 CA -0.0030 0.0077 0.0055 257 SER 34 C -0.0019 0.0075 0.0054 258 SER 34 O -0.0015 0.0079 0.0061 259 SER 34 CB -0.0028 0.0080 0.0060 260 SER 34 OG -0.0018 0.0077 0.0058 261 ILE 35 N -0.0018 0.0059 0.0055 262 ILE 35 CA -0.0005 0.0053 0.0057 263 ILE 35 C 0.0015 0.0043 0.0045 264 ILE 35 O 0.0014 0.0042 0.0028 265 ILE 35 CB -0.0014 0.0056 0.0046 266 ILE 35 CG1 -0.0036 0.0067 0.0053 267 ILE 35 CG2 -0.0002 0.0051 0.0053 268 ILE 35 CD1 -0.0047 0.0071 0.0040 269 LYS 36 N 0.0032 0.0035 0.0056 270 LYS 36 CA 0.0051 0.0026 0.0048 271 LYS 36 C 0.0065 0.0019 0.0049 272 LYS 36 O 0.0061 0.0022 0.0059 273 LYS 36 CB 0.0061 0.0022 0.0061 274 LYS 36 CG 0.0064 0.0022 0.0086 275 LYS 36 CD 0.0073 0.0019 0.0098 276 LYS 36 CE 0.0093 0.0009 0.0108 277 LYS 36 NZ 0.0097 0.0009 0.0129 278 GLY 37 N 0.0044 -0.0011 0.0051 279 GLY 37 CA 0.0058 -0.0026 0.0057 280 GLY 37 C 0.0055 -0.0025 0.0043 281 GLY 37 O 0.0066 -0.0035 0.0049 282 LEU 38 N 0.0041 -0.0013 0.0023 283 LEU 38 CA 0.0036 -0.0009 0.0008 284 LEU 38 C 0.0046 -0.0025 -0.0017 285 LEU 38 O 0.0052 -0.0034 -0.0028 286 LEU 38 CB 0.0015 0.0012 -0.0000 287 LEU 38 CG 0.0002 0.0031 0.0022 288 LEU 38 CD1 -0.0019 0.0051 0.0009 289 LEU 38 CD2 0.0004 0.0031 0.0037 290 THR 39 N 0.0055 -0.0064 -0.0011 291 THR 39 CA 0.0076 -0.0064 -0.0056 292 THR 39 C 0.0068 -0.0028 -0.0096 293 THR 39 O 0.0040 0.0005 -0.0087 294 THR 39 CB 0.0070 -0.0059 -0.0052 295 THR 39 OG1 0.0039 -0.0015 -0.0055 296 THR 39 CG2 0.0069 -0.0086 -0.0005 297 GLU 40 N 0.0093 -0.0034 -0.0140 298 GLU 40 CA 0.0088 -0.0003 -0.0180 299 GLU 40 C 0.0061 0.0040 -0.0187 300 GLU 40 O 0.0058 0.0041 -0.0182 301 GLU 40 CB 0.0121 -0.0018 -0.0226 302 GLU 40 CG 0.0116 0.0019 -0.0271 303 GLU 40 CD 0.0148 0.0004 -0.0316 304 GLU 40 OE1 0.0157 -0.0000 -0.0331 305 GLU 40 OE2 0.0163 -0.0003 -0.0339 306 GLY 41 N 0.0006 0.0036 -0.0117 307 GLY 41 CA -0.0008 0.0048 -0.0127 308 GLY 41 C -0.0026 0.0055 -0.0113 309 GLY 41 O -0.0028 0.0052 -0.0095 310 LEU 42 N -0.0040 0.0065 -0.0120 311 LEU 42 CA -0.0058 0.0073 -0.0108 312 LEU 42 C -0.0058 0.0069 -0.0090 313 LEU 42 O -0.0047 0.0062 -0.0090 314 LEU 42 CB -0.0072 0.0085 -0.0123 315 LEU 42 CG -0.0077 0.0093 -0.0139 316 LEU 42 CD1 -0.0061 0.0088 -0.0157 317 LEU 42 CD2 -0.0094 0.0105 -0.0148 318 HIS 43 N -0.0084 0.0077 -0.0037 319 HIS 43 CA -0.0083 0.0076 -0.0021 320 HIS 43 C -0.0093 0.0088 -0.0014 321 HIS 43 O -0.0098 0.0095 -0.0016 322 HIS 43 CB -0.0078 0.0068 -0.0013 323 HIS 43 CG -0.0068 0.0055 -0.0017 324 HIS 43 ND1 -0.0062 0.0047 -0.0009 325 HIS 43 CD2 -0.0063 0.0049 -0.0028 326 HIS 43 CE1 -0.0054 0.0036 -0.0015 327 HIS 43 NE2 -0.0054 0.0037 -0.0026 328 GLY 44 N -0.0095 0.0090 -0.0007 329 GLY 44 CA -0.0105 0.0102 -0.0000 330 GLY 44 C -0.0107 0.0104 0.0011 331 GLY 44 O -0.0101 0.0096 0.0019 332 PHE 45 N -0.0083 0.0091 0.0010 333 PHE 45 CA -0.0082 0.0093 0.0007 334 PHE 45 C -0.0078 0.0093 0.0007 335 PHE 45 O -0.0077 0.0092 0.0008 336 PHE 45 CB -0.0084 0.0094 0.0007 337 PHE 45 CG -0.0084 0.0096 0.0004 338 PHE 45 CD1 -0.0085 0.0098 0.0003 339 PHE 45 CD2 -0.0084 0.0097 0.0003 340 PHE 45 CE1 -0.0086 0.0100 0.0001 341 PHE 45 CE2 -0.0084 0.0100 0.0001 342 PHE 45 CZ -0.0085 0.0101 -0.0001 343 HIS 46 N -0.0076 0.0094 0.0006 344 HIS 46 CA -0.0073 0.0093 0.0006 345 HIS 46 C -0.0071 0.0096 0.0004 346 HIS 46 O -0.0072 0.0097 0.0002 347 HIS 46 CB -0.0071 0.0091 0.0008 348 HIS 46 CG -0.0073 0.0089 0.0010 349 HIS 46 ND1 -0.0074 0.0089 0.0011 350 HIS 46 CD2 -0.0074 0.0088 0.0012 351 HIS 46 CE1 -0.0076 0.0087 0.0013 352 HIS 46 NE2 -0.0075 0.0086 0.0014 353 VAL 47 N -0.0043 0.0074 -0.0000 354 VAL 47 CA -0.0037 0.0078 -0.0008 355 VAL 47 C -0.0030 0.0075 -0.0010 356 VAL 47 O -0.0026 0.0068 -0.0008 357 VAL 47 CB -0.0034 0.0076 -0.0009 358 VAL 47 CG1 -0.0027 0.0080 -0.0016 359 VAL 47 CG2 -0.0041 0.0080 -0.0006 360 HIS 48 N -0.0028 0.0080 -0.0016 361 HIS 48 CA -0.0022 0.0078 -0.0019 362 HIS 48 C -0.0014 0.0079 -0.0025 363 HIS 48 O -0.0015 0.0083 -0.0028 364 HIS 48 CB -0.0024 0.0083 -0.0020 365 HIS 48 CG -0.0030 0.0080 -0.0014 366 HIS 48 ND1 -0.0028 0.0077 -0.0013 367 HIS 48 CD2 -0.0038 0.0080 -0.0008 368 HIS 48 CE1 -0.0034 0.0075 -0.0007 369 HIS 48 NE2 -0.0040 0.0077 -0.0004 370 GLU 49 N 0.0008 0.0061 -0.0037 371 GLU 49 CA 0.0009 0.0061 -0.0038 372 GLU 49 C 0.0010 0.0064 -0.0037 373 GLU 49 O 0.0009 0.0065 -0.0037 374 GLU 49 CB 0.0011 0.0059 -0.0039 375 GLU 49 CG 0.0011 0.0057 -0.0040 376 GLU 49 CD 0.0014 0.0055 -0.0042 377 GLU 49 OE1 0.0015 0.0054 -0.0043 378 GLU 49 OE2 0.0015 0.0055 -0.0042 379 PHE 50 N 0.0012 0.0066 -0.0038 380 PHE 50 CA 0.0014 0.0069 -0.0038 381 PHE 50 C 0.0012 0.0072 -0.0036 382 PHE 50 O 0.0012 0.0073 -0.0036 383 PHE 50 CB 0.0017 0.0069 -0.0040 384 PHE 50 CG 0.0018 0.0066 -0.0041 385 PHE 50 CD1 0.0018 0.0065 -0.0041 386 PHE 50 CD2 0.0020 0.0065 -0.0042 387 PHE 50 CE1 0.0019 0.0062 -0.0043 388 PHE 50 CE2 0.0021 0.0062 -0.0044 389 PHE 50 CZ 0.0021 0.0061 -0.0044 390 GLY 51 N 0.0029 0.0051 -0.0035 391 GLY 51 CA 0.0032 0.0050 -0.0032 392 GLY 51 C 0.0033 0.0051 -0.0032 393 GLY 51 O 0.0034 0.0049 -0.0029 394 ASP 52 N 0.0034 0.0053 -0.0036 395 ASP 52 CA 0.0035 0.0054 -0.0036 396 ASP 52 C 0.0039 0.0056 -0.0037 397 ASP 52 O 0.0040 0.0058 -0.0040 398 ASP 52 CB 0.0032 0.0055 -0.0040 399 ASP 52 CG 0.0032 0.0055 -0.0041 400 ASP 52 OD1 0.0036 0.0056 -0.0040 401 ASP 52 OD2 0.0029 0.0055 -0.0042 402 ASN 53 N 0.0042 0.0072 -0.0023 403 ASN 53 CA 0.0043 0.0073 -0.0023 404 ASN 53 C 0.0048 0.0075 -0.0023 405 ASN 53 O 0.0049 0.0077 -0.0022 406 ASN 53 CB 0.0040 0.0075 -0.0020 407 ASN 53 CG 0.0036 0.0072 -0.0020 408 ASN 53 OD1 0.0036 0.0069 -0.0022 409 ASN 53 ND2 0.0033 0.0074 -0.0018 410 THR 54 N 0.0050 0.0074 -0.0025 411 THR 54 CA 0.0054 0.0076 -0.0026 412 THR 54 C 0.0056 0.0076 -0.0027 413 THR 54 O 0.0058 0.0078 -0.0026 414 THR 54 CB 0.0056 0.0075 -0.0027 415 THR 54 OG1 0.0054 0.0076 -0.0026 416 THR 54 CG2 0.0061 0.0077 -0.0028 417 ALA 55 N 0.0049 0.0108 -0.0032 418 ALA 55 CA 0.0054 0.0112 -0.0036 419 ALA 55 C 0.0048 0.0113 -0.0027 420 ALA 55 O 0.0050 0.0113 -0.0029 421 ALA 55 CB 0.0056 0.0105 -0.0048 422 GLY 56 N 0.0043 0.0114 -0.0016 423 GLY 56 CA 0.0037 0.0114 -0.0007 424 GLY 56 C 0.0029 0.0101 -0.0006 425 GLY 56 O 0.0027 0.0094 -0.0009 426 CYS 57 N 0.0008 0.0109 -0.0004 427 CYS 57 CA 0.0002 0.0099 -0.0002 428 CYS 57 C 0.0007 0.0089 -0.0008 429 CYS 57 O 0.0004 0.0081 -0.0008 430 CYS 57 CB -0.0007 0.0097 0.0003 431 CYS 57 SG -0.0014 0.0108 0.0010 432 THR 58 N 0.0015 0.0089 -0.0014 433 THR 58 CA 0.0020 0.0079 -0.0019 434 THR 58 C 0.0024 0.0077 -0.0023 435 THR 58 O 0.0026 0.0067 -0.0026 436 THR 58 CB 0.0028 0.0081 -0.0024 437 THR 58 OG1 0.0033 0.0071 -0.0030 438 THR 58 CG2 0.0036 0.0091 -0.0027 439 SER 59 N 0.0029 0.0090 -0.0035 440 SER 59 CA 0.0031 0.0089 -0.0036 441 SER 59 C 0.0025 0.0086 -0.0034 442 SER 59 O 0.0026 0.0084 -0.0035 443 SER 59 CB 0.0034 0.0096 -0.0035 444 SER 59 OG 0.0038 0.0100 -0.0036 445 ALA 60 N 0.0019 0.0085 -0.0030 446 ALA 60 CA 0.0014 0.0081 -0.0028 447 ALA 60 C 0.0014 0.0074 -0.0031 448 ALA 60 O 0.0010 0.0071 -0.0030 449 ALA 60 CB 0.0008 0.0082 -0.0024 450 GLY 61 N 0.0007 0.0087 -0.0025 451 GLY 61 CA 0.0010 0.0080 -0.0024 452 GLY 61 C 0.0004 0.0075 -0.0021 453 GLY 61 O -0.0001 0.0076 -0.0020 454 PRO 62 N 0.0006 0.0070 -0.0021 455 PRO 62 CA 0.0002 0.0065 -0.0018 456 PRO 62 C -0.0004 0.0067 -0.0017 457 PRO 62 O -0.0004 0.0073 -0.0018 458 PRO 62 CB 0.0006 0.0059 -0.0018 459 PRO 62 CG 0.0012 0.0062 -0.0020 460 PRO 62 CD 0.0013 0.0069 -0.0022 461 HIS 63 N -0.0036 0.0072 -0.0017 462 HIS 63 CA -0.0035 0.0068 -0.0013 463 HIS 63 C -0.0030 0.0061 -0.0017 464 HIS 63 O -0.0026 0.0057 -0.0021 465 HIS 63 CB -0.0036 0.0065 -0.0002 466 HIS 63 CG -0.0042 0.0071 0.0003 467 HIS 63 ND1 -0.0044 0.0070 0.0012 468 HIS 63 CD2 -0.0046 0.0079 0.0000 469 HIS 63 CE1 -0.0049 0.0076 0.0014 470 HIS 63 NE2 -0.0051 0.0082 0.0007 471 PHE 64 N -0.0029 0.0060 -0.0017 472 PHE 64 CA -0.0024 0.0054 -0.0020 473 PHE 64 C -0.0020 0.0046 -0.0015 474 PHE 64 O -0.0021 0.0044 -0.0007 475 PHE 64 CB -0.0025 0.0055 -0.0020 476 PHE 64 CG -0.0019 0.0049 -0.0024 477 PHE 64 CD1 -0.0015 0.0047 -0.0032 478 PHE 64 CD2 -0.0018 0.0046 -0.0020 479 PHE 64 CE1 -0.0010 0.0041 -0.0036 480 PHE 64 CE2 -0.0014 0.0040 -0.0024 481 PHE 64 CZ -0.0010 0.0038 -0.0032 482 ASN 65 N -0.0027 0.0047 -0.0016 483 ASN 65 CA -0.0021 0.0044 -0.0008 484 ASN 65 C -0.0012 0.0040 -0.0013 485 ASN 65 O -0.0010 0.0039 -0.0013 486 ASN 65 CB -0.0025 0.0046 -0.0001 487 ASN 65 CG -0.0019 0.0043 0.0008 488 ASN 65 OD1 -0.0014 0.0041 0.0011 489 ASN 65 ND2 -0.0020 0.0044 0.0011 490 PRO 66 N -0.0007 0.0038 -0.0019 491 PRO 66 CA 0.0001 0.0034 -0.0024 492 PRO 66 C 0.0008 0.0030 -0.0016 493 PRO 66 O 0.0014 0.0028 -0.0019 494 PRO 66 CB 0.0005 0.0032 -0.0030 495 PRO 66 CG 0.0001 0.0034 -0.0024 496 PRO 66 CD -0.0008 0.0038 -0.0020 497 LEU 67 N 0.0008 0.0048 0.0008 498 LEU 67 CA 0.0016 0.0043 0.0017 499 LEU 67 C 0.0015 0.0039 0.0028 500 LEU 67 O 0.0020 0.0034 0.0037 501 LEU 67 CB 0.0015 0.0041 0.0021 502 LEU 67 CG 0.0016 0.0045 0.0010 503 LEU 67 CD1 0.0013 0.0044 0.0015 504 LEU 67 CD2 0.0029 0.0045 0.0003 505 SER 68 N 0.0006 0.0041 0.0027 506 SER 68 CA 0.0005 0.0037 0.0037 507 SER 68 C 0.0001 0.0033 0.0049 508 SER 68 O 0.0006 0.0028 0.0058 509 SER 68 CB 0.0017 0.0034 0.0037 510 SER 68 OG 0.0023 0.0038 0.0025 511 ARG 69 N 0.0024 0.0056 0.0074 512 ARG 69 CA 0.0019 0.0051 0.0082 513 ARG 69 C 0.0006 0.0045 0.0087 514 ARG 69 O 0.0002 0.0044 0.0085 515 ARG 69 CB 0.0017 0.0054 0.0073 516 ARG 69 CG 0.0028 0.0061 0.0065 517 ARG 69 CD 0.0037 0.0062 0.0070 518 ARG 69 NE 0.0043 0.0068 0.0060 519 ARG 69 CZ 0.0045 0.0068 0.0060 520 ARG 69 NH1 0.0042 0.0064 0.0069 521 ARG 69 NH2 