1 ASN 8 N 0.0090 -0.0303 -0.0134 2 ASN 8 CA -0.0005 -0.0299 -0.0175 3 ASN 8 C -0.0065 -0.0251 -0.0146 4 ASN 8 O -0.0147 -0.0225 -0.0153 5 ASN 8 CB -0.0014 -0.0363 -0.0261 6 SER 9 N -0.0023 -0.0242 -0.0112 7 SER 9 CA -0.0070 -0.0196 -0.0078 8 SER 9 C -0.0046 -0.0137 0.0009 9 SER 9 O 0.0032 -0.0140 0.0043 10 SER 9 CB -0.0043 -0.0224 -0.0100 11 SER 9 OG -0.0108 -0.0190 -0.0089 12 PHE 10 N -0.0114 -0.0082 0.0044 13 PHE 10 CA -0.0102 -0.0021 0.0127 14 PHE 10 C -0.0150 0.0019 0.0154 15 PHE 10 O -0.0233 0.0038 0.0135 16 PHE 10 CB -0.0139 0.0010 0.0148 17 PHE 10 CG -0.0090 -0.0027 0.0126 18 PHE 10 CD1 0.0001 -0.0035 0.0161 19 PHE 10 CD2 -0.0134 -0.0053 0.0070 20 PHE 10 CE1 0.0046 -0.0069 0.0140 21 PHE 10 CE2 -0.0090 -0.0087 0.0050 22 PHE 10 CZ 0.0000 -0.0095 0.0085 23 HIS 11 N -0.0078 0.0053 0.0207 24 HIS 11 CA -0.0080 0.0054 0.0207 25 HIS 11 C -0.0076 0.0049 0.0188 26 HIS 11 O -0.0079 0.0051 0.0184 27 HIS 11 CB -0.0097 0.0068 0.0210 28 HIS 11 CG -0.0103 0.0075 0.0228 29 HIS 11 CD2 -0.0103 0.0075 0.0233 30 HIS 11 ND1 -0.0111 0.0082 0.0241 31 HIS 11 CE1 -0.0115 0.0087 0.0255 32 HIS 11 NE2 -0.0110 0.0083 0.0250 33 PHE 12 N -0.0068 0.0042 0.0176 34 PHE 12 CA -0.0064 0.0037 0.0156 35 PHE 12 C -0.0048 0.0023 0.0153 36 PHE 12 O -0.0043 0.0017 0.0137 37 PHE 12 CB -0.0074 0.0043 0.0140 38 PHE 12 CG -0.0090 0.0056 0.0138 39 PHE 12 CD1 -0.0094 0.0059 0.0129 40 PHE 12 CD2 -0.0101 0.0066 0.0144 41 PHE 12 CE1 -0.0109 0.0071 0.0127 42 PHE 12 CE2 -0.0116 0.0079 0.0142 43 PHE 12 CZ -0.0120 0.0081 0.0133 44 LYS 13 N -0.0039 0.0017 0.0168 45 LYS 13 CA -0.0023 0.0003 0.0166 46 LYS 13 C -0.0015 -0.0004 0.0158 47 LYS 13 O -0.0005 -0.0013 0.0146 48 LYS 13 CB -0.0016 -0.0001 0.0186 49 LYS 13 CG 0.0001 -0.0015 0.0186 50 LYS 13 CD 0.0006 -0.0017 0.0205 51 LYS 13 CE 0.0022 -0.0030 0.0211 52 LYS 13 NZ 0.0025 -0.0032 0.0217 53 GLU 14 N 0.0036 0.0005 0.0092 54 GLU 14 CA 0.0050 0.0001 0.0069 55 GLU 14 C 0.0041 -0.0002 0.0042 56 GLU 14 O 0.0056 -0.0006 0.0024 57 GLU 14 CB 0.0047 0.0001 0.0070 58 GLU 14 CG 0.0069 0.0002 0.0088 59 GLU 14 CD 0.0068 0.0006 0.0116 60 GLU 14 OE1 0.0049 0.0009 0.0131 61 GLU 14 OE2 0.0087 0.0006 0.0124 62 ALA 15 N 0.0016 -0.0001 0.0040 63 ALA 15 CA 0.0008 -0.0004 0.0016 64 ALA 15 C 0.0024 -0.0005 0.0013 65 ALA 15 O 0.0035 -0.0009 -0.0009 66 ALA 15 CB -0.0022 -0.0002 0.0016 67 TRP 16 N 0.0027 -0.0003 0.0034 68 TRP 16 CA 0.0043 -0.0004 0.0034 69 TRP 16 C 0.0072 -0.0007 0.0026 70 TRP 16 O 0.0083 -0.0010 0.0009 71 TRP 16 CB 0.0042 0.0000 0.0061 72 TRP 16 CG 0.0016 0.0003 0.0069 73 TRP 16 CD1 -0.0003 0.0007 0.0085 74 TRP 16 CD2 0.0005 0.0003 0.0062 75 TRP 16 CE2 -0.0020 0.0006 0.0075 76 TRP 16 CE3 0.0014 0.0000 0.0047 77 TRP 16 NE1 -0.0025 0.0009 0.0088 78 TRP 16 CZ2 -0.0036 0.0007 0.0072 79 TRP 16 CZ3 -0.0002 0.0001 0.0044 80 TRP 16 CH2 -0.0027 0.0004 0.0056 81 LYS 17 N 0.0078 -0.0018 0.0005 82 LYS 17 CA 0.0111 0.0012 -0.0013 83 LYS 17 C 0.0118 0.0003 -0.0055 84 LYS 17 O 0.0139 0.0023 -0.0063 85 LYS 17 CB 0.0127 0.0028 -0.0018 86 LYS 17 CG 0.0122 0.0041 0.0025 87 LYS 17 CD 0.0133 0.0052 0.0020 88 LYS 17 CE 0.0164 0.0090 0.0028 89 LYS 17 NZ 0.0185 0.0098 -0.0010 90 HIS 18 N 0.0102 -0.0027 -0.0082 91 HIS 18 CA 0.0106 -0.0038 -0.0121 92 HIS 18 C 0.0098 -0.0043 -0.0109 93 HIS 18 O 0.0113 -0.0034 -0.0131 94 HIS 18 CB 0.0086 -0.0072 -0.0147 95 HIS 18 CG 0.0096 -0.0079 -0.0194 96 HIS 18 CD2 0.0123 -0.0063 -0.0225 97 HIS 18 ND1 0.0078 -0.0108 -0.0214 98 HIS 18 CE1 0.0093 -0.0109 -0.0255 99 HIS 18 NE2 0.0120 -0.0081 -0.0262 100 ALA 19 N 0.0073 -0.0056 -0.0075 101 ALA 19 CA 0.0065 -0.0060 -0.0062 102 ALA 19 C 0.0090 -0.0025 -0.0045 103 ALA 19 O 0.0097 -0.0020 -0.0053 104 ALA 19 CB 0.0034 -0.0081 -0.0027 105 ILE 20 N 0.0059 -0.0036 -0.0027 106 ILE 20 CA 0.0035 0.0037 -0.0004 107 ILE 20 C 0.0028 0.0082 -0.0030 108 ILE 20 O 0.0010 0.0122 0.0011 109 ILE 20 CB 0.0031 0.0069 -0.0031 110 ILE 20 CG1 0.0036 0.0030 0.0005 111 ILE 20 CG2 0.0008 0.0149 -0.0018 112 ILE 20 CD1 0.0042 0.0034 -0.0038 113 GLN 21 N 0.0042 0.0071 -0.0098 114 GLN 21 CA 0.0037 0.0111 -0.0127 115 GLN 21 C 0.0037 0.0086 -0.0091 116 GLN 21 O 0.0023 0.0131 -0.0076 117 GLN 21 CB 0.0053 0.0103 -0.0210 118 GLN 21 CG 0.0042 0.0168 -0.0250 119 GLN 21 CD 0.0022 0.0236 -0.0237 120 GLN 21 NE2 0.0005 0.0294 -0.0229 121 GLN 21 OE1 0.0021 0.0237 -0.0235 122 LYS 22 N 0.0053 0.0017 -0.0075 123 LYS 22 CA 0.0053 -0.0008 -0.0036 124 LYS 22 C 0.0032 0.0024 0.0038 125 LYS 22 O 0.0022 0.0044 0.0062 126 LYS 22 CB 0.0074 -0.0090 -0.0028 127 LYS 22 CG 0.0095 -0.0126 -0.0092 128 LYS 22 CD 0.0099 -0.0155 -0.0072 129 LYS 22 CE 0.0124 -0.0228 -0.0104 130 ALA 23 N -0.0067 -0.0025 0.0059 131 ALA 23 CA -0.0135 0.0002 0.0138 132 ALA 23 C -0.0162 0.0087 0.0130 133 ALA 23 O -0.0204 0.0090 0.0185 134 ALA 23 CB -0.0170 0.0022 0.0174 135 LYS 24 N -0.0139 0.0158 0.0063 136 LYS 24 CA -0.0164 0.0240 0.0054 137 LYS 24 C -0.0158 0.0212 0.0061 138 LYS 24 O -0.0198 0.0260 0.0090 139 LYS 24 CB -0.0130 0.0310 -0.0027 140 LYS 24 CG -0.0170 0.0398 -0.0019 141 LYS 24 CD -0.0131 0.0458 -0.0102 142 LYS 24 CE -0.0107 0.0440 -0.0124 143 LYS 24 NZ -0.0058 0.0481 -0.0211 144 HIS 25 N -0.0109 0.0135 0.0033 145 HIS 25 CA -0.0098 0.0106 0.0033 146 HIS 25 C -0.0116 0.0021 0.0102 147 HIS 25 O -0.0096 -0.0026 0.0099 148 HIS 25 CB -0.0027 0.0085 -0.0050 149 HIS 25 CG -0.0006 0.0165 -0.0121 150 HIS 25 CD2 0.0047 0.0167 -0.0193 151 HIS 25 ND1 -0.0041 0.0258 -0.0121 152 HIS 25 CE1 -0.0010 0.0314 -0.0191 153 HIS 25 NE2 0.0043 0.0260 -0.0235 154 MET 26 N -0.0375 -0.0266 0.0138 155 MET 26 CA -0.0316 -0.0205 0.0140 156 MET 26 C -0.0302 -0.0207 0.0130 157 MET 26 O -0.0300 -0.0263 0.0093 158 MET 26 CB -0.0248 -0.0204 0.0099 159 MET 26 CG -0.0200 -0.0129 0.0116 160 MET 26 SD -0.0235 -0.0087 0.0163 161 MET 26 CE -0.0160 -0.0011 0.0165 162 PRO 27 N -0.0293 -0.0146 0.0162 163 PRO 27 CA -0.0280 -0.0145 0.0155 164 PRO 27 C -0.0203 -0.0144 0.0108 165 PRO 27 O -0.0152 -0.0116 0.0095 166 PRO 27 CB -0.0296 -0.0075 0.0208 167 PRO 27 CG -0.0275 -0.0028 0.0224 168 PRO 27 CD -0.0298 -0.0077 0.0208 169 ASP 28 N -0.0196 -0.0176 0.0084 170 ASP 28 CA -0.0125 -0.0177 0.0040 171 ASP 28 C -0.0085 -0.0103 0.0062 172 ASP 28 O -0.0109 -0.0075 0.0094 173 ASP 28 CB -0.0131 -0.0232 0.0010 174 ASP 28 CG -0.0058 -0.0235 -0.0036 175 ASP 28 OD1 -0.0003 -0.0207 -0.0053 176 ASP 28 OD2 -0.0056 -0.0265 -0.0056 177 PRO 29 N -0.0010 -0.0054 -0.0057 178 PRO 29 CA -0.0008 -0.0039 -0.0066 179 PRO 29 C 0.0001 -0.0046 -0.0082 180 PRO 29 O 0.0002 -0.0036 -0.0088 181 PRO 29 CB -0.0009 -0.0024 -0.0072 182 PRO 29 CG -0.0006 -0.0035 -0.0072 183 PRO 29 CD -0.0011 -0.0049 -0.0057 184 TRP 30 N 0.0007 -0.0062 -0.0088 185 TRP 30 CA 0.0016 -0.0069 -0.0103 186 TRP 30 C 0.0017 -0.0086 -0.0098 187 TRP 30 O 0.0025 -0.0096 -0.0109 188 TRP 30 CB 0.0023 -0.0073 -0.0116 189 TRP 30 CG 0.0024 -0.0056 -0.0126 190 TRP 30 CD1 0.0019 -0.0037 -0.0124 191 TRP 30 CD2 0.0031 -0.0055 -0.0139 192 TRP 30 CE2 0.0029 -0.0036 -0.0144 193 TRP 30 CE3 0.0037 -0.0069 -0.0146 194 TRP 30 NE1 0.0022 -0.0026 -0.0135 195 TRP 30 CZ2 0.0034 -0.0031 -0.0157 196 TRP 30 CZ3 0.0042 -0.0064 -0.0159 197 TRP 30 CH2 0.0041 -0.0045 -0.0164 198 ALA 31 N 0.0010 -0.0090 -0.0082 199 ALA 31 CA 0.0011 -0.0107 -0.0076 200 ALA 31 C 0.0016 -0.0108 -0.0086 201 ALA 31 O 0.0021 -0.0124 -0.0090 202 ALA 31 CB 0.0002 -0.0107 -0.0057 203 GLU 32 N 0.0035 -0.0106 -0.0108 204 GLU 32 CA 0.0029 -0.0122 -0.0105 205 GLU 32 C 0.0020 -0.0127 -0.0129 206 GLU 32 O 0.0014 -0.0141 -0.0130 207 GLU 32 CB 0.0037 -0.0113 -0.0088 208 GLU 32 CG 0.0047 -0.0104 -0.0065 209 GLU 32 CD 0.0044 -0.0123 -0.0048 210 GLU 32 OE1 0.0040 -0.0140 -0.0039 211 GLU 32 OE2 0.0046 -0.0120 -0.0045 212 PHE 33 N 0.0019 -0.0116 -0.0150 213 PHE 33 CA 0.0011 -0.0121 -0.0174 214 PHE 33 C -0.0000 -0.0139 -0.0186 215 PHE 33 O -0.0009 -0.0147 -0.0205 216 PHE 33 CB 0.0016 -0.0097 -0.0191 217 PHE 33 CG 0.0026 -0.0079 -0.0182 218 PHE 33 CD1 0.0025 -0.0083 -0.0178 219 PHE 33 CD2 0.0036 -0.0057 -0.0177 220 PHE 33 CE1 0.0035 -0.0066 -0.0169 221 PHE 33 CE2 0.0045 -0.0040 -0.0169 222 PHE 33 CZ 0.0045 -0.0045 -0.0164 223 HIS 34 N 0.0000 -0.0145 -0.0175 224 HIS 34 CA -0.0010 -0.0165 -0.0181 225 HIS 34 C -0.0017 -0.0164 -0.0209 226 HIS 34 O -0.0027 -0.0180 -0.0221 227 HIS 34 CB -0.0017 -0.0189 -0.0172 228 HIS 34 CG -0.0011 -0.0192 -0.0145 229 HIS 34 CD2 -0.0007 -0.0191 -0.0132 230 HIS 34 ND1 -0.0008 -0.0195 -0.0128 231 HIS 34 CE1 -0.0002 -0.0197 -0.0106 232 HIS 34 NE2 -0.0002 -0.0195 -0.0107 233 LEU 35 N -0.0046 -0.0085 -0.0189 234 LEU 35 CA -0.0040 -0.0091 -0.0196 235 LEU 35 C -0.0041 -0.0102 -0.0196 236 LEU 35 O -0.0035 -0.0108 -0.0202 237 LEU 35 CB -0.0038 -0.0087 -0.0197 238 LEU 35 CG -0.0036 -0.0076 -0.0197 239 LEU 35 CD1 -0.0037 -0.0073 -0.0196 240 LEU 35 CD2 -0.0028 -0.0072 -0.0204 241 GLU 36 N -0.0048 -0.0106 -0.0190 242 GLU 36 CA -0.0050 -0.0118 -0.0190 243 GLU 36 C -0.0048 -0.0122 -0.0192 244 GLU 36 O -0.0047 -0.0131 -0.0194 245 GLU 36 CB -0.0059 -0.0120 -0.0183 246 GLU 36 CG -0.0062 -0.0117 -0.0180 247 GLU 36 CD -0.0065 -0.0106 -0.0176 248 GLU 36 OE1 -0.0062 -0.0099 -0.0177 249 GLU 36 OE2 -0.0071 -0.0105 -0.0170 250 ASP 37 N -0.0047 -0.0115 -0.0192 251 ASP 37 CA -0.0045 -0.0118 -0.0194 252 ASP 37 C -0.0036 -0.0118 -0.0202 253 ASP 37 O -0.0034 -0.0122 -0.0205 254 ASP 37 CB -0.0048 -0.0111 -0.0191 255 ASP 37 CG -0.0057 -0.0109 -0.0183 256 ASP 37 OD1 -0.0061 -0.0116 -0.0180 257 ASP 37 OD2 -0.0060 -0.0101 -0.0180 258 ILE 38 N -0.0002 -0.0098 -0.0193 259 ILE 38 CA -0.0001 -0.0097 -0.0200 260 ILE 38 C 0.0008 -0.0102 -0.0187 261 ILE 38 O 0.0005 -0.0102 -0.0171 262 ILE 38 CB -0.0019 -0.0089 -0.0204 263 ILE 38 CG1 -0.0027 -0.0084 -0.0218 264 ILE 38 CG2 -0.0019 -0.0089 -0.0209 265 ILE 38 CD1 -0.0045 -0.0076 -0.0220 266 ALA 39 N 0.0019 -0.0107 -0.0195 267 ALA 39 CA 0.0027 -0.0111 -0.0184 268 ALA 39 C 0.0015 -0.0107 -0.0172 269 ALA 39 O 0.0003 -0.0101 -0.0179 270 ALA 39 CB 0.0038 -0.0115 -0.0196 271 THR 40 N 0.0018 -0.0109 -0.0155 272 THR 40 CA 0.0008 -0.0105 -0.0142 273 THR 40 C 0.0008 -0.0106 -0.0147 274 THR 40 O 0.0022 -0.0111 -0.0151 275 THR 40 CB 0.0012 -0.0109 -0.0123 276 THR 40 CG2 -0.0001 -0.0104 -0.0110 277 THR 40 OG1 0.0015 -0.0110 -0.0120 278 GLU 41 N 0.0017 -0.0051 -0.0085 279 GLU 41 CA 0.0006 -0.0049 -0.0077 280 GLU 41 C -0.0009 -0.0043 -0.0044 281 GLU 41 O -0.0020 -0.0041 -0.0032 282 GLU 41 CB -0.0019 -0.0051 -0.0102 283 GLU 41 CG -0.0005 -0.0057 -0.0134 284 GLU 41 CD -0.0030 -0.0059 -0.0156 285 GLU 41 OE1 -0.0040 -0.0057 -0.0146 286 GLU 41 OE2 -0.0039 -0.0062 -0.0182 287 ARG 42 N -0.0009 -0.0041 -0.0028 288 ARG 42 CA -0.0021 -0.0035 0.0004 289 ARG 42 C -0.0054 -0.0033 0.0004 290 ARG 42 O -0.0059 -0.0036 -0.0015 291 ARG 42 CB 0.0004 -0.0034 0.0024 292 ARG 42 CG 0.0039 -0.0037 0.0017 293 ARG 42 CD 0.0063 -0.0038 0.0023 294 ARG 42 NE 0.0064 -0.0033 0.0057 295 ARG 42 CZ 0.0082 -0.0030 0.0080 296 ARG 42 NH1 0.0103 -0.0033 0.0073 297 ARG 42 NH2 0.0080 -0.0026 0.0110 298 ALA 43 N -0.0076 -0.0029 0.0025 299 ALA 43 CA -0.0108 -0.0027 0.0025 300 ALA 43 C -0.0122 -0.0021 0.0059 301 ALA 43 O -0.0110 -0.0018 0.0080 302 ALA 43 CB -0.0132 -0.0029 0.0002 303 THR 44 N -0.0135 0.0050 0.0078 304 THR 44 CA -0.0136 0.0045 0.0081 305 THR 44 C -0.0140 0.0039 0.0079 306 THR 44 O -0.0140 0.0037 0.0081 307 THR 44 CB -0.0134 0.0045 0.0089 308 THR 44 CG2 -0.0135 0.0040 0.0092 309 THR 44 OG1 -0.0130 0.0051 0.0090 310 ARG 45 N -0.0142 0.0036 0.0076 311 ARG 45 CA -0.0146 0.0030 0.0074 312 ARG 45 C -0.0147 0.0024 0.0078 313 ARG 45 O -0.0147 0.0024 0.0080 314 ARG 45 CB -0.0148 0.0029 0.0067 315 ARG 45 CG -0.0152 0.0023 0.0064 316 ARG 45 CD -0.0154 0.0023 0.0057 317 ARG 45 NE -0.0154 0.0024 0.0057 318 ARG 45 CZ -0.0156 0.0024 0.0051 319 ARG 45 NH1 -0.0158 0.0024 0.0046 320 ARG 45 NH2 -0.0155 0.0025 0.0052 321 HIS 46 N -0.0148 0.0020 0.0081 322 HIS 46 CA -0.0149 0.0014 0.0085 323 HIS 46 C -0.0153 0.0009 0.0081 324 HIS 46 O -0.0154 0.0008 0.0078 325 HIS 46 CB -0.0148 0.0013 0.0091 326 HIS 46 CG -0.0144 0.0019 0.0094 327 HIS 46 CD2 -0.0141 0.0021 0.0100 328 HIS 46 ND1 -0.0142 0.0024 0.0093 329 HIS 46 CE1 -0.0139 0.0028 0.0097 330 HIS 46 NE2 -0.0138 0.0026 0.0101 331 ARG 47 N -0.0115 0.0070 0.0095 332 ARG 47 CA -0.0128 0.0068 0.0094 333 ARG 47 C -0.0116 0.0050 0.0094 334 ARG 47 O -0.0106 0.0033 0.0094 335 ARG 47 CB -0.0154 0.0062 0.0092 336 ARG 47 CG -0.0169 0.0082 0.0092 337 ARG 47 CD -0.0194 0.0074 0.0090 338 ARG 47 NE -0.0195 0.0056 0.0090 339 ARG 47 CZ -0.0215 0.0047 0.0088 340 ARG 47 NH1 -0.0236 0.0054 0.0087 341 ARG 47 NH2 -0.0213 0.0030 0.0087 342 TYR 48 N -0.0118 0.0054 0.0094 343 TYR 48 CA -0.0104 0.0041 0.0094 344 TYR 48 C -0.0120 0.0028 0.0093 345 TYR 48 O -0.0139 0.0037 0.0092 346 TYR 48 CB -0.0087 0.0058 0.0096 347 TYR 48 CG -0.0073 0.0047 0.0096 348 TYR 48 CD1 -0.0056 0.0030 0.0097 349 TYR 48 CD2 -0.0077 0.0054 0.0096 350 TYR 48 CE1 -0.0043 0.0020 0.0097 351 TYR 48 CE2 -0.0064 0.0044 0.0097 352 TYR 48 CZ -0.0047 0.0027 0.0097 353 TYR 48 OH -0.0034 0.0017 0.0097 354 ASN 49 N -0.0112 0.0007 0.0092 355 ASN 49 CA -0.0123 -0.0007 0.0091 356 ASN 49 C -0.0105 -0.0009 0.0092 357 ASN 49 O -0.0086 -0.0019 0.0093 358 ASN 49 CB -0.0131 -0.0031 0.0090 359 ASN 49 CG -0.0145 -0.0045 0.0088 360 ASN 49 ND2 -0.0163 -0.0057 0.0086 361 ASN 49 OD1 -0.0141 -0.0044 0.0088 362 ALA 50 N -0.0099 0.0030 0.0130 363 ALA 50 CA -0.0056 0.0042 0.0126 364 ALA 50 C -0.0044 0.0010 0.0110 365 ALA 50 O -0.0004 0.0010 0.0101 366 ALA 50 CB -0.0058 0.0085 0.0146 367 VAL 51 N -0.0077 -0.0016 0.0104 368 VAL 51 CA -0.0066 -0.0048 0.0087 369 VAL 51 C -0.0044 -0.0083 0.0067 370 VAL 51 O -0.0009 -0.0098 0.0053 371 VAL 51 CB -0.0108 -0.0066 0.0088 372 VAL 51 CG1 -0.0095 -0.0099 0.0070 373 VAL 51 CG2 -0.0130 -0.0030 0.0109 374 THR 52 N -0.0063 -0.0097 0.0065 375 THR 52 CA -0.0046 -0.0129 0.0046 376 THR 52 C -0.0012 -0.0111 0.0048 377 THR 52 O 0.0011 -0.0135 0.0032 378 THR 52 CB -0.0085 -0.0154 0.0043 379 THR 52 CG2 -0.0122 -0.0169 0.0044 380 THR 52 OG1 -0.0104 -0.0128 0.0059 381 GLY 53 N -0.0079 -0.0075 0.0082 382 GLY 53 CA -0.0056 -0.0059 0.0088 383 GLY 53 C -0.0057 -0.0060 0.0088 384 GLY 53 O -0.0034 -0.0060 0.0090 385 GLU 54 N -0.0084 -0.0060 0.0085 386 GLU 54 CA -0.0087 -0.0066 0.0084 387 GLU 54 C -0.0104 -0.0040 0.0088 388 GLU 54 O -0.0124 -0.0027 0.0089 389 GLU 54 CB -0.0104 -0.0094 0.0076 390 GLU 54 CG -0.0084 -0.0121 0.0071 391 GLU 54 CD -0.0101 -0.0149 0.0063 392 GLU 54 OE1 -0.0128 -0.0149 0.0061 393 GLU 54 OE2 -0.0087 -0.0172 0.0060 394 TRP 55 N -0.0096 -0.0034 0.0090 395 TRP 55 CA -0.0110 -0.0011 0.0094 396 TRP 55 C -0.0129 -0.0023 0.0089 397 TRP 55 O -0.0119 -0.0042 0.0086 398 TRP 55 CB -0.0086 0.0009 0.0101 399 TRP 55 CG -0.0072 0.0029 0.0106 400 TRP 55 CD1 -0.0047 0.0024 0.0107 401 TRP 55 CD2 -0.0081 0.0059 0.0112 402 TRP 55 CE2 -0.0061 0.0069 0.0116 403 TRP 55 CE3 -0.0104 0.0077 0.0114 404 TRP 55 NE1 -0.0040 0.0047 0.0113 405 TRP 55 CZ2 -0.0063 0.0097 0.0123 406 TRP 55 CZ3 -0.0107 0.0105 0.0120 407 TRP 55 CH2 -0.0086 0.0115 0.0124 408 LEU 56 N -0.0180 -0.0019 0.0109 409 LEU 56 CA -0.0181 -0.0020 0.0109 410 LEU 56 C -0.0178 -0.0014 0.0107 411 LEU 56 O -0.0181 -0.0008 0.0104 412 LEU 56 CB -0.0189 -0.0023 0.0109 413 LEU 56 CG -0.0190 -0.0022 0.0108 414 LEU 56 CD1 -0.0188 -0.0029 0.0111 415 LEU 56 CD2 -0.0199 -0.0021 0.0107 416 ASP 57 N -0.0174 -0.0014 0.0107 417 ASP 57 CA -0.0171 -0.0008 0.0105 418 ASP 57 C -0.0174 -0.0009 0.0105 419 ASP 57 O -0.0174 -0.0015 0.0108 420 ASP 57 CB -0.0163 -0.0007 0.0106 421 ASP 57 CG -0.0159 -0.0013 0.0109 422 ASP 57 OD1 -0.0158 -0.0018 0.0111 423 ASP 57 OD2 -0.0156 -0.0011 0.0109 424 ASP 58 N -0.0175 -0.0004 0.0103 425 ASP 58 CA -0.0177 -0.0004 0.0103 426 ASP 58 C -0.0174 0.0003 0.0100 427 ASP 58 O -0.0171 0.0008 0.0099 428 ASP 58 CB -0.0185 -0.0005 0.0102 429 ASP 58 CG -0.0190 0.0000 0.0099 430 ASP 58 OD1 -0.0187 0.0004 0.0098 431 ASP 58 OD2 -0.0196 0.0001 0.0098 432 GLU 59 N -0.0155 0.0019 0.0116 433 GLU 59 CA -0.0133 0.0009 0.0091 434 GLU 59 C -0.0117 -0.0001 0.0067 435 GLU 