0.0051 0.0074 0.0050 522 LYS 70 N -0.0000 0.0041 0.0093 523 LYS 70 CA -0.0013 0.0035 0.0098 524 LYS 70 C -0.0024 0.0035 0.0088 525 LYS 70 O -0.0021 0.0039 0.0081 526 LYS 70 CB -0.0013 0.0029 0.0111 527 LYS 70 CG -0.0006 0.0027 0.0122 528 LYS 70 CD -0.0005 0.0029 0.0119 529 LYS 70 CE -0.0018 0.0025 0.0119 530 LYS 70 NZ -0.0019 0.0028 0.0110 531 HIS 71 N -0.0010 0.0033 0.0074 532 HIS 71 CA -0.0028 0.0039 0.0067 533 HIS 71 C -0.0042 0.0032 0.0070 534 HIS 71 O -0.0043 0.0018 0.0079 535 HIS 71 CB -0.0036 0.0035 0.0069 536 HIS 71 CG -0.0055 0.0040 0.0063 537 HIS 71 ND1 -0.0059 0.0055 0.0052 538 HIS 71 CD2 -0.0072 0.0031 0.0066 539 HIS 71 CE1 -0.0078 0.0055 0.0049 540 HIS 71 NE2 -0.0086 0.0041 0.0058 541 GLY 72 N -0.0054 0.0042 0.0062 542 GLY 72 CA -0.0068 0.0036 0.0063 543 GLY 72 C -0.0085 0.0047 0.0054 544 GLY 72 O -0.0085 0.0057 0.0047 545 GLY 73 N -0.0103 0.0036 0.0042 546 GLY 73 CA -0.0114 0.0042 0.0034 547 GLY 73 C -0.0110 0.0054 0.0027 548 GLY 73 O -0.0099 0.0056 0.0029 549 PRO 74 N -0.0118 0.0062 0.0018 550 PRO 74 CA -0.0114 0.0073 0.0011 551 PRO 74 C -0.0113 0.0073 0.0012 552 PRO 74 O -0.0106 0.0081 0.0008 553 PRO 74 CB -0.0126 0.0079 0.0003 554 PRO 74 CG -0.0137 0.0069 0.0006 555 PRO 74 CD -0.0131 0.0060 0.0015 556 LYS 75 N -0.0147 0.0070 0.0010 557 LYS 75 CA -0.0146 0.0066 0.0014 558 LYS 75 C -0.0127 0.0048 0.0032 559 LYS 75 O -0.0128 0.0040 0.0039 560 LYS 75 CB -0.0175 0.0059 0.0013 561 LYS 75 CG -0.0192 0.0077 -0.0005 562 LYS 75 CD -0.0222 0.0070 -0.0006 563 LYS 75 CE -0.0235 0.0056 0.0002 564 LYS 75 NZ -0.0265 0.0056 -0.0004 565 ASP 76 N -0.0110 0.0044 0.0039 566 ASP 76 CA -0.0089 0.0029 0.0055 567 ASP 76 C -0.0062 0.0043 0.0050 568 ASP 76 O -0.0056 0.0062 0.0036 569 ASP 76 CB -0.0087 0.0015 0.0067 570 ASP 76 CG -0.0113 0.0000 0.0073 571 ASP 76 OD1 -0.0131 -0.0003 0.0072 572 ASP 76 OD2 -0.0116 -0.0008 0.0078 573 GLU 77 N -0.0034 0.0045 0.0068 574 GLU 77 CA -0.0014 0.0052 0.0065 575 GLU 77 C -0.0009 0.0051 0.0069 576 GLU 77 O 0.0001 0.0058 0.0060 577 GLU 77 CB -0.0000 0.0049 0.0075 578 GLU 77 CG 0.0020 0.0058 0.0069 579 GLU 77 CD 0.0034 0.0054 0.0081 580 GLU 77 OE1 0.0041 0.0049 0.0095 581 GLU 77 OE2 0.0037 0.0058 0.0076 582 GLU 78 N -0.0016 0.0041 0.0083 583 GLU 78 CA -0.0013 0.0039 0.0088 584 GLU 78 C -0.0030 0.0040 0.0078 585 GLU 78 O -0.0046 0.0033 0.0083 586 GLU 78 CB -0.0013 0.0028 0.0108 587 GLU 78 CG -0.0008 0.0026 0.0114 588 GLU 78 CD 0.0014 0.0030 0.0115 589 GLU 78 OE1 0.0025 0.0034 0.0113 590 GLU 78 OE2 0.0020 0.0030 0.0118 591 ARG 79 N -0.0036 0.0033 0.0046 592 ARG 79 CA -0.0045 0.0037 0.0040 593 ARG 79 C -0.0034 0.0047 0.0034 594 ARG 79 O -0.0021 0.0053 0.0034 595 ARG 79 CB -0.0059 0.0043 0.0030 596 ARG 79 CG -0.0054 0.0054 0.0022 597 ARG 79 CD -0.0068 0.0060 0.0012 598 ARG 79 NE -0.0068 0.0071 0.0002 599 ARG 79 CZ -0.0077 0.0080 -0.0008 600 ARG 79 NH1 -0.0086 0.0080 -0.0011 601 ARG 79 NH2 -0.0076 0.0089 -0.0016 602 HIS 80 N -0.0039 0.0049 0.0031 603 HIS 80 CA -0.0032 0.0060 0.0024 604 HIS 80 C -0.0038 0.0071 0.0011 605 HIS 80 O -0.0051 0.0070 0.0008 606 HIS 80 CB -0.0036 0.0058 0.0024 607 HIS 80 CG -0.0031 0.0046 0.0036 608 HIS 80 ND1 -0.0041 0.0039 0.0040 609 HIS 80 CD2 -0.0018 0.0041 0.0045 610 HIS 80 CE1 -0.0034 0.0029 0.0050 611 HIS 80 NE2 -0.0020 0.0031 0.0054 612 VAL 81 N -0.0042 0.0042 -0.0010 613 VAL 81 CA -0.0043 0.0044 -0.0012 614 VAL 81 C -0.0051 0.0052 -0.0013 615 VAL 81 O -0.0054 0.0054 -0.0010 616 VAL 81 CB -0.0037 0.0043 -0.0021 617 VAL 81 CG1 -0.0038 0.0046 -0.0025 618 VAL 81 CG2 -0.0029 0.0034 -0.0019 619 GLY 82 N -0.0054 0.0057 -0.0016 620 GLY 82 CA -0.0062 0.0064 -0.0017 621 GLY 82 C -0.0068 0.0066 -0.0008 622 GLY 82 O -0.0075 0.0072 -0.0008 623 ASP 83 N -0.0068 0.0078 0.0004 624 ASP 83 CA -0.0076 0.0072 0.0008 625 ASP 83 C -0.0084 0.0075 0.0005 626 ASP 83 O -0.0083 0.0074 0.0005 627 ASP 83 CB -0.0072 0.0066 0.0015 628 ASP 83 CG -0.0068 0.0062 0.0019 629 ASP 83 OD1 -0.0069 0.0064 0.0017 630 ASP 83 OD2 -0.0063 0.0057 0.0025 631 LEU 84 N -0.0091 0.0077 0.0001 632 LEU 84 CA -0.0099 0.0080 -0.0003 633 LEU 84 C -0.0108 0.0075 0.0001 634 LEU 84 O -0.0115 0.0077 -0.0002 635 LEU 84 CB -0.0101 0.0087 -0.0010 636 LEU 84 CG -0.0093 0.0093 -0.0015 637 LEU 84 CD1 -0.0096 0.0100 -0.0022 638 LEU 84 CD2 -0.0089 0.0092 -0.0014 639 GLY 85 N -0.0119 0.0111 -0.0014 640 GLY 85 CA -0.0120 0.0107 -0.0016 641 GLY 85 C -0.0122 0.0101 -0.0017 642 GLY 85 O -0.0122 0.0099 -0.0013 643 ASN 86 N -0.0123 0.0098 -0.0022 644 ASN 86 CA -0.0124 0.0092 -0.0023 645 ASN 86 C -0.0125 0.0092 -0.0028 646 ASN 86 O -0.0125 0.0095 -0.0033 647 ASN 86 CB -0.0125 0.0089 -0.0024 648 ASN 86 CG -0.0125 0.0088 -0.0018 649 ASN 86 OD1 -0.0125 0.0084 -0.0014 650 ASN 86 ND2 -0.0124 0.0091 -0.0017 651 VAL 87 N -0.0114 0.0132 -0.0050 652 VAL 87 CA -0.0101 0.0117 -0.0057 653 VAL 87 C -0.0079 0.0098 -0.0080 654 VAL 87 O -0.0072 0.0089 -0.0080 655 VAL 87 CB -0.0096 0.0102 -0.0025 656 VAL 87 CG1 -0.0118 0.0122 -0.0002 657 VAL 87 CG2 -0.0084 0.0082 -0.0006 658 THR 88 N -0.0069 0.0090 -0.0100 659 THR 88 CA -0.0049 0.0073 -0.0125 660 THR 88 C -0.0030 0.0047 -0.0116 661 THR 88 O -0.0031 0.0048 -0.0113 662 THR 88 CB -0.0052 0.0087 -0.0160 663 THR 88 OG1 -0.0071 0.0112 -0.0166 664 THR 88 CG2 -0.0032 0.0070 -0.0186 665 ALA 89 N -0.0023 0.0089 -0.0137 666 ALA 89 CA 0.0008 0.0050 -0.0125 667 ALA 89 C 0.0039 0.0032 -0.0172 668 ALA 89 O 0.0044 0.0037 -0.0201 669 ALA 89 CB 0.0018 0.0024 -0.0084 670 ASP 90 N 0.0059 0.0012 -0.0178 671 ASP 90 N 0.0059 0.0011 -0.0178 672 ASP 90 CA 0.0089 -0.0006 -0.0222 673 ASP 90 CA 0.0089 -0.0007 -0.0221 674 ASP 90 C 0.0122 -0.0046 -0.0211 675 ASP 90 C 0.0122 -0.0046 -0.0211 676 ASP 90 O 0.0120 -0.0057 -0.0173 677 ASP 90 O 0.0120 -0.0057 -0.0175 678 ASP 90 CB 0.0095 -0.0007 -0.0237 679 ASP 90 CB 0.0096 -0.0011 -0.0232 680 ASP 90 CG 0.0070 0.0031 -0.0268 681 ASP 90 CG 0.0114 -0.0044 -0.0195 682 ASP 90 OD1 0.0077 0.0039 -0.0314 683 ASP 90 OD1 0.0105 -0.0049 -0.0150 684 ASP 90 OD2 0.0042 0.0054 -0.0246 685 ASP 90 OD2 0.0138 -0.0064 -0.0212 686 LYS 91 N 0.0160 -0.0081 -0.0285 687 LYS 91 CA 0.0206 -0.0123 -0.0280 688 LYS 91 C 0.0224 -0.0140 -0.0220 689 LYS 91 O 0.0251 -0.0165 -0.0194 690 LYS 91 CB 0.0233 -0.0145 -0.0331 691 LYS 91 CG 0.0243 -0.0153 -0.0383 692 LYS 91 CD 0.0277 -0.0183 -0.0367 693 LYS 91 CE 0.0267 -0.0174 -0.0398 694 LYS 91 NZ 0.0260 -0.0166 -0.0463 695 ASP 92 N 0.0209 -0.0127 -0.0198 696 ASP 92 N 0.0209 -0.0127 -0.0198 697 ASP 92 CA 0.0224 -0.0142 -0.0140 698 ASP 92 CA 0.0224 -0.0142 -0.0140 699 ASP 92 C 0.0207 -0.0128 -0.0089 700 ASP 92 C 0.0207 -0.0128 -0.0089 701 ASP 92 O 0.0221 -0.0142 -0.0038 702 ASP 92 O 0.0222 -0.0143 -0.0039 703 ASP 92 CB 0.0211 -0.0130 -0.0131 704 ASP 92 CB 0.0209 -0.0129 -0.0131 705 ASP 92 CG 0.0164 -0.0088 -0.0149 706 ASP 92 CG 0.0235 -0.0151 -0.0171 707 ASP 92 OD1 0.0140 -0.0066 -0.0167 708 ASP 92 OD1 0.0268 -0.0180 -0.0198 709 ASP 92 OD2 0.0150 -0.0075 -0.0146 710 ASP 92 OD2 0.0222 -0.0139 -0.0174 711 GLY 93 N 0.0143 -0.0069 -0.0079 712 GLY 93 CA 0.0126 -0.0057 -0.0042 713 GLY 93 C 0.0094 -0.0032 -0.0016 714 GLY 93 O 0.0080 -0.0023 0.0019 715 VAL 94 N 0.0082 -0.0020 -0.0032 716 VAL 94 CA 0.0052 0.0004 -0.0009 717 VAL 94 C 0.0019 0.0035 -0.0034 718 VAL 94 O 0.0017 0.0040 -0.0077 719 VAL 94 CB 0.0060 -0.0003 -0.0008 720 VAL 94 CG1 0.0027 0.0025 0.0009 721 VAL 94 CG2 0.0091 -0.0033 0.0021 722 ALA 95 N -0.0014 0.0056 -0.0008 723 ALA 95 CA -0.0030 0.0056 -0.0014 724 ALA 95 C -0.0042 0.0061 -0.0001 725 ALA 95 O -0.0041 0.0065 0.0011 726 ALA 95 CB -0.0031 0.0054 -0.0021 727 ASP 96 N -0.0053 0.0062 -0.0003 728 ASP 96 N -0.0053 0.0062 -0.0003 729 ASP 96 CA -0.0066 0.0066 0.0008 730 ASP 96 CA -0.0066 0.0066 0.0008 731 ASP 96 C -0.0081 0.0066 0.0001 732 ASP 96 C -0.0081 0.0066 0.0001 733 ASP 96 O -0.0086 0.0063 -0.0012 734 ASP 96 O -0.0087 0.0063 -0.0012 735 ASP 96 CB -0.0070 0.0068 0.0011 736 ASP 96 CB -0.0070 0.0067 0.0011 737 ASP 96 CG -0.0079 0.0073 0.0026 738 ASP 96 CG -0.0055 0.0067 0.0015 739 ASP 96 OD1 -0.0073 0.0076 0.0038 740 ASP 96 OD1 -0.0050 0.0071 0.0029 741 ASP 96 OD2 -0.0093 0.0074 0.0024 742 ASP 96 OD2 -0.0048 0.0064 0.0005 743 VAL 97 N -0.0066 0.0078 0.0025 744 VAL 97 CA -0.0069 0.0075 0.0022 745 VAL 97 C -0.0073 0.0073 0.0025 746 VAL 97 O -0.0074 0.0073 0.0030 747 VAL 97 CB -0.0069 0.0075 0.0020 748 VAL 97 CG1 -0.0072 0.0072 0.0017 749 VAL 97 CG2 -0.0064 0.0077 0.0017 750 SER 98 N -0.0077 0.0070 0.0023 751 SER 98 CA -0.0081 0.0068 0.0026 752 SER 98 CA -0.0081 0.0068 0.0026 753 SER 98 C -0.0084 0.0065 0.0022 754 SER 98 O -0.0084 0.0064 0.0020 755 SER 98 CB -0.0081 0.0068 0.0030 756 SER 98 CB -0.0081 0.0068 0.0030 757 SER 98 OG -0.0085 0.0066 0.0033 758 SER 98 OG -0.0079 0.0070 0.0029 759 ILE 99 N -0.0085 0.0075 0.0035 760 ILE 99 CA -0.0092 0.0071 0.0028 761 ILE 99 C -0.0099 0.0059 0.0030 762 ILE 99 O -0.0100 0.0055 0.0034 763 ILE 99 CB -0.0094 0.0076 0.0014 764 ILE 99 CG1 -0.0093 0.0079 0.0011 765 ILE 99 CG2 -0.0089 0.0086 0.0011 766 ILE 99 CD1 -0.0097 0.0082 -0.0002 767 GLU 100 N -0.0104 0.0054 0.0028 768 GLU 100 CA -0.0112 0.0043 0.0027 769 GLU 100 C -0.0118 0.0042 0.0015 770 GLU 100 O -0.0117 0.0046 0.0011 771 GLU 100 CB -0.0113 0.0035 0.0037 772 GLU 100 CG -0.0120 0.0024 0.0038 773 GLU 100 CD -0.0120 0.0017 0.0049 774 GLU 100 OE1 -0.0123 0.0009 0.0054 775 GLU 100 OE2 -0.0116 0.0020 0.0053 776 ASP 101 N -0.0108 0.0047 0.0020 777 ASP 101 CA -0.0112 0.0043 0.0006 778 ASP 101 C -0.0123 0.0033 0.0007 779 ASP 101 O -0.0124 0.0032 0.0016 780 ASP 101 CB -0.0104 0.0049 -0.0004 781 ASP 101 CG -0.0106 0.0047 -0.0019 782 ASP 101 OD1 -0.0103 0.0049 -0.0026 783 ASP 101 OD2 -0.0111 0.0042 -0.0025 784 SER 102 N -0.0130 0.0026 -0.0001 785 SER 102 CA -0.0141 0.0016 -0.0001 786 SER 102 CA -0.0141 0.0016 -0.0001 787 SER 102 C -0.0143 0.0014 -0.0014 788 SER 102 O -0.0152 0.0006 -0.0016 789 SER 102 CB -0.0149 0.0009 -0.0000 790 SER 102 CB -0.0149 0.0009 -0.0001 791 SER 102 OG -0.0148 0.0010 0.0013 792 SER 102 OG -0.0147 0.0010 -0.0012 793 VAL 103 N -0.0076 0.0016 -0.0007 794 VAL 103 CA -0.0075 0.0015 -0.0013 795 VAL 103 C -0.0077 0.0018 -0.0020 796 VAL 103 O -0.0076 0.0015 -0.0026 797 VAL 103 CB -0.0077 0.0019 -0.0012 798 VAL 103 CG1 -0.0077 0.0018 -0.0019 799 VAL 103 CG2 -0.0075 0.0016 -0.0005 800 ILE 104 N -0.0079 0.0024 -0.0020 801 ILE 104 CA -0.0081 0.0026 -0.0026 802 ILE 104 C -0.0078 0.0021 -0.0027 803 ILE 104 O -0.0077 0.0017 -0.0022 804 ILE 104 CB -0.0084 0.0034 -0.0025 805 ILE 104 CG1 -0.0084 0.0034 -0.0017 806 ILE 104 CG2 -0.0086 0.0039 -0.0026 807 ILE 104 CD1 -0.0087 0.0041 -0.0016 808 SER 105 N -0.0073 -0.0001 -0.0058 809 SER 105 CA -0.0078 -0.0004 -0.0050 810 SER 105 C -0.0072 0.0004 -0.0047 811 SER 105 O -0.0065 0.0009 -0.0053 812 SER 105 CB -0.0085 -0.0013 -0.0055 813 SER 105 OG -0.0092 -0.0017 -0.0045 814 LEU 106 N -0.0076 0.0004 -0.0036 815 LEU 106 CA -0.0071 0.0010 -0.0033 816 LEU 106 C -0.0075 0.0004 -0.0035 817 LEU 106 O -0.0073 0.0008 -0.0032 818 LEU 106 CB -0.0072 0.0014 -0.0020 819 LEU 106 CG -0.0067 0.0021 -0.0016 820 LEU 106 CD1 -0.0067 0.0026 -0.0003 821 LEU 106 CD2 -0.0057 0.0028 -0.0024 822 SER 107 N -0.0047 -0.0006 -0.0046 823 SER 107 CA -0.0041 -0.0011 -0.0053 824 SER 107 C -0.0037 -0.0024 -0.0056 825 SER 107 O -0.0041 -0.0031 -0.0051 826 SER 107 CB -0.0044 -0.0011 -0.0049 827 SER 107 OG -0.0050 -0.0022 -0.0042 828 GLY 108 N -0.0029 -0.0028 -0.0065 829 GLY 108 CA -0.0025 -0.0041 -0.0069 830 GLY 108 C -0.0020 -0.0042 -0.0074 831 GLY 108 O -0.0017 -0.0031 -0.0078 832 ASP 109 N -0.0011 0.0010 -0.0052 833 ASP 109 CA -0.0016 0.0011 -0.0045 834 ASP 109 CA -0.0017 0.0011 -0.0045 835 ASP 109 C -0.0025 0.0012 -0.0040 836 ASP 109 O -0.0032 0.0013 -0.0037 837 ASP 109 CB -0.0010 0.0011 -0.0037 838 ASP 109 CB -0.0010 0.0011 -0.0037 839 ASP 109 CG -0.0015 0.0012 -0.0030 840 ASP 109 CG -0.0004 0.0011 -0.0032 841 ASP 109 OD1 -0.0021 0.0012 -0.0033 842 ASP 109 OD1 -0.0003 0.0011 -0.0036 843 ASP 109 OD2 -0.0012 0.0013 -0.0021 844 ASP 109 OD2 -0.0001 0.0012 -0.0023 845 HIS 110 N -0.0025 0.0012 -0.0040 846 HIS 110 CA -0.0032 0.0013 -0.0036 847 HIS 110 C -0.0040 0.0012 -0.0044 848 HIS 110 O -0.0046 0.0013 -0.0042 849 HIS 110 CB -0.0028 0.0013 -0.0031 850 HIS 110 CG -0.0021 0.0013 -0.0023 851 HIS 110 ND1 -0.0018 0.0014 -0.0016 852 HIS 110 CD2 -0.0017 0.0013 -0.0020 853 HIS 110 CE1 -0.0012 0.0014 -0.0010 854 HIS 110 NE2 -0.0012 0.0014 -0.0012 855 CYS 111 N -0.0029 0.0007 -0.0054 856 CYS 111 CA -0.0028 0.0015 -0.0051 857 CYS 111 CA -0.0028 0.0015 -0.0051 858 CYS 111 C -0.0025 0.0021 -0.0053 859 CYS 111 O -0.0022 0.0022 -0.0060 860 CYS 111 CB -0.0027 0.0015 -0.0054 861 CYS 111 CB -0.0027 0.0015 -0.0054 862 CYS 111 SG -0.0025 0.0025 -0.0051 863 CYS 111 SG -0.0027 0.0023 -0.0049 864 ILE 112 N -0.0026 0.0027 -0.0048 865 ILE 112 CA -0.0023 0.0034 -0.0050 866 ILE 112 C -0.0021 0.0041 -0.0049 867 ILE 112 O -0.0019 0.0048 -0.0050 868 ILE 112 CB -0.0025 0.0036 -0.0044 869 ILE 112 CG1 -0.0029 0.0037 -0.0036 870 ILE 112 CG2 -0.0027 0.0029 -0.0045 871 ILE 112 CD1 -0.0031 0.0039 -0.0031 872 ILE 113 N 0.0009 0.0017 -0.0048 873 ILE 113 CA 0.0011 0.0022 -0.0047 874 ILE 113 C 0.0014 0.0023 -0.0053 875 ILE 113 O 0.0014 0.0020 -0.0057 876 ILE 113 CB 0.0009 0.0020 -0.0044 877 ILE 113 CG1 0.0006 0.0020 -0.0039 878 ILE 113 CG2 0.0011 0.0024 -0.0044 879 ILE 113 CD1 0.0007 0.0024 -0.0036 880 GLY 114 N 0.0017 0.0028 -0.0053 881 GLY 114 CA 0.0020 0.0030 -0.0058 882 GLY 114 C 0.0022 0.0030 -0.0062 883 GLY 114 O 0.0024 0.0031 -0.0066 884 ARG 115 N -0.0001 0.0047 -0.0040 885 ARG 115 CA -0.0003 0.0053 -0.0038 886 ARG 115 C -0.0005 0.0060 -0.0033 887 ARG 115 O -0.0005 0.0060 -0.0032 888 ARG 115 CB -0.0000 0.0049 -0.0033 889 ARG 115 CG 0.0002 0.0041 -0.0037 890 ARG 115 CD 0.0004 0.0038 -0.0034 891 ARG 115 NE 0.0006 0.0031 -0.0038 892 ARG 115 CZ 0.0005 0.0030 -0.0044 893 ARG 115 NH1 0.0001 0.0035 -0.0048 894 ARG 115 NH2 0.0007 0.0023 -0.0047 895 THR 116 N -0.0007 0.0065 -0.0031 896 THR 116 CA -0.0009 0.0073 -0.0028 897 THR 116 C -0.0007 0.0074 -0.0019 898 THR 116 O -0.0006 0.0073 -0.0017 899 THR 116 CB -0.0013 0.0079 -0.0032 900 THR 116 OG1 -0.0015 0.0077 -0.0040 901 THR 116 CG2 -0.0015 0.0086 -0.0029 902 LEU 117 N -0.0037 0.0089 -0.0003 903 LEU 117 CA -0.0039 0.0089 0.0003 904 LEU 117 C -0.0043 0.0093 0.0004 905 LEU 117 O -0.0045 0.0096 0.0001 906 LEU 117 CB -0.0039 0.0089 0.0004 907 LEU 117 CG -0.0040 0.0089 0.0009 908 LEU 117 CD1 -0.0038 0.0086 0.0013 909 LEU 117 CD2 -0.0041 0.0090 0.0009 910 VAL 118 N -0.0043 0.0092 0.0008 911 VAL 118 CA -0.0047 0.0095 0.0009 912 VAL 118 C -0.0049 0.0096 0.0015 913 VAL 118 O -0.0046 0.0093 0.0019 914 VAL 118 CB -0.0046 0.0095 0.0008 915 VAL 118 CG1 -0.0049 0.0098 0.0011 916 VAL 118 CG2 -0.0045 0.0095 0.0003 917 VAL 119 N -0.0070 0.0086 0.0019 918 VAL 119 CA -0.0071 0.0085 0.0018 919 VAL 119 C -0.0071 0.0083 0.0020 920 VAL 119 O -0.0071 0.0082 0.0021 921 VAL 119 CB -0.0072 0.0084 0.0015 922 VAL 119 CG1 -0.0072 0.0082 0.0016 923 VAL 119 CG2 -0.0072 0.0082 0.0014 924 HIS 120 N -0.0071 0.0083 0.0020 925 HIS 120 CA -0.0071 0.0081 0.0022 926 HIS 120 C -0.0072 0.0078 0.0021 927 HIS 120 O -0.0073 0.0078 0.0018 928 HIS 120 CB -0.0071 0.0083 0.0023 929 HIS 120 CG -0.0070 0.0085 0.0025 930 HIS 120 ND1 -0.0070 0.0084 0.0028 931 HIS 120 CD2 -0.0069 0.0087 0.0025 932 HIS 120 CE1 -0.0069 0.0086 0.0029 933 HIS 120 NE2 -0.0069 0.0088 0.0027 934 GLU 121 N -0.0097 0.0068 0.0038 935 GLU 121 CA -0.0104 0.0059 0.0038 936 GLU 121 C -0.0107 0.0057 0.0037 937 GLU 121 O -0.0113 0.0053 0.0031 938 GLU 121 CB -0.0103 0.0053 0.0048 939 GLU 121 CG -0.0110 0.0044 0.0050 940 GLU 121 CD -0.0108 0.0039 0.0061 941 GLU 121 OE1 -0.0101 0.0043 0.0067 942 GLU 121 OE2 -0.0113 0.0031 0.0064 943 LYS 122 N -0.0102 0.0059 0.0043 944 LYS 122 CA -0.0103 0.0057 0.0043 945 LYS 122 C -0.0099 0.0064 0.0039 946 LYS 122 O -0.0095 0.0072 0.0036 947 LYS 122 CB -0.0101 0.0052 0.0054 948 LYS 122 CG -0.0107 0.0043 0.0058 949 LYS 122 CD -0.0103 0.0039 0.0069 950 LYS 122 CE -0.0100 0.0039 0.0075 951 LYS 122 NZ -0.0096 0.0036 0.0086 952 ALA 123 N -0.0114 0.0063 0.0037 953 ALA 123 CA -0.0120 0.0063 0.0036 954 ALA 123 C -0.0115 0.0061 0.0036 955 ALA 123 O -0.0109 0.0056 0.0036 956 ALA 123 CB -0.0127 0.0056 0.0035 957 ASP 124 N -0.0118 0.0065 0.0037 958 ASP 124 CA -0.0115 0.0062 0.0037 959 ASP 124 C -0.0120 0.0055 0.0035 960 ASP 124 O -0.0128 0.0055 0.0035 961 ASP 124 CB -0.0116 0.0070 0.0038 962 ASP 124 CG -0.0114 0.0068 0.0038 963 ASP 124 OD1 -0.0111 0.0061 0.0036 964 ASP 124 OD2 -0.0114 0.0074 0.0039 965 ASP 125 N -0.0161 0.0002 0.0061 966 ASP 125 CA -0.0164 -0.0012 0.0073 967 ASP 125 C -0.0147 -0.0007 0.0073 968 ASP 125 O -0.0146 -0.0020 0.0084 969 ASP 125 CB -0.0160 -0.0031 0.0090 970 ASP 125 CG -0.0135 -0.0030 0.0096 971 ASP 125 OD1 -0.0118 -0.0018 0.0090 972 ASP 125 OD2 -0.0133 -0.0043 0.0107 973 LEU 126 N -0.0135 0.0010 0.0062 974 LEU 126 CA -0.0121 0.0018 0.0060 975 LEU 126 C -0.0101 0.0006 0.0075 976 LEU 126 O -0.0093 0.0005 0.0078 977 LEU 126 CB -0.0136 0.0019 0.0054 978 LEU 126 CG -0.0158 0.0028 0.0040 979 LEU 126 CD1 -0.0172 0.0030 0.0035 980 LEU 126 CD2 -0.0151 0.0048 0.0026 981 GLY 127 N -0.0095 -0.0009 0.0090 982 GLY 127 CA -0.0064 -0.0029 0.0111 983 GLY 127 C -0.0078 -0.0062 0.0135 984 GLY 127 O -0.0053 -0.0080 0.0153 985 LYS 128 N -0.0116 -0.0071 0.0136 986 LYS 128 CA -0.0133 -0.0102 0.0158 987 LYS 128 C -0.0144 -0.0123 0.0173 988 LYS 128 O -0.0163 -0.0148 0.0190 989 LYS 128 CB -0.0169 -0.0101 0.0152 990 LYS 128 CG -0.0166 -0.0076 0.0133 991 LYS 128 CD -0.0151 -0.0088 0.0144 992 LYS 128 CE -0.0156 -0.0065 0.0125 993 LYS 128 NZ -0.0119 -0.0051 0.0120 994 GLY 129 N -0.0137 -0.0125 0.0182 995 GLY 129 CA -0.0172 -0.0162 0.0208 996 GLY 129 C -0.0152 -0.0192 0.0268 997 GLY 129 O -0.0184 -0.0227 0.0292 998 GLY 130 N -0.0101 -0.0180 0.0292 999 GLY 130 CA -0.0081 -0.0208 0.0350 1000 GLY 130 C -0.0061 -0.0214 0.0375 1001 GLY 130 O -0.0055 -0.0244 0.0423 1002 ASN 131 N -0.0052 -0.0181 0.0249 1003 ASN 131 CA -0.0029 -0.0178 0.0247 1004 ASN 131 C 0.0002 -0.0156 0.0227 1005 ASN 131 O 0.0002 -0.0142 0.0214 1006 ASN 131 CB -0.0053 -0.0169 0.0238 1007 ASN 131 CG -0.0080 -0.0146 0.0216 1008 ASN 131 OD1 -0.0069 -0.0126 0.0198 1009 ASN 131 ND2 -0.0114 -0.0147 0.0217 1010 GLU 132 N 0.0029 -0.0155 0.0227 1011 GLU 132 CA 0.0060 -0.0135 0.0209 1012 GLU 132 C 0.0046 -0.0106 0.0181 1013 GLU 132 O 0.0062 -0.0087 0.0165 1014 GLU 132 CB 0.0089 -0.0140 0.0214 1015 GLU 132 CG 0.0128 -0.0129 0.0205 1016 GLU 132 CD 0.0156 -0.0135 0.0211 1017 GLU 132 OE1 0.0150 -0.0155 0.0229 1018 GLU 132 OE2 0.0184 -0.0119 0.0197 1019 GLU 133 N 0.0012 -0.0075 0.0164 1020 GLU 133 CA -0.0001 -0.0050 0.0143 1021 GLU 133 C -0.0020 -0.0039 0.0131 1022 GLU 133 O -0.0023 -0.0014 0.0112 1023 GLU 133 CB -0.0022 -0.0055 0.0142 1024 GLU 133 CG -0.0033 -0.0029 0.0121 1025 GLU 133 CD -0.0006 -0.0013 0.0116 1026 GLU 133 OE1 0.0023 -0.0020 0.0127 1027 GLU 133 OE2 -0.0014 0.0005 0.0101 1028 SER 134 N -0.0035 -0.0057 0.0140 1029 SER 134 CA -0.0054 -0.0047 0.0129 1030 SER 134 C -0.0033 -0.0027 0.0120 1031 SER 134 O -0.0043 -0.0006 0.0102 1032 SER 134 CB -0.0070 -0.0072 0.0143 1033 SER 134 OG -0.0095 -0.0065 0.0132 1034 THR 135 N -0.0030 -0.0052 0.0128 1035 THR 135 CA -0.0008 -0.0030 0.0121 1036 THR 135 C 0.0013 -0.0006 0.0111 1037 THR 135 O 0.0035 0.0013 0.0107 1038 THR 135 CB 0.0016 -0.0045 