59 O -0.0101 0.0007 0.0076 436 GLU 59 CB -0.0105 0.0023 0.0105 437 GLU 59 CG -0.0118 0.0037 0.0133 438 GLU 59 CD -0.0139 0.0027 0.0124 439 GLU 59 OE1 -0.0122 0.0026 0.0116 440 GLU 59 OE2 -0.0172 0.0021 0.0126 441 VAL 60 N -0.0120 -0.0020 0.0037 442 VAL 60 CA -0.0108 -0.0032 0.0012 443 VAL 60 C -0.0085 -0.0042 -0.0013 444 VAL 60 O -0.0087 -0.0043 -0.0016 445 VAL 60 CB -0.0139 -0.0047 -0.0002 446 VAL 60 CG1 -0.0163 -0.0037 0.0023 447 VAL 60 CG2 -0.0160 -0.0061 -0.0019 448 LEU 61 N -0.0064 -0.0049 -0.0033 449 LEU 61 CA -0.0041 -0.0059 -0.0059 450 LEU 61 C -0.0052 -0.0079 -0.0089 451 LEU 61 O -0.0055 -0.0081 -0.0092 452 LEU 61 CB -0.0002 -0.0049 -0.0056 453 LEU 61 CG 0.0013 -0.0029 -0.0028 454 LEU 61 CD1 0.0050 -0.0019 -0.0024 455 LEU 61 CD2 0.0014 -0.0031 -0.0031 456 ILE 62 N -0.0031 -0.0099 -0.0133 457 ILE 62 CA -0.0036 -0.0094 -0.0137 458 ILE 62 C -0.0033 -0.0087 -0.0142 459 ILE 62 O -0.0027 -0.0085 -0.0142 460 ILE 62 CB -0.0034 -0.0094 -0.0137 461 ILE 62 CG1 -0.0025 -0.0091 -0.0137 462 ILE 62 CG2 -0.0035 -0.0101 -0.0132 463 ILE 62 CD1 -0.0024 -0.0087 -0.0139 464 LYS 63 N -0.0039 -0.0083 -0.0146 465 LYS 63 CA -0.0038 -0.0076 -0.0151 466 LYS 63 C -0.0041 -0.0072 -0.0155 467 LYS 63 O -0.0048 -0.0073 -0.0156 468 LYS 63 CB -0.0043 -0.0074 -0.0154 469 LYS 63 CG -0.0039 -0.0077 -0.0151 470 LYS 63 CD -0.0044 -0.0075 -0.0154 471 LYS 63 CE -0.0041 -0.0077 -0.0152 472 LYS 63 NZ -0.0034 -0.0072 -0.0153 473 MET 64 N -0.0035 -0.0069 -0.0156 474 MET 64 CA -0.0037 -0.0066 -0.0158 475 MET 64 C -0.0036 -0.0058 -0.0164 476 MET 64 O -0.0030 -0.0055 -0.0164 477 MET 64 CB -0.0032 -0.0069 -0.0155 478 MET 64 CG -0.0034 -0.0066 -0.0158 479 MET 64 SD -0.0027 -0.0068 -0.0154 480 MET 64 CE -0.0030 -0.0077 -0.0148 481 ALA 65 N -0.0052 -0.0076 -0.0152 482 ALA 65 CA -0.0061 -0.0061 -0.0094 483 ALA 65 C -0.0054 -0.0057 -0.0079 484 ALA 65 O -0.0020 -0.0061 -0.0103 485 ALA 65 CB -0.0022 -0.0051 -0.0062 486 SER 66 N -0.0085 -0.0048 -0.0038 487 SER 66 CA -0.0084 -0.0043 -0.0021 488 SER 66 C -0.0035 -0.0032 0.0014 489 SER 66 O -0.0019 -0.0030 0.0018 490 SER 66 CB -0.0138 -0.0039 0.0009 491 SER 66 OG -0.0151 -0.0029 0.0048 492 GLN 67 N -0.0011 -0.0024 0.0040 493 GLN 67 CA 0.0036 -0.0012 0.0075 494 GLN 67 C 0.0083 -0.0013 0.0060 495 GLN 67 O 0.0074 -0.0019 0.0039 496 GLN 67 CB 0.0019 0.0003 0.0134 497 GLN 67 CG -0.0022 0.0006 0.0156 498 GLN 67 CD -0.0002 0.0005 0.0148 499 GLN 67 NE2 -0.0040 -0.0000 0.0136 500 GLN 67 OE1 0.0048 0.0009 0.0154 501 PRO 68 N 0.0070 0.0035 0.0082 502 PRO 68 CA 0.0104 0.0025 0.0067 503 PRO 68 C 0.0105 0.0033 0.0087 504 PRO 68 O 0.0092 0.0049 0.0122 505 PRO 68 CB 0.0147 0.0024 0.0077 506 PRO 68 CG 0.0134 0.0028 0.0082 507 PRO 68 CD 0.0090 0.0041 0.0101 508 PHE 69 N 0.0120 0.0022 0.0064 509 PHE 69 CA 0.0127 0.0028 0.0081 510 PHE 69 C 0.0175 0.0028 0.0095 511 PHE 69 O 0.0185 0.0038 0.0120 512 PHE 69 CB 0.0113 0.0017 0.0050 513 PHE 69 CG 0.0138 -0.0002 0.0012 514 PHE 69 CD1 0.0127 -0.0015 -0.0021 515 PHE 69 CD2 0.0172 -0.0008 0.0007 516 PHE 69 CE1 0.0149 -0.0032 -0.0057 517 PHE 69 CE2 0.0194 -0.0026 -0.0028 518 PHE 69 CZ 0.0183 -0.0038 -0.0060 519 GLY 70 N 0.0206 0.0019 0.0080 520 GLY 70 CA 0.0252 0.0019 0.0093 521 GLY 70 C 0.0275 0.0012 0.0084 522 GLY 70 O 0.0259 0.0003 0.0058 523 ARG 71 N 0.0369 0.0009 0.0241 524 ARG 71 CA 0.0321 0.0037 0.0182 525 ARG 71 C 0.0315 0.0098 0.0175 526 ARG 71 O 0.0335 0.0091 0.0198 527 ARG 71 CB 0.0281 -0.0023 0.0137 528 ARG 71 CG 0.0271 -0.0045 0.0125 529 ARG 71 CD 0.0218 -0.0063 0.0062 530 ARG 71 NE 0.0190 0.0005 0.0028 531 ARG 71 CZ 0.0144 0.0007 -0.0027 532 ARG 71 NH1 0.0119 -0.0055 -0.0056 533 ARG 71 NH2 0.0122 0.0073 -0.0054 534 GLY 72 N 0.0291 0.0158 0.0145 535 GLY 72 CA 0.0279 0.0216 0.0129 536 GLY 72 C 0.0227 0.0207 0.0068 537 GLY 72 O 0.0206 0.0145 0.0044 538 ALA 73 N 0.0206 0.0270 0.0042 539 ALA 73 CA 0.0156 0.0268 -0.0018 540 ALA 73 C 0.0122 0.0265 -0.0059 541 ALA 73 O 0.0083 0.0229 -0.0104 542 ALA 73 CB 0.0146 0.0337 -0.0032 543 MET 74 N 0.0105 0.0173 -0.0026 544 MET 74 CA 0.0116 0.0156 -0.0032 545 MET 74 C 0.0120 0.0133 -0.0023 546 MET 74 O 0.0132 0.0118 -0.0032 547 MET 74 CB 0.0113 0.0157 -0.0028 548 MET 74 CG 0.0111 0.0178 -0.0038 549 MET 74 SD 0.0127 0.0180 -0.0065 550 MET 74 CE 0.0137 0.0158 -0.0066 551 ARG 75 N 0.0109 0.0130 -0.0005 552 ARG 75 CA 0.0111 0.0108 0.0006 553 ARG 75 C 0.0106 0.0108 0.0015 554 ARG 75 O 0.0096 0.0124 0.0019 555 ARG 75 CB 0.0105 0.0099 0.0022 556 ARG 75 CG 0.0111 0.0095 0.0014 557 ARG 75 CD 0.0104 0.0086 0.0031 558 ARG 75 NE 0.0089 0.0101 0.0045 559 ARG 75 CZ 0.0080 0.0097 0.0062 560 ARG 75 NH1 0.0084 0.0079 0.0068 561 ARG 75 NH2 0.0067 0.0112 0.0073 562 GLU 76 N 0.0111 0.0088 0.0019 563 GLU 76 CA 0.0106 0.0084 0.0030 564 GLU 76 C 0.0100 0.0068 0.0049 565 GLU 76 O 0.0105 0.0054 0.0051 566 GLU 76 CB 0.0118 0.0074 0.0018 567 GLU 76 CG 0.0131 0.0055 0.0009 568 GLU 76 CD 0.0143 0.0048 -0.0005 569 GLU 76 OE1 0.0141 0.0060 -0.0009 570 GLU 76 OE2 0.0154 0.0032 -0.0012 571 CYS 77 N 0.0150 -0.0016 -0.0035 572 CYS 77 CA 0.0140 -0.0019 -0.0056 573 CYS 77 C 0.0118 -0.0007 -0.0056 574 CYS 77 O 0.0113 0.0001 -0.0041 575 CYS 77 CB 0.0150 -0.0026 -0.0062 576 CYS 77 SG 0.0177 -0.0039 -0.0060 577 PHE 78 N 0.0106 -0.0007 -0.0072 578 PHE 78 CA 0.0085 0.0003 -0.0075 579 PHE 78 C 0.0078 -0.0002 -0.0096 580 PHE 78 O 0.0085 -0.0011 -0.0112 581 PHE 78 CB 0.0074 0.0008 -0.0076 582 PHE 78 CG 0.0081 0.0012 -0.0056 583 PHE 78 CD1 0.0097 0.0004 -0.0055 584 PHE 78 CD2 0.0069 0.0024 -0.0040 585 PHE 78 CE1 0.0103 0.0008 -0.0037 586 PHE 78 CE2 0.0075 0.0028 -0.0023 587 PHE 78 CZ 0.0092 0.0020 -0.0021 588 ARG 79 N 0.0064 0.0006 -0.0096 589 ARG 79 CA 0.0054 0.0003 -0.0115 590 ARG 79 C 0.0040 0.0006 -0.0127 591 ARG 79 O 0.0028 0.0015 -0.0119 592 ARG 79 CB 0.0044 0.0011 -0.0109 593 ARG 79 CG 0.0057 0.0008 -0.0098 594 ARG 79 CD 0.0046 0.0014 -0.0097 595 ARG 79 NE 0.0058 0.0013 -0.0085 596 ARG 79 CZ 0.0058 0.0020 -0.0065 597 ARG 79 NH1 0.0046 0.0031 -0.0055 598 ARG 79 NH2 0.0070 0.0018 -0.0056 599 THR 80 N -0.0031 -0.0064 -0.0150 600 THR 80 CA -0.0031 -0.0068 -0.0151 601 THR 80 C -0.0035 -0.0072 -0.0150 602 THR 80 O -0.0038 -0.0071 -0.0149 603 THR 80 CB -0.0026 -0.0071 -0.0152 604 THR 80 CG2 -0.0025 -0.0076 -0.0152 605 THR 80 OG1 -0.0022 -0.0068 -0.0152 606 LYS 81 N -0.0036 -0.0075 -0.0150 607 LYS 81 CA -0.0040 -0.0079 -0.0149 608 LYS 81 C -0.0038 -0.0084 -0.0150 609 LYS 81 O -0.0034 -0.0084 -0.0151 610 LYS 81 CB -0.0044 -0.0078 -0.0149 611 LYS 81 CG -0.0049 -0.0074 -0.0148 612 LYS 81 CD -0.0053 -0.0074 -0.0147 613 LYS 81 CE -0.0057 -0.0070 -0.0146 614 LYS 81 NZ -0.0060 -0.0071 -0.0145 615 LYS 82 N -0.0039 -0.0088 -0.0150 616 LYS 82 CA -0.0037 -0.0093 -0.0151 617 LYS 82 C -0.0041 -0.0097 -0.0150 618 LYS 82 O -0.0045 -0.0097 -0.0149 619 LYS 82 CB -0.0033 -0.0094 -0.0151 620 LYS 82 CG -0.0030 -0.0098 -0.0152 621 LYS 82 CD -0.0026 -0.0099 -0.0153 622 LYS 82 CE -0.0030 -0.0100 -0.0152 623 LYS 82 NZ -0.0033 -0.0105 -0.0152 624 LEU 83 N -0.0090 -0.0186 -0.0195 625 LEU 83 CA -0.0067 -0.0160 -0.0188 626 LEU 83 C -0.0087 -0.0145 -0.0168 627 LEU 83 O -0.0116 -0.0141 -0.0152 628 LEU 83 CB -0.0048 -0.0136 -0.0179 629 LEU 83 CG -0.0021 -0.0145 -0.0198 630 LEU 83 CD1 -0.0006 -0.0120 -0.0187 631 LEU 83 CD2 0.0009 -0.0152 -0.0216 632 SER 84 N -0.0070 -0.0136 -0.0169 633 SER 84 CA -0.0087 -0.0122 -0.0151 634 SER 84 C -0.0084 -0.0087 -0.0129 635 SER 84 O -0.0057 -0.0071 -0.0129 636 SER 84 CB -0.0071 -0.0126 -0.0162 637 SER 84 OG -0.0084 -0.0109 -0.0144 638 ASN 85 N -0.0111 -0.0076 -0.0108 639 ASN 85 CA -0.0111 -0.0043 -0.0085 640 ASN 85 C -0.0104 -0.0028 -0.0078 641 ASN 85 O -0.0102 0.0000 -0.0059 642 ASN 85 CB -0.0145 -0.0038 -0.0066 643 ASN 85 CG -0.0151 -0.0050 -0.0071 644 ASN 85 ND2 -0.0184 -0.0055 -0.0061 645 ASN 85 OD1 -0.0127 -0.0053 -0.0085 646 PHE 86 N -0.0066 -0.0048 -0.0107 647 PHE 86 CA -0.0053 -0.0040 -0.0112 648 PHE 86 C -0.0052 -0.0042 -0.0110 649 PHE 86 O -0.0049 -0.0035 -0.0118 650 PHE 86 CB -0.0038 -0.0040 -0.0106 651 PHE 86 CG -0.0024 -0.0031 -0.0111 652 PHE 86 CD1 -0.0023 -0.0021 -0.0124 653 PHE 86 CD2 -0.0011 -0.0033 -0.0103 654 PHE 86 CE1 -0.0010 -0.0013 -0.0129 655 PHE 86 CE2 0.0001 -0.0026 -0.0107 656 PHE 86 CZ 0.0002 -0.0016 -0.0120 657 LEU 87 N -0.0054 -0.0052 -0.0098 658 LEU 87 CA -0.0056 -0.0054 -0.0095 659 LEU 87 C -0.0072 -0.0054 -0.0102 660 LEU 87 O -0.0083 -0.0055 -0.0105 661 LEU 87 CB -0.0054 -0.0065 -0.0081 662 LEU 87 CG -0.0038 -0.0066 -0.0073 663 LEU 87 CD1 -0.0038 -0.0077 -0.0058 664 LEU 87 CD2 -0.0025 -0.0058 -0.0077 665 HIS 88 N -0.0073 -0.0053 -0.0104 666 HIS 88 CA -0.0087 -0.0052 -0.0112 667 HIS 88 C -0.0099 -0.0062 -0.0104 668 HIS 88 O -0.0113 -0.0063 -0.0109 669 HIS 88 CB -0.0083 -0.0045 -0.0119 670 HIS 88 CG -0.0076 -0.0034 -0.0131 671 HIS 88 CD2 -0.0071 -0.0029 -0.0135 672 HIS 88 ND1 -0.0072 -0.0026 -0.0139 673 HIS 88 CE1 -0.0066 -0.0017 -0.0148 674 HIS 88 NE2 -0.0065 -0.0018 -0.0146 675 ALA 89 N -0.0122 -0.0311 -0.0133 676 ALA 89 CA -0.0124 -0.0342 -0.0134 677 ALA 89 C -0.0127 -0.0318 -0.0113 678 ALA 89 O -0.0136 -0.0330 -0.0077 679 ALA 89 CB -0.0132 -0.0387 -0.0110 680 GLN 90 N -0.0120 -0.0284 -0.0135 681 GLN 90 CA -0.0122 -0.0260 -0.0120 682 GLN 90 C -0.0121 -0.0287 -0.0131 683 GLN 90 O -0.0114 -0.0307 -0.0167 684 GLN 90 CB -0.0115 -0.0212 -0.0140 685 GLN 90 CG -0.0118 -0.0180 -0.0118 686 GLN 90 CD -0.0111 -0.0135 -0.0142 687 GLN 90 NE2 -0.0114 -0.0098 -0.0116 688 GLN 90 OE1 -0.0101 -0.0134 -0.0183 689 GLN 91 N -0.0128 -0.0286 -0.0100 690 GLN 91 CA -0.0128 -0.0307 -0.0107 691 GLN 91 C -0.0123 -0.0271 -0.0119 692 GLN 91 O -0.0123 -0.0230 -0.0110 693 GLN 91 CB -0.0139 -0.0333 -0.0065 694 GLN 91 CG -0.0145 -0.0362 -0.0044 695 GLN 91 CD -0.0141 -0.0399 -0.0074 696 GLN 91 NE2 -0.0140 -0.0404 -0.0076 697 GLN 91 OE1 -0.0137 -0.0424 -0.0095 698 TRP 92 N -0.0135 -0.0185 -0.0184 699 TRP 92 CA -0.0119 -0.0158 -0.0176 700 TRP 92 C -0.0138 -0.0139 -0.0168 701 TRP 92 O -0.0125 -0.0120 -0.0162 702 TRP 92 CB -0.0107 -0.0142 -0.0171 703 TRP 92 CG -0.0080 -0.0156 -0.0178 704 TRP 92 CD1 -0.0080 -0.0171 -0.0183 705 TRP 92 CD2 -0.0049 -0.0157 -0.0180 706 TRP 92 CE2 -0.0031 -0.0172 -0.0187 707 TRP 92 CE3 -0.0035 -0.0145 -0.0177 708 TRP 92 NE1 -0.0050 -0.0181 -0.0188 709 TRP 92 CZ2 -0.0000 -0.0177 -0.0190 710 TRP 92 CZ3 -0.0004 -0.0150 -0.0181 711 TRP 92 CH2 0.0013 -0.0166 -0.0187 712 LYS 93 N -0.0169 -0.0142 -0.0167 713 LYS 93 CA -0.0188 -0.0124 -0.0159 714 LYS 93 C -0.0183 -0.0130 -0.0162 715 LYS 93 O -0.0187 -0.0111 -0.0155 716 LYS 93 CB -0.0222 -0.0128 -0.0159 717 LYS 93 CG -0.0229 -0.0157 -0.0168 718 LYS 93 CD -0.0263 -0.0158 -0.0166 719 LYS 93 CE -0.0271 -0.0186 -0.0175 720 LYS 93 NZ -0.0256 -0.0186 -0.0177 721 GLY 94 N -0.0175 -0.0157 -0.0172 722 GLY 94 CA -0.0170 -0.0165 -0.0175 723 GLY 94 C -0.0137 -0.0170 -0.0179 724 GLY 94 O -0.0131 -0.0181 -0.0183 725 ALA 95 N -0.0083 -0.0129 -0.0144 726 ALA 95 CA -0.0066 -0.0124 -0.0157 727 ALA 95 C -0.0054 -0.0107 -0.0150 728 ALA 95 O -0.0058 -0.0097 -0.0135 729 ALA 95 CB -0.0065 -0.0129 -0.0165 730 SER 96 N -0.0040 -0.0102 -0.0161 731 SER 96 CA -0.0027 -0.0086 -0.0155 732 SER 96 C -0.0019 -0.0077 -0.0153 733 SER 96 O -0.0021 -0.0083 -0.0160 734 SER 96 CB -0.0014 -0.0084 -0.0168 735 SER 96 OG -0.0021 -0.0091 -0.0169 736 ASN 97 N -0.0010 -0.0061 -0.0145 737 ASN 97 CA -0.0001 -0.0050 -0.0142 738 ASN 97 C 0.0017 -0.0045 -0.0156 739 ASN 97 O 0.0024 -0.0042 -0.0160 740 ASN 97 CB -0.0002 -0.0036 -0.0124 741 ASN 97 CG -0.0020 -0.0041 -0.0110 742 ASN 97 ND2 -0.0024 -0.0034 -0.0097 743 ASN 97 OD1 -0.0029 -0.0050 -0.0111 744 TYR 98 N 0.0014 -0.0003 -0.0119 745 TYR 98 CA 0.0027 -0.0008 -0.0117 746 TYR 98 C 0.0034 -0.0001 -0.0105 747 TYR 98 O 0.0028 0.0008 -0.0099 748 TYR 98 CB 0.0028 -0.0012 -0.0122 749 TYR 98 CG 0.0022 -0.0020 -0.0134 750 TYR 98 CD1 0.0009 -0.0017 -0.0138 751 TYR 98 CD2 0.0029 -0.0030 -0.0141 752 TYR 98 CE1 0.0003 -0.0024 -0.0148 753 TYR 98 CE2 0.0023 -0.0037 -0.0151 754 TYR 98 CZ 0.0010 -0.0034 -0.0155 755 TYR 98 OH 0.0004 -0.0041 -0.0166 756 VAL 99 N 0.0047 -0.0004 -0.0103 757 VAL 99 CA 0.0055 0.0001 -0.0092 758 VAL 99 C 0.0062 -0.0002 -0.0092 759 VAL 99 O 0.0069 -0.0011 -0.0098 760 VAL 99 CB 0.0064 -0.0000 -0.0088 761 VAL 99 CG1 0.0073 0.0006 -0.0077 762 VAL 99 CG2 0.0057 0.0002 -0.0090 763 ALA 100 N 0.0061 0.0005 -0.0085 764 ALA 100 CA 0.0068 0.0003 -0.0084 765 ALA 100 C 0.0078 0.0007 -0.0073 766 ALA 100 O 0.0075 0.0016 -0.0065 767 ALA 100 CB 0.0058 0.0006 -0.0084 768 LYS 101 N 0.0055 0.0096 0.0000 769 LYS 101 CA 0.0053 0.0092 0.0003 770 LYS 101 C 0.0053 0.0094 0.0011 771 LYS 101 O 0.0053 0.0097 0.0015 772 LYS 101 CB 0.0049 0.0084 0.0003 773 LYS 101 CG 0.0049 0.0081 -0.0005 774 LYS 101 CD 0.0047 0.0076 -0.0004 775 LYS 101 CE 0.0046 0.0071 -0.0011 776 LYS 101 NZ 0.0043 0.0065 -0.0010 777 ARG 102 N 0.0052 0.0094 0.0012 778 ARG 102 CA 0.0052 0.0097 0.0019 779 ARG 102 C 0.0050 0.0092 0.0022 780 ARG 102 O 0.0049 0.0089 0.0018 781 ARG 102 CB 0.0055 0.0104 0.0019 782 ARG 102 CG 0.0055 0.0106 0.0026 783 ARG 102 CD 0.0055 0.0108 0.0032 784 ARG 102 NE 0.0056 0.0112 0.0038 785 ARG 102 CZ 0.0056 0.0115 0.0044 786 ARG 102 NH1 0.0055 0.0113 0.0045 787 ARG 102 NH2 0.0057 0.0118 0.0049 788 TYR 103 N 0.0048 0.0090 0.0029 789 TYR 103 CA 0.0046 0.0086 0.0032 790 TYR 103 C 0.0047 0.0089 0.0032 791 TYR 103 O 0.0049 0.0095 0.0035 792 TYR 103 CB 0.0044 0.0084 0.0039 793 TYR 103 CG 0.0041 0.0078 0.0040 794 TYR 103 CD1 0.0038 0.0071 0.0039 795 TYR 103 CD2 0.0041 0.0079 0.0040 796 TYR 103 CE1 0.0036 0.0066 0.0039 797 TYR 103 CE2 0.0039 0.0073 0.0041 798 TYR 103 CZ 0.0036 0.0067 0.0040 799 TYR 103 OH 0.0034 0.0061 0.0040 800 ILE 104 N 0.0089 0.0134 0.0052 801 ILE 104 CA 0.0121 0.0103 -0.0024 802 ILE 104 C 0.0110 0.0100 -0.0055 803 ILE 104 O 0.0163 0.0073 -0.0079 804 ILE 104 CB 0.0087 0.0102 -0.0083 805 ILE 104 CG1 0.0100 0.0105 -0.0049 806 ILE 104 CG2 0.0121 0.0070 -0.0161 807 ILE 104 CD1 0.0055 0.0112 -0.0095 808 GLU 105 N 0.0041 0.0127 -0.0056 809 GLU 105 CA 0.0031 0.0126 -0.0075 810 GLU 105 C 0.0047 0.0138 -0.0000 811 GLU 105 O 0.0024 0.0162 0.0062 812 GLU 105 CB -0.0050 0.0150 -0.0110 813 GLU 105 CG -0.0073 0.0141 -0.0185 814 GLU 105 CD -0.0022 0.0105 -0.0250 815 GLU 105 OE1 0.0001 0.0094 -0.0258 816 GLU 105 OE2 -0.0004 0.0088 -0.0293 817 PRO 106 N 0.0087 0.0121 -0.0005 818 PRO 106 CA 0.0105 0.0131 0.0066 819 PRO 106 C 0.0034 0.0166 0.0098 820 PRO 106 O -0.0017 0.0176 0.0054 821 PRO 106 CB 0.0154 0.0104 0.0038 822 PRO 106 CG 0.0134 0.0092 -0.0049 823 PRO 106 CD 0.0117 0.0092 -0.0075 824 VAL 107 N -0.0059 0.0194 0.0265 825 VAL 107 CA -0.0043 0.0178 0.0257 826 VAL 107 C -0.0047 0.0172 0.0245 827 VAL 107 O -0.0062 0.0179 0.0241 828 VAL 107 CB -0.0039 0.0168 0.0247 829 VAL 107 CG1 -0.0035 0.0174 0.0260 830 VAL 107 CG2 -0.0057 0.0168 0.0229 831 ASP 108 N -0.0033 0.0158 0.0238 832 ASP 108 CA -0.0036 0.0150 0.0225 833 ASP 108 C -0.0050 0.0146 0.0206 834 ASP 108 O -0.0053 0.0145 0.0201 835 ASP 108 CB -0.0017 0.0136 0.0223 836 ASP 108 CG -0.0017 0.0131 0.0215 837 ASP 108 OD1 -0.0030 0.0130 0.0201 838 ASP 108 OD2 -0.0003 0.0127 0.0224 839 ARG 109 N -0.0059 0.0145 0.0196 840 ARG 109 CA -0.0073 0.0142 0.0177 841 ARG 109 C -0.0065 0.0126 0.0163 842 ARG 109 O -0.0074 0.0124 0.0151 843 ARG 109 CB -0.0084 0.0144 0.0169 844 ARG 109 CG -0.0101 0.0160 0.0177 845 ARG 109 CD -0.0112 0.0161 0.0167 846 ARG 109 NE -0.0127 0.0159 0.0150 847 ARG 109 CZ -0.0125 0.0146 0.0133 848 ARG 109 NH1 -0.0110 0.0133 0.0130 849 ARG 109 NH2 -0.0140 0.0145 0.0118 850 ASP 110 N -0.0043 0.0145 0.0199 851 ASP 110 CA -0.0050 0.0138 0.0202 852 ASP 110 C -0.0054 0.0123 0.0186 853 ASP 110 O -0.0057 0.0118 0.0184 854 ASP 110 CB -0.0064 0.0135 0.0220 855 ASP 110 CG -0.0070 0.0132 0.0225 856 ASP 110 OD1 -0.0063 0.0143 0.0229 857 ASP 110 OD2 -0.0082 0.0118 0.0225 858 VAL 111 N -0.0054 0.0116 0.0174 859 VAL 111 CA -0.0057 0.0102 0.0159 860 VAL 111 C -0.0046 0.0105 0.0146 861 VAL 111 O -0.0050 0.0096 0.0138 862 VAL 111 CB -0.0058 0.0094 0.0149 863 VAL 