0.0139 1039 THR 135 OG1 0.0029 -0.0067 0.0158 1040 THR 135 CG2 -0.0003 -0.0060 0.0143 1041 LYS 136 N 0.0006 -0.0005 0.0108 1042 LYS 136 CA 0.0022 0.0019 0.0098 1043 LYS 136 C -0.0003 0.0038 0.0077 1044 LYS 136 O 0.0002 0.0065 0.0060 1045 LYS 136 CB 0.0041 0.0006 0.0113 1046 LYS 136 CG 0.0072 -0.0005 0.0131 1047 LYS 136 CD 0.0090 -0.0016 0.0145 1048 LYS 136 CE 0.0128 -0.0006 0.0151 1049 LYS 136 NZ 0.0139 0.0025 0.0134 1050 THR 137 N -0.0027 0.0039 0.0071 1051 THR 137 CA -0.0042 0.0051 0.0062 1052 THR 137 C -0.0064 0.0047 0.0063 1053 THR 137 O -0.0077 0.0058 0.0055 1054 THR 137 CB -0.0044 0.0053 0.0061 1055 THR 137 OG1 -0.0053 0.0037 0.0070 1056 THR 137 CG2 -0.0023 0.0056 0.0061 1057 GLY 138 N -0.0067 0.0032 0.0072 1058 GLY 138 CA -0.0088 0.0027 0.0074 1059 GLY 138 C -0.0101 0.0022 0.0076 1060 GLY 138 O -0.0120 0.0020 0.0076 1061 ASN 139 N -0.0075 0.0023 0.0090 1062 ASN 139 CA -0.0087 0.0013 0.0093 1063 ASN 139 C -0.0105 0.0024 0.0081 1064 ASN 139 O -0.0122 0.0014 0.0081 1065 ASN 139 CB -0.0096 -0.0009 0.0102 1066 ASN 139 CG -0.0077 -0.0022 0.0115 1067 ASN 139 OD1 -0.0067 -0.0026 0.0121 1068 ASN 139 ND2 -0.0074 -0.0028 0.0120 1069 ALA 140 N -0.0101 0.0044 0.0070 1070 ALA 140 CA -0.0118 0.0056 0.0058 1071 ALA 140 C -0.0120 0.0057 0.0057 1072 ALA 140 O -0.0135 0.0065 0.0048 1073 ALA 140 CB -0.0113 0.0077 0.0048 1074 GLY 141 N -0.0074 0.0060 0.0065 1075 GLY 141 CA -0.0076 0.0062 0.0064 1076 GLY 141 C -0.0072 0.0070 0.0058 1077 GLY 141 O -0.0067 0.0074 0.0056 1078 SER 142 N -0.0076 0.0072 0.0056 1079 SER 142 CA -0.0073 0.0079 0.0052 1080 SER 142 C -0.0075 0.0086 0.0047 1081 SER 142 O -0.0081 0.0086 0.0046 1082 SER 142 CB -0.0077 0.0079 0.0051 1083 SER 142 OG -0.0086 0.0081 0.0049 1084 ARG 143 N -0.0046 0.0072 0.0015 1085 ARG 143 CA -0.0047 0.0076 0.0014 1086 ARG 143 C -0.0051 0.0081 0.0013 1087 ARG 143 O -0.0048 0.0085 0.0011 1088 ARG 143 CB -0.0042 0.0077 0.0011 1089 ARG 143 CG -0.0037 0.0072 0.0011 1090 ARG 143 CD -0.0032 0.0072 0.0009 1091 ARG 143 NE -0.0028 0.0067 0.0009 1092 ARG 143 CZ -0.0024 0.0067 0.0008 1093 ARG 143 NH1 -0.0022 0.0071 0.0005 1094 ARG 143 NH2 -0.0020 0.0061 0.0008 1095 LEU 144 N -0.0056 0.0082 0.0015 1096 LEU 144 CA -0.0060 0.0087 0.0015 1097 LEU 144 C -0.0059 0.0093 0.0012 1098 LEU 144 O -0.0059 0.0097 0.0010 1099 LEU 144 CB -0.0066 0.0086 0.0018 1100 LEU 144 CG -0.0068 0.0081 0.0021 1101 LEU 144 CD1 -0.0074 0.0080 0.0023 1102 LEU 144 CD2 -0.0066 0.0081 0.0020 1103 ALA 145 N -0.0047 0.0093 0.0024 1104 ALA 145 CA -0.0047 0.0096 0.0022 1105 ALA 145 C -0.0045 0.0094 0.0022 1106 ALA 145 O -0.0045 0.0091 0.0023 1107 ALA 145 CB -0.0050 0.0098 0.0023 1108 CYS 146 N -0.0043 0.0096 0.0020 1109 CYS 146 CA -0.0041 0.0094 0.0019 1110 CYS 146 C -0.0041 0.0097 0.0017 1111 CYS 146 O -0.0042 0.0100 0.0016 1112 CYS 146 CB -0.0038 0.0092 0.0018 1113 CYS 146 SG -0.0036 0.0094 0.0015 1114 GLY 147 N -0.0024 0.0081 0.0013 1115 GLY 147 CA -0.0020 0.0078 -0.0004 1116 GLY 147 C -0.0004 0.0065 -0.0008 1117 GLY 147 O 0.0004 0.0057 0.0005 1118 VAL 148 N 0.0001 0.0062 -0.0025 1119 VAL 148 CA 0.0016 0.0050 -0.0032 1120 VAL 148 C 0.0023 0.0043 -0.0028 1121 VAL 148 O 0.0018 0.0049 -0.0033 1122 VAL 148 CB 0.0018 0.0050 -0.0053 1123 VAL 148 CG1 0.0034 0.0037 -0.0060 1124 VAL 148 CG2 0.0011 0.0056 -0.0056 1125 ILE 149 N 0.0004 0.0043 -0.0043 1126 ILE 149 CA 0.0012 0.0037 -0.0040 1127 ILE 149 C 0.0014 0.0029 -0.0048 1128 ILE 149 O 0.0014 0.0025 -0.0053 1129 ILE 149 CB 0.0019 0.0037 -0.0033 1130 ILE 149 CG1 0.0016 0.0045 -0.0026 1131 ILE 149 CG2 0.0027 0.0031 -0.0029 1132 ILE 149 CD1 0.0021 0.0045 -0.0019 1133 GLY 150 N 0.0016 0.0025 -0.0050 1134 GLY 150 CA 0.0018 0.0018 -0.0058 1135 GLY 150 C 0.0026 0.0011 -0.0055 1136 GLY 150 O 0.0029 0.0013 -0.0048 1137 ILE 151 N 0.0030 -0.0011 -0.0079 1138 ILE 151 CA 0.0022 -0.0016 -0.0068 1139 ILE 151 C 0.0023 -0.0006 -0.0055 1140 ILE 151 O 0.0029 0.0004 -0.0055 1141 ILE 151 CB 0.0020 -0.0022 -0.0070 1142 ILE 151 CG1 0.0018 -0.0032 -0.0082 1143 ILE 151 CG2 0.0012 -0.0026 -0.0058 1144 ILE 151 CD1 0.0019 -0.0035 -0.0088 1145 ALA 152 N 0.0017 -0.0009 -0.0045 1146 ALA 152 CA 0.0017 -0.0001 -0.0033 1147 ALA 152 C 0.0010 -0.0006 -0.0022 1148 ALA 152 O 0.0004 -0.0016 -0.0024 1149 ALA 152 CB 0.0016 0.0001 -0.0028 1150 GLN 153 N -0.0011 -0.0054 0.0041 1151 GLN 153 CA -0.0002 -0.0085 0.0056 1152 GLN 153 C 0.0013 -0.0098 0.0080 1153 GLN 153 O 0.0022 -0.0077 0.0095 1154 GLN 153 CB 0.0006 -0.0079 0.0068 1155 GLN 153 CG 0.0004 -0.0109 0.0065 1156 GLN 153 CD 0.0010 -0.0101 0.0075 1157 GLN 153 OE1 0.0002 -0.0079 0.0061 1158 GLN 153 NE2 0.0024 -0.0118 0.0098 1159 GLN 153 OXT 0.0016 -0.0129 0.0085 1160 ALA 1 N 0.0072 0.0152 0.0068 1161 ALA 1 CA 0.0070 0.0138 0.0060 1162 ALA 1 C 0.0066 0.0116 0.0027 1163 ALA 1 O 0.0064 0.0102 0.0018 1164 ALA 1 CB 0.0076 0.0116 0.0089 1165 THR 2 N 0.0063 0.0113 0.0009 1166 THR 2 CA 0.0058 0.0092 -0.0022 1167 THR 2 C 0.0060 0.0059 -0.0014 1168 THR 2 O 0.0063 0.0060 0.0005 1169 THR 2 CB 0.0053 0.0112 -0.0051 1170 THR 2 OG1 0.0052 0.0145 -0.0056 1171 THR 2 CG2 0.0048 0.0091 -0.0085 1172 LYS 3 N 0.0056 0.0044 -0.0018 1173 LYS 3 CA 0.0056 0.0023 -0.0013 1174 LYS 3 C 0.0057 0.0011 -0.0033 1175 LYS 3 O 0.0057 0.0015 -0.0049 1176 LYS 3 CB 0.0057 0.0012 -0.0001 1177 LYS 3 CG 0.0056 0.0022 0.0020 1178 LYS 3 CD 0.0056 0.0011 0.0033 1179 LYS 3 CE 0.0055 0.0026 0.0045 1180 LYS 3 NZ 0.0055 0.0018 0.0065 1181 ALA 4 N 0.0058 -0.0004 -0.0032 1182 ALA 4 CA 0.0059 -0.0018 -0.0049 1183 ALA 4 C 0.0060 -0.0039 -0.0041 1184 ALA 4 O 0.0059 -0.0043 -0.0022 1185 ALA 4 CB 0.0059 -0.0011 -0.0060 1186 VAL 5 N 0.0035 -0.0033 -0.0019 1187 VAL 5 CA 0.0040 -0.0043 -0.0016 1188 VAL 5 C 0.0055 -0.0053 -0.0019 1189 VAL 5 O 0.0062 -0.0049 -0.0026 1190 VAL 5 CB 0.0040 -0.0035 -0.0021 1191 VAL 5 CG1 0.0052 -0.0028 -0.0033 1192 VAL 5 CG2 0.0041 -0.0044 -0.0016 1193 CYS 6 N 0.0058 -0.0066 -0.0013 1194 CYS 6 CA 0.0072 -0.0076 -0.0015 1195 CYS 6 C 0.0077 -0.0085 -0.0013 1196 CYS 6 O 0.0069 -0.0091 -0.0004 1197 CYS 6 CB 0.0072 -0.0086 -0.0009 1198 CYS 6 SG 0.0088 -0.0100 -0.0010 1199 VAL 7 N 0.0080 -0.0075 0.0010 1200 VAL 7 CA 0.0078 -0.0066 0.0009 1201 VAL 7 C 0.0086 -0.0074 0.0014 1202 VAL 7 O 0.0098 -0.0075 0.0021 1203 VAL 7 CB 0.0083 -0.0050 0.0011 1204 VAL 7 CG1 0.0080 -0.0041 0.0009 1205 VAL 7 CG2 0.0076 -0.0042 0.0007 1206 LEU 8 N 0.0079 -0.0080 0.0010 1207 LEU 8 CA 0.0086 -0.0088 0.0014 1208 LEU 8 C 0.0089 -0.0077 0.0016 1209 LEU 8 O 0.0081 -0.0068 0.0011 1210 LEU 8 CB 0.0077 -0.0101 0.0009 1211 LEU 8 CG 0.0072 -0.0113 0.0006 1212 LEU 8 CD1 0.0058 -0.0116 -0.0002 1213 LEU 8 CD2 0.0080 -0.0127 0.0012 1214 LYS 9 N 0.0118 -0.0055 0.0007 1215 LYS 9 CA 0.0113 -0.0035 0.0015 1216 LYS 9 C 0.0130 -0.0055 0.0014 1217 LYS 9 O 0.0154 -0.0078 0.0015 1218 LYS 9 CB 0.0125 -0.0003 0.0039 1219 LYS 9 CG 0.0097 0.0028 0.0040 1220 LYS 9 CD 0.0106 0.0048 0.0055 1221 LYS 9 CE 0.0084 0.0083 0.0062 1222 LYS 9 NZ 0.0049 0.0083 0.0042 1223 GLY 10 N 0.0118 -0.0045 0.0012 1224 GLY 10 CA 0.0132 -0.0062 0.0012 1225 GLY 10 C 0.0127 -0.0039 0.0021 1226 GLY 10 O 0.0119 -0.0008 0.0032 1227 ASP 11 N 0.0195 -0.0045 0.0002 1228 ASP 11 CA 0.0215 -0.0039 0.0002 1229 ASP 11 C 0.0160 -0.0060 0.0001 1230 ASP 11 O 0.0168 -0.0050 0.0001 1231 ASP 11 CB 0.0280 -0.0080 0.0002 1232 ASP 11 CG 0.0334 -0.0068 0.0003 1233 ASP 11 OD1 0.0337 -0.0011 0.0005 1234 ASP 11 OD2 0.0373 -0.0115 0.0001 1235 GLY 12 N 0.0105 -0.0090 -0.0001 1236 GLY 12 CA 0.0049 -0.0110 -0.0003 1237 GLY 12 C -0.0013 -0.0065 -0.0002 1238 GLY 12 O -0.0007 -0.0006 0.0001 1239 PRO 13 N -0.0066 -0.0042 0.0005 1240 PRO 13 CA -0.0079 -0.0032 0.0017 1241 PRO 13 C -0.0062 -0.0033 0.0018 1242 PRO 13 O -0.0070 -0.0023 0.0030 1243 PRO 13 CB -0.0107 -0.0040 0.0002 1244 PRO 13 CG -0.0098 -0.0058 -0.0022 1245 PRO 13 CD -0.0079 -0.0057 -0.0018 1246 VAL 14 N -0.0038 -0.0043 0.0006 1247 VAL 14 CA -0.0022 -0.0045 0.0005 1248 VAL 14 C -0.0006 -0.0030 0.0028 1249 VAL 14 O 0.0011 -0.0025 0.0035 1250 VAL 14 CB -0.0003 -0.0061 -0.0016 1251 VAL 14 CG1 0.0013 -0.0063 -0.0017 1252 VAL 14 CG2 -0.0020 -0.0076 -0.0038 1253 GLN 15 N -0.0024 -0.0041 0.0026 1254 GLN 15 CA -0.0012 -0.0040 0.0046 1255 GLN 15 C -0.0011 -0.0048 0.0034 1256 GLN 15 O -0.0026 -0.0046 0.0016 1257 GLN 15 CB -0.0023 -0.0020 0.0066 1258 GLN 15 CG -0.0048 -0.0005 0.0056 1259 GLN 15 CD -0.0059 0.0016 0.0076 1260 GLN 15 OE1 -0.0061 0.0024 0.0088 1261 GLN 15 NE2 -0.0066 0.0023 0.0079 1262 GLY 16 N 0.0008 -0.0057 0.0044 1263 GLY 16 CA 0.0011 -0.0065 0.0034 1264 GLY 16 C 0.0029 -0.0070 0.0051 1265 GLY 16 O 0.0040 -0.0067 0.0072 1266 ILE 17 N 0.0051 -0.0111 0.0028 1267 ILE 17 CA 0.0056 -0.0101 0.0032 1268 ILE 17 C 0.0056 -0.0105 0.0030 1269 ILE 17 O 0.0045 -0.0110 0.0030 1270 ILE 17 CB 0.0049 -0.0090 0.0039 1271 ILE 17 CG1 0.0054 -0.0080 0.0043 1272 ILE 17 CG2 0.0034 -0.0093 0.0041 1273 ILE 17 CD1 0.0066 -0.0073 0.0044 1274 ILE 18 N 0.0066 -0.0103 0.0029 1275 ILE 18 CA 0.0067 -0.0107 0.0027 1276 ILE 18 C 0.0074 -0.0096 0.0030 1277 ILE 18 O 0.0084 -0.0091 0.0031 1278 ILE 18 CB 0.0075 -0.0118 0.0019 1279 ILE 18 CG1 0.0067 -0.0128 0.0015 1280 ILE 18 CG2 0.0077 -0.0120 0.0017 1281 ILE 18 CD1 0.0055 -0.0133 0.0016 1282 ASN 19 N 0.0071 -0.0103 0.0020 1283 ASN 19 CA 0.0071 -0.0087 0.0020 1284 ASN 19 C 0.0071 -0.0073 0.0021 1285 ASN 19 O 0.0070 -0.0076 0.0028 1286 ASN 19 CB 0.0068 -0.0085 0.0035 1287 ASN 19 CG 0.0068 -0.0100 0.0036 1288 ASN 19 OD1 0.0066 -0.0112 0.0045 1289 ASN 19 ND2 0.0070 -0.0099 0.0027 1290 PHE 20 N 0.0073 -0.0059 0.0014 1291 PHE 20 CA 0.0073 -0.0045 0.0014 1292 PHE 20 C 0.0072 -0.0030 0.0021 1293 PHE 20 O 0.0072 -0.0027 0.0017 1294 PHE 20 CB 0.0077 -0.0041 -0.0004 1295 PHE 20 CG 0.0078 -0.0055 -0.0012 1296 PHE 20 CD1 0.0080 -0.0068 -0.0019 1297 PHE 20 CD2 0.0079 -0.0054 -0.0014 1298 PHE 20 CE1 0.0081 -0.0081 -0.0026 1299 PHE 20 CE2 0.0080 -0.0067 -0.0021 1300 PHE 20 CZ 0.0081 -0.0080 -0.0028 1301 GLU 21 N 0.0077 -0.0014 0.0040 1302 GLU 21 CA 0.0075 0.0011 0.0051 1303 GLU 21 C 0.0073 0.0040 0.0052 1304 GLU 21 O 0.0072 0.0039 0.0064 1305 GLU 21 CB 0.0075 0.0005 0.0082 1306 GLU 21 CG 0.0073 0.0028 0.0093 1307 GLU 21 CD 0.0073 0.0014 0.0111 1308 GLU 21 OE1 0.0075 -0.0013 0.0119 1309 GLU 21 OE2 0.0072 0.0031 0.0118 1310 GLN 22 N 0.0071 0.0065 0.0040 1311 GLN 22 CA 0.0069 0.0094 0.0041 1312 GLN 22 C 0.0066 0.0118 0.0050 1313 GLN 22 O 0.0066 0.0125 0.0032 1314 GLN 22 CB 0.0069 0.0102 0.0010 1315 GLN 22 CG 0.0067 0.0128 0.0011 1316 GLN 22 CD 0.0067 0.0135 -0.0020 1317 GLN 22 OE1 0.0068 0.0130 -0.0043 1318 GLN 22 NE2 0.0066 0.0147 -0.0019 1319 LYS 23 N 0.0094 0.0188 0.0131 1320 LYS 23 CA 0.0086 0.0222 0.0145 1321 LYS 23 C 0.0072 0.0276 0.0122 1322 LYS 23 O 0.0066 0.0301 0.0109 1323 LYS 23 CB 0.0088 0.0225 0.0205 1324 LYS 23 CG 0.0101 0.0173 0.0232 1325 LYS 23 CD 0.0104 0.0170 0.0285 1326 LYS 23 CE 0.0093 0.0220 0.0316 1327 LYS 23 NZ 0.0096 0.0217 0.0366 1328 GLU 24 N 0.0068 0.0294 0.0116 1329 GLU 24 CA 0.0054 0.0346 0.0097 1330 GLU 24 C 0.0053 0.0344 0.0047 1331 GLU 24 O 0.0061 0.0308 0.0040 1332 GLU 24 CB 0.0048 0.0380 0.0139 1333 GLU 24 CG 0.0043 0.0407 0.0176 1334 GLU 24 CD 0.0048 0.0395 0.0234 1335 GLU 24 OE1 0.0053 0.0380 0.0248 1336 GLU 24 OE2 0.0048 0.0400 0.0266 1337 SER 25 N 0.0086 0.0336 0.0078 1338 SER 25 CA 0.0085 0.0335 -0.0001 1339 SER 25 C 0.0084 0.0329 -0.0030 1340 SER 25 O 0.0074 0.0291 -0.0082 1341 SER 25 CB 0.0102 0.0401 -0.0030 1342 SER 25 OG 0.0108 0.0421 0.0014 1343 ASN 26 N 0.0094 0.0367 0.0003 1344 ASN 26 CA 0.0092 0.0363 -0.0017 1345 ASN 26 C 0.0082 0.0320 0.0037 1346 ASN 26 O 0.0081 0.0319 0.0033 1347 ASN 26 CB 0.0111 0.0437 -0.0024 1348 ASN 26 CG 0.0123 0.0481 0.0043 1349 ASN 26 OD1 0.0118 0.0459 0.0093 1350 ASN 26 ND2 0.0139 0.0544 0.0044 1351 GLY 27 N 0.0078 0.0253 0.0042 1352 GLY 27 CA 0.0064 0.0225 0.0079 1353 GLY 27 C 0.0062 0.0175 0.0065 1354 GLY 27 O 0.0071 0.0160 0.0027 1355 PRO 28 N 0.0050 0.0148 0.0097 1356 PRO 28 CA 0.0047 0.0098 0.0088 1357 PRO 28 C 0.0046 0.0075 0.0082 1358 PRO 28 O 0.0045 0.0094 0.0091 1359 PRO 28 CB 0.0033 0.0082 0.0130 1360 PRO 28 CG 0.0027 0.0115 0.0166 1361 PRO 28 CD 0.0038 0.0161 0.0143 1362 VAL 29 N 0.0058 0.0040 0.0049 1363 VAL 29 CA 0.0066 0.0024 0.0038 1364 VAL 29 C 0.0068 -0.0000 0.0057 1365 VAL 29 O 0.0070 -0.0015 0.0065 1366 VAL 29 CB 0.0076 0.0015 0.0010 1367 VAL 29 CG1 0.0085 -0.0004 0.0000 1368 VAL 29 CG2 0.0074 0.0039 -0.0010 1369 LYS 30 N 0.0068 -0.0005 0.0064 1370 LYS 30 N 0.0067 -0.0005 0.0065 1371 LYS 30 CA 0.0070 -0.0029 0.0082 1372 LYS 30 CA 0.0071 -0.0029 0.0081 1373 LYS 30 C 0.0082 -0.0051 0.0064 1374 LYS 30 C 0.0083 -0.0051 0.0063 1375 LYS 30 O 0.0086 -0.0049 0.0047 1376 LYS 30 O 0.0087 -0.0047 0.0043 1377 LYS 30 CB 0.0064 -0.0023 0.0099 1378 LYS 30 CB 0.0065 -0.0025 0.0098 1379 LYS 30 CG 0.0065 -0.0045 0.0120 1380 LYS 30 CG 0.0053 -0.0006 0.0120 1381 LYS 30 CD 0.0056 -0.0036 0.0140 1382 LYS 30 CD 0.0048 -0.0006 0.0137 1383 LYS 30 CE 0.0046 -0.0006 0.0142 1384 LYS 30 CE 0.0036 0.0011 0.0160 1385 LYS 30 NZ 0.0038 0.0002 0.0164 1386 LYS 30 NZ 0.0034 0.0002 0.0179 1387 VAL 31 N 0.0096 -0.0071 0.0049 1388 VAL 31 CA 0.0096 -0.0084 0.0040 1389 VAL 31 C 0.0090 -0.0097 0.0051 1390 VAL 31 O 0.0087 -0.0103 0.0057 1391 VAL 31 CB 0.0100 -0.0090 0.0027 1392 VAL 31 CG1 0.0101 -0.0101 0.0016 1393 VAL 31 CG2 0.0105 -0.0075 0.0018 1394 TRP 32 N 0.0089 -0.0101 0.0054 1395 TRP 32 CA 0.0083 -0.0113 0.0065 1396 TRP 32 CA 0.0083 -0.0113 0.0065 1397 TRP 32 C 0.0083 -0.0123 0.0060 1398 TRP 32 O 0.0086 -0.0118 0.0052 1399 TRP 32 CB 0.0079 -0.0106 0.0081 1400 TRP 32 CB 0.0079 -0.0105 0.0081 1401 TRP 32 CG 0.0080 -0.0098 0.0083 1402 TRP 32 CG 0.0082 -0.0091 0.0080 1403 TRP 32 CD1 0.0076 -0.0105 0.0090 1404 TRP 32 CD1 0.0086 -0.0076 0.0076 1405 TRP 32 CD2 0.0084 -0.0083 0.0079 1406 TRP 32 CD2 0.0081 -0.0090 0.0084 1407 TRP 32 NE1 0.0078 -0.0094 0.0090 1408 TRP 32 NE1 0.0087 -0.0067 0.0077 1409 TRP 32 CE2 0.0083 -0.0081 0.0083 1410 TRP 32 CE2 0.0084 -0.0075 0.0081 1411 TRP 32 CE3 0.0088 -0.0071 0.0072 1412 TRP 32 CE3 0.0077 -0.0101 0.0088 1413 TRP 32 CZ2 0.0086 -0.0067 0.0081 1414 TRP 32 CZ2 0.0084 -0.0070 0.0084 1415 TRP 32 CZ3 0.0092 -0.0058 0.0069 1416 TRP 32 CZ3 0.0078 -0.0096 0.0091 1417 TRP 32 CH2 0.0090 -0.0056 0.0074 1418 TRP 32 CH2 0.0081 -0.0081 0.0088 1419 GLY 33 N 0.0100 -0.0130 0.0051 1420 GLY 33 CA 0.0086 -0.0128 0.0059 1421 GLY 33 C 0.0073 -0.0124 0.0050 1422 GLY 33 O 0.0074 -0.0122 0.0039 1423 SER 34 N 0.0060 -0.0121 0.0053 1424 SER 34 CA 0.0046 -0.0117 0.0046 1425 SER 34 C 0.0036 -0.0115 0.0046 1426 SER 34 O 0.0033 -0.0116 0.0058 1427 SER 34 CB 0.0039 -0.0117 0.0054 1428 SER 34 OG 0.0024 -0.0113 0.0053 1429 ILE 35 N 0.0019 -0.0094 0.0037 1430 ILE 35 CA -0.0003 -0.0082 0.0041 1431 ILE 35 C -0.0049 -0.0064 0.0018 1432 ILE 35 O -0.0056 -0.0067 -0.0021 1433 ILE 35 CB 0.0021 -0.0098 0.0018 1434 ILE 35 CG1 0.0071 -0.0120 0.0030 1435 ILE 35 CG2 0.0004 -0.0087 0.0032 1436 ILE 35 CD1 0.0097 -0.0139 -0.0001 1437 LYS 36 N -0.0081 -0.0044 0.0043 1438 LYS 36 CA -0.0126 -0.0025 0.0025 1439 LYS 36 C -0.0146 -0.0015 0.0027 1440 LYS 36 O -0.0127 -0.0020 0.0048 1441 LYS 36 CB -0.0153 -0.0007 0.0053 1442 LYS 36 CG -0.0166 0.0008 0.0100 1443 LYS 36 CD -0.0189 0.0024 0.0127 1444 LYS 36 CE -0.0185 0.0031 0.0181 1445 LYS 36 NZ -0.0208 0.0047 0.0206 1446 GLY 37 N -0.0126 0.0038 0.0036 1447 GLY 37 CA -0.0154 0.0068 0.0051 1448 GLY 37 C -0.0143 0.0059 0.0025 1449 GLY 37 O -0.0157 0.0071 0.0050 1450 LEU 38 N -0.0120 0.0039 -0.0023 1451 LEU 38 CA -0.0106 0.0026 -0.0051 1452 LEU 38 C -0.0127 0.0058 -0.0103 1453 LEU 38 O -0.0145 0.0081 -0.0128 1454 LEU 38 CB -0.0062 -0.0020 -0.0070 1455 LEU 38 CG -0.0035 -0.0058 -0.0022 1456 LEU 38 CD1 0.0006 -0.0101 -0.0047 1457 LEU 38 CD2 -0.0036 -0.0060 0.0005 1458 THR 39 N -0.0142 0.0169 -0.0056 1459 THR 39 CA -0.0188 0.0177 -0.0160 1460 THR 39 C -0.0174 0.0092 -0.0262 1461 THR 39 O -0.0112 0.0006 -0.0246 1462 THR 39 CB -0.0172 0.0165 -0.0139 1463 THR 39 OG1 -0.0093 0.0074 -0.0088 1464 THR 39 CG2 -0.0202 0.0262 -0.0057 1465 GLU 40 N -0.0232 0.0118 -0.0367 1466 GLU 40 CA -0.0223 0.0041 -0.0471 1467 GLU 40 C -0.0163 -0.0060 -0.0483 1468 GLU 40 O -0.0156 -0.0058 -0.0462 1469 GLU 40 CB -0.0296 0.0085 -0.0583 1470 GLU 40 CG -0.0298 0.0031 -0.0678 1471 GLU 40 CD -0.0350 0.0037 -0.0800 1472 GLU 40 OE1 -0.0418 0.0123 -0.0832 1473 GLU 40 OE2 -0.0323 -0.0047 -0.0866 1474 GLY 41 N -0.0031 -0.0062 -0.0299 1475 GLY 41 CA -0.0006 -0.0101 -0.0309 1476 GLY 41 C 0.0026 -0.0126 -0.0276 1477 GLY 41 O 0.0029 -0.0115 -0.0250 1478 LEU 42 N 0.0050 -0.0159 -0.0277 1479 LEU 42 CA 0.0082 -0.0188 -0.0251 1480 LEU 42 C 0.0094 -0.0176 -0.0202 1481 LEU 42 C 0.0094 -0.0176 -0.0202 1482 LEU 42 O 0.0085 -0.0159 -0.0192 1483 LEU 42 O 0.0085 -0.0159 -0.0192 1484 LEU 42 CB 0.0103 -0.0230 -0.0274 1485 LEU 42 CG 0.0106 -0.0255 -0.0313 1486 LEU 42 CD1 0.0074 -0.0236 -0.0354 1487 LEU 42 CD2 0.0130 -0.0297 -0.0328 1488 HIS 43 N 0.0121 -0.0188 -0.0123 1489 HIS 43 CA 0.0126 -0.0184 -0.0090 1490 HIS 43 C 0.0145 -0.0210 -0.0078 1491 HIS 43 O 0.0151 -0.0221 -0.0083 1492 HIS 43 CB 0.0116 -0.0162 -0.0075 1493 HIS 43 CG 0.0097 -0.0135 -0.0082 1494 HIS 43 ND1 0.0092 -0.0121 -0.0068 1495 HIS 43 CD2 0.0083 -0.0120 -0.0102 1496 HIS 43 CE1 0.0075 -0.0098 -0.0079 1497 HIS 43 NE2 0.0069 -0.0097 -0.0100 1498 GLY 44 N 0.0155 -0.0219 -0.0061 1499 GLY 44 CA 0.0174 -0.0243 -0.0048 1500 GLY 44 C 0.0179 -0.0243 -0.0026 1501 GLY 44 O 0.0172 -0.0224 -0.0007 1502 PHE 45 N 0.0132 -0.0209 -0.0024 1503 PHE 45 CA 0.0129 -0.0206 -0.0031 1504 PHE 45 C 0.0124 -0.0204 -0.0032 1505 PHE 45 O 0.0118 -0.0203 -0.0029 1506 PHE 45 CB 0.0127 -0.0205 -0.0032 1507 PHE 45 CG 0.0128 -0.0204 -0.0039 1508 PHE 45 CD1 0.0134 -0.0205 -0.0042 1509 PHE 45 CD2 0.0124 -0.0202 -0.0042 1510 PHE 45 CE1 0.0136 -0.0204 -0.0049 1511 PHE 45 CE2 0.0125 -0.0200 -0.0048 1512 PHE 45 CZ 0.0131 -0.0202 -0.0052 1513 HIS 46 N 0.0125 -0.0204 -0.0037 1514 HIS 46 CA 0.0121 -0.0202 -0.0038 1515 HIS 46 C 0.0120 -0.0200 -0.0045 1516 HIS 46 O 0.0125 -0.0200 -0.0049 1517 HIS 46 CB 0.0122 -0.0203 -0.0034 1518 HIS 46 CG 0.0124 -0.0206 -0.0027 1519 HIS 46 ND1 0.0131 -0.0208 -0.0025 1520 HIS 46 CD2 0.0121 -0.0206 -0.0021 1521 HIS 46 CE1 0.0131 -0.0210 -0.0019 1522 HIS 46 NE2 0.0125 -0.0209 -0.0016 1523 VAL 47 N 0.0072 -0.0135 -0.0048 1524 VAL 47 CA 0.0069 -0.0133 -0.0059 1525 VAL 47 C 0.0068 -0.0132 -0.0064 1526 VAL 47 O 0.0065 -0.0128 -0.0059 1527 VAL 47 CB 0.0062 -0.0125 -0.0061 1528 VAL 47 CG1 0.0060 -0.0123 -0.0073 1529 VAL 47 CG2 0.0063 -0.0126 -0.0055 1530 HIS 48 N 0.0072 -0.0136 -0.0074 1531 HIS 48 CA 0.0072 -0.0136 -0.0079 1532 HIS 48 C 0.0066 -0.0130 -0.0089 1533 HIS 48 O 0.0064 -0.0128 -0.0093 1534 HIS 48 CB 0.0079 -0.0145 -0.0082 1535 HIS 48 CG 0.0084 -0.0149 -0.0073 1536 HIS 48 ND1 0.0087 -0.0152 -0.0071 1537 HIS 48 CD2 0.0087 -0.0152 -0.0063 1538 HIS 48 CE1 0.0091 -0.0156 -0.0062 1539 HIS 48 NE2 0.0091 -0.0156 -0.0057 1540 GLU 49 N 0.0046 -0.0081 -0.0099 1541 GLU 49 CA 0.0050 -0.0083 -0.0097 1542 GLU 49 C 0.0050 -0.0080 -0.0092 1543 GLU 49 O 0.0051 -0.0080 -0.0090 1544 GLU 49 CB 0.0052 -0.0085 -0.0097 1545 GLU 49 CG 0.0056 -0.0087 -0.0097 1546 GLU 49 CD 0.0059 -0.0089 -0.0096 1547 GLU 49 OE1 0.0058 -0.0089 -0.0097 1548 GLU 49 OE2 0.0063 -0.0090 -0.0094 1549 PHE 50 N 0.0048 -0.0078 -0.0090 1550 PHE 50 CA 0.0048 -0.0076 -0.0085 1551 PHE 50 C 0.0044 -0.0073 -0.0085 1552 PHE 50 O 