111 CG1 -0.0062 0.0079 0.0134 864 VAL 111 CG2 -0.0069 0.0091 0.0163 865 TYR 112 N -0.0033 0.0119 0.0143 866 TYR 112 CA -0.0021 0.0124 0.0131 867 TYR 112 C -0.0023 0.0126 0.0138 868 TYR 112 O -0.0022 0.0120 0.0127 869 TYR 112 CB -0.0006 0.0139 0.0128 870 TYR 112 CG -0.0002 0.0137 0.0117 871 TYR 112 CD1 -0.0006 0.0138 0.0125 872 TYR 112 CD2 0.0006 0.0133 0.0098 873 TYR 112 CE1 -0.0002 0.0136 0.0116 874 TYR 112 CE2 0.0010 0.0131 0.0088 875 TYR 112 CZ 0.0006 0.0132 0.0097 876 TYR 112 OH 0.0010 0.0130 0.0087 877 PHE 113 N -0.0046 0.0130 0.0154 878 PHE 113 CA -0.0044 0.0128 0.0146 879 PHE 113 C -0.0034 0.0128 0.0146 880 PHE 113 O -0.0032 0.0126 0.0142 881 PHE 113 CB -0.0045 0.0126 0.0140 882 PHE 113 CG -0.0055 0.0126 0.0139 883 PHE 113 CD1 -0.0059 0.0127 0.0144 884 PHE 113 CD2 -0.0059 0.0124 0.0132 885 PHE 113 CE1 -0.0067 0.0127 0.0143 886 PHE 113 CE2 -0.0068 0.0124 0.0131 887 PHE 113 CZ -0.0072 0.0125 0.0136 888 GLU 114 N -0.0029 0.0129 0.0151 889 GLU 114 CA -0.0020 0.0129 0.0152 890 GLU 114 C -0.0019 0.0130 0.0156 891 GLU 114 O -0.0014 0.0129 0.0154 892 GLU 114 CB -0.0015 0.0130 0.0156 893 GLU 114 CG -0.0005 0.0130 0.0155 894 GLU 114 CD -0.0002 0.0127 0.0146 895 GLU 114 OE1 -0.0005 0.0126 0.0142 896 GLU 114 OE2 0.0003 0.0126 0.0144 897 ASP 115 N -0.0024 0.0132 0.0162 898 ASP 115 CA -0.0024 0.0133 0.0166 899 ASP 115 C -0.0027 0.0132 0.0161 900 ASP 115 O -0.0024 0.0132 0.0161 901 ASP 115 CB -0.0030 0.0136 0.0174 902 ASP 115 CG -0.0026 0.0138 0.0181 903 ASP 115 OD1 -0.0018 0.0137 0.0180 904 ASP 115 OD2 -0.0031 0.0139 0.0186 905 VAL 116 N -0.0037 0.0132 0.0148 906 VAL 116 CA -0.0043 0.0128 0.0139 907 VAL 116 C -0.0034 0.0120 0.0131 908 VAL 116 O -0.0035 0.0118 0.0126 909 VAL 116 CB -0.0053 0.0127 0.0133 910 VAL 116 CG1 -0.0059 0.0122 0.0122 911 VAL 116 CG2 -0.0063 0.0134 0.0140 912 ARG 117 N -0.0025 0.0117 0.0130 913 ARG 117 CA -0.0016 0.0110 0.0123 914 ARG 117 C -0.0008 0.0111 0.0127 915 ARG 117 O -0.0006 0.0106 0.0121 916 ARG 117 CB -0.0008 0.0107 0.0122 917 ARG 117 CG -0.0014 0.0105 0.0116 918 ARG 117 CD -0.0005 0.0101 0.0114 919 ARG 117 NE -0.0002 0.0106 0.0123 920 ARG 117 CZ -0.0008 0.0109 0.0124 921 ARG 117 NH1 -0.0016 0.0106 0.0117 922 ARG 117 NH2 -0.0004 0.0113 0.0133 923 LEU 118 N -0.0005 0.0117 0.0138 924 LEU 118 CA 0.0002 0.0118 0.0143 925 LEU 118 C -0.0006 0.0118 0.0140 926 LEU 118 O -0.0001 0.0115 0.0137 927 LEU 118 CB 0.0004 0.0125 0.0155 928 LEU 118 CG 0.0013 0.0128 0.0163 929 LEU 118 CD1 0.0016 0.0134 0.0174 930 LEU 118 CD2 0.0008 0.0130 0.0164 931 GLN 119 N -0.0010 0.0077 0.0095 932 GLN 119 CA -0.0009 0.0077 0.0092 933 GLN 119 C -0.0009 0.0077 0.0092 934 GLN 119 O -0.0010 0.0075 0.0091 935 GLN 119 CB -0.0008 0.0079 0.0091 936 GLN 119 CG -0.0007 0.0079 0.0087 937 GLN 119 CD -0.0006 0.0079 0.0085 938 GLN 119 NE2 -0.0006 0.0079 0.0082 939 GLN 119 OE1 -0.0007 0.0079 0.0086 940 MET 120 N -0.0009 0.0078 0.0095 941 MET 120 CA -0.0009 0.0078 0.0095 942 MET 120 C -0.0011 0.0076 0.0096 943 MET 120 O -0.0011 0.0075 0.0095 944 MET 120 CB -0.0008 0.0080 0.0097 945 MET 120 CG -0.0006 0.0083 0.0096 946 MET 120 SD -0.0005 0.0083 0.0092 947 MET 120 CE -0.0004 0.0084 0.0092 948 GLU 121 N -0.0012 0.0074 0.0098 949 GLU 121 CA -0.0014 0.0072 0.0099 950 GLU 121 C -0.0014 0.0070 0.0096 951 GLU 121 O -0.0015 0.0068 0.0095 952 GLU 121 CB -0.0015 0.0071 0.0101 953 GLU 121 CG -0.0017 0.0068 0.0102 954 GLU 121 CD -0.0017 0.0068 0.0104 955 GLU 121 OE1 -0.0016 0.0070 0.0106 956 GLU 121 OE2 -0.0019 0.0066 0.0105 957 ALA 122 N -0.0000 0.0041 0.0080 958 ALA 122 CA -0.0002 0.0032 0.0067 959 ALA 122 C 0.0004 0.0036 0.0060 960 ALA 122 O 0.0001 0.0029 0.0053 961 ALA 122 CB 0.0001 0.0031 0.0058 962 LYS 123 N 0.0013 0.0046 0.0061 963 LYS 123 CA 0.0019 0.0050 0.0055 964 LYS 123 C 0.0015 0.0048 0.0062 965 LYS 123 O 0.0015 0.0045 0.0055 966 LYS 123 CB 0.0030 0.0062 0.0056 967 LYS 123 CG 0.0037 0.0067 0.0050 968 LYS 123 CD 0.0047 0.0079 0.0051 969 LYS 123 CE 0.0055 0.0084 0.0043 970 LYS 123 NZ 0.0058 0.0080 0.0029 971 LEU 124 N 0.0011 0.0051 0.0075 972 LEU 124 CA 0.0005 0.0048 0.0082 973 LEU 124 C -0.0004 0.0036 0.0078 974 LEU 124 O -0.0006 0.0033 0.0076 975 LEU 124 CB 0.0001 0.0051 0.0098 976 LEU 124 CG 0.0009 0.0064 0.0105 977 LEU 124 CD1 0.0004 0.0065 0.0120 978 LEU 124 CD2 0.0015 0.0069 0.0101 979 TRP 125 N 0.0004 0.0035 0.0053 980 TRP 125 CA 0.0005 0.0033 0.0053 981 TRP 125 C 0.0021 0.0027 0.0056 982 TRP 125 O 0.0027 0.0032 0.0058 983 TRP 125 CB -0.0007 0.0023 0.0050 984 TRP 125 CG -0.0022 0.0031 0.0047 985 TRP 125 CD1 -0.0035 0.0029 0.0044 986 TRP 125 CD2 -0.0026 0.0043 0.0047 987 TRP 125 CE2 -0.0041 0.0048 0.0044 988 TRP 125 CE3 -0.0018 0.0050 0.0049 989 TRP 125 NE1 -0.0046 0.0039 0.0042 990 TRP 125 CZ2 -0.0048 0.0059 0.0043 991 TRP 125 CZ3 -0.0025 0.0062 0.0048 992 TRP 125 CH2 -0.0040 0.0066 0.0045 993 GLY 126 N 0.0028 0.0017 0.0057 994 GLY 126 CA 0.0043 0.0012 0.0060 995 GLY 126 C 0.0054 0.0026 0.0064 996 GLY 126 O 0.0064 0.0027 0.0066 997 GLU 127 N 0.0052 0.0036 0.0064 998 GLU 127 CA 0.0061 0.0050 0.0067 999 GLU 127 C 0.0059 0.0061 0.0067 1000 GLU 127 O 0.0069 0.0067 0.0070 1001 GLU 127 CB 0.0057 0.0059 0.0067 1002 GLU 127 CG 0.0061 0.0050 0.0067 1003 GLU 127 CD 0.0056 0.0058 0.0066 1004 GLU 127 OE1 0.0052 0.0072 0.0066 1005 GLU 127 OE2 0.0055 0.0051 0.0066 1006 GLU 128 N 0.0042 0.0054 0.0074 1007 GLU 128 CA 0.0034 0.0060 0.0077 1008 GLU 128 C 0.0036 0.0052 0.0073 1009 GLU 128 O 0.0037 0.0057 0.0076 1010 GLU 128 CB 0.0018 0.0060 0.0077 1011 GLU 128 CG 0.0008 0.0065 0.0079 1012 GLU 128 CD 0.0011 0.0079 0.0086 1013 GLU 128 OE1 0.0016 0.0087 0.0090 1014 GLU 128 OE2 0.0008 0.0083 0.0088 1015 TYR 129 N 0.0036 0.0039 0.0066 1016 TYR 129 CA 0.0040 0.0031 0.0062 1017 TYR 129 C 0.0055 0.0034 0.0064 1018 TYR 129 O 0.0057 0.0034 0.0064 1019 TYR 129 CB 0.0039 0.0017 0.0055 1020 TYR 129 CG 0.0043 0.0007 0.0050 1021 TYR 129 CD1 0.0034 0.0004 0.0048 1022 TYR 129 CD2 0.0057 0.0002 0.0048 1023 TYR 129 CE1 0.0039 -0.0005 0.0044 1024 TYR 129 CE2 0.0062 -0.0007 0.0043 1025 TYR 129 CZ 0.0052 -0.0010 0.0041 1026 TYR 129 OH 0.0057 -0.0019 0.0037 1027 ASN 130 N 0.0065 0.0035 0.0065 1028 ASN 130 CA 0.0080 0.0038 0.0067 1029 ASN 130 C 0.0081 0.0051 0.0074 1030 ASN 130 O 0.0089 0.0052 0.0075 1031 ASN 130 CB 0.0090 0.0038 0.0068 1032 ASN 130 CG 0.0092 0.0025 0.0061 1033 ASN 130 ND2 0.0097 0.0025 0.0061 1034 ASN 130 OD1 0.0090 0.0015 0.0056 1035 ARG 131 N 0.0081 0.0075 0.0113 1036 ARG 131 CA 0.0079 0.0091 0.0127 1037 ARG 131 C 0.0069 0.0094 0.0126 1038 ARG 131 O 0.0070 0.0106 0.0137 1039 ARG 131 CB 0.0068 0.0102 0.0133 1040 ARG 131 CG 0.0081 0.0107 0.0141 1041 ARG 131 CD 0.0071 0.0120 0.0149 1042 ARG 131 NE 0.0056 0.0115 0.0141 1043 ARG 131 CZ 0.0061 0.0109 0.0138 1044 ARG 131 NH1 0.0080 0.0108 0.0141 1045 ARG 131 NH2 0.0047 0.0104 0.0130 1046 HIS 132 N 0.0058 0.0083 0.0115 1047 HIS 132 CA 0.0049 0.0084 0.0114 1048 HIS 132 C 0.0062 0.0077 0.0111 1049 HIS 132 O 0.0055 0.0074 0.0106 1050 HIS 132 CB 0.0029 0.0077 0.0103 1051 HIS 132 CG 0.0013 0.0086 0.0107 1052 HIS 132 CD2 -0.0005 0.0093 0.0110 1053 HIS 132 ND1 0.0015 0.0087 0.0109 1054 HIS 132 CE1 -0.0002 0.0096 0.0112 1055 HIS 132 NE2 -0.0014 0.0099 0.0113 1056 LYS 133 N 0.0082 0.0074 0.0113 1057 LYS 133 CA 0.0097 0.0068 0.0111 1058 LYS 133 C 0.0092 0.0053 0.0097 1059 LYS 133 O 0.0089 0.0053 0.0096 1060 LYS 133 CB 0.0100 0.0080 0.0122 1061 LYS 133 CG 0.0101 0.0096 0.0136 1062 LYS 133 CD 0.0110 0.0107 0.0147 1063 LYS 133 CE 0.0105 0.0124 0.0160 1064 LYS 133 NZ 0.0114 0.0127 0.0164 1065 PRO 134 N 0.0070 0.0027 0.0018 1066 PRO 134 CA 0.0070 0.0016 0.0015 1067 PRO 134 C 0.0076 0.0016 0.0003 1068 PRO 134 O 0.0082 0.0025 -0.0002 1069 PRO 134 CB 0.0066 0.0020 0.0024 1070 PRO 134 CG 0.0068 0.0034 0.0025 1071 PRO 134 CD 0.0069 0.0038 0.0025 1072 PRO 135 N 0.0077 0.0005 -0.0001 1073 PRO 135 CA 0.0083 0.0005 -0.0013 1074 PRO 135 C 0.0086 0.0015 -0.0014 1075 PRO 135 O 0.0092 0.0020 -0.0023 1076 PRO 135 CB 0.0082 -0.0008 -0.0015 1077 PRO 135 CG 0.0074 -0.0013 -0.0004 1078 PRO 135 CD 0.0071 -0.0007 0.0003 1079 LYS 136 N 0.0082 0.0018 -0.0006 1080 LYS 136 CA 0.0084 0.0028 -0.0006 1081 LYS 136 C 0.0080 0.0036 0.0005 1082 LYS 136 O 0.0074 0.0032 0.0014 1083 LYS 136 CB 0.0084 0.0023 -0.0008 1084 LYS 136 CG 0.0090 0.0017 -0.0020 1085 LYS 136 CD 0.0089 0.0012 -0.0021 1086 LYS 136 CE 0.0095 0.0006 -0.0033 1087 LYS 136 NZ 0.0094 0.0000 -0.0034 1088 GLN 137 N 0.0089 0.0022 0.0022 1089 GLN 137 CA 0.0084 0.0025 0.0022 1090 GLN 137 C 0.0082 0.0018 0.0019 1091 GLN 137 O 0.0087 0.0012 0.0017 1092 GLN 137 CB 0.0090 0.0031 0.0026 1093 GLN 137 CG 0.0090 0.0040 0.0030 1094 GLN 137 CD 0.0094 0.0046 0.0034 1095 GLN 137 NE2 0.0099 0.0050 0.0037 1096 GLN 137 OE1 0.0092 0.0047 0.0034 1097 VAL 138 N 0.0076 0.0020 0.0018 1098 VAL 138 CA 0.0073 0.0014 0.0014 1099 VAL 138 C 0.0073 0.0018 0.0016 1100 VAL 138 O 0.0075 0.0025 0.0020 1101 VAL 138 CB 0.0063 0.0012 0.0011 1102 VAL 138 CG1 0.0062 0.0009 0.0010 1103 VAL 138 CG2 0.0057 0.0020 0.0013 1104 ASP 139 N 0.0072 0.0013 0.0014 1105 ASP 139 CA 0.0072 0.0015 0.0015 1106 ASP 139 C 0.0068 0.0009 0.0011 1107 ASP 139 O 0.0071 0.0001 0.0008 1108 ASP 139 CB 0.0081 0.0017 0.0018 1109 ASP 139 CG 0.0081 0.0022 0.0020 1110 ASP 139 OD1 0.0073 0.0024 0.0019 1111 ASP 139 OD2 0.0088 0.0023 0.0022 1112 ILE 140 N 0.0058 0.0013 0.0010 1113 ILE 140 CA 0.0053 0.0013 0.0016 1114 ILE 140 C 0.0050 0.0021 0.0015 1115 ILE 140 O 0.0050 0.0026 0.0012 1116 ILE 140 CB 0.0050 0.0012 0.0022 1117 ILE 140 CG1 0.0052 0.0003 0.0024 1118 ILE 140 CG2 0.0044 0.0014 0.0027 1119 ILE 140 CD1 0.0057 0.0001 0.0020 1120 MET 141 N 0.0049 0.0021 0.0017 1121 MET 141 CA 0.0046 0.0028 0.0015 1122 MET 141 C 0.0041 0.0033 0.0019 1123 MET 141 O 0.0038 0.0031 0.0025 1124 MET 141 CB 0.0045 0.0027 0.0017 1125 MET 141 CG 0.0050 0.0023 0.0014 1126 MET 141 SD 0.0053 0.0028 0.0007 1127 MET 141 CE 0.0048 0.0034 0.0009 1128 GLN 142 N 0.0039 0.0040 0.0016 1129 GLN 142 CA 0.0034 0.0045 0.0019 1130 GLN 142 C 0.0030 0.0046 0.0024 1131 GLN 142 O 0.0031 0.0046 0.0023 1132 GLN 142 CB 0.0034 0.0052 0.0014 1133 GLN 142 CG 0.0029 0.0059 0.0017 1134 GLN 142 CD 0.0029 0.0066 0.0012 1135 GLN 142 NE2 0.0030 0.0070 0.0008 1136 GLN 142 OE1 0.0027 0.0067 0.0013 1137 MET 143 N -0.0036 0.0086 0.0077 1138 MET 143 CA -0.0043 0.0089 0.0086 1139 MET 143 C -0.0049 0.0090 0.0080 1140 MET 143 O -0.0044 0.0088 0.0074 1141 MET 143 CB -0.0036 0.0088 0.0097 1142 MET 143 CG -0.0043 0.0092 0.0107 1143 MET 143 SD -0.0035 0.0091 0.0121 1144 MET 143 CE -0.0026 0.0087 0.0114 1145 CYS 144 N -0.0060 0.0094 0.0082 1146 CYS 144 CA -0.0067 0.0096 0.0077 1147 CYS 144 C -0.0073 0.0099 0.0087 1148 CYS 144 O -0.0072 0.0100 0.0098 1149 CYS 144 CB -0.0076 0.0097 0.0067 1150 CYS 144 SG -0.0088 0.0102 0.0073 1151 ILE 145 N -0.0081 0.0101 0.0084 1152 ILE 145 CA -0.0087 0.0104 0.0093 1153 ILE 145 C -0.0100 0.0108 0.0090 1154 ILE 145 O -0.0104 0.0108 0.0079 1155 ILE 145 CB -0.0083 0.0103 0.0093 1156 ILE 145 CG1 -0.0071 0.0100 0.0098 1157 ILE 145 CG2 -0.0092 0.0106 0.0100 1158 ILE 145 CD1 -0.0065 0.0098 0.0096 1159 ILE 146 N -0.0128 0.0034 0.0039 1160 ILE 146 CA -0.0103 0.0039 0.0040 1161 ILE 146 C -0.0106 0.0035 0.0035 1162 ILE 146 O -0.0117 0.0023 0.0018 1163 ILE 146 CB -0.0082 0.0032 0.0026 1164 ILE 146 CG1 -0.0089 0.0016 0.0002 1165 ILE 146 CG2 -0.0076 0.0038 0.0034 1166 ILE 146 CD1 -0.0066 0.0009 -0.0013 1167 GLU 147 N -0.0098 0.0044 0.0048 1168 GLU 147 CA -0.0099 0.0042 0.0046 1169 GLU 147 C -0.0073 0.0042 0.0040 1170 GLU 147 O -0.0056 0.0052 0.0052 1171 GLU 147 CB -0.0111 0.0054 0.0066 1172 GLU 147 CG -0.0116 0.0051 0.0063 1173 GLU 147 CD -0.0129 0.0062 0.0083 1174 GLU 147 OE1 -0.0132 0.0072 0.0100 1175 GLU 147 OE2 -0.0138 0.0060 0.0082 1176 LEU 148 N -0.0069 0.0031 0.0021 1177 LEU 148 CA -0.0044 0.0029 0.0013 1178 LEU 148 C -0.0044 0.0033 0.0019 1179 LEU 148 O -0.0050 0.0024 0.0006 1180 LEU 148 CB -0.0039 0.0014 -0.0011 1181 LEU 148 CG -0.0033 0.0009 -0.0020 1182 LEU 148 CD1 -0.0010 0.0019 -0.0010 1183 LEU 148 CD2 -0.0055 0.0008 -0.0018 1184 LYS 149 N 0.0006 0.0022 0.0067 1185 LYS 149 CA 0.0010 0.0019 0.0063 1186 LYS 149 C 0.0043 -0.0004 0.0043 1187 LYS 149 O 0.0047 -0.0010 0.0034 1188 LYS 149 CB 0.0014 0.0032 0.0101 1189 LYS 149 CG -0.0020 0.0056 0.0120 1190 LYS 149 CD -0.0017 0.0069 0.0155 1191 LYS 149 CE -0.0049 0.0092 0.0177 1192 LYS 149 NZ -0.0044 0.0105 0.0214 1193 ASP 150 N 0.0067 -0.0018 0.0037 1194 ASP 150 CA 0.0098 -0.0040 0.0018 1195 ASP 150 C 0.0090 -0.0053 -0.0024 1196 ASP 150 O 0.0112 -0.0072 -0.0044 1197 ASP 150 CB 0.0132 -0.0048 0.0037 1198 ASP 150 CG 0.0149 -0.0041 0.0074 1199 ASP 150 OD1 0.0152 -0.0042 0.0075 1200 ASP 150 OD2 0.0159 -0.0034 0.0102 1201 ARG 151 N 0.0061 -0.0045 -0.0036 1202 ARG 151 CA 0.0050 -0.0056 -0.0076 1203 ARG 151 C 0.0030 -0.0054 -0.0095 1204 ARG 151 O 0.0013 -0.0039 -0.0077 1205 ARG 151 CB 0.0026 -0.0048 -0.0083 1206 ARG 151 CG 0.0046 -0.0053 -0.0073 1207 ARG 151 CD 0.0022 -0.0049 -0.0090 1208 ARG 151 NE 0.0034 -0.0047 -0.0073 1209 ARG 151 CZ 0.0020 -0.0045 -0.0084 1210 ARG 151 NH1 -0.0008 -0.0044 -0.0112 1211 ARG 151 NH2 0.0033 -0.0044 -0.0067 1212 PRO 152 N 0.0072 -0.0120 -0.0164 1213 PRO 152 CA 0.0036 -0.0118 -0.0198 1214 PRO 152 C -0.0024 -0.0085 -0.0197 1215 PRO 152 O -0.0046 -0.0080 -0.0211 1216 PRO 152 CB 0.0047 -0.0155 -0.0256 1217 PRO 152 CG 0.0104 -0.0181 -0.0245 1218 PRO 152 CD 0.0108 -0.0157 -0.0195 1219 GLY 153 N -0.0049 -0.0062 -0.0180 1220 GLY 153 CA -0.0106 -0.0028 -0.0177 1221 GLY 153 C -0.0115 0.0007 -0.0121 1222 GLY 153 O -0.0163 0.0037 -0.0113 1223 LYS 154 N -0.0072 0.0004 -0.0081 1224 LYS 154 CA -0.0076 0.0035 -0.0027 1225 LYS 154 C -0.0119 0.0055 -0.0032 1226 LYS 154 O -0.0162 0.0088 -0.0017 1227 LYS 154 CB -0.0089 0.0061 0.0009 1228 LYS 154 CG -0.0049 0.0042 0.0014 1229 LYS 154 CD -0.0060 0.0069 0.0055 1230 LYS 154 CE -0.0010 0.0052 0.0076 1231 LYS 154 NZ 0.0014 0.0015 0.0029 1232 PRO 155 N -0.0038 0.0073 0.0009 1233 PRO 155 CA -0.0049 0.0071 0.0004 1234 PRO 155 C -0.0046 0.0085 0.0017 1235 PRO 155 O -0.0030 0.0092 0.0028 1236 PRO 155 CB -0.0038 0.0054 -0.0010 1237 PRO 155 CG -0.0016 0.0051 -0.0006 1238 PRO 155 CD -0.0018 0.0059 0.0001 1239 LEU 156 N -0.0063 0.0089 0.0016 1240 LEU 156 CA -0.0063 0.0101 0.0027 1241 LEU 156 C -0.0058 0.0091 0.0020 1242 LEU 156 O -0.0066 0.0078 0.0005 1243 LEU 156 CB -0.0086 0.0113 0.0032 1244 LEU 156 CG -0.0092 0.0127 0.0043 1245 LEU 156 CD1 -0.0116 0.0137 0.0046 1246 LEU 156 CD2 -0.0075 0.0139 0.0059 1247 PHE 157 N -0.0045 0.0097 0.0029 1248 PHE 157 CA -0.0040 0.0090 0.0024 1249 PHE 157 C -0.0044 0.0104 0.0036 1250 PHE 157 O -0.0038 0.0118 0.0050 1251 PHE 157 CB -0.0016 0.0080 0.0021 1252 PHE 157 CG -0.0011 0.0063 0.0007 1253 PHE 157 CD1 -0.0008 0.0063 0.0007 1254 PHE 157 CD2 -0.0010 0.0048 -0.0007 1255 PHE 157 CE1 -0.0004 0.0047 -0.0006 1256 PHE 157 CE2 -0.0005 0.0033 -0.0020 1257 PHE 157 CZ -0.0002 0.0032 -0.0019 1258 HIS 158 N -0.0015 0.0060 0.0044 1259 HIS 158 CA -0.0006 0.0053 0.0031 1260 HIS 158 C -0.0008 0.0057 0.0021 1261 HIS 158 O -0.0011 0.0059 0.0026 1262 HIS 158 CB 0.0004 0.0040 0.0037 1263 HIS 158 CG 0.0008 0.0035 0.0043 1264 HIS 158 CD2 0.0008 0.0035 0.0038 1265 HIS 158 ND1 0.0012 0.0028 0.0057 1266 HIS 158 CE1 0.0014 0.0024 0.0060 1267 HIS 158 NE2 0.0013 0.0028 0.0048 1268 LEU 159 N -0.0006 0.0057 0.0006 1269 LEU 159 CA -0.0007 0.0061 -0.0005 1270 LEU 159 C 0.0003 0.0052 -0.0016 1271 LEU 159 O 0.0007 0.0047 -0.0021 1272 LEU 159 CB -0.0016 0.0072 -0.0014 1273 LEU 159 CG -0.0020 0.0078 -0.0023 1274 LEU 159 CD1 -0.0025 0.0082 -0.0012 1275 LEU 159 CD2 -0.0027 0.0088 -0.0034 1276 GLU 160 N 0.0006 0.0049 -0.0019 1277 GLU 160 CA 0.0014 0.0041 -0.0031 1278 GLU 160 C 0.0013 0.0045 -0.0038 1279 GLU 160 O 0.0006 0.0052 -0.0033 1280 GLU 160 CB 0.0025 0.0029 -0.0024 1281 GLU 160 CG 0.0025 0.0026 -0.0011 1282 GLU 160 CD 0.0034 0.0015 -0.0002 1283 GLU 160 OE1 0.0035 0.0012 0.0004 1284 GLU 160 OE2 0.0040 0.0007 -0.0002 1285 HIS 161 N 0.0067 0.0018 -0.0112 1286 HIS 161 CA 0.0078 0.0015 -0.0113 1287 HIS 161 C 0.0080 0.0003 -0.0113 1288 HIS 161 O 0.0077 -0.0001 -0.0112 1289 HIS 161 CB 0.0087 0.0023 -0.0114 1290 HIS 161 CG 0.0088 0.0033 -0.0115 1291 HIS 161 CD2 0.0083 0.0043 -0.0115 1292 HIS 161 ND1 0.0097 0.0034 -0.0116 1293 HIS 161 CE1 0.0096 0.0044 -0.0116 1294 HIS 161 NE2 0.0088 0.0049 -0.0115 1295 TYR 162 N 0.0087 -0.0002 -0.0113 1296 TYR 162 CA 0.0090 -0.0014 -0.0113 1297 TYR 162 C 0.0100 -0.0014 -0.0114 1298 TYR 162 O 0.0109 -0.0009 -0.0115 1299 TYR 162 CB 0.0093 -0.0020 -0.0113 1300 TYR 162 CG 0.0099 -0.0031 -0.0113 1301 TYR 162 CD1 0.0094 -0.0040 -0.0112 1302 TYR 162 CD2 0.0110 -0.0032 -0.0114 1303 TYR 162 CE1 0.0099 -0.0050 -0.0112 1304 TYR 162 CE2 0.0115 -0.0042 -0.0114 1305 TYR 162 CZ 0.0110 -0.0051 -0.0113 1306 TYR 162 OH 0.0115 -0.0061 -0.0113 1307 ILE 163 N 0.0099 -0.0020 -0.0113 1308 ILE 163 CA 0.0107 -0.0021 -0.0114 1309 ILE 163 C 0.0113 -0.0032 -0.0114 1310 ILE 163 O 0.0108 -0.0041 -0.0113 1311 ILE 163 CB 0.0102 -0.0021 -0.0114 1312 ILE 163 CG1 0.0091 -0.0014 -0.0113 1313 ILE 163 CG2 0.0110 -0.0016 -0.0115 1314 ILE 163 CD1 0.0085 -0.0015 -0.0112 1315 GLU 164 N 0.0233 -0.0091 -0.0092 1316 GLU 164 CA 0.0210 -0.0061 -0.0121 1317 GLU 164 C 0.0171 -0.0052 -0.0131 1318 GLU 164 O 0.0146 -0.0075 -0.0112 1319 GLU 164 CB 0.0192 -0.0066 -0.0117 1320 GLU 164 CG 0.0229 -0.0062 -0.0119 1321 GLU 164 CD 0.0209 -0.0068 -0.0114 1322 GLU 164 OE1 0.0174 -0.0052 -0.0131 1323 GLU 164 OE2 0.0228 -0.0089 -0.0095 1324 GLY 165 N 0.0166 -0.0019 -0.0161 1325 GLY 165 CA 0.0127 -0.0007 -0.0173 1326 GLY 165 C 0.0141 0.0017 -0.0194 1327 GLY 165 O 0.0181 0.0029 -0.0202 1328 LYS 166 N 0.0107 0.0025 -0.0203 1329 LYS 166 CA 0.0114 0.0048 -0.0223 1330 LYS 166 C 0.0137 0.0029 -0.0205 1331 LYS 166 O 0.0116 0.0005 -0.0185 1332 LYS 166 CB 0.0069 0.0062 -0.0239 1333 LYS 166 CG 0.0055 0.0094 -0.0268 1334 LYS 166 CD 0.0006 0.0103 -0.0279 1335 LYS 166 CE -0.0003 0.0103 -0.0279 1336 LYS 166 NZ 0.0027 0.0129 -0.0300 1337 TYR 167 N 0.0183 -0.0020 -0.0099 1338 TYR 167 CA 0.0176 -0.0022 -0.0082 1339 TYR 167 C 0.0164 -0.0036 -0.0083 1340 TYR 167 O 0.0163 -0.0040 -0.0090 1341 TYR 167 CB 0.0182 -0.0011 -0.0073 1342 TYR 167 CG 0.0176 -0.0010 -0.0054 1343 TYR 167 CD1 0.0166 -0.0019 -0.0047 1344 TYR 167 CD2 0.0181 0.0000 -0.0044 1345 TYR 167 CE1 0.0162 -0.0018 -0.0030 1346 TYR 167 CE2 0.0177 0.0001 -0.0026 1347 TYR 167 CZ 0.0167 -0.0007 -0.0020 1348 TYR 167 OH 0.0162 -0.0006 -0.0003 1349 ILE 168 N 0.0155 -0.0044 -0.0075 1350 ILE 168 CA 0.0143 -0.0058 -0.0076 1351 ILE 168 C 0.0135 -0.0061 -0.0058 1352 ILE 168 O 0.0136 -0.0055 -0.0047 1353 ILE 168 CB 0.0138 -0.0067 -0.0085 1354 ILE 168 CG1 0.0147 -0.0064 -0.0102 1355 ILE 168 CG2 0.0127 -0.0082 -0.0088 1356 ILE 168 CD1 0.0149 -0.0067 -0.0115 1357 LYS 169 N 0.0128 -0.0068 -0.0056 1358 LYS 169 CA 0.0118 -0.0073 -0.0041 1359 LYS 169 C 0.0107 -0.0088 -0.0043 1360 LYS 169 O 0.0102 -0.0097 -0.0053 1361 LYS 169 CB 0.0117 -0.0073 -0.0036 1362 LYS 169 CG 0.0127 -0.0059 -0.0032 1363 LYS 169 CD 0.0126 -0.0060 -0.0032 1364 LYS 169 CE 0.0132 -0.0048 -0.0020 1365 LYS 169 NZ 0.0145 -0.0035 -0.0023 1366 TYR 170 N 0.0094 -0.0067 -0.0030 1367 TYR 170 CA 0.0087 -0.0069 -0.0029 1368 TYR 170 C 0.0085 -0.0069 -0.0029 1369 TYR 170 O 0.0080 -0.0070 -0.0032 1370 TYR 170 CB 0.0085 -0.0070 -0.0024 1371 TYR 170 CG 0.0088 -0.0070 -0.0025 1372 TYR 170 CD1 0.0085 -0.0069 -0.0029 1373 TYR 170 CD2 0.0093 -0.0069 -0.0021 1374 TYR 170 CE1 0.0087 -0.0069 -0.0029 1375 TYR 170 CE2 0.0095 -0.0069 -0.0021 1376 TYR 170 CZ 0.0092 -0.0068 -0.0025 1377 TYR 170 OH 0.0094 -0.0068 -0.0026 1378 ASN 171 N 0.0088 -0.0070 -0.0025 1379 ASN 171 CA 0.0087 -0.0070 -0.0024 1380 ASN 171 C 0.0093 -0.0069 -0.0022 1381 ASN 171 O 0.0097 -0.0068 -0.0021 1382 ASN 171 CB 0.0082 -0.0073 -0.0019 1383 ASN 171 CG 0.0084 -0.0074 -0.0013 1384 ASN 171 ND2 0.0079 -0.0075 -0.0010 1385 ASN 171 OD1 0.0089 -0.0073 -0.0011 1386 SER 172 N 0.0092 -0.0069 -0.0023 1387 SER 172 CA 0.0097 -0.0068 -0.0021 1388 SER 172 C 0.0096 -0.0070 -0.0016 1389 SER 172 O 0.0092 -0.0072 -0.0013 1390 SER 172 CB 0.0099 -0.0066 -0.0027 1391 SER 172 OG 0.0094 -0.0067 -0.0028 1392 ASN 173 N 0.0074 -0.0013 -0.0014 1393 ASN 173 CA 0.0063 -0.0009 -0.0004 1394 ASN 173 C 0.0049 -0.0017 -0.0006 1395 ASN 173 O 0.0039 -0.0015 0.0001 1396 ASN 173 CB 0.0066 -0.0000 0.0004 1397 ASN 173 CG 0.0065 -0.0005 -0.0001 1398 ASN 173 ND2 0.0059 -0.0001 0.0006 1399 ASN 173 OD1 0.0070 -0.0012 -0.0011 1400 SER 174 N 0.0048 -0.0027 -0.0017 1401 SER 174 CA 0.0035 -0.0036 -0.0020 1402 SER 174 C 0.0032 -0.0045 -0.0028 1403 SER 174 O 0.0028 -0.0054 -0.0036 1404 SER 174 CB 0.0036 -0.0040 -0.0025 1405 SER 174 OG 0.0036 -0.0033 -0.0017 1406 GLY 175 N 0.0035 -0.0042 -0.0027 1407 GLY 175 CA 0.0031 -0.0049 -0.0033 1408 GLY 175 C 0.0042 -0.0055 -0.0044 1409 GLY 175 O 0.0039 -0.0061 -0.0049 1410 PHE 176 N 0.0110 -0.0054 -0.0083 1411 PHE 176 CA 0.0109 -0.0056 -0.0073 1412 PHE 176 C 0.0108 -0.0054 -0.0061 1413 PHE 176 O 0.0108 -0.0058 -0.0058 1414 PHE 176 CB 0.0112 -0.0069 -0.0074 1415 PHE 176 CG 0.0111 -0.0074 -0.0063 1416 PHE 176 CD1 0.0110 -0.0069 -0.0059 1417 PHE 176 CD2 0.0112 -0.0082 -0.0055 1418 PHE 176 CE1 0.0110 -0.0074 -0.0048 1419 PHE 176 CE2 0.0112 -0.0087 -0.0044 1420 PHE 176 CZ 0.0111 -0.0082 -0.0041 1421 VAL 177 N 0.0106 -0.0048 -0.0053 1422 VAL 177 CA 0.0105 -0.0046 -0.0040 1423 VAL 177 C 0.0104 -0.0048 -0.0031 1424 VAL 177 O 0.0104 -0.0043 -0.0034 1425 VAL 177 CB 0.0102 -0.0032 -0.0038 1426 VAL 177 CG1 0.0101 -0.0030 -0.0025 1427 VAL 177 CG2 0.0102 -0.0030 -0.0046 1428 ARG 178 N 0.0105 -0.0055 -0.0022 1429 ARG 178 CA 0.0104 -0.0058 -0.0012 1430 ARG 178 C 0.0102 -0.0047 -0.0004 1431 ARG 178 O 0.0101 -0.0046 0.0005 1432 ARG 178 CB 0.0106 -0.0070 -0.0005 1433 ARG 178 CG 0.0105 -0.0073 0.0004 1434 ARG 178 CD 0.0107 -0.0084 0.0012 1435 ARG 178 NE 0.0106 -0.0086 0.0023 1436 ARG 178 CZ 0.0107 -0.0094 0.0023 1437 ARG 178 NH1 0.0109 -0.0101 0.0013 1438 ARG 178 NH2 0.0107 -0.0096 0.0033 1439 ASP 179 N 0.0237 0.0087 0.0087 1440 ASP 179 CA 0.0181 0.0115 0.0101 1441 ASP 179 C 0.0066 0.0159 0.0126 1442 ASP 179 O -0.0003 0.0155 0.0136 1443 ASP 179 CB 0.0250 0.0200 0.0107 1444 ASP 180 N 0.0044 0.0202 0.0138 1445 ASP 180 CA -0.0065 0.0240 0.0162 1446 ASP 180 C -0.0149 0.0145 0.0155 1447 ASP 180 O -0.0143 0.0071 0.0140 1448 ASP 180 CB -0.0063 0.0296 0.0172 1449 ASP 180 CG 0.0005 0.0402 0.0183 1450 ASP 180 OD1 0.0098 0.0403 0.0170 1451 ASP 180 OD2 -0.0034 0.0483 0.0205 1452 ASN 181 N -0.0228 0.0147 0.0167 1453 ASN 181 CA -0.0309 0.0057 0.0162 1454 ASN 181 C -0.0248 -0.0050 0.0131 1455 ASN 181 O -0.0258 -0.0126 0.0118 1456 ASN 181 CB -0.0390 0.0049 0.0172 1457 ASN 181 CG -0.0424 0.0160 0.0199 1458 ASN 181 ND2 -0.0526 0.0190 0.0220 1459 ASN 181 OD1 -0.0360 0.0218 0.0201 1460 ILE 182 N -0.0038 -0.0119 0.0025 1461 ILE 182 CA -0.0036 -0.0123 0.0032 1462 ILE 182 C -0.0037 -0.0124 0.0025 1463 ILE 182 O -0.0040 -0.0128 0.0014 1464 ILE 182 CB -0.0033 -0.0136 0.0038 1465 ILE 182 CG1 -0.0030 -0.0139 0.0048 1466 ILE 182 CG2 -0.0035 -0.0147 0.0028 1467 ILE 182 CD1 -0.0027 -0.0144 0.0059 1468 ARG 183 N -0.0036 -0.0121 0.0031 1469 ARG 183 CA -0.0037 -0.0122 0.0025 1470 ARG 183 C -0.0035 -0.0132 0.0033 1471 ARG 183 O -0.0032 -0.0133 0.0044 1472 ARG 183 CB -0.0038 -0.0110 0.0025 1473 ARG 183 CG -0.0041 -0.0100 0.0018 1474 ARG 183 CD -0.0042 -0.0090 0.0015 1475 ARG 183 NE -0.0043 -0.0095 0.0011 1476 ARG 183 CZ -0.0043 -0.0091 0.0013 1477 ARG 183 NH1 -0.0042 -0.0080 0.0019 1478 ARG 183 NH2 -0.0043 -0.0097 0.0009 1479 LEU 184 N -0.0036 -0.0138 0.0027 1480 LEU 184 CA -0.0033 -0.0148 0.0033 1481 LEU 184 C -0.0033 -0.0144 0.0038 1482 LEU 184 O -0.0030 -0.0149 0.0047 1483 LEU 184 CB -0.0035 -0.0160 0.0024 1484 LEU 184 CG -0.0036 -0.0164 0.0017 1485 LEU 184 CD1 -0.0037 -0.0175 0.0010 1486 LEU 184 CD2 -0.0034 -0.0165 0.0026 1487 THR 185 N 0.0025 -0.0100 0.0002 1488 THR 185 CA 0.0028 -0.0097 0.0010 1489 THR 185 C 0.0030 -0.0095 0.0015 1490 THR 185 O 0.0028 -0.0095 0.0023 1491 THR 185 CB 0.0035 -0.0092 0.0008 1492 THR 185 CG2 0.0038 -0.0088 0.0016 1493 THR 185 OG1 0.0033 -0.0094 0.0004 1494 PRO 186 N 0.0033 -0.0093 0.0011 1495 PRO 186 CA 0.0034 -0.0091 0.0017 1496 PRO 186 C 0.0028 -0.0095 0.0021 1497 PRO 186 O 0.0027 -0.0094 0.0029 1498 PRO 186 CB 0.0037 -0.0089 0.0010 1499 PRO 186 CG 0.0040 -0.0088 0.0003 1500 PRO 186 CD 0.0035 -0.0092 0.0002 1501 GLN 187 N 0.0022 -0.0100 0.0017 1502 GLN 187 CA 0.0016 -0.0104 0.0021 1503 GLN 187 C 0.0013 -0.0106 0.0028 1504 GLN 187 O 0.0010 -0.0107 0.0035 1505 GLN 187 CB 0.0012 -0.0109 0.0014 1506 GLN 187 CG 0.0015 -0.0108 0.0006 1507 GLN 187 CD 0.0019 -0.0105 0.0007 1508 GLN 187 NE2 0.0024 -0.0101 0.0002 1509 GLN 187 OE1 0.0017 -0.0105 0.0013 1510 ALA 188 N 0.0006 -0.0077 0.0012 1511 ALA 188 CA 0.0003 -0.0075 0.0020 1512 ALA 188 C 0.0005 -0.0067 0.0030 1513 ALA 188 O -0.0000 -0.0065 0.0038 1514 ALA 188 CB 0.0007 -0.0076 0.0014 1515 PHE 189 N 0.0014 -0.0060 0.0028 1516 PHE 189 CA 0.0017 -0.0051 0.0037 1517 PHE 189 C 0.0010 -0.0052 0.0044 1518 PHE 189 O 0.0007 -0.0048 0.0054 1519 PHE 189 CB 0.0027 -0.0045 0.0032 1520 PHE 189 CG 0.0030 -0.0037 0.0041 1521 PHE 189 CD1 0.0031 -0.0031 0.0049 1522 PHE 189 CD2 0.0033 -0.0035 0.0040 1523 PHE 189 CE1 0.0034 -0.0023 0.0057 1524 PHE 189 CE2 0.0036 -0.0027 0.0048 1525 PHE 189 CZ 0.0036 -0.0021 0.0056 1526 SER 190 N 0.0008 -0.0057 0.0040 1527 SER 190 CA 0.0001 -0.0058 0.0047 1528 SER 190 C -0.0008 -0.0063 0.0053 1529 SER 190 O -0.0012 -0.0060 0.0063 1530 SER 190 CB 0.0000 -0.0064 0.0040 1531 SER 190 OG 0.0009 -0.0060 0.0034 1532 HIS 191 N -0.0005 -0.0058 0.0024 1533 HIS 191 CA -0.0016 -0.0054 0.0028 1534 HIS 191 C -0.0015 -0.0036 0.0035 1535 HIS 191 O -0.0027 -0.0029 0.0040 1536 HIS 191 CB -0.0012 -0.0063 0.0023 1537 HIS 191 CG -0.0026 -0.0064 0.0025 1538 HIS 191 CD2 -0.0041 -0.0057 0.0030 1539 HIS 191 ND1 -0.0026 -0.0072 0.0022 1540 HIS 191 CE1 -0.0040 -0.0071 0.0024 1541 HIS 191 NE2 -0.0050 -0.0062 0.0030 1542 PHE 192 N 0.0001 -0.0029 0.0036 1543 PHE 192 CA 0.0003 -0.0012 0.0043 1544 PHE 192 C -0.0006 -0.0003 0.0048 1545 PHE 192 O -0.0013 0.0009 0.0054 1546 PHE 192 CB 0.0022 -0.0007 0.0042 1547 PHE 192 CG 0.0026 0.0010 0.0049 1548 PHE 192 CD1 0.0028 0.0018 0.0052 1549 PHE 192 CD2 0.0028 0.0018 0.0052 1550 PHE 192 CE1 0.0031 0.0034 0.0058 1551 PHE 192 CE2 0.0032 0.0034 0.0058 1552 PHE 192 CZ 0.0033 0.0042 0.0061 1553 THR 193 N -0.0005 -0.0009 0.0046 1554 THR 193 CA -0.0014 -0.0001 0.0050 1555 THR 193 C -0.0033 -0.0003 0.0053 1556 THR 193 O -0.0042 0.0008 0.0059 1557 THR 193 CB -0.0010 -0.0008 0.0047 1558 THR 193 CG2 0.0009 -0.0004 0.0045 1559 THR 193 OG1 -0.0014 -0.0024 0.0040 1560 PHE 194 N -0.0006 -0.0007 0.0011 1561 PHE 194 CA -0.0017 -0.0007 0.0011 1562 PHE 194 C -0.0015 0.0006 0.0008 1563 PHE 194 O -0.0026 0.0014 0.0007 1564 PHE 194 CB -0.0016 -0.0022 0.0015 1565 PHE 194 CG -0.0027 -0.0023 0.0015 1566 PHE 194 CD1 -0.0042 -0.0026 0.0015 1567 PHE 194 CD2 -0.0022 -0.0020 0.0014 1568 PHE 194 CE1 -0.0052 -0.0027 0.0016 1569 PHE 194 CE2 -0.0032 -0.0021 0.0014 1570 PHE 194 CZ -0.0047 -0.0024 0.0015 1571 GLU 195 N -0.0001 0.0009 0.0008 1572 GLU 195 CA 0.0002 0.0021 0.0005 1573 GLU 195 C 0.0001 0.0036 0.0002 1574 GLU 195 O -0.0006 0.0046 -0.0001 1575 GLU 195 CB 0.0018 0.0019 0.0006 1576 GLU 195 CG 0.0019 0.0006 0.0009 1577 GLU 195 CD 0.0028 0.0009 0.0008 1578 GLU 195 OE1 0.0035 0.0022 0.0005 1579 GLU 195 OE2 0.0030 -0.0000 0.0010 1580 ARG 196 N 0.0007 0.0039 0.0001 1581 ARG 196 CA 0.0008 0.0054 -0.0002 1582 ARG 196 C -0.0008 0.0060 -0.0004 1583 ARG 196 O -0.0011 0.0073 -0.0007 1584 ARG 196 CB 0.0018 0.0054 -0.0002 1585 ARG 196 CG 0.0022 0.0069 -0.0006 1586 ARG 196 CD 0.0032 0.0078 -0.0008 1587 ARG 196 NE 0.0040 0.0090 -0.0010 1588 ARG 196 CZ 0.0035 0.0104 -0.0013 1589 ARG 196 NH1 0.0021 0.0108 -0.0014 1590 ARG 196 NH2 0.0043 0.0114 -0.0016 1591 SER 197 N -0.0051 0.0080 -0.0058 1592 SER 197 CA -0.0072 0.0087 -0.0057 1593 SER 197 C -0.0069 0.0084 -0.0055 1594 SER 197 O -0.0086 0.0089 -0.0052 1595 SER 197 CB -0.0089 0.0081 -0.0040 1596 SER 197 OG -0.0084 0.0065 -0.0023 1597 GLY 198 N -0.0050 0.0077 -0.0056 1598 GLY 198 CA -0.0047 0.0074 -0.0052 1599 GLY 198 C -0.0057 0.0062 -0.0033 1600 GLY 198 O -0.0066 0.0064 -0.0030 1601 HIS 199 N -0.0056 0.0051 -0.0019 1602 HIS 199 CA -0.0066 0.0040 0.0000 1603 HIS 199 C -0.0090 0.0046 0.0005 1604 HIS 199 O -0.0101 0.0038 0.0020 1605 HIS 199 CB -0.0057 0.0031 0.0008 1606 HIS 199 CG -0.0032 0.0024 0.0005 1607 HIS 199 CD2 -0.0019 0.0017 0.0007 1608 HIS 199 ND1 -0.0019 0.0023 -0.0002 1609 HIS 199 CE1 0.0001 0.0017 -0.0003 1610 HIS 199 NE2 0.0002 0.0012 0.0002 1611 GLN 200 N -0.0055 0.0086 0.0033 1612 GLN 200 CA -0.0071 0.0088 0.0032 1613 GLN 200 C -0.0069 0.0074 0.0035 1614 GLN 200 O -0.0084 0.0070 0.0036 1615 GLN 200 CB -0.0072 0.0108 0.0028 1616 GLN 200 CG -0.0078 0.0123 0.0025 1617 GLN 200 CD -0.0078 0.0143 0.0021 1618 GLN 200 NE2 -0.0082 0.0157 0.0019 1619 GLN 200 OE1 -0.0074 0.0146 0.0021 1620 LEU 201 N -0.0052 0.0067 0.0036 1621 LEU 201 CA -0.0049 0.0053 0.0039 1622 LEU 201 C -0.0031 0.0042 0.0041 1623 LEU 201 O -0.0018 0.0048 0.0040 1624 LEU 201 CB -0.0049 0.0063 0.0037 1625 LEU 201 CG -0.0032 0.0075 0.0035 1626 LEU 201 CD1 -0.0017 0.0064 0.0037 1627 LEU 201 CD2 -0.0038 0.0093 0.0031 1628 ILE 202 N -0.0029 0.0026 0.0044 1629 ILE 202 CA -0.0011 0.0015 0.0047 1630 ILE 202 C -0.0009 0.0007 0.0048 1631 ILE 202 O -0.0023 0.0000 0.0050 1632 ILE 202 CB -0.0012 -0.0001 0.0050 1633 ILE 202 CG1 0.0007 -0.0012 0.0052 1634 ILE 202 CG2 -0.0029 -0.0014 0.0053 1635 ILE 202 CD1 0.0009 -0.0027 0.0055 1636 VAL 203 N 0.0031 0.0011 0.0069 1637 VAL 203 CA 0.0042 0.0012 0.0064 1638 VAL 203 C 0.0043 0.0003 0.0053 1639 VAL 203 O 0.0044 0.0000 0.0050 1640 VAL 203 CB 0.0052 0.0019 0.0067 1641 VAL 203 CG1 0.0063 0.0020 0.0062 1642 VAL 203 CG2 0.0049 0.0027 0.0078 1643 VAL 204 N 0.0044 -0.0001 0.0048 1644 VAL 204 CA 0.0045 -0.0010 0.0038 1645 VAL 204 C 0.0055 -0.0009 0.0033 1646 VAL 204 O 0.0061 -0.0002 0.0037 1647 VAL 204 CB 0.0033 -0.0017 0.0035 1648 VAL 204 CG1 0.0030 -0.0017 0.0036 1649 VAL 204 CG2 0.0033 -0.0025 0.0026 1650 ASP 205 N 0.0056 -0.0017 0.0024 1651 ASP 205 CA 0.0065 -0.0017 0.0018 1652 ASP 205 C 0.0077 -0.0013 0.0017 1653 ASP 205 O 0.0085 -0.0009 0.0017 1654 ASP 205 CB 0.0066 -0.0014 0.0022 1655 ASP 205 CG 0.0066 -0.0020 0.0014 1656 ASP 205 OD1 0.0070 -0.0026 0.0006 1657 ASP 205 OD2 0.0062 -0.0019 0.0017 1658 ILE 206 N 0.0084 -0.0050 0.0016 1659 ILE 206 CA 0.0091 -0.0045 0.0011 1660 ILE 206 C 0.0098 -0.0045 -0.0001 1661 ILE 206 O 0.0096 -0.0053 -0.0009 1662 ILE 206 CB 0.0087 -0.0051 0.0008 1663 ILE 206 CG1 0.0079 -0.0052 0.0020 1664 ILE 206 CG2 0.0095 -0.0046 0.0004 1665 ILE 206 CD1 0.0082 -0.0043 0.0030 1666 GLN 207 N 0.0108 -0.0037 -0.0002 1667 GLN 207 CA 0.0115 -0.0035 -0.0012 1668 GLN 207 C 0.0125 -0.0026 -0.0013 1669 GLN 207 O 0.0126 -0.0019 -0.0004 1670 GLN 207 CB 0.0115 -0.0035 -0.0012 1671 GLN 207 CG 0.0115 -0.0028 0.0000 1672 GLN 207 CD 0.0113 -0.0029 0.0001 1673 GLN 207 NE2 0.0107 -0.0028 0.0011 1674 GLN 207 OE1 0.0117 -0.0030 -0.0007 1675 GLY 208 N 0.0132 -0.0026 -0.0024 1676 GLY 208 CA 0.0141 -0.0017 -0.0026 1677 GLY 208 C 0.0146 -0.0020 -0.0038 1678 GLY 208 O 0.0144 -0.0028 -0.0046 1679 VAL 209 N 0.0124 -0.0039 -0.0061 1680 VAL 209 CA 0.0130 -0.0040 -0.0071 1681 VAL 209 C 0.0120 -0.0040 -0.0062 1682 VAL 209 O 0.0123 -0.0034 -0.0048 1683 VAL 209 CB 0.0150 -0.0035 -0.0072 1684 VAL 209 CG1 0.0155 -0.0037 -0.0082 1685 VAL 209 CG2 0.0159 -0.0035 -0.0079 1686 GLY 210 N 0.0109 -0.0046 -0.0071 1687 GLY 210 CA 0.0099 -0.0047 -0.0064 1688 GLY 210 C 0.0087 -0.0045 -0.0049 1689 GLY 210 O 0.0075 -0.0049 -0.0051 1690 ASP 211 N 0.0090 -0.0039 -0.0034 1691 ASP 211 CA 0.0080 -0.0037 -0.0018 1692 ASP 211 C 0.0092 -0.0030 -0.0006 1693 ASP 211 O 0.0087 -0.0026 0.0010 1694 ASP 211 CB 0.0071 -0.0037 -0.0008 1695 ASP 211 CG 0.0056 -0.0044 -0.0018 1696 ASP 211 OD1 0.0047 -0.0049 -0.0025 1697 ASP 