0.0041 -0.0071 -0.0087 1553 PHE 50 CB 0.0048 -0.0075 -0.0084 1554 PHE 50 CG 0.0051 -0.0078 -0.0085 1555 PHE 50 CD1 0.0055 -0.0080 -0.0085 1556 PHE 50 CD2 0.0050 -0.0078 -0.0087 1557 PHE 50 CE1 0.0058 -0.0083 -0.0086 1558 PHE 50 CE2 0.0052 -0.0080 -0.0089 1559 PHE 50 CZ 0.0056 -0.0083 -0.0088 1560 GLY 51 N 0.0041 -0.0053 -0.0062 1561 GLY 51 CA 0.0035 -0.0046 -0.0060 1562 GLY 51 C 0.0039 -0.0043 -0.0058 1563 GLY 51 O 0.0039 -0.0036 -0.0056 1564 ASP 52 N 0.0043 -0.0049 -0.0060 1565 ASP 52 CA 0.0047 -0.0047 -0.0059 1566 ASP 52 C 0.0041 -0.0049 -0.0061 1567 ASP 52 O 0.0038 -0.0056 -0.0063 1568 ASP 52 CB 0.0055 -0.0052 -0.0061 1569 ASP 52 CG 0.0060 -0.0049 -0.0059 1570 ASP 52 OD1 0.0057 -0.0047 -0.0059 1571 ASP 52 OD2 0.0068 -0.0051 -0.0059 1572 ASN 53 N 0.0045 -0.0083 -0.0050 1573 ASN 53 CA 0.0048 -0.0077 -0.0051 1574 ASN 53 C 0.0046 -0.0075 -0.0048 1575 ASN 53 O 0.0048 -0.0072 -0.0049 1576 ASN 53 CB 0.0053 -0.0077 -0.0057 1577 ASN 53 CG 0.0056 -0.0077 -0.0060 1578 ASN 53 OD1 0.0055 -0.0075 -0.0058 1579 ASN 53 ND2 0.0060 -0.0080 -0.0065 1580 THR 54 N 0.0041 -0.0076 -0.0043 1581 THR 54 CA 0.0038 -0.0074 -0.0039 1582 THR 54 C 0.0040 -0.0067 -0.0038 1583 THR 54 O 0.0041 -0.0065 -0.0038 1584 THR 54 CB 0.0033 -0.0077 -0.0035 1585 THR 54 OG1 0.0031 -0.0083 -0.0036 1586 THR 54 CG2 0.0030 -0.0076 -0.0031 1587 ALA 55 N 0.0064 -0.0117 -0.0053 1588 ALA 55 CA 0.0060 -0.0121 -0.0056 1589 ALA 55 C 0.0061 -0.0122 -0.0051 1590 ALA 55 O 0.0060 -0.0122 -0.0054 1591 ALA 55 CB 0.0060 -0.0118 -0.0065 1592 GLY 56 N 0.0063 -0.0122 -0.0043 1593 GLY 56 CA 0.0065 -0.0123 -0.0038 1594 GLY 56 C 0.0070 -0.0115 -0.0038 1595 GLY 56 O 0.0074 -0.0111 -0.0039 1596 CYS 57 N 0.0099 -0.0147 -0.0048 1597 CYS 57 CA 0.0100 -0.0138 -0.0043 1598 CYS 57 C 0.0097 -0.0130 -0.0047 1599 CYS 57 O 0.0096 -0.0121 -0.0045 1600 CYS 57 CB 0.0105 -0.0139 -0.0034 1601 CYS 57 SG 0.0109 -0.0147 -0.0028 1602 THR 58 N 0.0094 -0.0133 -0.0053 1603 THR 58 CA 0.0091 -0.0126 -0.0058 1604 THR 58 C 0.0087 -0.0120 -0.0064 1605 THR 58 O 0.0084 -0.0112 -0.0065 1606 THR 58 CB 0.0089 -0.0131 -0.0063 1607 THR 58 OG1 0.0086 -0.0124 -0.0067 1608 THR 58 CG2 0.0086 -0.0138 -0.0070 1609 SER 59 N 0.0074 -0.0118 -0.0077 1610 SER 59 CA 0.0073 -0.0117 -0.0078 1611 SER 59 C 0.0073 -0.0115 -0.0077 1612 SER 59 O 0.0072 -0.0113 -0.0078 1613 SER 59 CB 0.0074 -0.0116 -0.0079 1614 SER 59 OG 0.0075 -0.0118 -0.0080 1615 ALA 60 N 0.0072 -0.0115 -0.0075 1616 ALA 60 CA 0.0071 -0.0114 -0.0074 1617 ALA 60 C 0.0071 -0.0113 -0.0074 1618 ALA 60 O 0.0070 -0.0111 -0.0074 1619 ALA 60 CB 0.0071 -0.0114 -0.0072 1620 GLY 61 N 0.0068 -0.0126 -0.0083 1621 GLY 61 CA 0.0067 -0.0128 -0.0080 1622 GLY 61 C 0.0062 -0.0130 -0.0075 1623 GLY 61 O 0.0061 -0.0131 -0.0073 1624 PRO 62 N 0.0059 -0.0130 -0.0073 1625 PRO 62 CA 0.0055 -0.0132 -0.0068 1626 PRO 62 C 0.0049 -0.0129 -0.0067 1627 PRO 62 O 0.0048 -0.0125 -0.0071 1628 PRO 62 CB 0.0053 -0.0132 -0.0066 1629 PRO 62 CG 0.0054 -0.0128 -0.0071 1630 PRO 62 CD 0.0059 -0.0128 -0.0075 1631 HIS 63 N 0.0053 -0.0159 -0.0085 1632 HIS 63 CA 0.0044 -0.0148 -0.0072 1633 HIS 63 C 0.0040 -0.0129 -0.0079 1634 HIS 63 O 0.0042 -0.0123 -0.0088 1635 HIS 63 CB 0.0038 -0.0153 -0.0056 1636 HIS 63 CG 0.0040 -0.0171 -0.0048 1637 HIS 63 ND1 0.0036 -0.0178 -0.0033 1638 HIS 63 CD2 0.0047 -0.0185 -0.0052 1639 HIS 63 CE1 0.0040 -0.0195 -0.0029 1640 HIS 63 NE2 0.0047 -0.0199 -0.0041 1641 PHE 64 N 0.0035 -0.0118 -0.0075 1642 PHE 64 CA 0.0030 -0.0099 -0.0080 1643 PHE 64 C 0.0025 -0.0092 -0.0072 1644 PHE 64 O 0.0018 -0.0091 -0.0057 1645 PHE 64 CB 0.0025 -0.0090 -0.0074 1646 PHE 64 CG 0.0021 -0.0070 -0.0080 1647 PHE 64 CD1 0.0026 -0.0064 -0.0096 1648 PHE 64 CD2 0.0012 -0.0059 -0.0069 1649 PHE 64 CE1 0.0022 -0.0046 -0.0101 1650 PHE 64 CE2 0.0008 -0.0041 -0.0074 1651 PHE 64 CZ 0.0013 -0.0034 -0.0090 1652 ASN 65 N 0.0008 -0.0093 -0.0078 1653 ASN 65 CA -0.0001 -0.0070 -0.0066 1654 ASN 65 C -0.0016 -0.0048 -0.0084 1655 ASN 65 O -0.0024 -0.0039 -0.0099 1656 ASN 65 CB 0.0002 -0.0075 -0.0065 1657 ASN 65 CG -0.0005 -0.0054 -0.0047 1658 ASN 65 OD1 -0.0009 -0.0038 -0.0030 1659 ASN 65 ND2 -0.0006 -0.0053 -0.0050 1660 PRO 66 N -0.0021 -0.0039 -0.0084 1661 PRO 66 CA -0.0036 -0.0018 -0.0101 1662 PRO 66 C -0.0047 0.0007 -0.0091 1663 PRO 66 O -0.0059 0.0025 -0.0106 1664 PRO 66 CB -0.0036 -0.0016 -0.0098 1665 PRO 66 CG -0.0026 -0.0024 -0.0070 1666 PRO 66 CD -0.0014 -0.0045 -0.0066 1667 LEU 67 N -0.0062 -0.0001 -0.0065 1668 LEU 67 CA -0.0075 0.0020 -0.0049 1669 LEU 67 C -0.0073 0.0021 -0.0040 1670 LEU 67 O -0.0082 0.0038 -0.0025 1671 LEU 67 CB -0.0073 0.0026 -0.0025 1672 LEU 67 CG -0.0073 0.0023 -0.0034 1673 LEU 67 CD1 -0.0066 0.0024 -0.0010 1674 LEU 67 CD2 -0.0093 0.0040 -0.0050 1675 SER 68 N -0.0061 0.0003 -0.0047 1676 SER 68 CA -0.0059 0.0003 -0.0042 1677 SER 68 C -0.0054 0.0009 -0.0012 1678 SER 68 O -0.0062 0.0022 -0.0003 1679 SER 68 CB -0.0076 0.0018 -0.0058 1680 SER 68 OG -0.0081 0.0012 -0.0086 1681 ARG 69 N -0.0097 -0.0029 0.0028 1682 ARG 69 CA -0.0091 -0.0027 0.0052 1683 ARG 69 C -0.0070 -0.0038 0.0059 1684 ARG 69 O -0.0061 -0.0046 0.0046 1685 ARG 69 CB -0.0092 -0.0025 0.0058 1686 ARG 69 CG -0.0112 -0.0016 0.0048 1687 ARG 69 CD -0.0128 -0.0003 0.0064 1688 ARG 69 NE -0.0142 0.0005 0.0061 1689 ARG 69 CZ -0.0139 0.0005 0.0070 1690 ARG 69 NH1 -0.0122 -0.0002 0.0083 1691 ARG 69 NH2 -0.0153 0.0012 0.0066 1692 LYS 70 N -0.0062 -0.0038 0.0081 1693 LYS 70 CA -0.0042 -0.0047 0.0090 1694 LYS 70 C -0.0026 -0.0056 0.0090 1695 LYS 70 O -0.0031 -0.0054 0.0087 1696 LYS 70 CB -0.0042 -0.0041 0.0115 1697 LYS 70 CG -0.0054 -0.0034 0.0116 1698 LYS 70 CD -0.0052 -0.0030 0.0139 1699 LYS 70 CE -0.0057 -0.0022 0.0157 1700 LYS 70 NZ -0.0074 -0.0010 0.0171 1701 HIS 71 N -0.0069 -0.0047 0.0072 1702 HIS 71 CA -0.0029 -0.0068 0.0067 1703 HIS 71 C 0.0003 -0.0050 0.0086 1704 HIS 71 O 0.0002 -0.0018 0.0108 1705 HIS 71 CB -0.0014 -0.0074 0.0066 1706 HIS 71 CG 0.0029 -0.0093 0.0062 1707 HIS 71 ND1 0.0037 -0.0129 0.0039 1708 HIS 71 CD2 0.0066 -0.0081 0.0079 1709 HIS 71 CE1 0.0077 -0.0138 0.0042 1710 HIS 71 NE2 0.0095 -0.0109 0.0066 1711 GLY 72 N 0.0032 -0.0072 0.0077 1712 GLY 72 CA 0.0065 -0.0059 0.0094 1713 GLY 72 C 0.0099 -0.0088 0.0081 1714 GLY 72 O 0.0100 -0.0117 0.0061 1715 GLY 73 N 0.0116 -0.0084 0.0079 1716 GLY 73 CA 0.0135 -0.0099 0.0073 1717 GLY 73 C 0.0121 -0.0102 0.0059 1718 GLY 73 O 0.0097 -0.0090 0.0059 1719 PRO 74 N 0.0135 -0.0118 0.0047 1720 PRO 74 CA 0.0121 -0.0122 0.0033 1721 PRO 74 C 0.0112 -0.0106 0.0048 1722 PRO 74 O 0.0092 -0.0103 0.0038 1723 PRO 74 CB 0.0144 -0.0142 0.0022 1724 PRO 74 CG 0.0170 -0.0142 0.0038 1725 PRO 74 CD 0.0163 -0.0133 0.0046 1726 LYS 75 N 0.0165 -0.0103 0.0089 1727 LYS 75 CA 0.0164 -0.0079 0.0108 1728 LYS 75 C 0.0136 -0.0044 0.0125 1729 LYS 75 O 0.0135 -0.0020 0.0145 1730 LYS 75 CB 0.0207 -0.0078 0.0129 1731 LYS 75 CG 0.0239 -0.0112 0.0115 1732 LYS 75 CD 0.0274 -0.0120 0.0125 1733 LYS 75 CE 0.0293 -0.0090 0.0158 1734 LYS 75 NZ 0.0336 -0.0102 0.0168 1735 ASP 76 N 0.0114 -0.0039 0.0119 1736 ASP 76 CA 0.0082 -0.0008 0.0130 1737 ASP 76 C 0.0041 -0.0013 0.0108 1738 ASP 76 O 0.0034 -0.0041 0.0081 1739 ASP 76 CB 0.0078 -0.0001 0.0135 1740 ASP 76 CG 0.0118 -0.0001 0.0153 1741 ASP 76 OD1 0.0122 -0.0006 0.0150 1742 ASP 76 OD2 0.0146 0.0003 0.0169 1743 GLU 77 N -0.0035 -0.0016 0.0159 1744 GLU 77 CA -0.0073 -0.0008 0.0134 1745 GLU 77 C -0.0077 -0.0011 0.0119 1746 GLU 77 O -0.0092 -0.0016 0.0083 1747 GLU 77 CB -0.0107 0.0013 0.0160 1748 GLU 77 CG -0.0147 0.0024 0.0143 1749 GLU 77 CD -0.0180 0.0044 0.0169 1750 GLU 77 OE1 -0.0209 0.0051 0.0153 1751 GLU 77 OE2 -0.0177 0.0054 0.0206 1752 GLU 78 N -0.0063 -0.0009 0.0144 1753 GLU 78 CA -0.0061 -0.0014 0.0130 1754 GLU 78 C -0.0023 -0.0035 0.0110 1755 GLU 78 O 0.0010 -0.0041 0.0131 1756 GLU 78 CB -0.0064 -0.0002 0.0166 1757 GLU 78 CG -0.0057 -0.0008 0.0153 1758 GLU 78 CD -0.0096 0.0005 0.0147 1759 GLU 78 OE1 -0.0127 0.0014 0.0137 1760 GLU 78 OE2 -0.0095 0.0005 0.0150 1761 ARG 79 N -0.0011 -0.0044 0.0066 1762 ARG 79 CA 0.0007 -0.0059 0.0054 1763 ARG 79 C -0.0010 -0.0073 0.0034 1764 ARG 79 O -0.0032 -0.0073 0.0027 1765 ARG 79 CB 0.0029 -0.0069 0.0049 1766 ARG 79 CG 0.0019 -0.0079 0.0036 1767 ARG 79 CD 0.0041 -0.0092 0.0026 1768 ARG 79 NE 0.0041 -0.0111 0.0004 1769 ARG 79 CZ 0.0055 -0.0126 -0.0009 1770 ARG 79 NH1 0.0070 -0.0124 -0.0003 1771 ARG 79 NH2 0.0053 -0.0143 -0.0028 1772 HIS 80 N 0.0000 -0.0084 0.0024 1773 HIS 80 CA -0.0011 -0.0100 0.0003 1774 HIS 80 C -0.0002 -0.0115 -0.0012 1775 HIS 80 O 0.0020 -0.0116 -0.0007 1776 HIS 80 CB -0.0001 -0.0107 -0.0002 1777 HIS 80 CG -0.0009 -0.0092 0.0012 1778 HIS 80 ND1 0.0008 -0.0090 0.0019 1779 HIS 80 CD2 -0.0032 -0.0080 0.0020 1780 HIS 80 CE1 -0.0005 -0.0077 0.0031 1781 HIS 80 NE2 -0.0029 -0.0070 0.0031 1782 VAL 81 N 0.0025 -0.0071 -0.0044 1783 VAL 81 CA 0.0025 -0.0070 -0.0044 1784 VAL 81 C 0.0039 -0.0092 -0.0043 1785 VAL 81 O 0.0042 -0.0096 -0.0030 1786 VAL 81 CB 0.0015 -0.0058 -0.0066 1787 VAL 81 CG1 0.0017 -0.0061 -0.0069 1788 VAL 81 CG2 0.0001 -0.0035 -0.0063 1789 GLY 82 N 0.0047 -0.0108 -0.0056 1790 GLY 82 CA 0.0061 -0.0130 -0.0055 1791 GLY 82 C 0.0070 -0.0141 -0.0031 1792 GLY 82 O 0.0082 -0.0160 -0.0029 1793 ASP 83 N 0.0066 -0.0157 -0.0026 1794 ASP 83 CA 0.0081 -0.0153 -0.0011 1795 ASP 83 C 0.0093 -0.0157 -0.0011 1796 ASP 83 O 0.0087 -0.0152 -0.0007 1797 ASP 83 CB 0.0074 -0.0139 0.0005 1798 ASP 83 CG 0.0067 -0.0135 0.0007 1799 ASP 83 OD1 0.0071 -0.0143 -0.0002 1800 ASP 83 OD2 0.0057 -0.0124 0.0018 1801 LEU 84 N 0.0110 -0.0167 -0.0015 1802 LEU 84 CA 0.0122 -0.0172 -0.0015 1803 LEU 84 C 0.0140 -0.0170 -0.0002 1804 LEU 84 O 0.0153 -0.0175 -0.0001 1805 LEU 84 CB 0.0127 -0.0185 -0.0033 1806 LEU 84 CG 0.0111 -0.0188 -0.0046 1807 LEU 84 CD1 0.0117 -0.0201 -0.0063 1808 LEU 84 CD2 0.0104 -0.0181 -0.0039 1809 GLY 85 N 0.0179 -0.0253 -0.0063 1810 GLY 85 CA 0.0181 -0.0249 -0.0065 1811 GLY 85 C 0.0187 -0.0238 -0.0066 1812 GLY 85 O 0.0191 -0.0234 -0.0059 1813 ASN 86 N 0.0189 -0.0234 -0.0074 1814 ASN 86 CA 0.0194 -0.0224 -0.0076 1815 ASN 86 C 0.0194 -0.0221 -0.0087 1816 ASN 86 O 0.0190 -0.0226 -0.0095 1817 ASN 86 CB 0.0197 -0.0220 -0.0074 1818 ASN 86 CG 0.0198 -0.0221 -0.0062 1819 ASN 86 OD1 0.0202 -0.0215 -0.0056 1820 ASN 86 ND2 0.0194 -0.0229 -0.0059 1821 VAL 87 N 0.0192 -0.0288 -0.0152 1822 VAL 87 CA 0.0162 -0.0253 -0.0171 1823 VAL 87 C 0.0118 -0.0209 -0.0217 1824 VAL 87 O 0.0107 -0.0191 -0.0211 1825 VAL 87 CB 0.0155 -0.0220 -0.0104 1826 VAL 87 CG1 0.0199 -0.0265 -0.0059 1827 VAL 87 CG2 0.0134 -0.0175 -0.0060 1828 THR 88 N 0.0093 -0.0191 -0.0264 1829 THR 88 CA 0.0052 -0.0152 -0.0315 1830 THR 88 C 0.0013 -0.0094 -0.0300 1831 THR 88 O 0.0014 -0.0095 -0.0300 1832 THR 88 CB 0.0054 -0.0182 -0.0392 1833 THR 88 OG1 0.0093 -0.0241 -0.0400 1834 THR 88 CG2 0.0014 -0.0146 -0.0443 1835 ALA 89 N 0.0021 -0.0172 -0.0362 1836 ALA 89 CA -0.0044 -0.0081 -0.0339 1837 ALA 89 C -0.0107 -0.0023 -0.0443 1838 ALA 89 O -0.0112 -0.0033 -0.0507 1839 ALA 89 CB -0.0066 -0.0025 -0.0226 1840 ASP 90 N -0.0156 0.0037 -0.0460 1841 ASP 90 CA -0.0218 0.0095 -0.0558 1842 ASP 90 C -0.0288 0.0195 -0.0518 1843 ASP 90 O -0.0285 0.0215 -0.0419 1844 ASP 90 CB -0.0229 0.0096 -0.0610 1845 ASP 90 CG -0.0171 0.0003 -0.0680 1846 ASP 90 OD1 -0.0110 -0.0064 -0.0626 1847 ASP 90 OD2 -0.0185 -0.0004 -0.0790 1848 LYS 91 N -0.0376 0.0378 -0.0785 1849 LYS 91 CA -0.0540 0.0486 -0.0748 1850 LYS 91 C -0.0603 0.0456 -0.0570 1851 LYS 91 O -0.0731 0.0516 -0.0485 1852 LYS 91 CB -0.0586 0.0583 -0.0888 1853 LYS 91 CG -0.0583 0.0653 -0.1056 1854 LYS 91 CD -0.0722 0.0753 -0.1041 1855 LYS 91 CE -0.0774 0.0866 -0.1209 1856 LYS 91 NZ -0.0686 0.0855 -0.1336 1857 ASP 92 N -0.0515 0.0364 -0.0512 1858 ASP 92 CA -0.0563 0.0324 -0.0338 1859 ASP 92 C -0.0569 0.0268 -0.0199 1860 ASP 92 O -0.0639 0.0255 -0.0048 1861 ASP 92 CB -0.0457 0.0234 -0.0315 1862 ASP 92 CG -0.0292 0.0130 -0.0363 1863 ASP 92 OD1 -0.0259 0.0123 -0.0405 1864 ASP 92 OD2 -0.0195 0.0054 -0.0359 1865 GLY 93 N -0.0325 0.0149 -0.0213 1866 GLY 93 CA -0.0294 0.0123 -0.0144 1867 GLY 93 C -0.0226 0.0066 -0.0092 1868 GLY 93 O -0.0203 0.0045 -0.0023 1869 VAL 94 N -0.0194 0.0040 -0.0123 1870 VAL 94 CA -0.0131 -0.0013 -0.0074 1871 VAL 94 C -0.0061 -0.0070 -0.0130 1872 VAL 94 O -0.0057 -0.0071 -0.0218 1873 VAL 94 CB -0.0143 -0.0003 -0.0061 1874 VAL 94 CG1 -0.0070 -0.0064 -0.0039 1875 VAL 94 CG2 -0.0201 0.0043 0.0017 1876 ALA 95 N 0.0003 -0.0122 -0.0075 1877 ALA 95 CA 0.0029 -0.0113 -0.0085 1878 ALA 95 C 0.0049 -0.0114 -0.0061 1879 ALA 95 O 0.0051 -0.0117 -0.0048 1880 ALA 95 CB 0.0033 -0.0107 -0.0105 1881 ASP 96 N 0.0065 -0.0112 -0.0056 1882 ASP 96 N 0.0065 -0.0112 -0.0055 1883 ASP 96 CA 0.0086 -0.0112 -0.0034 1884 ASP 96 CA 0.0086 -0.0112 -0.0034 1885 ASP 96 C 0.0111 -0.0103 -0.0046 1886 ASP 96 C 0.0111 -0.0103 -0.0046 1887 ASP 96 O 0.0124 -0.0096 -0.0061 1888 ASP 96 O 0.0123 -0.0096 -0.0061 1889 ASP 96 CB 0.0090 -0.0114 -0.0023 1890 ASP 96 CB 0.0090 -0.0114 -0.0022 1891 ASP 96 CG 0.0112 -0.0114 -0.0002 1892 ASP 96 CG 0.0066 -0.0124 -0.0007 1893 ASP 96 OD1 0.0116 -0.0117 0.0013 1894 ASP 96 OD1 0.0055 -0.0130 0.0007 1895 ASP 96 OD2 0.0126 -0.0111 0.0000 1896 ASP 96 OD2 0.0059 -0.0125 -0.0008 1897 VAL 97 N 0.0094 -0.0150 0.0022 1898 VAL 97 CA 0.0094 -0.0142 0.0019 1899 VAL 97 C 0.0085 -0.0128 0.0023 1900 VAL 97 O 0.0085 -0.0120 0.0020 1901 VAL 97 CB 0.0103 -0.0140 0.0005 1902 VAL 97 CG1 0.0103 -0.0134 0.0002 1903 VAL 97 CG2 0.0111 -0.0154 0.0001 1904 SER 98 N 0.0079 -0.0125 0.0030 1905 SER 98 CA 0.0072 -0.0111 0.0033 1906 SER 98 CA 0.0072 -0.0111 0.0033 1907 SER 98 C 0.0069 -0.0108 0.0035 1908 SER 98 O 0.0064 -0.0114 0.0045 1909 SER 98 CB 0.0063 -0.0110 0.0044 1910 SER 98 CB 0.0063 -0.0110 0.0044 1911 SER 98 OG 0.0055 -0.0097 0.0048 1912 SER 98 OG 0.0058 -0.0117 0.0055 1913 ILE 99 N 0.0062 -0.0143 0.0102 1914 ILE 99 CA 0.0063 -0.0133 0.0098 1915 ILE 99 C 0.0066 -0.0097 0.0090 1916 ILE 99 O 0.0069 -0.0083 0.0083 1917 ILE 99 CB 0.0076 -0.0152 0.0076 1918 ILE 99 CG1 0.0091 -0.0153 0.0049 1919 ILE 99 CG2 0.0072 -0.0184 0.0087 1920 ILE 99 CD1 0.0105 -0.0168 0.0026 1921 GLU 100 N 0.0064 -0.0084 0.0091 1922 GLU 100 CA 0.0067 -0.0051 0.0083 1923 GLU 100 C 0.0077 -0.0051 0.0065 1924 GLU 100 O 0.0073 -0.0065 0.0072 1925 GLU 100 CB 0.0052 -0.0030 0.0108 1926 GLU 100 CG 0.0054 0.0005 0.0101 1927 GLU 100 CD 0.0039 0.0024 0.0125 1928 GLU 100 OE1 0.0028 0.0025 0.0147 1929 GLU 100 OE2 0.0040 0.0039 0.0122 1930 ASP 101 N 0.0062 -0.0060 0.0083 1931 ASP 101 CA 0.0068 -0.0055 0.0065 1932 ASP 101 C 0.0065 -0.0019 0.0054 1933 ASP 101 O 0.0067 -0.0005 0.0042 1934 ASP 101 CB 0.0083 -0.0076 0.0038 1935 ASP 101 CG 0.0089 -0.0077 0.0022 1936 ASP 101 OD1 0.0087 -0.0093 0.0035 1937 ASP 101 OD2 0.0096 -0.0061 -0.0003 1938 SER 102 N 0.0061 -0.0006 0.0058 1939 SER 102 CA 0.0058 0.0028 0.0049 1940 SER 102 CA 0.0058 0.0028 0.0049 1941 SER 102 C 0.0069 0.0034 0.0017 1942 SER 102 O 0.0068 0.0061 0.0007 1943 SER 102 CB 0.0046 0.0043 0.0073 1944 SER 102 CB 0.0046 0.0042 0.0073 1945 SER 102 OG 0.0035 0.0046 0.0100 1946 SER 102 OG 0.0046 0.0019 0.0084 1947 VAL 103 N 0.0026 0.0004 0.0019 1948 VAL 103 CA 0.0034 0.0006 -0.0001 1949 VAL 103 C 0.0043 0.0006 -0.0025 1950 VAL 103 O 0.0044 0.0020 -0.0042 1951 VAL 103 CB 0.0042 -0.0013 0.0003 1952 VAL 103 CG1 0.0049 -0.0011 -0.0018 1953 VAL 103 CG2 0.0032 -0.0012 0.0026 1954 ILE 104 N 0.0051 -0.0010 -0.0025 1955 ILE 104 CA 0.0059 -0.0009 -0.0046 1956 ILE 104 C 0.0050 0.0013 -0.0049 1957 ILE 104 O 0.0038 0.0023 -0.0032 1958 ILE 104 CB 0.0069 -0.0031 -0.0044 1959 ILE 104 CG1 0.0061 -0.0033 -0.0021 1960 ILE 104 CG2 0.0080 -0.0052 -0.0044 1961 ILE 104 CD1 0.0070 -0.0051 -0.0021 1962 SER 105 N 0.0047 0.0050 -0.0072 1963 SER 105 CA 0.0044 0.0066 -0.0071 1964 SER 105 C 0.0047 0.0055 -0.0087 1965 SER 105 O 0.0051 0.0039 -0.0103 1966 SER 105 CB 0.0041 0.0094 -0.0080 1967 SER 105 OG 0.0037 0.0111 -0.0075 1968 LEU 106 N 0.0045 0.0064 -0.0082 1969 LEU 106 CA 0.0048 0.0058 -0.0097 1970 LEU 106 C 0.0046 0.0079 -0.0116 1971 LEU 106 O 0.0047 0.0079 -0.0127 1972 LEU 106 CB 0.0047 0.0051 -0.0079 1973 LEU 106 CG 0.0049 0.0029 -0.0060 1974 LEU 106 CD1 0.0049 0.0021 -0.0048 1975 LEU 106 CD2 0.0053 0.0006 -0.0072 1976 SER 107 N -0.0000 0.0120 -0.0124 1977 SER 107 CA -0.0013 0.0146 -0.0154 1978 SER 107 C -0.0024 0.0152 -0.0140 1979 SER 107 O -0.0027 0.0141 -0.0106 1980 SER 107 CB -0.0039 0.0176 -0.0159 1981 SER 107 OG -0.0066 0.0192 -0.0130 1982 GLY 108 N -0.0029 0.0169 -0.0169 1983 GLY 108 CA -0.0041 0.0178 -0.0159 1984 GLY 108 C -0.0018 0.0153 -0.0159 1985 GLY 108 O 0.0009 0.0133 -0.0177 1986 ASP 109 N -0.0027 0.0061 -0.0118 1987 ASP 109 CA -0.0017 0.0054 -0.0112 1988 ASP 109 C -0.0004 0.0042 -0.0100 1989 ASP 109 O 0.0009 0.0034 -0.0099 1990 ASP 109 CB -0.0029 0.0059 -0.0101 1991 ASP 109 CG -0.0020 0.0052 -0.0094 1992 ASP 109 OD1 -0.0012 0.0049 -0.0106 1993 ASP 109 OD2 -0.0021 0.0048 -0.0075 1994 HIS 110 N -0.0005 0.0041 -0.0090 1995 HIS 110 CA 0.0007 0.0030 -0.0079 1996 HIS 110 C 0.0020 0.0025 -0.0091 1997 HIS 110 O 0.0030 0.0017 -0.0082 1998 HIS 110 CB -0.0001 0.0032 -0.0060 1999 HIS 110 CG -0.0012 0.0036 -0.0047 2000 HIS 110 ND1 -0.0023 0.0040 -0.0031 2001 HIS 110 CD2 -0.0015 0.0038 -0.0047 2002 HIS 110 CE1 -0.0031 0.0043 -0.0022 2003 HIS 110 NE2 -0.0027 0.0042 -0.0031 2004 CYS 111 N 0.0026 0.0035 -0.0111 2005 CYS 111 CA 0.0030 0.0027 -0.0114 2006 CYS 111 CA 0.0030 0.0027 -0.0115 2007 CYS 111 C 0.0039 0.0009 -0.0117 2008 CYS 111 O 0.0044 0.0004 -0.0127 2009 CYS 111 CB 0.0031 0.0037 -0.0131 2010 CYS 111 CB 0.0031 0.0037 -0.0131 2011 CYS 111 SG 0.0032 0.0035 -0.0133 2012 CYS 111 SG 0.0032 0.0035 -0.0133 2013 ILE 112 N 0.0041 -0.0002 -0.0108 2014 ILE 112 CA 0.0049 -0.0020 -0.0109 2015 ILE 112 C 0.0054 -0.0025 -0.0120 2016 ILE 112 O 0.0061 -0.0040 -0.0121 2017 ILE 112 CB 0.0048 -0.0030 -0.0091 2018 ILE 112 CG1 0.0043 -0.0026 -0.0080 2019 ILE 112 CG2 0.0044 -0.0027 -0.0082 2020 ILE 112 CD1 0.0042 -0.0036 -0.0062 2021 ILE 113 N 0.0034 0.0002 -0.0107 2022 ILE 113 CA 0.0033 0.0004 -0.0104 2023 ILE 113 C 0.0035 0.0004 -0.0105 2024 ILE 113 O 0.0039 0.0003 -0.0107 2025 ILE 113 CB 0.0034 0.0008 -0.0101 2026 ILE 113 CG1 0.0032 0.0009 -0.0100 2027 ILE 113 CG2 0.0033 0.0011 -0.0098 2028 ILE 113 CD1 0.0027 0.0008 -0.0098 2029 GLY 114 N 0.0033 0.0004 -0.0105 2030 GLY 114 CA 0.0035 0.0003 -0.0106 2031 GLY 114 C 0.0035 -0.0001 -0.0110 2032 GLY 114 O 0.0037 -0.0001 -0.0111 2033 ARG 115 N 0.0054 -0.0036 -0.0106 2034 ARG 115 CA 0.0060 -0.0050 -0.0100 2035 ARG 115 C 0.0063 -0.0064 -0.0092 2036 ARG 115 O 0.0062 -0.0062 -0.0092 2037 ARG 115 CB 0.0051 -0.0048 -0.0089 2038 ARG 115 CG 0.0047 -0.0034 -0.0097 2039 ARG 115 CD 0.0041 -0.0033 -0.0088 2040 ARG 115 NE 0.0036 -0.0019 -0.0095 2041 ARG 115 CZ 0.0042 -0.0017 -0.0107 2042 ARG 115 NH1 0.0054 -0.0028 -0.0113 2043 ARG 115 NH2 0.0037 -0.0003 -0.0112 2044 THR 116 N 0.0068 -0.0078 -0.0086 2045 THR 116 CA 0.0073 -0.0092 -0.0081 2046 THR 116 C 0.0066 -0.0098 -0.0063 2047 THR 116 O 0.0062 -0.0100 -0.0057 2048 THR 116 CB 0.0086 -0.0104 -0.0088 2049 THR 116 OG1 0.0093 -0.0098 -0.0104 2050 THR 116 CG2 0.0092 -0.0119 -0.0082 2051 LEU 117 N 0.0115 -0.0135 -0.0053 2052 LEU 117 CA 0.0110 -0.0141 -0.0044 2053 LEU 117 C 0.0116 -0.0152 -0.0042 2054 LEU 117 O 0.0122 -0.0153 -0.0047 2055 LEU 117 CB 0.0102 -0.0136 -0.0040 2056 LEU 117 CG 0.0095 -0.0140 -0.0030 2057 LEU 117 CD1 0.0089 -0.0139 -0.0026 2058 LEU 117 CD2 0.0089 -0.0135 -0.0028 2059 VAL 118 N 0.0115 -0.0160 -0.0036 2060 VAL 118 CA 0.0121 -0.0171 -0.0035 2061 VAL 118 C 0.0116 -0.0177 -0.0026 2062 VAL 118 O 0.0110 -0.0177 -0.0020 2063 VAL 118 CB 0.0128 -0.0175 -0.0038 2064 VAL 118 CG1 0.0134 -0.0186 -0.0037 2065 VAL 118 CG2 0.0133 -0.0168 -0.0048 2066 VAL 119 N 0.0135 -0.0172 -0.0028 2067 VAL 119 CA 0.0132 -0.0174 -0.0029 2068 VAL 119 C 0.0137 -0.0176 -0.0025 2069 VAL 119 O 0.0143 -0.0172 -0.0023 2070 VAL 119 CB 0.0129 -0.0169 -0.0033 2071 VAL 119 CG1 0.0134 -0.0162 -0.0033 2072 VAL 119 CG2 0.0126 -0.0171 -0.0034 2073 HIS 120 N 0.0135 -0.0182 -0.0024 2074 HIS 120 CA 0.0140 -0.0185 -0.0020 2075 HIS 120 C 0.0140 -0.0184 -0.0020 2076 HIS 120 O 0.0135 -0.0183 -0.0024 2077 HIS 120 CB 0.0139 -0.0193 -0.0017 2078 HIS 120 CG 0.0143 -0.0195 -0.0014 2079 HIS 120 ND1 0.0149 -0.0195 -0.0010 2080 HIS 120 CD2 0.0140 -0.0195 -0.0015 2081 HIS 120 CE1 0.0151 -0.0196 -0.0008 2082 HIS 120 NE2 0.0146 -0.0196 -0.0012 2083 GLU 121 N 0.0196 -0.0165 0.0005 2084 GLU 121 CA 0.0204 -0.0160 0.0007 2085 GLU 121 C 0.0196 -0.0169 0.0010 2086 GLU 121 O 0.0195 -0.0165 0.0004 2087 GLU 121 CB 0.0219 -0.0158 0.0020 2088 GLU 121 CG 0.0225 -0.0161 0.0029 2089 GLU 121 CD 0.0238 -0.0162 0.0043 2090 GLU 121 OE1 0.0238 -0.0167 0.0050 2091 GLU 121 OE2 0.0248 -0.0158 0.0048 2092 LYS 122 N 0.0190 -0.0182 0.0020 2093 LYS 122 CA 0.0183 -0.0191 0.0025 2094 LYS 122 C 0.0166 -0.0198 0.0018 2095 LYS 122 O 0.0160 -0.0197 0.0009 2096 LYS 122 CB 0.0188 -0.0200 0.0042 2097 LYS 122 CG 0.0203 -0.0194 0.0050 2098 LYS 122 CD 0.0207 -0.0204 0.0066 2099 LYS 122 CE 0.0223 -0.0199 0.0075 2100 LYS 122 NZ 0.0226 -0.0208 0.0091 2101 ALA 123 N 0.0187 -0.0210 0.0033 2102 ALA 123 CA 0.0199 -0.0203 0.0037 2103 ALA 123 C 0.0186 -0.0192 0.0032 2104 ALA 123 O 0.0170 -0.0182 0.0027 2105 ALA 123 CB 0.0217 -0.0188 0.0042 2106 ASP 124 N 0.0193 -0.0193 0.0035 2107 ASP 124 CA 0.0184 -0.0181 0.0031 2108 ASP 124 C 0.0195 -0.0159 0.0034 2109 ASP 124 O 0.0214 -0.0158 0.0040 2110 ASP 124 CB 0.0186 -0.0193 0.0032 2111 ASP 124 CG 0.0175 -0.0182 0.0029 2112 ASP 124 OD1 0.0169 -0.0163 0.0026 2113 ASP 124 OD2 0.0174 -0.0192 0.0029 2114 ASP 125 N 0.0272 -0.0030 0.0101 2115 ASP 125 CA 0.0275 0.0009 0.0136 2116 ASP 125 C 0.0236 0.0008 0.0135 2117 ASP 125 O 0.0233 0.0039 0.0164 2118 ASP 125 CB 0.0262 0.0047 0.0172 2119 ASP 125 CG 0.0203 0.0046 0.0170 2120 ASP 125 OD1 0.0163 0.0028 0.0153 2121 ASP 125 OD2 0.0197 0.0063 0.0185 2122 LEU 126 N 0.0206 -0.0027 0.0103 2123 LEU 126 CA 0.0172 -0.0034 0.0097 2124 LEU 126 C 0.0127 0.0001 0.0128 2125 LEU 126 O 0.0115 0.0013 0.0139 2126 LEU 126 CB 0.0210 -0.0038 0.0093 2127 LEU 126 CG 0.0269 -0.0058 0.0075 2128 LEU 126 CD1 0.0307 -0.0050 0.0083 2129 LEU 126 CD2 0.0265 -0.0105 0.0032 2130 GLY 127 N 0.0105 0.0057 0.0147 2131 GLY 127 CA 0.0037 0.0114 0.0184 2132 GLY 127 C 0.0070 0.0189 0.0242 2133 GLY 127 O 0.0016 0.0240 0.0276 2134 LYS 128 N 0.0156 0.0197 0.0256 2135 LYS 128 CA 0.0194 0.0267 0.0312 2136 LYS 128 C 0.0218 0.0295 0.0335 2137 LYS 128 O 0.0270 0.0344 0.0375 2138 LYS 128 CB 0.0278 0.0266 0.0318 2139 LYS 128 CG 0.0283 0.0217 0.0282 2140 LYS 128 CD 0.0258 0.0255 0.0308 2141 LYS 128 CE 0.0258 0.0199 0.0266 2142 LYS 128 NZ 0.0177 0.0197 0.0257 2143 GLY 129 N 0.0197 0.0303 0.0355 2144 GLY 129 CA 0.0264 0.0353 0.0394 2145 GLY 129 C 0.0219 0.0433 0.0502 2146 GLY 129 O 0.0286 0.0487 0.0547 2147 GLY 130 N 0.0109 0.0444 0.0545 2148 GLY 130 CA 0.0063 0.0520 0.0649 2149 GLY 130 C -0.0004 0.0521 0.0669 2150 GLY 130 O -0.0010 0.0590 0.0752 2151 ASN 131 N -0.0010 0.0493 0.0426 2152 ASN 131 CA -0.0100 0.0479 0.0384 2153 ASN 131 C -0.0173 0.0434 0.0331 2154 ASN 131 O -0.0148 0.0406 0.0326 2155 ASN 131 CB -0.0069 0.0415 0.0361 2156 ASN 131 CG 0.0015 0.0328 0.0345 2157 ASN 131 OD1 0.0008 0.0275 0.0313 2158 ASN 131 ND2 0.0095 0.0313 0.0367 2159 GLU 132 N -0.0266 0.0428 0.0293 2160 GLU 132 CA -0.0342 0.0385 0.0240 2161 GLU 132 C -0.0305 0.0276 0.0195 2162 GLU 132 O -0.0325 0.0238 0.0166 2163 GLU 132 CB -0.0447 0.0401 0.0209 2164 GLU 132 CG -0.0540 0.0410 0.0178 2165 GLU 132 CD -0.0637 0.0387 0.0129 2166 GLU 132 OE1 -0.0656 0.0417 0.0138 2167 GLU 132 OE2 -0.0693 0.0339 0.0081 2168 GLU 133 N -0.0206 0.0180 0.0178 2169 GLU 133 CA -0.0173 0.0104 0.0138 2170 GLU 133 C -0.0112 0.0083 0.0134 2171 GLU 133 O -0.0106 0.0020 0.0098 2172 GLU 133 CB -0.0131 0.0090 0.0136 2173 GLU 133 CG -0.0088 0.0014 0.0097 2174 GLU 133 CD -0.0142 -0.0037 0.0060 2175 GLU 133 OE1 -0.0219 -0.0035 0.0050 2176 GLU 133 OE2 -0.0108 -0.0081 0.0039 2177 SER 134 N -0.0068 0.0136 0.0171 2178 SER 134 CA -0.0008 0.0120 0.0171 2179 SER 134 C -0.0052 0.0096 0.0150 2180 SER 134 O -0.0019 0.0045 0.0125 2181 SER 134 CB 0.0041 0.0188 0.0217 2182 SER 134 OG 0.0099 0.0175 0.0217 2183 THR 135 N -0.0053 0.0172 0.0161 2184 THR 135 CA -0.0096 0.0142 0.0145 2185 THR 135 C -0.0161 0.0072 0.0110 2186 THR 135 O -0.0213 0.0048 0.0096 2187 THR 135 CB -0.0146 0.0212 0.0174 2188 THR 135 OG1 -0.0186 0.0269 0.0197 2189 THR 135 CG2 -0.0081 0.0258 0.0198 2190 LYS 136 N -0.0161 0.0039 0.0095 2191 LYS 136 CA -0.0213 -0.0034 0.0060 2192 LYS 136 C -0.0152 -0.0107 0.0030 2193 LYS 136 O -0.0159 -0.0175 -0.0001 2194 LYS 136 CB -0.0280 -0.0012 0.0066 2195 LYS 136 CG -0.0364 0.0036 0.0083 2196 LYS 136 CD -0.0399 0.0094 0.0107 2197 LYS 136 CE -0.0454 0.0048 0.0084 2198 LYS 136 NZ -0.0510 -0.0017 0.0052 2199 THR 137 N -0.0049 -0.0102 0.0031 2200 THR 137 CA -0.0012 -0.0140 0.0015 2201 THR 137 C 0.0041 -0.0133 0.0034 2202 THR 137 O 0.0073 -0.0165 0.0021 2203 THR 137 CB -0.0011 -0.0157 0.0004 2204 THR 137 OG1 0.0014 -0.0129 0.0029 2205 THR 137 CG2 -0.0063 -0.0158 -0.0011 2206 GLY 138 N 0.0050 -0.0094 0.0063 2207 GLY 138 CA 0.0100 -0.0085 0.0082 2208 GLY 138 C 0.0135 -0.0089 0.0089 2209 GLY 138 O 0.0180 -0.0089 0.0100 2210 ASN 139 N 0.0093 -0.0093 0.0100 2211 ASN 139 CA 0.0122 -0.0085 0.0105 2212 ASN 139 C 0.0164 -0.0119 0.0083 2213 ASN 139 O 0.0206 -0.0109 0.0089 2214 ASN 139 CB 0.0146 -0.0038 0.0134 2215 ASN 139 CG 0.0105 -0.0003 0.0157 2216 ASN 139 OD1 0.0084 0.0006 0.0163 2217 ASN 139 ND2 0.0093 0.0016 0.0169 2218 ALA 140 N 0.0152 -0.0160 0.0057 2219 ALA 140 CA 0.0189 -0.0195 0.0035 2220 ALA 140 C 0.0196 -0.0211 0.0025 2221 ALA 140 O 0.0231 -0.0236 0.0008 2222 ALA 140 CB 0.0173 -0.0234 0.0010 2223 GLY 141 N 0.0155 -0.0212 0.0032 2224 GLY 141 CA 0.0166 -0.0212 0.0029 2225 GLY 141 C 0.0168 -0.0208 0.0019 2226 GLY 141 O 0.0161 -0.0205 0.0014 2227 SER 142 N 0.0177 -0.0207 0.0015 2228 SER 142 CA 0.0181 -0.0203 0.0006 2229 SER 142 C 0.0175 -0.0199 -0.0003 2230 SER 142 O 0.0170 -0.0199 -0.0002 2231 SER 142 CB 0.0193 -0.0203 0.0004 2232 SER 142 OG 0.0195 -0.0201 0.0000 2233 ARG 143 N 0.0143 -0.0151 -0.0025 2234 ARG 143 CA 0.0141 -0.0149 -0.0028 2235 ARG 143 C 0.0144 -0.0151 -0.0030 2236 ARG 143 O 0.0146 -0.0152 -0.0033 2237 ARG 143 CB 0.0138 -0.0148 -0.0031 2238 ARG 143 CG 0.0136 -0.0147 -0.0029 2239 ARG 143 CD 0.0134 -0.0145 -0.0032 2240 ARG 143 NE 0.0131 -0.0144 -0.0030 2241 ARG 143 CZ 0.0128 -0.0142 -0.0032 2242 ARG 143 NH1 0.0128 -0.0142 -0.0036 2243 ARG 143 NH2 0.0126 -0.0142 -0.0029 2244 LEU 144 N 0.0144 -0.0151 -0.0028 2245 LEU 144 CA 0.0148 -0.0153 -0.0030 2246 LEU 144 C 0.0147 -0.0152 -0.0034 2247 LEU 144 O 0.0150 -0.0153 -0.0037 2248 LEU 144 CB 0.0148 -0.0153 -0.0026 2249 LEU 144 CG 0.0149 -0.0155 -0.0022 2250 LEU 144 CD1 0.0149 -0.0155 -0.0018 2251 LEU 144 CD2 0.0153 -0.0157 -0.0022 2252 ALA 145 N 0.0131 -0.0142 -0.0013 2253 ALA 145 CA 0.0131 -0.0135 -0.0013 2254 ALA 145 C 0.0132 -0.0134 -0.0013 2255 ALA 145 O 0.0131 -0.0138 -0.0013 2256 ALA 145 CB 0.0126 -0.0132 -0.0012 2257 CYS 146 N 0.0134 -0.0129 -0.0013 2258 CYS 146 CA 0.0136 -0.0127 -0.0013 2259 CYS 146 C 0.0136 -0.0120 -0.0013 2260 CYS 146 O 0.0137 -0.0117 -0.0013 2261 CYS 146 CB 0.0141 -0.0130 -0.0014 2262 CYS 146 SG 0.0148 -0.0128 -0.0014 2263 GLY 147 N 0.0102 -0.0090 -0.0014 2264 GLY 147 CA 0.0097 -0.0085 -0.0034 2265 GLY 147 C 0.0079 -0.0068 -0.0038 2266 GLY 147 O 0.0069 -0.0061 -0.0023 2267 VAL 148 N 0.0074 -0.0063 -0.0059 2268 VAL 148 CA 0.0057 -0.0048 -0.0066 2269 VAL 148 C 0.0047 -0.0039 -0.0061 2270 VAL 148 O 0.0052 -0.0044 -0.0067 2271 VAL 148 CB 0.0056 -0.0046 -0.0091 2272 VAL 148 CG1 0.0038 -0.0030 -0.0098 2273 VAL 148 CG2 0.0066 -0.0054 -0.0095 2274 ILE 149 N 0.0052 -0.0039 -0.0079 2275 ILE 149 CA 0.0044 -0.0032 -0.0074 2276 ILE 149 C 0.0047 -0.0019 -0.0076 2277 ILE 149 O 0.0054 -0.0015 -0.0081 2278 ILE 149 CB 0.0041 -0.0034 -0.0072 2279 ILE 149 CG1 0.0039 -0.0047 -0.0071 2280 ILE 149 CG2 0.0031 -0.0028 -0.0066 2281 ILE 149 CD1 0.0036 -0.0051 -0.0069 2282 GLY 150 N 0.0041 -0.0012 -0.0072 2283 GLY 150 CA 0.0044 -0.0000 -0.0074 2284 GLY 150 C 0.0036 0.0008 -0.0068 2285 GLY 150 O 0.0027 0.0005 -0.0063 2286 ILE 151 N 0.0032 0.0031 -0.0065 2287 ILE 151 CA 0.0034 0.0033 -0.0061 2288 ILE 151 C 0.0035 0.0028 -0.0057 2289 ILE 151 O 0.0034 0.0024 -0.0059 2290 ILE 151 CB 0.0033 0.0036 -0.0063 2291 ILE 151 CG1 0.0031 0.0040 -0.0068 2292 ILE 151 CG2 0.0035 0.0039 -0.0059 2293 ILE 151 CD1 0.0031 0.0044 -0.0070 2294 ALA 152 N 0.0037 0.0029 -0.0052 2295 ALA 152 CA 0.0039 0.0025 -0.0048 2296 ALA 152 C 0.0040 0.0027 -0.0045 2297 ALA 152 O 0.0041 0.0032 -0.0045 2298 ALA 152 CB 0.0040 0.0025 -0.0044 2299 GLN 153 N 0.0051 0.0051 -0.0026 2300 GLN 153 CA 0.0047 0.0053 -0.0029 2301 GLN 153 C 0.0042 0.0052 -0.0027 2302 GLN 153 O 0.0042 0.0051 -0.0025 2303 GLN 153 CB 0.0049 0.0056 -0.0033 2304 GLN 153 CG 0.0047 0.0059 -0.0037 2305 GLN 153 CD 0.0050 0.0061 -0.0040 2306 GLN 153 OE1 0.0054 0.0060 -0.0040 2307 GLN 153 NE2 0.0047 0.0064 -0.0044 2308 GLN 153 OXT 0.0038 0.0053 -0.0028