211 OD2 0.0053 -0.0045 -0.0018 1698 LEU 212 N 0.0077 -0.0020 -0.0030 1699 LEU 212 CA 0.0081 -0.0012 -0.0023 1700 LEU 212 C 0.0084 -0.0010 -0.0014 1701 LEU 212 O 0.0085 -0.0004 -0.0016 1702 LEU 212 CB 0.0082 -0.0001 -0.0030 1703 LEU 212 CG 0.0081 0.0000 -0.0034 1704 LEU 212 CD1 0.0077 -0.0009 -0.0041 1705 LEU 212 CD2 0.0083 0.0012 -0.0039 1706 TYR 213 N 0.0085 -0.0014 -0.0004 1707 TYR 213 CA 0.0088 -0.0014 0.0005 1708 TYR 213 C 0.0092 -0.0005 0.0012 1709 TYR 213 O 0.0093 -0.0002 0.0014 1710 TYR 213 CB 0.0086 -0.0025 0.0011 1711 TYR 213 CG 0.0082 -0.0035 0.0004 1712 TYR 213 CD1 0.0080 -0.0034 -0.0005 1713 TYR 213 CD2 0.0080 -0.0046 0.0007 1714 TYR 213 CE1 0.0076 -0.0043 -0.0011 1715 TYR 213 CE2 0.0076 -0.0055 0.0001 1716 TYR 213 CZ 0.0074 -0.0053 -0.0008 1717 TYR 213 OH 0.0070 -0.0062 -0.0015 1718 THR 214 N 0.0094 -0.0001 0.0018 1719 THR 214 CA 0.0099 0.0007 0.0026 1720 THR 214 C 0.0100 0.0005 0.0034 1721 THR 214 O 0.0098 0.0000 0.0031 1722 THR 214 CB 0.0100 0.0019 0.0021 1723 THR 214 CG2 0.0100 0.0023 0.0017 1724 THR 214 OG1 0.0104 0.0026 0.0030 1725 ASP 215 N 0.0075 0.0050 0.0072 1726 ASP 215 CA 0.0074 0.0051 0.0067 1727 ASP 215 C 0.0067 0.0054 0.0066 1728 ASP 215 O 0.0063 0.0056 0.0061 1729 ASP 215 CB 0.0077 0.0052 0.0059 1730 ASP 215 CG 0.0077 0.0052 0.0053 1731 ASP 215 OD1 0.0079 0.0051 0.0055 1732 ASP 215 OD2 0.0075 0.0054 0.0047 1733 PRO 216 N 0.0064 0.0054 0.0072 1734 PRO 216 CA 0.0057 0.0056 0.0072 1735 PRO 216 C 0.0057 0.0057 0.0070 1736 PRO 216 O 0.0063 0.0055 0.0069 1737 PRO 216 CB 0.0054 0.0056 0.0080 1738 PRO 216 CG 0.0060 0.0053 0.0084 1739 PRO 216 CD 0.0066 0.0052 0.0080 1740 GLN 217 N 0.0051 0.0059 0.0069 1741 GLN 217 CA 0.0050 0.0059 0.0067 1742 GLN 217 C 0.0045 0.0060 0.0072 1743 GLN 217 O 0.0040 0.0062 0.0074 1744 GLN 217 CB 0.0049 0.0061 0.0059 1745 GLN 217 CG 0.0049 0.0061 0.0057 1746 GLN 217 CD 0.0055 0.0059 0.0058 1747 GLN 217 NE2 0.0061 0.0057 0.0056 1748 GLN 217 OE1 0.0055 0.0058 0.0062 1749 ILE 218 N 0.0050 0.0089 0.0064 1750 ILE 218 CA 0.0039 0.0090 0.0074 1751 ILE 218 C 0.0023 0.0083 0.0080 1752 ILE 218 O 0.0022 0.0086 0.0085 1753 ILE 218 CB 0.0043 0.0105 0.0087 1754 ILE 218 CG1 0.0059 0.0111 0.0081 1755 ILE 218 CG2 0.0031 0.0105 0.0098 1756 ILE 218 CD1 0.0064 0.0126 0.0093 1757 HIS 219 N 0.0012 0.0073 0.0079 1758 HIS 219 CA -0.0004 0.0067 0.0086 1759 HIS 219 C -0.0012 0.0073 0.0100 1760 HIS 219 O -0.0012 0.0073 0.0100 1761 HIS 219 CB -0.0013 0.0051 0.0077 1762 HIS 219 CG -0.0006 0.0044 0.0063 1763 HIS 219 CD2 0.0000 0.0036 0.0049 1764 HIS 219 ND1 -0.0005 0.0044 0.0062 1765 HIS 219 CE1 0.0001 0.0037 0.0048 1766 HIS 219 NE2 0.0005 0.0032 0.0040 1767 THR 220 N -0.0019 0.0080 0.0113 1768 THR 220 CA -0.0026 0.0087 0.0127 1769 THR 220 C -0.0043 0.0078 0.0133 1770 THR 220 O -0.0049 0.0069 0.0128 1771 THR 220 CB -0.0020 0.0101 0.0137 1772 THR 220 CG2 -0.0002 0.0109 0.0131 1773 THR 220 OG1 -0.0024 0.0100 0.0141 1774 GLU 221 N 0.0009 0.0110 0.0110 1775 GLU 221 CA -0.0007 0.0083 0.0137 1776 GLU 221 C -0.0028 0.0094 0.0174 1777 GLU 221 O -0.0039 0.0068 0.0193 1778 GLU 221 CB -0.0006 0.0084 0.0137 1779 GLU 221 CG -0.0026 0.0067 0.0170 1780 GLU 221 CD -0.0029 0.0082 0.0174 1781 GLU 221 OE1 -0.0013 0.0096 0.0148 1782 GLU 221 OE2 -0.0046 0.0079 0.0204 1783 THR 222 N -0.0034 0.0133 0.0183 1784 THR 222 CA -0.0055 0.0147 0.0218 1785 THR 222 C -0.0056 0.0149 0.0220 1786 THR 222 O -0.0073 0.0141 0.0248 1787 THR 222 CB -0.0061 0.0188 0.0226 1788 THR 222 CG2 -0.0064 0.0184 0.0232 1789 THR 222 OG1 -0.0044 0.0216 0.0198 1790 GLY 223 N -0.0039 0.0159 0.0191 1791 GLY 223 CA -0.0040 0.0163 0.0191 1792 GLY 223 C -0.0051 0.0200 0.0210 1793 GLY 223 O -0.0056 0.0202 0.0219 1794 THR 224 N 0.0067 0.0130 0.0257 1795 THR 224 CA 0.0077 0.0148 0.0270 1796 THR 224 C 0.0082 0.0166 0.0258 1797 THR 224 O 0.0091 0.0184 0.0264 1798 THR 224 CB 0.0078 0.0142 0.0292 1799 THR 224 CG2 0.0074 0.0125 0.0306 1800 THR 224 OG1 0.0074 0.0134 0.0286 1801 ASP 225 N 0.0077 0.0163 0.0240 1802 ASP 225 CA 0.0081 0.0179 0.0228 1803 ASP 225 C 0.0079 0.0183 0.0205 1804 ASP 225 O 0.0073 0.0173 0.0198 1805 ASP 225 CB 0.0078 0.0172 0.0227 1806 ASP 225 CG 0.0068 0.0150 0.0222 1807 ASP 225 OD1 0.0064 0.0137 0.0228 1808 ASP 225 OD2 0.0064 0.0145 0.0211 1809 PHE 226 N 0.0083 0.0199 0.0193 1810 PHE 226 CA 0.0081 0.0205 0.0169 1811 PHE 226 C 0.0084 0.0214 0.0166 1812 PHE 226 O 0.0079 0.0212 0.0149 1813 PHE 226 CB 0.0070 0.0187 0.0155 1814 PHE 226 CG 0.0067 0.0180 0.0154 1815 PHE 226 CD1 0.0073 0.0194 0.0156 1816 PHE 226 CD2 0.0058 0.0159 0.0151 1817 PHE 226 CE1 0.0071 0.0188 0.0155 1818 PHE 226 CE2 0.0055 0.0153 0.0150 1819 PHE 226 CZ 0.0062 0.0167 0.0152 1820 GLY 227 N 0.0099 0.0230 0.0166 1821 GLY 227 CA 0.0107 0.0278 0.0175 1822 GLY 227 C 0.0111 0.0245 0.0196 1823 GLY 227 O 0.0112 0.0186 0.0219 1824 ASP 228 N 0.0112 0.0285 0.0188 1825 ASP 228 CA 0.0118 0.0264 0.0210 1826 ASP 228 C 0.0096 0.0226 0.0160 1827 ASP 228 O 0.0098 0.0198 0.0176 1828 ASP 228 CB 0.0132 0.0326 0.0230 1829 ASP 228 CG 0.0157 0.0353 0.0294 1830 ASP 228 OD1 0.0165 0.0314 0.0331 1831 ASP 228 OD2 0.0168 0.0413 0.0306 1832 GLY 229 N 0.0075 0.0226 0.0100 1833 GLY 229 CA 0.0054 0.0185 0.0052 1834 GLY 229 C 0.0048 0.0111 0.0058 1835 GLY 229 O 0.0033 0.0070 0.0028 1836 ASN 230 N 0.0068 0.0096 0.0083 1837 ASN 230 CA 0.0051 0.0093 0.0094 1838 ASN 230 C 0.0029 0.0077 0.0096 1839 ASN 230 O 0.0018 0.0080 0.0110 1840 ASN 230 CB 0.0051 0.0113 0.0115 1841 ASN 230 CG 0.0037 0.0112 0.0127 1842 ASN 230 ND2 0.0040 0.0130 0.0143 1843 ASN 230 OD1 0.0025 0.0097 0.0121 1844 LEU 231 N 0.0023 0.0059 0.0082 1845 LEU 231 CA 0.0002 0.0042 0.0083 1846 LEU 231 C -0.0016 0.0040 0.0097 1847 LEU 231 O -0.0035 0.0026 0.0097 1848 LEU 231 CB 0.0003 0.0022 0.0061 1849 LEU 231 CG 0.0020 0.0021 0.0045 1850 LEU 231 CD1 0.0021 0.0002 0.0024 1851 LEU 231 CD2 0.0013 0.0023 0.0052 1852 GLY 232 N -0.0011 0.0055 0.0109 1853 GLY 232 CA -0.0027 0.0056 0.0123 1854 GLY 232 C -0.0035 0.0040 0.0113 1855 GLY 232 O -0.0023 0.0033 0.0096 1856 VAL 233 N -0.0017 0.0009 0.0051 1857 VAL 233 CA -0.0025 0.0008 0.0049 1858 VAL 233 C -0.0026 0.0006 0.0040 1859 VAL 233 O -0.0029 0.0006 0.0037 1860 VAL 233 CB -0.0033 0.0008 0.0053 1861 VAL 233 CG1 -0.0032 0.0010 0.0062 1862 VAL 233 CG2 -0.0033 0.0008 0.0050 1863 ARG 234 N -0.0023 0.0005 0.0035 1864 ARG 234 CA -0.0023 0.0004 0.0026 1865 ARG 234 C -0.0018 0.0003 0.0023 1866 ARG 234 O -0.0022 0.0002 0.0019 1867 ARG 234 CB -0.0019 0.0003 0.0021 1868 ARG 234 CG -0.0025 0.0003 0.0022 1869 ARG 234 CD -0.0021 0.0002 0.0017 1870 ARG 234 NE -0.0013 0.0003 0.0021 1871 ARG 234 CZ -0.0005 0.0003 0.0017 1872 ARG 234 NH1 -0.0004 0.0001 0.0010 1873 ARG 234 NH2 0.0002 0.0004 0.0021 1874 GLY 235 N -0.0011 0.0004 0.0027 1875 GLY 235 CA -0.0006 0.0004 0.0025 1876 GLY 235 C -0.0011 0.0004 0.0028 1877 GLY 235 O -0.0012 0.0004 0.0023 1878 MET 236 N -0.0002 -0.0009 0.0022 1879 MET 236 CA -0.0004 -0.0009 0.0022 1880 MET 236 C -0.0010 -0.0017 0.0016 1881 MET 236 O -0.0007 -0.0019 0.0011 1882 MET 236 CB -0.0009 -0.0005 0.0031 1883 MET 236 CG -0.0004 0.0002 0.0037 1884 MET 236 SD -0.0011 0.0007 0.0048 1885 MET 236 CE -0.0003 0.0016 0.0054 1886 ALA 237 N -0.0017 -0.0020 0.0016 1887 ALA 237 CA -0.0023 -0.0027 0.0010 1888 ALA 237 C -0.0017 -0.0031 0.0001 1889 ALA 237 O -0.0017 -0.0035 -0.0004 1890 ALA 237 CB -0.0031 -0.0030 0.0011 1891 LEU 238 N -0.0010 -0.0030 -0.0001 1892 LEU 238 CA -0.0004 -0.0034 -0.0009 1893 LEU 238 C 0.0002 -0.0033 -0.0011 1894 LEU 238 O 0.0004 -0.0037 -0.0019 1895 LEU 238 CB 0.0002 -0.0032 -0.0010 1896 LEU 238 CG -0.0003 -0.0034 -0.0010 1897 LEU 238 CD1 0.0004 -0.0031 -0.0011 1898 LEU 238 CD2 -0.0008 -0.0042 -0.0017 1899 PHE 239 N 0.0018 -0.0052 -0.0018 1900 PHE 239 CA 0.0010 -0.0053 -0.0011 1901 PHE 239 C 0.0004 -0.0047 -0.0010 1902 PHE 239 O -0.0002 -0.0042 -0.0009 1903 PHE 239 CB 0.0011 -0.0062 -0.0005 1904 PHE 239 CG 0.0003 -0.0064 0.0002 1905 PHE 239 CD1 0.0001 -0.0065 0.0004 1906 PHE 239 CD2 -0.0002 -0.0064 0.0006 1907 PHE 239 CE1 -0.0005 -0.0066 0.0011 1908 PHE 239 CE2 -0.0009 -0.0065 0.0012 1909 PHE 239 CZ -0.0010 -0.0066 0.0015 1910 PHE 240 N 0.0005 -0.0047 -0.0011 1911 PHE 240 CA -0.0002 -0.0042 -0.0009 1912 PHE 240 C -0.0004 -0.0032 -0.0014 1913 PHE 240 O -0.0010 -0.0028 -0.0012 1914 PHE 240 CB -0.0001 -0.0045 -0.0008 1915 PHE 240 CG -0.0002 -0.0053 -0.0001 1916 PHE 240 CD1 -0.0009 -0.0053 0.0005 1917 PHE 240 CD2 0.0004 -0.0060 -0.0002 1918 PHE 240 CE1 -0.0011 -0.0060 0.0011 1919 PHE 240 CE2 0.0003 -0.0067 0.0004 1920 PHE 240 CZ -0.0005 -0.0067 0.0011 1921 TYR 241 N 0.0001 -0.0030 -0.0020 1922 TYR 241 CA -0.0001 -0.0021 -0.0024 1923 TYR 241 C -0.0006 -0.0018 -0.0021 1924 TYR 241 O -0.0011 -0.0011 -0.0023 1925 TYR 241 CB 0.0007 -0.0019 -0.0031 1926 TYR 241 CG 0.0006 -0.0010 -0.0036 1927 TYR 241 CD1 0.0004 -0.0004 -0.0040 1928 TYR 241 CD2 0.0006 -0.0008 -0.0038 1929 TYR 241 CE1 0.0003 0.0004 -0.0044 1930 TYR 241 CE2 0.0004 0.0000 -0.0042 1931 TYR 241 CZ 0.0003 0.0006 -0.0045 1932 TYR 241 OH 0.0002 0.0014 -0.0050 1933 SER 242 N 0.0005 -0.0062 -0.0008 1934 SER 242 CA -0.0002 -0.0056 -0.0020 1935 SER 242 C -0.0012 -0.0063 -0.0017 1936 SER 242 O -0.0020 -0.0059 -0.0027 1937 SER 242 CB 0.0012 -0.0045 -0.0024 1938 SER 242 OG 0.0024 -0.0039 -0.0024 1939 HIS 243 N -0.0012 -0.0073 -0.0005 1940 HIS 243 CA -0.0021 -0.0079 -0.0001 1941 HIS 243 C -0.0038 -0.0085 -0.0005 1942 HIS 243 O -0.0043 -0.0092 0.0001 1943 HIS 243 CB -0.0015 -0.0088 0.0014 1944 HIS 243 CG -0.0023 -0.0096 0.0018 1945 HIS 243 CD2 -0.0032 -0.0107 0.0026 1946 HIS 243 ND1 -0.0024 -0.0092 0.0012 1947 HIS 243 CE1 -0.0032 -0.0100 0.0017 1948 HIS 243 NE2 -0.0038 -0.0110 0.0026 1949 ALA 244 N -0.0048 -0.0083 -0.0014 1950 ALA 244 CA -0.0065 -0.0089 -0.0017 1951 ALA 244 C -0.0069 -0.0097 -0.0010 1952 ALA 244 O -0.0068 -0.0092 -0.0015 1953 ALA 244 CB -0.0073 -0.0081 -0.0032 1954 CYS 245 N -0.0063 -0.0155 0.0006 1955 CYS 245 CA -0.0063 -0.0154 0.0004 1956 CYS 245 C -0.0063 -0.0155 0.0004 1957 CYS 245 O -0.0061 -0.0155 0.0005 1958 CYS 245 CB -0.0062 -0.0155 0.0003 1959 CYS 245 SG -0.0063 -0.0154 0.0002 1960 ASN 246 N -0.0064 -0.0154 0.0003 1961 ASN 246 CA -0.0063 -0.0154 0.0003 1962 ASN 246 C -0.0063 -0.0154 0.0001 1963 ASN 246 O -0.0062 -0.0154 0.0000 1964 ASN 246 CB -0.0065 -0.0154 0.0003 1965 ASN 246 CG -0.0066 -0.0153 0.0002 1966 ASN 246 ND2 -0.0068 -0.0153 0.0003 1967 ASN 246 OD1 -0.0066 -0.0153 0.0001 1968 ARG 247 N -0.0062 -0.0154 0.0001 1969 ARG 247 CA -0.0062 -0.0154 -0.0001 1970 ARG 247 C -0.0063 -0.0153 -0.0002 1971 ARG 247 O -0.0062 -0.0153 -0.0004 1972 ARG 247 CB -0.0061 -0.0154 -0.0001 1973 ARG 247 CG -0.0062 -0.0154 -0.0000 1974 ARG 247 CD -0.0062 -0.0154 -0.0001 1975 ARG 247 NE -0.0063 -0.0154 0.0000 1976 ARG 247 CZ -0.0063 -0.0154 0.0002 1977 ARG 247 NH1 -0.0061 -0.0155 0.0003 1978 ARG 247 NH2 -0.0064 -0.0154 0.0002 1979 ILE 248 N -0.0038 -0.0115 0.0003 1980 ILE 248 CA -0.0034 -0.0104 0.0013 1981 ILE 248 C -0.0046 -0.0101 0.0023 1982 ILE 248 O -0.0047 -0.0093 0.0033 1983 ILE 248 CB -0.0023 -0.0100 0.0010 1984 ILE 248 CG1 -0.0011 -0.0103 -0.0001 1985 ILE 248 CG2 -0.0017 -0.0087 0.0020 1986 ILE 248 CD1 0.0000 -0.0099 -0.0004 1987 CYS 249 N -0.0055 -0.0108 0.0021 1988 CYS 249 CA -0.0068 -0.0107 0.0031 1989 CYS 249 C -0.0076 -0.0107 0.0036 1990 CYS 249 O -0.0081 -0.0100 0.0046 1991 CYS 249 CB -0.0077 -0.0117 0.0026 1992 CYS 249 SG -0.0070 -0.0118 0.0020 1993 GLU 250 N -0.0076 -0.0114 0.0028 1994 GLU 250 CA -0.0084 -0.0115 0.0032 1995 GLU 250 C -0.0077 -0.0105 0.0038 1996 GLU 250 O -0.0083 -0.0102 0.0046 1997 GLU 250 CB -0.0087 -0.0125 0.0022 1998 GLU 250 CG -0.0095 -0.0135 0.0016 1999 GLU 250 CD -0.0093 -0.0145 0.0004 2000 GLU 250 OE1 -0.0084 -0.0144 -0.0000 2001 GLU 250 OE2 -0.0099 -0.0154 -0.0001 2002 SER 251 N -0.0067 -0.0072 0.0012 2003 SER 251 CA -0.0057 -0.0061 0.0022 2004 SER 251 C -0.0057 -0.0048 0.0042 2005 SER 251 O -0.0053 -0.0039 0.0054 2006 SER 251 CB -0.0035 -0.0058 0.0011 2007 SER 251 OG -0.0023 -0.0052 0.0012 2008 MET 252 N -0.0060 -0.0047 0.0046 2009 MET 252 CA -0.0060 -0.0036 0.0065 2010 MET 252 C -0.0082 -0.0039 0.0076 2011 MET 252 O -0.0084 -0.0030 0.0091 2012 MET 252 CB -0.0046 -0.0030 0.0063 2013 MET 252 CG -0.0024 -0.0025 0.0056 2014 MET 252 SD -0.0007 -0.0017 0.0056 2015 MET 252 CE 0.0018 -0.0010 0.0049 2016 GLY 253 N -0.0098 -0.0050 0.0069 2017 GLY 253 CA -0.0119 -0.0053 0.0079 2018 GLY 253 C -0.0126 -0.0057 0.0078 2019 GLY 253 O -0.0141 -0.0056 0.0091 2020 LEU 254 N -0.0049 -0.0064 0.0004 2021 LEU 254 CA -0.0042 -0.0062 -0.0001 2022 LEU 254 C -0.0046 -0.0057 -0.0005 2023 LEU 254 O -0.0052 -0.0053 -0.0009 2024 LEU 254 CB -0.0037 -0.0059 -0.0005 2025 LEU 254 CG -0.0033 -0.0063 -0.0001 2026 LEU 254 CD1 -0.0027 -0.0061 -0.0005 2027 LEU 254 CD2 -0.0028 -0.0069 0.0005 2028 ALA 255 N -0.0044 -0.0058 -0.0005 2029 ALA 255 CA -0.0048 -0.0053 -0.0009 2030 ALA 255 C -0.0044 -0.0048 -0.0017 2031 ALA 255 O -0.0036 -0.0049 -0.0018 2032 ALA 255 CB -0.0046 -0.0056 -0.0007 2033 PRO 256 N -0.0049 -0.0043 -0.0022 2034 PRO 256 CA -0.0045 -0.0038 -0.0029 2035 PRO 256 C -0.0039 -0.0038 -0.0031 2036 PRO 256 O -0.0040 -0.0039 -0.0028 2037 PRO 256 CB -0.0053 -0.0033 -0.0033 2038 PRO 256 CG -0.0060 -0.0036 -0.0028 2039 PRO 256 CD -0.0058 -0.0042 -0.0021 2040 PHE 257 N 0.0008 -0.0017 -0.0045 2041 PHE 257 CA 0.0013 -0.0016 -0.0045 2042 PHE 257 C 0.0015 -0.0013 -0.0044 2043 PHE 257 O 0.0013 -0.0010 -0.0043 2044 PHE 257 CB 0.0012 -0.0013 -0.0044 2045 PHE 257 CG 0.0017 -0.0013 -0.0044 2046 PHE 257 CD1 0.0019 -0.0017 -0.0045 2047 PHE 257 CD2 0.0020 -0.0009 -0.0042 2048 PHE 257 CE1 0.0024 -0.0016 -0.0045 2049 PHE 257 CE2 0.0024 -0.0009 -0.0042 2050 PHE 257 CZ 0.0026 -0.0012 -0.0043 2051 ASP 258 N 0.0020 -0.0014 -0.0044 2052 ASP 258 CA 0.0022 -0.0011 -0.0043 2053 ASP 258 C 0.0024 -0.0007 -0.0042 2054 ASP 258 O 0.0027 -0.0006 -0.0041 2055 ASP 258 CB 0.0027 -0.0014 -0.0044 2056 ASP 258 CG 0.0026 -0.0018 -0.0045 2057 ASP 258 OD1 0.0024 -0.0017 -0.0045 2058 ASP 258 OD2 0.0026 -0.0022 -0.0047 2059 LEU 259 N 0.0021 -0.0003 -0.0040 2060 LEU 259 CA 0.0022 0.0001 -0.0039 2061 LEU 259 C 0.0024 0.0004 -0.0038 2062 LEU 259 O 0.0024 0.0003 -0.0038 2063 LEU 259 CB 0.0017 0.0004 -0.0038 2064 LEU 259 CG 0.0015 0.0003 -0.0038 2065 LEU 259 CD1 0.0011 0.0006 -0.0037 2066 LEU 259 CD2 0.0019 0.0003 -0.0038 2067 SER 260 N 0.0064 0.0011 -0.0074 2068 SER 260 CA 0.0075 0.0012 -0.0066 2069 SER 260 C 0.0070 0.0016 -0.0065 2070 SER 260 O 0.0058 0.0020 -0.0067 2071 SER 260 CB 0.0081 0.0019 -0.0054 2072 SER 260 OG 0.0073 0.0029 -0.0047 2073 PRO 261 N 0.0079 0.0014 -0.0061 2074 PRO 261 CA 0.0074 0.0018 -0.0059 2075 PRO 261 C 0.0065 0.0030 -0.0051 2076 PRO 261 O 0.0054 0.0033 -0.0055 2077 PRO 261 CB 0.0088 0.0016 -0.0053 2078 PRO 261 CG 0.0098 0.0007 -0.0058 2079 PRO 261 CD 0.0094 0.0008 -0.0059 2080 ARG 262 N 0.0068 0.0036 -0.0041 2081 ARG 262 CA 0.0059 0.0047 -0.0034 2082 ARG 262 C 0.0045 0.0049 -0.0041 2083 ARG 262 O 0.0034 0.0054 -0.0041 2084 ARG 262 CB 0.0065 0.0053 -0.0023 2085 ARG 262 CG 0.0079 0.0053 -0.0015 2086 ARG 262 CD 0.0076 0.0063 -0.0004 2087 ARG 262 NE 0.0071 0.0072 0.0004 2088 ARG 262 CZ 0.0079 0.0075 0.0012 2089 ARG 262 NH1 0.0093 0.0070 0.0015 2090 ARG 262 NH2 0.0074 0.0084 0.0019 2091 GLU 263 N 0.0024 0.0041 -0.0055 2092 GLU 263 CA 0.0014 0.0035 -0.0058 2093 GLU 263 C -0.0001 0.0028 -0.0061 2094 GLU 263 O -0.0013 0.0030 -0.0062 2095 GLU 263 CB 0.0024 0.0024 -0.0060 2096 GLU 263 CG 0.0039 0.0030 -0.0057 2097 GLU 263 CD 0.0050 0.0018 -0.0059 2098 GLU 263 OE1 0.0048 0.0005 -0.0063 2099 GLU 263 OE2 0.0062 0.0021 -0.0057 2100 ARG 264 N 0.0001 0.0020 -0.0063 2101 ARG 264 CA -0.0012 0.0012 -0.0067 2102 ARG 264 C -0.0025 0.0023 -0.0065 2103 ARG 264 O -0.0039 0.0021 -0.0067 2104 ARG 264 CB -0.0007 0.0002 -0.0069 2105 ARG 264 CG -0.0020 -0.0008 -0.0073 2106 ARG 264 CD -0.0025 -0.0019 -0.0077 2107 ARG 264 NE -0.0013 -0.0029 -0.0078 2108 ARG 264 CZ -0.0012 -0.0044 -0.0082 2109 ARG 264 NH1 -0.0023 -0.0050 -0.0085 2110 ARG 264 NH2 0.0000 -0.0052 -0.0083 2111 ASP 265 N -0.0020 0.0036 -0.0061 2112 ASP 265 CA -0.0031 0.0048 -0.0059 2113 ASP 265 C -0.0038 0.0056 -0.0058 2114 ASP 265 O -0.0052 0.0060 -0.0058 2115 ASP 265 CB -0.0024 0.0059 -0.0055 2116 ASP 265 CG -0.0019 0.0051 -0.0057 2117 ASP 265 OD1 -0.0028 0.0042 -0.0060 2118 ASP 265 OD2 -0.0007 0.0055 -0.0054 2119 ALA 266 N -0.0039 0.0026 -0.0050 2120 ALA 266 CA -0.0042 0.0018 -0.0048 2121 ALA 266 C -0.0053 -0.0003 -0.0040 2122 ALA 266 O -0.0062 -0.0007 -0.0032 2123 ALA 266 CB -0.0027 0.0014 -0.0063 2124 VAL 267 N -0.0052 -0.0016 -0.0043 2125 VAL 267 CA -0.0063 -0.0035 -0.0035 2126 VAL 267 C -0.0078 -0.0032 -0.0021 2127 VAL 267 O -0.0089 -0.0044 -0.0011 2128 VAL 267 CB -0.0054 -0.0054 -0.0045 2129 VAL 267 CG1 -0.0040 -0.0059 -0.0059 2130 VAL 267 CG2 -0.0050 -0.0048 -0.0048 2131 ASN 268 N -0.0078 -0.0015 -0.0019 2132 ASN 268 CA -0.0092 -0.0009 -0.0005 2133 ASN 268 C -0.0103 0.0003 0.0006 2134 ASN 268 O -0.0117 0.0004 0.0019 2135 ASN 268 CB -0.0088 0.0004 -0.0007 2136 ASN 268 CG -0.0082 -0.0009 -0.0014 2137 ASN 268 ND2 -0.0073 0.0002 -0.0021 2138 ASN 268 OD1 -0.0086 -0.0028 -0.0013 2139 GLN 269 N -0.0096 -0.0028 0.0029 2140 GLN 269 CA -0.0103 -0.0018 0.0033 2141 GLN 269 C -0.0109 -0.0036 0.0051 2142 GLN 269 O -0.0120 -0.0027 0.0060 2143 GLN 269 CB -0.0091 -0.0013 0.0014 2144 GLN 269 CG -0.0077 -0.0035 0.0009 2145 GLN 269 CD -0.0064 -0.0029 -0.0011 2146 GLN 269 NE2 -0.0055 -0.0045 -0.0014 2147 GLN 269 OE1 -0.0062 -0.0011 -0.0025 2148 ASN 270 N -0.0103 -0.0059 0.0055 2149 ASN 270 CA -0.0109 -0.0076 0.0072 2150 ASN 270 C -0.0121 -0.0083 0.0092 2151 ASN 270 O -0.0122 -0.0102 0.0105 2152 ASN 270 CB -0.0094 -0.0098 0.0065 2153 ASN 270 CG -0.0081 -0.0109 0.0056 2154 ASN 270 ND2 -0.0068 -0.0102 0.0035 2155 ASN 270 OD1 -0.0083 -0.0123 0.0066 2156 THR 271 N -0.0129 -0.0068 0.0095 2157 THR 271 CA -0.0141 -0.0074 0.0113 2158 THR 271 C -0.0157 -0.0073 0.0133 2159 THR 271 O -0.0164 -0.0086 0.0150 2160 THR 271 CB -0.0146 -0.0058 0.0111 2161 THR 271 CG2 -0.0132 -0.0067 0.0098 2162 THR 271 OG1 -0.0149 -0.0034 0.0101 2163 LYS 272 N -0.0094 -0.0076 0.0119 2164 LYS 272 CA -0.0102 -0.0077 0.0137 2165 LYS 272 C -0.0111 -0.0095 0.0141 2166 LYS 272 O -0.0118 -0.0100 0.0152 2167 LYS 272 CB -0.0102 -0.0064 0.0146 2168 LEU 273 N -0.0110 -0.0104 0.0133 2169 LEU 273 CA -0.0118 -0.0122 0.0135 2170 LEU 273 C -0.0119 -0.0133 0.0128 2171 LEU 273 O -0.0127 -0.0146 0.0135 2172 LEU 273 CB -0.0117 -0.0129 0.0127 2173 LEU 274 N -0.0111 -0.0129 0.0114 2174 LEU 274 CA -0.0112 -0.0139 0.0108 2175 LEU 274 C -0.0117 -0.0136 0.0120 2176 LEU 274 O -0.0121 -0.0148 0.0121 2177 LEU 274 CB -0.0102 -0.0132 0.0091 2178 LEU 274 CG -0.0099 -0.0145 0.0075 2179 LEU 274 CD1 -0.0099 -0.0150 0.0072 2180 LEU 274 CD2 -0.0090 -0.0138 0.0060 2181 GLN 275 N -0.0102 -0.0108 0.0143 2182 GLN 275 CA -0.0085 -0.0098 0.0152 2183 GLN 275 C -0.0093 -0.0114 0.0176 2184 GLN 275 O -0.0085 -0.0109 0.0179 2185 GLN 275 CB -0.0059 -0.0081 0.0165 2186 GLN 275 CG -0.0040 -0.0059 0.0150 2187 GLN 275 CD -0.0038 -0.0059 0.0154 2188 GLN 275 NE2 -0.0040 -0.0051 0.0129 2189 GLN 275 OE1 -0.0036 -0.0066 0.0179 2190 SER 276 N -0.0107 -0.0132 0.0192 2191 SER 276 CA -0.0116 -0.0148 0.0215 2192 SER 276 C -0.0141 -0.0165 0.0202 2193 SER 276 O -0.0152 -0.0181 0.0219 2194 SER 276 CB -0.0117 -0.0160 0.0241 2195 SER 276 OG -0.0121 -0.0173 0.0266 2196 ALA 277 N -0.0149 -0.0160 0.0172 2197 ALA 277 CA -0.0173 -0.0175 0.0159 2198 ALA 277 C -0.0170 -0.0174 0.0162 2199 ALA 277 O -0.0150 -0.0158 0.0165 2200 ALA 277 CB -0.0181 -0.0169 0.0125 2201 LYS 278 N -0.0208 -0.0147 0.0115 2202 LYS 278 CA -0.0202 -0.0111 0.0036 2203 LYS 278 C -0.0205 -0.0075 -0.0032 2204 LYS 278 O -0.0181 -0.0056 -0.0105 2205 LYS 278 CB -0.0263 -0.0068 0.0045 2206 LYS 278 CG -0.0275 -0.0098 0.0122 2207 ILE 280 N -0.0012 -0.0001 -0.0191 2208 ILE 280 CA -0.0004 -0.0065 -0.0216 2209 ILE 280 C -0.0006 -0.0054 -0.0206 2210 ILE 280 O -0.0010 0.0007 -0.0211 2211 ILE 280 CB 0.0006 -0.0083 -0.0296 2212 ILE 280 CG1 0.0009 -0.0037 -0.0348 2213 ILE 280 CG2 0.0007 -0.0070 -0.0311 2214 ILE 280 CD1 0.0019 -0.0052 -0.0427 2215 LEU 281 N -0.0004 -0.0112 -0.0190 2216 LEU 281 CA -0.0005 -0.0109 -0.0178 2217 LEU 281 C 0.0003 -0.0113 -0.0250 2218 LEU 281 O 0.0011 -0.0147 -0.0301 2219 LEU 281 CB -0.0007 -0.0171 -0.0129 2220 LEU 281 CG -0.0016 -0.0168 -0.0052 2221 LEU 281 CD1 -0.0015 -0.0237 -0.0011 2222 LEU 281 CD2 -0.0025 -0.0102 -0.0013 2223 ARG 282 N 0.0001 -0.0077 -0.0252 2224 ARG 282 CA 0.0008 -0.0077 -0.0315 2225 ARG 282 C 0.0011 -0.0133 -0.0309 2226 ARG 282 O 0.0020 -0.0165 -0.0363 2227 ARG 282 CB 0.0004 -0.0002 -0.0326 2228 GLY 283 N 0.0022 -0.0057 -0.0079 2229 GLY 283 CA -0.0008 -0.0067 -0.0045 2230 GLY 283 C 0.0001 -0.0037 0.0002 2231 GLY 283 O -0.0026 -0.0044 0.0036 2232 THR 284 N 0.0037 -0.0005 0.0004 2233 THR 284 CA 0.0048 0.0025 0.0047 2234 THR 284 C 0.0037 0.0030 0.0076 2235 THR 284 O 0.0046 0.0055 0.0113 2236 THR 284 CB 0.0092 0.0059 0.0037 2237 THR 284 CG2 0.0105 0.0053 0.0001 2238 THR 284 OG1 0.0113 0.0069 0.0019 2239 GLU 285 N 0.0017 0.0005 0.0061 2240 GLU 285 CA 0.0005 0.0007 0.0087 2241 GLU 285 C -0.0027 0.0001 0.0132 2242 GLU 285 O -0.0058 -0.0027 0.0130 2243 GLU 285 CB -0.0008 -0.0019 0.0057 2244 GLU 285 CG 0.0024 -0.0010 0.0016 2245 GLU 285 CD 0.0036 -0.0019 -0.0025 2246 GLU 285 OE1 0.0010 -0.0045 -0.0033 2247 GLU 285 OE2 0.0070 -0.0002 -0.0051 2248 GLU 286 N -0.0013 0.0095 0.0130 2249 GLU 286 CA -0.0027 0.0098 0.0145 2250 GLU 286 C -0.0035 0.0101 0.0124 2251 GLU 286 O -0.0026 0.0101 0.0098 2252 GLU 286 CB -0.0008 0.0091 0.0170 2253 GLU 286 CG 0.0001 0.0088 0.0193 2254 GLU 286 CD 0.0017 0.0082 0.0218 2255 GLU 286 OE1 0.0030 0.0079 0.0214 2256 GLU 286 OE2 0.0017 0.0080 0.0242 2257 LYS 287 N -0.0051 0.0104 0.0135 2258 LYS 287 CA -0.0060 0.0108 0.0117 2259 LYS 287 C -0.0038 0.0102 0.0118 2260 LYS 287 O -0.0023 0.0097 0.0140 2261 LYS 287 CB -0.0090 0.0114 0.0128 2262 CYS 288 N -0.0037 0.0104 0.0094 2263 CYS 288 CA -0.0017 0.0099 0.0092 2264 CYS 288 C -0.0021 0.0098 0.0118 2265 CYS 288 O -0.0034 0.0102 0.0114 2266 CYS 288 CB -0.0021 0.0102 0.0063 2267 CYS 288 SG 0.0008 0.0096 0.0053 2268 HIS 426 N -0.0249 0.0141 -0.0419 2269 HIS 426 CA -0.0159 0.0177 -0.0386 2270 HIS 426 C -0.0071 0.0237 -0.0374 2271 HIS 426 O 0.0014 0.0253 -0.0328 2272 HIS 426 CB -0.0174 0.0234 -0.0442 2273 LEU 427 N -0.0093 0.0270 -0.0415 2274 LEU 427 CA -0.0016 0.0327 -0.0408 2275 LEU 427 C 0.0014 0.0263 -0.0336 2276 LEU 427 O -0.0045 0.0217 -0.0340 2277 LEU 427 CB -0.0053 0.0393 -0.0487 2278 LEU 427 CG 0.0026 0.0479 -0.0501 2279 LEU 427 CD1 0.0092 0.0538 -0.0503 2280 LEU 427 CD2 -0.0022 0.0537 -0.0580 2281 PRO 428 N 0.0103 0.0258 -0.0270 2282 PRO 428 CA 0.0131 0.0192 -0.0198 2283 PRO 428 C 0.0148 0.0222 -0.0210 2284 PRO 428 O 0.0176 0.0305 -0.0257 2285 PRO 428 CB 0.0227 0.0193 -0.0132 2286 PRO 428 CG 0.0270 0.0288 -0.0179 2287 PRO 428 CD 0.0183 0.0312 -0.0258 2288 ARG 429 N 0.0016 0.0060 -0.0095 2289 ARG 429 CA 0.0016 0.0042 -0.0086 2290 ARG 429 C 0.0026 0.0025 -0.0087 2291 ARG 429 O 0.0027 0.0026 -0.0089 2292 ARG 429 CB 0.0000 0.0041 -0.0068 2293 ARG 429 CG -0.0010 0.0054 -0.0064 2294 ARG 429 CD -0.0025 0.0051 -0.0046 2295 ARG 429 NE -0.0035 0.0065 -0.0042 2296 ARG 429 CZ -0.0049 0.0066 -0.0027 2297 ARG 429 NH1 -0.0055 0.0054 -0.0015 2298 ARG 429 NH2 -0.0059 0.0080 -0.0025 2299 ALA 430 N 0.0033 0.0009 -0.0086 2300 ALA 430 CA 0.0043 -0.0009 -0.0087 2301 ALA 430 C 0.0033 -0.0020 -0.0070 2302 ALA 430 O 0.0021 -0.0018 -0.0058 2303 ALA 430 CB 0.0055 -0.0022 -0.0093 2304 SER 431 N 0.0039 -0.0032 -0.0070 2305 SER 431 CA 0.0031 -0.0042 -0.0055 2306 SER 431 C 0.0035 -0.0063 -0.0047 2307 SER 431 O 0.0029 -0.0073 -0.0035 2308 SER 431 CB 0.0035 -0.0043 -0.0059 2309 SER 431 OG 0.0033 -0.0025 -0.0067 2310 ALA 432 N -0.0028 -0.0026 -0.0111 2311 ALA 432 CA -0.0014 -0.0036 -0.0103 2312 ALA 432 C 0.0008 -0.0049 -0.0089 2313 ALA 432 O 0.0011 -0.0060 -0.0091 2314 ALA 432 CB -0.0022 -0.0054 -0.0120 2315 VAL 433 N 0.0023 -0.0047 -0.0073 2316 VAL 433 CA 0.0044 -0.0059 -0.0058 2317 VAL 433 C 0.0051 -0.0088 -0.0067 2318 VAL 433 O 0.0063 -0.0100 -0.0062 2319 VAL 433 CB 0.0058 -0.0049 -0.0040 2320 VAL 433 CG1 0.0080 -0.0061 -0.0024 2321 VAL 433 CG2 0.0052 -0.0020 -0.0030 2322 ALA 434 N 0.0042 -0.0099 -0.0081 2323 ALA 434 CA 0.0048 -0.0126 -0.0090 2324 ALA 434 C 0.0041 -0.0137 -0.0103 2325 ALA 434 O 0.0053 -0.0155 -0.0100 2326 ALA 434 CB 0.0039 -0.0134 -0.0103 2327 LEU 435 N 0.0039 -0.0144 -0.0153 2328 LEU 435 CA 0.0037 -0.0126 -0.0161 2329 LEU 435 C 0.0033 -0.0107 -0.0133 2330 LEU 435 O 0.0032 -0.0102 -0.0128 2331 LEU 435 CB 0.0038 -0.0106 -0.0189 2332 LEU 435 CG 0.0042 -0.0124 -0.0217 2333 LEU 435 CD1 0.0043 -0.0103 -0.0244 2334 LEU 435 CD2 0.0046 -0.0149 -0.0226 2335 GLU 436 N 0.0030 -0.0097 -0.0114 2336 GLU 436 CA 0.0026 -0.0078 -0.0088 2337 GLU 436 C 0.0026 -0.0098 -0.0063 2338 GLU 436 O 0.0023 -0.0087 -0.0047 2339 GLU 436 CB 0.0023 -0.0061 -0.0075 2340 GLU 436 CG 0.0019 -0.0042 -0.0047 2341 GLU 436 CD 0.0016 -0.0012 -0.0054 2342 GLU 436 OE1 0.0018 -0.0008 -0.0081 2343 GLU 436 OE2 0.0013 0.0007 -0.0033 2344 VAL 437 N 0.0028 -0.0126 -0.0058 2345 VAL 437 CA 0.0028 -0.0146 -0.0035 2346 VAL 437 C 0.0030 -0.0156 -0.0048 2347 VAL 437 O 0.0029 -0.0159 -0.0030 2348 VAL 437 CB 0.0030 -0.0175 -0.0026 2349 VAL 437 CG1 0.0028 -0.0165 -0.0013 2350 VAL 437 CG2 0.0035 -0.0197 -0.0052 2351 GLN 438 N 0.0054 -0.0250 -0.0142 2352 GLN 438 CA 0.0061 -0.0246 -0.0162 2353 GLN 438 C 0.0055 -0.0185 -0.0146 2354 GLN 438 O 0.0048 -0.0182 -0.0125 2355 GLN 438 CB 0.0084 -0.0257 -0.0226 2356 GLN 438 CG 0.0090 -0.0323 -0.0242 2357 GLN 438 CD 0.0113 -0.0332 -0.0305 2358 GLN 438 NE2 0.0118 -0.0356 -0.0320 2359 GLN 438 OE1 0.0125 -0.0317 -0.0340 2360 ARG 439 N 0.0058 -0.0136 -0.0155 2361 ARG 439 CA 0.0052 -0.0076 -0.0140 2362 ARG 439 C 0.0029 -0.0070 -0.0076 2363 ARG 439 O 0.0022 -0.0046 -0.0055 2364 ARG 439 CB 0.0060 -0.0028 -0.0162 2365 ARG 439 CG 0.0051 0.0035 -0.0138 2366 ARG 439 CD 0.0056 0.0077 -0.0152 2367 ARG 439 NE 0.0041 0.0072 -0.0110 2368 ARG 439 CZ 0.0023 0.0099 -0.0060 2369 ARG 439 NH1 0.0017 0.0134 -0.0044 2370 ARG 439 NH2 0.0011 0.0091 -0.0025 2371 LEU 440 N 0.0018 -0.0090 -0.0043 2372 LEU 440 CA -0.0004 -0.0086 0.0019 2373 LEU 440 C -0.0012 -0.0121 0.0042 2374 LEU 440 O -0.0027 -0.0102 0.0083 2375 LEU 440 CB -0.0014 -0.0107 0.0046 2376 LEU 440 CG -0.0011 -0.0067 0.0039 2377 LEU 440 CD1 -0.0015 -0.0102 0.0051 2378 LEU 440 CD2 -0.0026 -0.0012 0.0078 2379 ASN 441 N -0.0031 -0.0203 0.0075 2380 ASN 441 CA -0.0043 -0.0215 0.0089 2381 ASN 441 C -0.0031 -0.0164 0.0076 2382 ASN 441 O -0.0053 -0.0148 0.0103 2383 ASN 441 CB -0.0026 -0.0274 0.0067 2384 ASN 441 CG -0.0042 -0.0328 0.0086 2385 ASN 441 ND2 -0.0019 -0.0374 0.0057 2386 ASN 441 OD1 -0.0075 -0.0328 0.0125 2387 ALA 442 N 0.0003 -0.0139 0.0035 2388 ALA 442 CA 0.0017 -0.0089 0.0020 2389 ALA 442 C -0.0009 -0.0035 0.0053 2390 ALA 442 O -0.0009 0.0004 0.0053 2391 ALA 442 CB 0.0058 -0.0071 -0.0028 2392 LEU 443 N -0.0031 -0.0032 0.0079 2393 LEU 443 CA -0.0060 0.0014 0.0115 2394 LEU 443 C -0.0089 0.0007 0.0150 2395 LEU 443 O -0.0101 0.0051 0.0166 2396 LEU 443 CB -0.0079 0.0012 0.0139 2397 ASP 444 N -0.0328 0.0066 0.0213 2398 ASP 444 CA -0.0278 0.0110 0.0138 2399 ASP 444 C -0.0235 0.0083 0.0033 2400 ASP 444 O -0.0185 0.0141 -0.0030 2401 LEU 445 N -0.0253 -0.0003 0.0013 2402 LEU 445 CA -0.0215 -0.0038 -0.0087 2403 LEU 445 C -0.0185 0.0026 -0.0107 2404 LEU 445 O -0.0196 -0.0009 -0.0108 2405 LEU 445 CB -0.0247 -0.0155 -0.0099 2406 LEU 445 CG -0.0256 -0.0233 -0.0132 2407 LEU 445 CD1 -0.0217 -0.0276 -0.0241 2408 LEU 445 CD2 -0.0251 -0.0185 -0.0111 2409 GLU 446 N -0.0145 0.0123 -0.0125 2410 GLU 446 CA -0.0110 0.0196 -0.0148 2411 GLU 446 C -0.0074 0.0157 -0.0246 2412 GLU 446 O -0.0080 0.0135 -0.0249 2413 GLU 446 CB -0.0074 0.0305 -0.0150 2414 LYS 448 N -0.0161 -0.0001 0.0063 2415 LYS 448 CA -0.0129 0.0002 0.0050 2416 LYS 448 C -0.0116 0.0021 0.0018 2417 LYS 448 O -0.0136 0.0034 0.0004 2418 LYS 448 CB -0.0098 -0.0018 0.0071 2419 ILE 449 N -0.0082 0.0023 0.0006 2420 ILE 449 CA -0.0067 0.0041 -0.0025 2421 ILE 449 C -0.0039 0.0035 -0.0023 2422 ILE 449 O -0.0018 0.0017 -0.0003 2423 ILE 449 CB -0.0050 0.0050 -0.0043 2424 ILE 449 CG1 -0.0020 0.0033 -0.0026 2425 ILE 449 CG2 -0.0079 0.0059 -0.0048 2426 ILE 449 CD1 0.0007 0.0042 -0.0047 2427 GLY 450 N -0.0039 0.0049 -0.0045 2428 GLY 450 CA -0.0014 0.0046 -0.0047 2429 GLY 450 C -0.0016 0.0028 -0.0019 2430 GLY 450 O 0.0011 0.0017 -0.0010 2431 LYS 451 N -0.0025 0.0033 0.0028 2432 LYS 451 CA -0.0022 0.0038 0.0023 2433 LYS 451 C -0.0016 0.0036 0.0023 2434 LYS 451 O -0.0012 0.0039 0.0018 2435 LYS 451 CB -0.0019 0.0042 0.0019 2436 LYS 451 CG -0.0023 0.0042 0.0020 2437 LYS 451 CD -0.0028 0.0049 0.0016 2438 LYS 451 CE -0.0036 0.0050 0.0019 2439 LYS 451 NZ -0.0041 0.0056 0.0015 2440 SER 452 N -0.0015 0.0030 0.0027 2441 SER 452 CA -0.0009 0.0027 0.0027 2442 SER 452 C -0.0013 0.0024 0.0031 2443 SER 452 O -0.0016 0.0019 0.0036 2444 SER 452 CB -0.0002 0.0022 0.0028 2445 SER 452 OG 0.0002 0.0019 0.0029 2446 ILE 453 N -0.0012 0.0025 0.0029 2447 ILE 453 CA -0.0015 0.0022 0.0033 2448 ILE 453 C -0.0010 0.0016 0.0036 2449 ILE 453 O -0.0012 0.0011 0.0041 2450 ILE 453 CB -0.0016 0.0026 0.0030 2451 ILE 453 CG1 -0.0020 0.0033 0.0026 2452 ILE 453 CG2 -0.0020 0.0024 0.0034 2453 ILE 453 CD1 -0.0020 0.0038 0.0022 2454 LEU 454 N 0.0009 0.0016 -0.0011 2455 LEU 454 CA 0.0009 0.0012 -0.0016 2456 LEU 454 C 0.0007 0.0009 -0.0012 2457 LEU 454 O 0.0007 0.0008 -0.0015 2458 LEU 454 CB 0.0008 0.0008 -0.0019 2459 LEU 454 CG 0.0008 0.0005 -0.0025 2460 LEU 454 CD1 0.0010 0.0009 -0.0029 2461 LEU 454 CD2 0.0007 0.0001 -0.0027 2462 GLY 455 N 0.0006 0.0007 -0.0007 2463 GLY 455 CA 0.0004 0.0004 -0.0004 2464 GLY 455 C 0.0005 0.0008 -0.0002 2465 GLY 455 O 0.0004 0.0006 -0.0002 2466 LYS 456 N 0.0006 0.0014 -0.0000 2467 LYS 456 CA 0.0007 0.0018 0.0001 2468 LYS 456 C 0.0009 0.0019 -0.0004 2469 LYS 456 O 0.0009 0.0019 -0.0004 2470 LYS 456 CB 0.0009 0.0023 0.0004 2471 LYS 456 CG 0.0008 0.0022 0.0009 2472 LYS 456 CD 0.0009 0.0028 0.0011 2473 LYS 456 CE 0.0008 0.0027 0.0017 2474 LYS 456 NZ 0.0006 0.0024 0.0021 2475 VAL 457 N 0.0018 0.0005 -0.0036 2476 VAL 457 CA 0.0017 0.0004 -0.0029 2477 VAL 457 C 0.0019 0.0008 -0.0027 2478 VAL 457 O 0.0018 0.0008 -0.0024 2479 VAL 457 CB 0.0016 0.0004 -0.0026 2480 VAL 457 CG1 0.0015 0.0004 -0.0019 2481 VAL 457 CG2 0.0013 -0.0001 -0.0028 2482 HIS 458 N 0.0023 0.0013 -0.0028 2483 HIS 458 CA 0.0025 0.0017 -0.0026 2484 HIS 458 C 0.0026 0.0017 -0.0029 2485 HIS 458 O 0.0026 0.0018 -0.0026 2486 HIS 458 CB 0.0029 0.0022 -0.0028 2487 HIS 458 CG 0.0029 0.0023 -0.0024 2488 HIS 458 CD2 0.0029 0.0023 -0.0024 2489 HIS 458 ND1 0.0030 0.0025 -0.0018 2490 HIS 458 CE1 0.0030 0.0026 -0.0015 2491 HIS 458 NE2 0.0030 0.0025 -0.0019 2492 LEU 459 N 0.0025 0.0015 -0.0035 2493 LEU 459 CA 0.0025 0.0014 -0.0038 2494 LEU 459 C 0.0022 0.0011 -0.0035 2495 LEU 459 O 0.0022 0.0011 -0.0034 2496 LEU 459 CB 0.0025 0.0013 -0.0044 2497 LEU 459 CG 0.0026 0.0013 -0.0048 2498 LEU 459 CD1 0.0030 0.0019 -0.0047 2499 LEU 459 CD2 0.0026 0.0012 -0.0055 2500 ALA 460 N 0.0041 0.0022 -0.0045 2501 ALA 460 CA 0.0039 0.0022 -0.0044 2502 ALA 460 C 0.0038 0.0026 -0.0042 2503 ALA 460 O 0.0038 0.0028 -0.0042 2504 ALA 460 CB 0.0037 0.0017 -0.0042 2505 MET 461 N 0.0035 0.0028 -0.0039 2506 MET 461 CA 0.0034 0.0032 -0.0038 2507 MET 461 C 0.0037 0.0036 -0.0039 2508 MET 461 O 0.0036 0.0039 -0.0039 2509 MET 461 CB 0.0031 0.0033 -0.0035 2510 MET 461 CG 0.0028 0.0029 -0.0033 2511 MET 461 SD 0.0024 0.0032 -0.0029 2512 MET 461 CE 0.0024 0.0037 -0.0029 2513 VAL 462 N 0.0039 0.0036 -0.0042 2514 VAL 462 CA 0.0042 0.0040 -0.0044 2515 VAL 462 C 0.0044 0.0040 -0.0045 2516 VAL 462 O 0.0045 0.0044 -0.0045 2517 VAL 462 CB 0.0045 0.0039 -0.0046 2518 VAL 462 CG1 0.0048 0.0043 -0.0048 2519 VAL 462 CG2 0.0043 0.0040 -0.0045 2520 ARG 463 N 0.0050 0.0037 -0.0055 2521 ARG 463 CA 0.0045 0.0035 -0.0054 2522 ARG 463 C 0.0043 0.0033 -0.0049 2523 ARG 463 O 0.0041 0.0031 -0.0045 2524 ARG 463 CB 0.0041 0.0034 -0.0059 2525 ARG 463 CG 0.0043 0.0036 -0.0064 2526 ARG 463 CD 0.0038 0.0034 -0.0069 2527 ARG 463 NE 0.0040 0.0036 -0.0074 2528 ARG 463 CZ 0.0040 0.0037 -0.0078 2529 ARG 463 NH1 0.0039 0.0036 -0.0078 2530 ARG 463 NH2 0.0042 0.0039 -0.0083 2531 TYR 464 N 0.0043 0.0032 -0.0047 2532 TYR 464 CA 0.0041 0.0031 -0.0042 2533 TYR 464 C 0.0045 0.0031 -0.0037 2534 TYR 464 O 0.0043 0.0030 -0.0033 2535 TYR 464 CB 0.0041 0.0030 -0.0042 2536 TYR 464 CG 0.0035 0.0028 -0.0044 2537 TYR 464 CD1 0.0031 0.0026 -0.0043 2538 TYR 464 CD2 0.0035 0.0029 -0.0047 2539 TYR 464 CE1 0.0026 0.0024 -0.0045 2540 TYR 464 CE2 0.0030 0.0027 -0.0049 2541 TYR 464 CZ 0.0025 0.0025 -0.0048 2542 TYR 464 OH 0.0021 0.0023 -0.0050 2543 HIS 465 N 0.0050 0.0034 -0.0037 2544 HIS 465 CA 0.0054 0.0035 -0.0033 2545 HIS 465 C 0.0053 0.0034 -0.0032 2546 HIS 465 O 0.0052 0.0033 -0.0027 2547 HIS 465 CB 0.0059 0.0038 -0.0035 2548 HIS 465 CG 0.0061 0.0038 -0.0032 2549 HIS 465 CD2 0.0063 0.0040 -0.0035 2550 HIS 465 ND1 0.0062 0.0037 -0.0027 2551 HIS 465 CE1 0.0064 0.0038 -0.0026 2552 HIS 465 NE2 0.0065 0.0040 -0.0031 2553 GLU 466 N 0.0063 0.0054 -0.0050 2554 GLU 466 CA 0.0056 0.0050 -0.0046 2555 GLU 466 C 0.0052 0.0048 -0.0045 2556 GLU 466 O 0.0049 0.0041 -0.0042 2557 GLU 466 CB 0.0049 0.0055 -0.0046 2558 GLU 466 CG 0.0042 0.0051 -0.0043 2559 GLU 466 CD 0.0036 0.0056 -0.0042 2560 GLU 466 OE1 0.0037 0.0064 -0.0045 2561 GLU 466 OE2 0.0029 0.0053 -0.0040 2562 GLY 467 N 0.0054 0.0052 -0.0046 2563 GLY 467 CA 0.0050 0.0051 -0.0045 2564 GLY 467 C 0.0055 0.0045 -0.0045 2565 GLY 467 O 0.0053 0.0042 -0.0043 2566 GLY 468 N 0.0063 0.0042 -0.0046 2567 GLY 468 CA 0.0068 0.0036 -0.0046 2568 GLY 468 C 0.0073 0.0040 -0.0048 2569 GLY 468 O 0.0075 0.0036 -0.0048 2570 ARG 469 N 0.0072 0.0031 -0.0041 2571 ARG 469 CA 0.0063 0.0024 -0.0037 2572 ARG 469 C 0.0059 0.0029 -0.0029 2573 ARG 469 O 0.0051 0.0025 -0.0023 2574 ARG 469 CB 0.0063 0.0015 -0.0044 2575 ARG 469 CG 0.0054 0.0007 -0.0041 2576 ARG 469 CD 0.0048 0.0003 -0.0039 2577 ARG 469 NE 0.0041 -0.0006 -0.0038 2578 ARG 469 CZ 0.0034 -0.0007 -0.0030 2579 ARG 469 NH1 0.0034 0.0001 -0.0023 2580 ARG 469 NH2 0.0027 -0.0016 -0.0030 2581 PHE 470 N 0.0064 0.0037 -0.0028 2582 PHE 470 CA 0.0061 0.0041 -0.0020 2583 PHE 470 C 0.0062 0.0051 -0.0013 2584 PHE 470 O 0.0060 0.0056 -0.0007 2585 PHE 470 CB 0.0064 0.0042 -0.0024 2586 PHE 470 CG 0.0063 0.0032 -0.0030 2587 PHE 470 CD1 0.0055 0.0024 -0.0028 2588 PHE 470 CD2 0.0069 0.0032 -0.0037 2589 PHE 470 CE1 0.0053 0.0015 -0.0034 2590 PHE 470 CE2 0.0067 0.0023 -0.0043 2591 PHE 470 CZ 0.0059 0.0015 -0.0041 2592 CYS 471 N 0.0065 0.0054 -0.0014 2593 CYS 471 CA 0.0066 0.0063 -0.0008 2594 CYS 471 C 0.0062 0.0061 -0.0004 2595 CYS 471 O 0.0060 0.0054 -0.0008 2596 CYS 471 CB 0.0076 0.0071 -0.0012 2597 CYS 471 SG 0.0081 0.0067 -0.0021 2598 GLU 472 N 0.0107 -0.0020 0.0078 2599 GLU 472 CA 0.0105 -0.0020 0.0080 2600 GLU 472 C 0.0120 -0.0001 0.0065 2601 GLU 472 O 0.0133 0.0010 0.0053 2602 GLU 472 CB 0.0084 -0.0011 0.0100 2603 LYS 473 N 0.0119 0.0001 0.0066 2604 LYS 473 CA 0.0133 0.0018 0.0053 2605 LYS 473 C 0.0131 0.0049 0.0056 2606 LYS 473 O 0.0114 0.0058 0.0072 2607 LYS 473 CB 0.0131 0.0013 0.0055 2608 GLU 475 N 0.0087 -0.0008 0.0071 2609 GLU 475 CA 0.0100 -0.0001 0.0064 2610 GLU 475 C 0.0099 0.0005 0.0052 2611 GLU 475 O 0.0088 0.0005 0.0044 2612 GLU 475 CB 0.0103 0.0002 0.0061 2613 GLU 475 CG 0.0115 0.0009 0.0053 2614 GLU 475 CD 0.0129 0.0010 0.0061 2615 GLU 475 OE1 0.0132 0.0005 0.0073 2616 GLU 475 OE2 0.0136 0.0015 0.0056 2617 GLU 476 N 0.0110 0.0009 0.0051 2618 GLU 476 CA 0.0110 0.0015 0.0039 2619 GLU 476 C 0.0112 0.0021 0.0027 2620 GLU 476 O 0.0121 0.0024 0.0029 2621 GLU 476 CB 0.0122 0.0017 0.0041 2622 GLU 476 CG 0.0123 0.0011 0.0055 2623 TRP 477 N 0.0104 0.0024 0.0016 2624 TRP 477 CA 0.0105 0.0030 0.0005 2625 TRP 477 C 0.0119 0.0037 -0.0001 2626 TRP 477 O 0.0125 0.0039 0.0000 2627 TRP 477 CB 0.0093 0.0031 -0.0006 2628 TRP 477 CG 0.0091 0.0033 -0.0011 2629 TRP 477 CD1 0.0085 0.0029 -0.0005 2630 TRP 477 CD2 0.0095 0.0041 -0.0023 2631 TRP 477 CE2 0.0091 0.0040 -0.0023 2632 TRP 477 CE3 0.0101 0.0048 -0.0033 2633 TRP 477 NE1 0.0085 0.0032 -0.0012 2634 TRP 477 CZ2 0.0094 0.0046 -0.0034 2635 TRP 477 CZ3 0.0104 0.0054 -0.0043 2636 TRP 477 CH2 0.0100 0.0053 -0.0044 2637 ASP 478 N 0.0097 0.0027 -0.0012 2638 ASP 478 CA 0.0106 0.0028 -0.0015 2639 ASP 478 C 0.0104 0.0033 -0.0020 2640 ASP 478 O 0.0101 0.0038 -0.0025 2641 ASP 478 CB 0.0111 0.0032 -0.0020 2642 ASP 478 CG 0.0121 0.0032 -0.0022 2643 ASP 478 OD1 0.0124 0.0031 -0.0021 2644 ASP 478 OD2 0.0127 0.0034 -0.0025 2645 GLN 479 N 0.0105 0.0030 -0.0017 2646 GLN 479 CA 0.0103 0.0034 -0.0021 2647 GLN 479 C 0.0111 0.0038 -0.0027 2648 GLN 479 O 0.0109 0.0043 -0.0032 2649 GLN 479 CB 0.0102 0.0030 -0.0016 2650 GLN 479 CG 0.0094 0.0025 -0.0010 2651 GLN 479 CD 0.0092 0.0021 -0.0005 2652 GLN 479 NE2 0.0084 0.0020 -0.0002 2653 GLN 479 OE1 0.0098 0.0020 -0.0005 2654 GLU 480 N 0.0119 0.0036 -0.0026 2655 GLU 480 CA 0.0127 0.0039 -0.0031 2656 GLU 480 C 0.0126 0.0045 -0.0038 2657 GLU 480 O 0.0127 0.0050 -0.0043 2658 GLU 480 CB 0.0136 0.0035 -0.0028 2659 GLU 480 CG 0.0138 0.0029 -0.0022 2660 GLU 480 CD 0.0135 0.0024 -0.0015 2661 GLU 480 OE1 0.0138 0.0022 -0.0013 2662 GLU 480 OE2 0.0128 0.0021 -0.0011 2663 SER 481 N 0.0095 0.0032 -0.0045 2664 SER 481 CA 0.0094 0.0035 -0.0048 2665 SER 481 C 0.0091 0.0036 -0.0049 2666 SER 481 O 0.0091 0.0039 -0.0051 2667 SER 481 CB 0.0095 0.0034 -0.0047 2668 SER 481 OG 0.0098 0.0032 -0.0046 2669 ALA 482 N 0.0088 0.0035 -0.0047 2670 ALA 482 CA 0.0085 0.0037 -0.0048 2671 ALA 482 C 0.0086 0.0038 -0.0050 2672 ALA 482 O 0.0085 0.0041 -0.0052 2673 ALA 482 CB 0.0082 0.0035 -0.0046 2674 VAL 483 N 0.0088 0.0037 -0.0049 2675 VAL 483 CA 0.0089 0.0038 -0.0050 2676 VAL 483 C 0.0091 0.0040 -0.0053 2677 VAL 483 O 0.0091 0.0042 -0.0054 2678 VAL 483 CB 0.0090 0.0036 -0.0049 2679 VAL 483 CG1 0.0091 0.0038 -0.0050 2680 VAL 483 CG2 0.0088 0.0034 -0.0046 2681 PHE 484 N 0.0071 0.0022 -0.0043 2682 PHE 484 CA 0.0074 0.0025 -0.0046 2683 PHE 484 C 0.0071 0.0028 -0.0049 2684 PHE 484 O 0.0072 0.0031 -0.0052 2685 PHE 484 CB 0.0077 0.0023 -0.0043 2686 PHE 484 CG 0.0081 0.0026 -0.0046 2687 PHE 484 CD1 0.0086 0.0027 -0.0047 2688 PHE 484 CD2 0.0079 0.0027 -0.0047 2689 PHE 484 CE1 0.0089 0.0030 -0.0049 2690 PHE 484 CE2 0.0082 0.0029 -0.0049 2691 PHE 484 CZ 0.0087 0.0031 -0.0050 2692 HIS 485 N 0.0067 0.0026 -0.0048 2693 HIS 485 CA 0.0063 0.0029 -0.0051 2694 HIS 485 C 0.0060 0.0031 -0.0053 2695 HIS 485 O 0.0058 0.0034 -0.0057 2696 HIS 485 CB 0.0060 0.0027 -0.0049 2697 HIS 485 CG 0.0064 0.0026 -0.0048 2698 HIS 485 CD2 0.0064 0.0022 -0.0044 2699 HIS 485 ND1 0.0067 0.0028 -0.0050 2700 HIS 485 CE1 0.0069 0.0027 -0.0048 2701 HIS 485 NE2 0.0068 0.0023 -0.0044 2702 LEU 486 N 0.0058 0.0029 -0.0052 2703 LEU 486 CA 0.0055 0.0031 -0.0054 2704 LEU 486 C 0.0058 0.0034 -0.0057 2705 LEU 486 O 0.0057 0.0037 -0.0060 2706 LEU 486 CB 0.0053 0.0028 -0.0051 2707 LEU 486 CG 0.0048 0.0029 -0.0053 2708 LEU 486 CD1 0.0044 0.0030 -0.0055 2709 LEU 486 CD2 0.0047 0.0026 -0.0050 2710 GLU 487 N 0.0059 0.0024 -0.0041 2711 GLU 487 CA 0.0060 0.0026 -0.0042 2712 GLU 487 C 0.0061 0.0029 -0.0043 2713 GLU 487 O 0.0060 0.0032 -0.0044 2714 GLU 487 CB 0.0063 0.0024 -0.0042 2715 GLU 487 CG 0.0061 0.0021 -0.0041 2716 GLU 487 CD 0.0060 0.0022 -0.0041 2717 GLU 487 OE1 0.0062 0.0023 -0.0042 2718 GLU 487 OE2 0.0057 0.0021 -0.0040 2719 HIS 488 N 0.0064 0.0029 -0.0043 2720 HIS 488 CA 0.0065 0.0032 -0.0044 2721 HIS 488 C 0.0062 0.0035 -0.0044 2722 HIS 488 O 0.0062 0.0038 -0.0045 2723 HIS 488 CB 0.0068 0.0031 -0.0044 2724 HIS 488 CG 0.0071 0.0030 -0.0044 2725 HIS 488 CD2 0.0074 0.0029 -0.0044 2726 HIS 488 ND1 0.0072 0.0032 -0.0045 2727 HIS 488 CE1 0.0076 0.0031 -0.0045 2728 HIS 488 NE2 0.0077 0.0029 -0.0044 2729 ALA 489 N 0.0060 0.0033 -0.0044 2730 ALA 489 CA 0.0057 0.0035 -0.0044 2731 ALA 489 C 0.0055 0.0037 -0.0044 2732 ALA 489 O 0.0054 0.0040 -0.0045 2733 ALA 489 CB 0.0054 0.0033 -0.0043 2734 ALA 490 N 0.0051 0.0029 -0.0038 2735 ALA 490 CA 0.0054 0.0032 -0.0045 2736 ALA 490 C 0.0053 0.0034 -0.0042 2737 ALA 490 O 0.0055 0.0031 -0.0047 2738 ALA 490 CB 0.0056 0.0042 -0.0049 2739 ASN 491 N 0.0050 0.0037 -0.0034 2740 ASN 491 CA 0.0048 0.0038 -0.0030 2741 ASN 491 C 0.0047 0.0029 -0.0029 2742 ASN 491 O 0.0046 0.0028 -0.0028 2743 ASN 491 CB 0.0045 0.0044 -0.0022 2744 ASN 491 CG 0.0046 0.0054 -0.0023 2745 ASN 491 ND2 0.0044 0.0058 -0.0016 2746 ASN 491 OD1 0.0050 0.0058 -0.0030 2747 LEU 492 N 0.0046 0.0021 -0.0029 2748 LEU 492 CA 0.0044 0.0012 -0.0027 2749 LEU 492 C 0.0047 0.0006 -0.0036 2750 LEU 492 O 0.0046 -0.0003 -0.0036 2751 LEU 492 CB 0.0041 0.0006 -0.0021 2752 LEU 492 CG 0.0037 0.0011 -0.0012 2753 LEU 492 CD1 0.0034 0.0006 -0.0006 2754 LEU 492 CD2 0.0036 0.0011 -0.0008 2755 GLY 493 N -0.0019 0.0091 -0.0031 2756 GLY 493 CA -0.0024 0.0089 -0.0042 2757 GLY 493 C -0.0025 0.0074 -0.0052 2758 GLY 493 O -0.0026 0.0069 -0.0058 2759 GLU 494 N -0.0024 0.0066 -0.0053 2760 GLU 494 CA -0.0025 0.0052 -0.0063 2761 GLU 494 C -0.0033 0.0057 -0.0078 2762 GLU 494 O -0.0035 0.0062 -0.0080 2763 GLU 494 CB -0.0020 0.0041 -0.0058 2764 GLU 494 CG -0.0013 0.0032 -0.0045 2765 GLU 494 CD -0.0012 0.0024 -0.0048 2766 GLU 494 OE1 -0.0014 0.0013 -0.0058 2767 GLU 494 OE2 -0.0010 0.0029 -0.0041 2768 LEU 495 N -0.0037 0.0055 -0.0089 2769 LEU 495 CA -0.0045 0.0060 -0.0103 2770 LEU 495 C -0.0047 0.0053 -0.0111 2771 LEU 495 O -0.0052 0.0060 -0.0118 2772 LEU 495 CB -0.0048 0.0057 -0.0112 2773 LEU 495 CG -0.0057 0.0065 -0.0126 2774 LEU 495 CD1 -0.0059 0.0083 -0.0123 2775 LEU 495 CD2 -0.0060 0.0064 -0.0134 2776 GLU 496 N -0.0044 0.0077 -0.0093 2777 GLU 496 CA -0.0047 0.0068 -0.0089 2778 GLU 496 C -0.0039 0.0063 -0.0086 2779 GLU 496 O -0.0040 0.0057 -0.0084 2780 GLU 496 CB -0.0048 0.0064 -0.0087 2781 GLU 496 CG -0.0049 0.0054 -0.0083 2782 GLU 496 CD -0.0056 0.0051 -0.0081 2783 GLU 496 OE1 -0.0059 0.0056 -0.0083 2784 GLU 496 OE2 -0.0059 0.0043 -0.0078 2785 ALA 497 N -0.0029 0.0065 -0.0088 2786 ALA 497 CA -0.0021 0.0060 -0.0086 2787 ALA 497 C -0.0021 0.0062 -0.0086 2788 ALA 497 O -0.0019 0.0056 -0.0084 2789 ALA 497 CB -0.0012 0.0063 -0.0087 2790 ILE 498 N -0.0023 0.0070 -0.0090 2791 ILE 498 CA -0.0023 0.0073 -0.0091 2792 ILE 498 C -0.0031 0.0068 -0.0089 2793 ILE 498 O -0.0029 0.0064 -0.0087 2794 ILE 498 CB -0.0024 0.0083 -0.0096 2795 ILE 498 CG1 -0.0016 0.0087 -0.0098 2796 ILE 498 CG2 -0.0025 0.0085 -0.0097 2797 ILE 498 CD1 -0.0018 0.0097 -0.0102 2798 VAL 499 N -0.0051 0.0076 -0.0089 2799 VAL 499 CA -0.0062 0.0068 -0.0079 2800 VAL 499 C -0.0056 0.0054 -0.0063 2801 VAL 499 O -0.0053 0.0046 -0.0055 2802 VAL 499 CB -0.0084 0.0073 -0.0079 2803 VAL 499 CG1 -0.0095 0.0064 -0.0068 2804 VAL 499 CG2 -0.0089 0.0087 -0.0094 2805 GLY 500 N -0.0056 0.0050 -0.0059 2806 GLY 500 CA -0.0050 0.0036 -0.0045 2807 GLY 500 C -0.0031 0.0030 -0.0042 2808 GLY 500 O -0.0028 0.0019 -0.0031 2809 LEU 501 N -0.0016 0.0037 -0.0053 2810 LEU 501 CA 0.0003 0.0032 -0.0051 2811 LEU 501 C 0.0005 0.0033 -0.0052 2812 LEU 501 O 0.0016 0.0024 -0.0044 2813 LEU 501 CB 0.0018 0.0040 -0.0062 2814 LEU 501 CG 0.0023 0.0037 -0.0059 2815 LEU 501 CD1 0.0039 0.0045 -0.0071 2816 LEU 501 CD2 0.0030 0.0022 -0.0044 2817 GLY 502 N -0.0014 0.0040 -0.0049 2818 GLY 502 CA -0.0017 0.0033 -0.0041 2819 GLY 502 C -0.0026 0.0021 -0.0025 2820 GLY 502 O -0.0023 0.0008 -0.0018 2821 LEU 503 N -0.0037 0.0025 -0.0018 2822 LEU 503 CA -0.0045 0.0014 -0.0003 2823 LEU 503 C -0.0034 -0.0003 -0.0000 2824 LEU 503 O -0.0035 -0.0017 0.0010 2825 LEU 503 CB -0.0060 0.0023 0.0004 2826 LEU 503 CG -0.0072 0.0039 0.0003 2827 LEU 503 CD1 -0.0086 0.0048 0.0009 2828 LEU 503 CD2 -0.0079 0.0034 0.0012 2829 MET 504 N -0.0023 -0.0001 -0.0011 2830 MET 504 CA -0.0012 -0.0017 -0.0009 2831 MET 504 C 0.0000 -0.0029 -0.0011 2832 MET 504 O 0.0004 -0.0045 -0.0003 2833 MET 504 CB -0.0004 -0.0011 -0.0020 2834 MET 504 CG -0.0015 -0.0005 -0.0015 2835 MET 504 SD -0.0008 0.0008 -0.0030 2836 MET 504 CE 0.0005 -0.0009 -0.0029 2837 TYR 505 N -0.0020 -0.0032 -0.0016 2838 TYR 505 CA -0.0010 -0.0034 -0.0017 2839 TYR 505 C -0.0006 -0.0035 -0.0014 2840 TYR 505 O 0.0002 -0.0036 -0.0012 2841 TYR 505 CB -0.0007 -0.0033 -0.0026 2842 TYR 505 CG -0.0009 -0.0033 -0.0028 2843 TYR 505 CD1 -0.0005 -0.0034 -0.0022 2844 TYR 505 CD2 -0.0014 -0.0031 -0.0035 2845 TYR 505 CE1 -0.0006 -0.0034 -0.0024 2846 TYR 505 CE2 -0.0015 -0.0031 -0.0036 2847 TYR 505 CZ -0.0011 -0.0032 -0.0031 2848 TYR 505 OH -0.0012 -0.0032 -0.0033 2849 SER 506 N -0.0011 -0.0034 -0.0015 2850 SER 506 CA -0.0008 -0.0034 -0.0012 2851 SER 506 C -0.0009 -0.0035 -0.0002 2852 SER 506 O -0.0008 -0.0036 0.0001 2853 SER 506 CB -0.0012 -0.0033 -0.0017 2854 SER 506 OG -0.0010 -0.0033 -0.0027 2855 GLN 507 N -0.0012 -0.0035 0.0003 2856 GLN 507 CA -0.0014 -0.0036 0.0013 2857 GLN 507 C -0.0021 -0.0034 0.0015 2858 GLN 507 O -0.0020 -0.0035 0.0021 2859 GLN 507 CB -0.0006 -0.0038 0.0018 2860 GLN 507 CG 0.0002 -0.0039 0.0015 2861 GLN 507 CD 0.0001 -0.0039 0.0015 2862 GLN 507 NE2 -0.0004 -0.0039 0.0022 2863 GLN 507 OE1 0.0003 -0.0039 0.0008 2864 LEU 508 N -0.0054 -0.0049 0.0037 2865 LEU 508 CA -0.0085 -0.0036 0.0049 2866 LEU 508 C -0.0089 -0.0031 0.0049 2867 LEU 508 O -0.0068 -0.0030 0.0036 2868 LEU 508 CB -0.0095 -0.0005 0.0040 2869 LEU 508 CG -0.0100 -0.0006 0.0044 2870 LEU 508 CD1 -0.0108 0.0026 0.0034 2871 LEU 508 CD2 -0.0124 -0.0024 0.0066 2872 PRO 509 N -0.0117 -0.0027 0.0063 2873 PRO 509 CA -0.0122 -0.0019 0.0062 2874 PRO 509 C -0.0118 0.0014 0.0045 2875 PRO 509 O -0.0124 0.0035 0.0039 2876 PRO 509 CB -0.0154 -0.0022 0.0082 2877 PRO 509 CG -0.0168 -0.0018 0.0088 2878 PRO 509 CD -0.0143 -0.0033 0.0080 2879 HIS 510 N -0.0107 0.0019 0.0037 2880 HIS 510 CA -0.0099 0.0048 0.0020 2881 HIS 510 C -0.0106 0.0054 0.0021 2882 HIS 510 O -0.0109 0.0033 0.0032 2883 HIS 510 CB -0.0066 0.0047 0.0001 2884 HIS 510 CG -0.0047 0.0017 0.0003 2885 HIS 510 CD2 -0.0029 0.0010 -0.0003 2886 HIS 510 ND1 -0.0043 -0.0010 0.0013 2887 HIS 510 CE1 -0.0025 -0.0032 0.0013 2888 HIS 510 NE2 -0.0016 -0.0021 0.0003 2889 HIS 511 N -0.0058 0.0070 -0.0001 2890 HIS 511 CA -0.0070 0.0078 0.0001 2891 HIS 511 C -0.0055 0.0076 -0.0009 2892 HIS 511 O -0.0055 0.0066 0.0000 2893 HIS 511 CB -0.0086 0.0099 -0.0008 2894 HIS 511 CG -0.0099 0.0108 -0.0006 2895 HIS 511 CD2 -0.0103 0.0125 -0.0020 2896 HIS 511 ND1 -0.0112 0.0099 0.0010 2897 HIS 511 CE1 -0.0122 0.0111 0.0007 2898 HIS 511 NE2 -0.0117 0.0126 -0.0011 2899 ILE 512 N -0.0043 0.0087 -0.0027 2900 ILE 512 CA -0.0028 0.0086 -0.0037 2901 ILE 512 C -0.0010 0.0065 -0.0031 2902 ILE 512 O -0.0001 0.0057 -0.0030 2903 ILE 512 CB -0.0019 0.0102 -0.0058 2904 ILE 512 CG1 -0.0002 0.0100 -0.0068 2905 ILE 512 CG2 -0.0010 0.0101 -0.0064 2906 ILE 512 CD1 0.0001 0.0119 -0.0088 2907 LEU 513 N -0.0005 0.0057 -0.0027 2908 LEU 513 CA 0.0011 0.0037 -0.0020 2909 LEU 513 C 0.0005 0.0023 -0.0002 2910 LEU 513 O 0.0019 0.0010 -0.0000 2911 LEU 513 CB 0.0034 0.0036 -0.0034 2912 LEU 513 CG 0.0043 0.0048 -0.0052 2913 LEU 513 CD1 0.0067 0.0043 -0.0064 2914 LEU 513 CD2 0.0040 0.0045 -0.0047 2915 ALA 514 N -0.0024 0.0037 0.0009 2916 ALA 514 CA -0.0037 0.0027 0.0018 2917 ALA 514 C -0.0029 0.0006 0.0023 2918 ALA 514 O -0.0031 -0.0001 0.0027 2919 ALA 514 CB -0.0055 0.0029 0.0025 2920 ASP 515 N -0.0020 -0.0003 0.0023 2921 ASP 515 CA -0.0013 -0.0023 0.0028 2922 ASP 515 C 0.0005 -0.0028 0.0023 2923 ASP 515 O 0.0012 -0.0044 0.0026 2924 ASP 515 CB -0.0011 -0.0031 0.0030 2925 ASP 515 CG -0.0028 -0.0028 0.0037 2926 ASP 515 OD1 -0.0044 -0.0030 0.0044 2927 ASP 515 OD2 -0.0027 -0.0023 0.0034 2928 VAL 516 N 0.0012 -0.0014 0.0014 2929 VAL 516 CA 0.0029 -0.0017 0.0008 2930 VAL 516 C 0.0024 -0.0018 0.0011 2931 VAL 516 O 0.0013 -0.0005 0.0010 2932 VAL 516 CB 0.0042 -0.0002 -0.0003 2933 VAL 516 CG1 0.0060 -0.0006 -0.0009 2934 VAL 516 CG2 0.0046 -0.0000 -0.0005 2935 SER 517 N -0.0016 -0.0084 0.0036 2936 SER 517 CA -0.0017 -0.0074 0.0030 2937 SER 517 C -0.0003 -0.0065 0.0035 2938 SER 517 O 0.0006 -0.0071 0.0044 2939 SER 517 CB -0.0023 -0.0081 0.0030 2940 SER 517 OG -0.0036 -0.0087 0.0024 2941 LEU 518 N -0.0001 -0.0052 0.0030 2942 LEU 518 CA 0.0012 -0.0042 0.0033 2943 LEU 518 C 0.0015 -0.0038 0.0033 2944 LEU 518 O 0.0006 -0.0038 0.0027 2945 LEU 518 CB 0.0014 -0.0029 0.0028 2946 LEU 518 CG 0.0013 -0.0032 0.0028 2947 LEU 518 CD1 0.0015 -0.0018 0.0023 2948 LEU 518 CD2 0.0022 -0.0040 0.0039 2949 LYS 519 N 0.0027 -0.0035 0.0040 2950 LYS 519 CA 0.0031 -0.0031 0.0040 2951 LYS 519 C 0.0027 -0.0017 0.0030 2952 LYS 519 O 0.0027 -0.0008 0.0026 2953 LYS 519 CB 0.0046 -0.0029 0.0049 2954 LYS 519 CG 0.0051 -0.0042 0.0058 2955 LYS 519 CD 0.0053 -0.0050 0.0064 2956 LYS 519 CE 0.0054 -0.0065 0.0072 2957 LYS 519 NZ 0.0066 -0.0064 0.0079 2958 GLU 520 N -0.0032 0.0052 0.0074 2959 GLU 520 CA -0.0015 0.0057 0.0044 2960 GLU 520 C -0.0011 0.0084 0.0056 2961 GLU 520 O -0.0007 0.0115 0.0070 2962 GLU 520 CB 0.0005 0.0070 0.0016 2963 GLU 520 CG 0.0024 0.0081 -0.0013 2964 GLU 520 CD 0.0043 0.0099 -0.0038 2965 GLU 520 OE1 0.0042 0.0095 -0.0038 2966 GLU 520 OE2 0.0060 0.0117 -0.0058 2967 THR 521 N -0.0012 0.0072 0.0050 2968 THR 521 CA -0.0007 0.0096 0.0056 2969 THR 521 C 0.0005 0.0086 0.0026 2970 THR 521 O 0.0007 0.0059 0.0004 2971 THR 521 CB -0.0026 0.0092 0.0090 2972 THR 521 CG2 -0.0038 0.0104 0.0121 2973 THR 521 OG1 -0.0039 0.0055 0.0090 2974 GLU 522 N 0.0014 0.0110 0.0025 2975 GLU 522 CA 0.0025 0.0101 -0.0002 2976 GLU 522 C 0.0010 0.0068 0.0004 2977 GLU 522 O 0.0014 0.0044 -0.0020 2978 GLU 522 CB 0.0037 0.0135 -0.0002 2979 GLU 522 CG 0.0054 0.0168 -0.0011 2980 GLU 522 CD 0.0068 0.0160 -0.0045 2981 GLU 522 OE1 0.0076 0.0145 -0.0071 2982 GLU 522 OE2 0.0071 0.0169 -0.0045 2983 GLU 523 N -0.0027 0.0029 0.0027 2984 GLU 523 CA -0.0039 0.0004 0.0035 2985 GLU 523 C -0.0034 -0.0016 0.0028 2986 GLU 523 O -0.0033 -0.0039 0.0023 2987 GLU 523 CB -0.0059 0.0008 0.0056 2988 GLU 523 CG -0.0064 0.0033 0.0064 2989 GLU 523 CD -0.0061 0.0057 0.0065 2990 GLU 523 OE1 -0.0062 0.0053 0.0066 2991 GLU 523 OE2 -0.0058 0.0079 0.0065 2992 ASN 524 N -0.0032 -0.0006 0.0026 2993 ASN 524 CA -0.0027 -0.0023 0.0019 2994 ASN 524 C -0.0008 -0.0032 -0.0002 2995 ASN 524 O -0.0005 -0.0054 -0.0008 2996 ASN 524 CB -0.0029 -0.0009 0.0023 2997 ASN 524 CG -0.0049 -0.0008 0.0043 2998 ASN 524 ND2 -0.0052 0.0009 0.0049 2999 ASN 524 OD1 -0.0062 -0.0022 0.0054 3000 LYS 525 N 0.0005 -0.0016 -0.0013 3001 LYS 525 CA 0.0024 -0.0025 -0.0033 3002 LYS 525 C 0.0023 -0.0046 -0.0035 3003 LYS 525 O 0.0031 -0.0066 -0.0046 3004 LYS 525 CB 0.0037 -0.0001 -0.0044 3005 LYS 525 CG 0.0058 -0.0005 -0.0064 3006 LYS 525 CD 0.0059 -0.0014 -0.0067 3007 LYS 525 CE 0.0079 -0.0011 -0.0087 3008 LYS 525 NZ 0.0081 -0.0020 -0.0090 3009 THR 526 N 0.0031 -0.0073 -0.0025 3010 THR 526 CA 0.0027 -0.0104 -0.0035 3011 THR 526 C 0.0005 -0.0116 -0.0037 3012 THR 526 O 0.0011 -0.0138 -0.0045 3013 THR 526 CB 0.0014 -0.0111 -0.0036 3014 THR 526 CG2 0.0007 -0.0143 -0.0046 3015 THR 526 OG1 0.0036 -0.0103 -0.0035 3016 LYS 527 N -0.0019 -0.0101 -0.0030 3017 LYS 527 CA -0.0041 -0.0111 -0.0031 3018 LYS 527 C -0.0027 -0.0111 -0.0032 3019 LYS 527 O -0.0033 -0.0130 -0.0038 3020 LYS 527 CB -0.0069 -0.0092 -0.0022 3021 LYS 527 CG -0.0098 -0.0107 -0.0024 3022 LYS 527 CD -0.0124 -0.0086 -0.0015 3023 LYS 527 CE -0.0124 -0.0071 -0.0010 3024 LYS 527 NZ -0.0147 -0.0048 -0.0000 3025 GLY 528 N -0.0009 -0.0088 -0.0026 3026 GLY 528 CA 0.0006 -0.0087 -0.0027 3027 GLY 528 C 0.0027 -0.0112 -0.0037 3028 GLY 528 O 0.0027 -0.0126 -0.0042 3029 PHE 529 N 0.0057 -0.0155 -0.0076 3030 PHE 529 CA 0.0017 -0.0112 -0.0014 3031 PHE 529 C 0.0067 -0.0062 0.0062 3032 PHE 529 O 0.0079 -0.0031 0.0109 3033 PHE 529 CB -0.0087 -0.0103 -0.0008 3034 PHE 529 CG -0.0132 -0.0061 0.0051 3035 PHE 529 CD1 -0.0164 -0.0073 0.0031 3036 PHE 529 CD2 -0.0143 -0.0010 0.0125 3037 PHE 529 CE1 -0.0205 -0.0035 0.0084 3038 PHE 529 CE2 -0.0184 0.0028 0.0179 3039 PHE 529 CZ -0.0215 0.0016 0.0158 3040 ASP 734 N -0.0441 -0.0381 -0.0475 3041 ASP 734 CA -0.0360 -0.0625 -0.0317 3042 ASP 734 C -0.0128 -0.0530 -0.0148 3043 ASP 734 O -0.0079 -0.0653 -0.0062 3044 ASP 734 CB -0.0347 -0.0831 -0.0232 3045 THR 735 N 0.0015 -0.0311 -0.0102 3046 THR 735 CA 0.0238 -0.0201 0.0053 3047 THR 735 C 0.0220 -0.0031 -0.0023 3048 THR 735 O 0.0313 -0.0080 0.0076 3049 THR 735 CB 0.0394 -0.0018 0.0123 3050 THR 735 CG2 0.0422 -0.0191 0.0210 3051 THR 735 OG1 0.0299 0.0218 -0.0043 3052 ASP 736 N 0.0101 0.0170 -0.0199 3053 ASP 736 CA 0.0074 0.0339 -0.0283 3054 ASP 736 C -0.0084 0.0169 -0.0360 3055 ASP 736 O -0.0067 0.0245 -0.0372 3056 ASP 736 CB -0.0013 0.0600 -0.0452 3057 ASP 736 CG 0.0159 0.0806 -0.0375 3058 ASP 736 OD1 0.0364 0.0801 -0.0195 3059 ASP 736 OD2 0.0089 0.0972 -0.0495 3060 SER 737 N -0.0062 -0.0003 -0.0205 3061 SER 737 CA -0.0066 -0.0040 -0.0214 3062 SER 737 C -0.0038 -0.0065 -0.0180 3063 SER 737 O -0.0032 -0.0075 -0.0174 3064 SER 737 CB -0.0087 -0.0072 -0.0242 3065 SER 737 OG -0.0116 -0.0058 -0.0277 3066 GLU 738 N -0.0020 -0.0076 -0.0159 3067 GLU 738 CA 0.0008 -0.0097 -0.0125 3068 GLU 738 C 0.0026 -0.0066 -0.0101 3069 GLU 738 O 0.0040 -0.0083 -0.0085 3070 GLU 738 CB 0.0024 -0.0106 -0.0107 3071 GLU 738 CG 0.0024 -0.0155 -0.0110 3072 GLU 738 CD 0.0041 -0.0188 -0.0092 3073 GLU 738 OE1 0.0030 -0.0199 -0.0106 3074 GLU 738 OE2 0.0066 -0.0201 -0.0062 3075 GLU 739 N 0.0025 -0.0022 -0.0099 3076 GLU 739 CA 0.0040 0.0009 -0.0078 3077 GLU 739 C 0.0027 0.0011 -0.0094 3078 GLU 739 O 0.0042 0.0014 -0.0074 3079 GLU 739 CB 0.0038 0.0057 -0.0076 3080 GLU 739 CG 0.0054 0.0091 -0.0054 3081 GLU 739 CD 0.0085 0.0091 -0.0014 3082 GLU 739 OE1 0.0097 0.0055 -0.0002 3083 GLU 739 OE2 0.0098 0.0126 0.0004 3084 GLU 740 N 0.0049 0.0036 -0.0126 3085 GLU 740 CA 0.0036 0.0029 -0.0146 3086 GLU 740 C 0.0028 0.0001 -0.0138 3087 GLU 740 O 0.0024 -0.0004 -0.0142 3088 GLU 740 CB 0.0025 0.0032 -0.0172 3089 GLU 740 CG 0.0029 0.0060 -0.0187 3090 GLU 740 CD 0.0024 0.0065 -0.0203 3091 GLU 740 OE1 0.0013 0.0046 -0.0208 3092 GLU 740 OE2 0.0030 0.0089 -0.0211 3093 ILE 741 N 0.0026 -0.0018 -0.0126 3094 ILE 741 CA 0.0018 -0.0045 -0.0118 3095 ILE 741 C 0.0028 -0.0046 -0.0096 3096 ILE 741 O 0.0023 -0.0060 -0.0095 3097 ILE 741 CB 0.0014 -0.0064 -0.0110 3098 ILE 741 CG1 0.0002 -0.0066 -0.0133 3099 ILE 741 CG2 0.0009 -0.0091 -0.0096 3100 ILE 741 CD1 -0.0013 -0.0075 -0.0155 3101 ARG 742 N 0.0044 -0.0031 -0.0078 3102 ARG 742 CA 0.0054 -0.0030 -0.0058 3103 ARG 742 C 0.0054 -0.0017 -0.0069 3104 ARG 742 O 0.0054 -0.0026 -0.0060 3105 ARG 742 CB 0.0071 -0.0014 -0.0038 3106 ARG 742 CG 0.0073 -0.0029 -0.0021 3107 ARG 742 CD 0.0089 -0.0014 0.0002 3108 ARG 742 NE 0.0096 0.0011 -0.0008 3109 ARG 742 CZ 0.0096 0.0015 -0.0009 3110 ARG 742 NH1 0.0091 -0.0006 -0.0002 3111 ARG 742 NH2 0.0102 0.0039 -0.0018 3112 GLU 743 N 0.0038 0.0002 -0.0053 3113 GLU 743 CA 0.0038 -0.0000 -0.0057 3114 GLU 743 C 0.0035 -0.0002 -0.0059 3115 GLU 743 O 0.0033 -0.0005 -0.0061 3116 GLU 743 CB 0.0042 -0.0000 -0.0059 3117 GLU 743 CG 0.0044 0.0001 -0.0059 3118 GLU 743 CD 0.0049 0.0002 -0.0061 3119 GLU 743 OE1 0.0050 -0.0000 -0.0064 3120 GLU 743 OE2 0.0052 0.0004 -0.0059 3121 ALA 744 N 0.0035 -0.0002 -0.0058 3122 ALA 744 CA 0.0033 -0.0004 -0.0059 3123 ALA 744 C 0.0029 -0.0004 -0.0058 3124 ALA 744 O 0.0026 -0.0007 -0.0060 3125 ALA 744 CB 0.0034 -0.0002 -0.0058 3126 PHE 745 N 0.0027 -0.0003 -0.0054 3127 PHE 745 CA 0.0023 -0.0003 -0.0053 3128 PHE 745 C 0.0021 -0.0005 -0.0055 3129 PHE 745 O 0.0018 -0.0007 -0.0056 3130 PHE 745 CB 0.0022 -0.0001 -0.0049 3131 PHE 745 CG 0.0018 -0.0001 -0.0047 3132 PHE 745 CD1 0.0016 -0.0002 -0.0046 3133 PHE 745 CD2 0.0016 -0.0001 -0.0046 3134 PHE 745 CE1 0.0012 -0.0002 -0.0044 3135 PHE 745 CE2 0.0012 -0.0002 -0.0044 3136 PHE 745 CZ 0.0010 -0.0002 -0.0043 3137 ARG 746 N 0.0002 -0.0022 -0.0052 3138 ARG 746 CA -0.0002 -0.0028 -0.0056 3139 ARG 746 C 0.0002 -0.0029 -0.0047 3140 ARG 746 O -0.0000 -0.0031 -0.0050 3141 ARG 746 CB -0.0009 -0.0040 -0.0059 3142 ARG 746 CG -0.0014 -0.0039 -0.0069 3143 ARG 746 CD -0.0021 -0.0052 -0.0074 3144 ARG 746 NE -0.0027 -0.0054 -0.0081 3145 ARG 746 CZ -0.0028 -0.0063 -0.0078 3146 ARG 746 NH1 -0.0025 -0.0071 -0.0068 3147 ARG 746 NH2 -0.0033 -0.0065 -0.0085 3148 VAL 747 N 0.0008 -0.0029 -0.0036 3149 VAL 747 CA 0.0013 -0.0030 -0.0028 3150 VAL 747 C 0.0016 -0.0018 -0.0030 3151 VAL 747 O 0.0016 -0.0019 -0.0029 3152 VAL 747 CB 0.0020 -0.0031 -0.0016 3153 VAL 747 CG1 0.0025 -0.0030 -0.0007 3154 VAL 747 CG2 0.0017 -0.0043 -0.0013 3155 PHE 748 N 0.0018 -0.0007 -0.0034 3156 PHE 748 CA 0.0021 0.0004 -0.0036 3157 PHE 748 C 0.0015 0.0008 -0.0048 3158 PHE 748 O 0.0017 0.0015 -0.0050 3159 PHE 748 CB 0.0027 0.0014 -0.0031 3160 PHE 748 CG 0.0033 0.0011 -0.0019 3161 PHE 748 CD1 0.0038 0.0011 -0.0010 3162 PHE 748 CD2 0.0033 0.0007 -0.0017 3163 PHE 748 CE1 0.0044 0.0007 0.0001 3164 PHE 748 CE2 0.0038 0.0003 -0.0006 3165 PHE 748 CZ 0.0043 0.0004 0.0003 3166 ASP 749 N 0.0047 0.0015 -0.0045 3167 ASP 749 CA 0.0042 0.0015 -0.0043 3168 ASP 749 C 0.0040 0.0012 -0.0041 3169 ASP 749 O 0.0038 0.0013 -0.0040 3170 ASP 749 CB 0.0041 0.0021 -0.0042 3171 ASP 749 CG 0.0036 0.0021 -0.0039 3172 ASP 749 OD1 0.0034 0.0018 -0.0038 3173 ASP 749 OD2 0.0034 0.0026 -0.0038 3174 LYS 750 N 0.0040 0.0007 -0.0041 3175 LYS 750 CA 0.0038 0.0003 -0.0041 3176 LYS 750 C 0.0033 0.0003 -0.0038 3177 LYS 750 O 0.0032 0.0003 -0.0037 3178 LYS 750 CB 0.0039 -0.0003 -0.0041 3179 LYS 750 CG 0.0040 -0.0007 -0.0042 3180 LYS 750 CD 0.0044 -0.0005 -0.0044 3181 LYS 750 CE 0.0043 -0.0004 -0.0043 3182 LYS 750 NZ 0.0047 -0.0001 -0.0045 3183 ASP 751 N 0.0031 0.0005 -0.0036 3184 ASP 751 CA 0.0026 0.0005 -0.0034 3185 ASP 751 C 0.0024 0.0011 -0.0033 3186 ASP 751 O 0.0020 0.0012 -0.0031 3187 ASP 751 CB 0.0023 0.0003 -0.0032 3188 ASP 751 CG 0.0023 0.0007 -0.0032 3189 ASP 751 OD1 0.0026 0.0010 -0.0034 3190 ASP 751 OD2 0.0019 0.0007 -0.0030 3191 GLY 752 N 0.0019 0.0021 -0.0021 3192 GLY 752 CA 0.0022 0.0020 -0.0019 3193 GLY 752 C 0.0022 0.0018 -0.0016 3194 GLY 752 O 0.0025 0.0018 -0.0015 3195 ASN 753 N 0.0020 0.0017 -0.0016 3196 ASN 753 CA 0.0020 0.0016 -0.0013 3197 ASN 753 C 0.0020 0.0014 -0.0011 3198 ASN 753 O 0.0020 0.0012 -0.0009 3199 ASN 753 CB 0.0018 0.0015 -0.0014 3200 ASN 753 CG 0.0015 0.0015 -0.0014 3201 ASN 753 ND2 0.0014 0.0013 -0.0012 3202 ASN 753 OD1 0.0014 0.0015 -0.0015 3203 GLY 754 N 0.0018 0.0014 -0.0012 3204 GLY 754 CA 0.0017 0.0012 -0.0010 3205 GLY 754 C 0.0014 0.0011 -0.0009 3206 GLY 754 O 0.0013 0.0009 -0.0008 3207 TYR 755 N 0.0006 0.0006 -0.0009 3208 TYR 755 CA 0.0003 0.0006 -0.0009 3209 TYR 755 C 0.0001 0.0008 -0.0011 3210 TYR 755 O 0.0002 0.0010 -0.0012 3211 TYR 755 CB 0.0003 0.0006 -0.0009 3212 TYR 755 CG 0.0005 0.0003 -0.0007 3213 TYR 755 CD1 0.0003 0.0001 -0.0005 3214 TYR 755 CD2 0.0008 0.0003 -0.0007 3215 TYR 755 CE1 0.0005 -0.0001 -0.0003 3216 TYR 755 CE2 0.0009 0.0001 -0.0005 3217 TYR 755 CZ 0.0008 -0.0001 -0.0003 3218 TYR 755 OH 0.0009 -0.0003 -0.0002 3219 ILE 756 N -0.0001 0.0008 -0.0010 3220 ILE 756 CA -0.0004 0.0010 -0.0012 3221 ILE 756 C -0.0006 0.0010 -0.0012 3222 ILE 756 O -0.0008 0.0009 -0.0011 3223 ILE 756 CB -0.0005 0.0010 -0.0011 3224 ILE 756 CG1 -0.0003 0.0009 -0.0011 3225 ILE 756 CG2 -0.0008 0.0012 -0.0013 3226 ILE 756 CD1 -0.0005 0.0009 -0.0010 3227 SER 757 N -0.0005 0.0012 -0.0014 3228 SER 757 CA -0.0007 0.0013 -0.0014 3229 SER 757 C -0.0010 0.0014 -0.0015 3230 SER 757 O -0.0010 0.0015 -0.0016 3231 SER 757 CB -0.0006 0.0014 -0.0015 3232 SER 757 OG -0.0005 0.0016 -0.0017 3233 ALA 758 N 0.0002 0.0013 -0.0002 3234 ALA 758 CA 0.0004 0.0011 -0.0002 3235 ALA 758 C 0.0005 0.0004 -0.0008 3236 ALA 758 O 0.0010 -0.0000 -0.0009 3237 ALA 758 CB -0.0001 0.0017 -0.0000 3238 ALA 759 N -0.0002 0.0002 -0.0014 3239 ALA 759 CA -0.0002 -0.0006 -0.0020 3240 ALA 759 C 0.0006 -0.0012 -0.0021 3241 ALA 759 O 0.0010 -0.0017 -0.0023 3242 ALA 759 CB -0.0010 -0.0006 -0.0026 3243 GLU 760 N 0.0008 -0.0010 -0.0018 3244 GLU 760 CA 0.0015 -0.0015 -0.0018 3245 GLU 760 C 0.0023 -0.0016 -0.0014 3246 GLU 760 O 0.0028 -0.0022 -0.0016 3247 GLU 760 CB 0.0016 -0.0013 -0.0016 3248 GLU 760 CG 0.0009 -0.0014 -0.0021 3249 GLU 760 CD 0.0009 -0.0011 -0.0018 3250 GLU 760 OE1 0.0011 -0.0005 -0.0012 3251 GLU 760 OE2 0.0008 -0.0014 -0.0022 3252 LEU 761 N 0.0022 -0.0035 0.0012 3253 LEU 761 CA 0.0035 -0.0035 0.0012 3254 LEU 761 C 0.0034 -0.0045 -0.0001 3255 LEU 761 O 0.0048 -0.0050 -0.0007 3256 LEU 761 CB 0.0033 -0.0024 0.0027 3257 LEU 761 CG 0.0049 -0.0022 0.0030 3258 LEU 761 CD1 0.0067 -0.0022 0.0030 3259 LEU 761 CD2 0.0045 -0.0012 0.0044 3260 ARG 762 N 0.0017 -0.0048 -0.0006 3261 ARG 762 CA 0.0014 -0.0058 -0.0020 3262 ARG 762 C 0.0022 -0.0068 -0.0033 3263 ARG 762 O 0.0032 -0.0074 -0.0042 3264 ARG 762 CB -0.0007 -0.0059 -0.0023 3265 ARG 762 CG -0.0012 -0.0070 -0.0038 3266 ARG 762 CD -0.0008 -0.0071 -0.0038 3267 ARG 762 NE 0.0011 -0.0074 -0.0042 3268 ARG 762 CZ 0.0019 -0.0072 -0.0040 3269 ARG 762 NH1 0.0010 -0.0068 -0.0034 3270 ARG 762 NH2 0.0036 -0.0076 -0.0044 3271 HIS 763 N 0.0019 -0.0069 -0.0035 3272 HIS 763 CA 0.0026 -0.0078 -0.0047 3273 HIS 763 C 0.0047 -0.0078 -0.0046 3274 HIS 763 O 0.0056 -0.0087 -0.0058 3275 HIS 763 CB 0.0019 -0.0077 -0.0046 3276 HIS 763 CG 0.0028 -0.0085 -0.0057 3277 HIS 763 CD2 0.0043 -0.0084 -0.0055 3278 HIS 763 ND1 0.0022 -0.0096 -0.0071 3279 HIS 763 CE1 0.0032 -0.0101 -0.0078 3280 HIS 763 NE2 0.0045 -0.0094 -0.0068 3281 VAL 764 N 0.0015 -0.0116 0.0004 3282 VAL 764 CA 0.0028 -0.0114 0.0004 3283 VAL 764 C 0.0055 -0.0120 0.0005 3284 VAL 764 O 0.0066 -0.0133 0.0006 3285 VAL 764 CB 0.0025 -0.0089 0.0003 3286 VAL 764 CG1 0.0042 -0.0086 0.0003 3287 VAL 764 CG2 -0.0001 -0.0087 0.0003 3288 MET 765 N 0.0066 -0.0111 0.0004 3289 MET 765 CA 0.0091 -0.0116 0.0005 3290 MET 765 C 0.0095 -0.0143 0.0006 3291 MET 765 O 0.0112 -0.0153 0.0007 3292 MET 765 CB 0.0100 -0.0101 0.0004 3293 MET 765 CG 0.0103 -0.0074 0.0003 3294 MET 765 SD 0.0118 -0.0069 0.0003 3295 MET 765 CE 0.0121 -0.0037 0.0001 3296 THR 766 N 0.0079 -0.0154 0.0007 3297 THR 766 CA 0.0082 -0.0180 0.0008 3298 THR 766 C 0.0078 -0.0195 0.0009 3299 THR 766 O 0.0091 -0.0212 0.0010 3300 THR 766 CB 0.0064 -0.0187 0.0009 3301 THR 766 CG2 0.0065 -0.0214 0.0010 3302 THR 766 OG1 0.0069 -0.0175 0.0008 3303 ASN 767 N 0.0041 -0.0203 0.0067 3304 ASN 767 CA 0.0029 -0.0213 0.0073 3305 ASN 767 C 0.0046 -0.0207 0.0067 3306 ASN 767 O 0.0048 -0.0223 0.0073 3307 ASN 767 CB -0.0002 -0.0200 0.0075 3308 ASN 767 CG -0.0017 -0.0213 0.0082 3309 ASN 767 ND2 -0.0035 -0.0196 0.0080 3310 ASN 767 OD1 -0.0014 -0.0237 0.0091 3311 LEU 768 N 0.0059 -0.0184 0.0056 3312 LEU 768 CA 0.0075 -0.0176 0.0050 3313 LEU 768 C 0.0105 -0.0189 0.0049 3314 LEU 768 O 0.0121 -0.0183 0.0043 3315 LEU 768 CB 0.0076 -0.0145 0.0038 3316 LEU 768 CG 0.0047 -0.0130 0.0038 3317 LEU 768 CD1 0.0050 -0.0100 0.0026 3318 LEU 768 CD2 0.0036 -0.0139 0.0044 3319 GLY 769 N 0.0114 -0.0205 0.0053 3320 GLY 769 CA 0.0142 -0.0218 0.0052 3321 GLY 769 C 0.0165 -0.0199 0.0041 3322 GLY 769 O 0.0190 -0.0208 0.0039 3323 GLU 770 N 0.0127 -0.0260 0.0001 3324 GLU 770 CA 0.0161 -0.0214 0.0004 3325 GLU 770 C 0.0156 -0.0227 0.0003 3326 GLU 770 O 0.0111 -0.0249 0.0001 3327 GLU 770 CB 0.0136 -0.0152 0.0007 3328 GLU 770 CG 0.0135 -0.0136 0.0007 3329 GLU 770 CD 0.0195 -0.0117 0.0009 3330 GLU 770 OE1 0.0209 -0.0063 0.0012 3331 GLU 770 OE2 0.0228 -0.0155 0.0007 3332 LYS 771 N 0.0204 -0.0213 0.0004 3333 LYS 771 CA 0.0209 -0.0227 0.0003 3334 LYS 771 C 0.0205 -0.0169 0.0006 3335 LYS 771 O 0.0250 -0.0142 0.0008 3336 LYS 771 CB 0.0266 -0.0261 0.0002 3337 LYS 771 CG 0.0268 -0.0324 -0.0001 3338 LYS 771 CD 0.0231 -0.0367 -0.0004 3339 LYS 771 CE 0.0172 -0.0382 -0.0005 3340 LYS 771 NZ 0.0132 -0.0416 -0.0008 3341 LEU 772 N 0.0150 -0.0151 0.0007 3342 LEU 772 CA 0.0138 -0.0098 0.0010 3343 LEU 772 C 0.0096 -0.0115 0.0008 3344 LEU 772 O 0.0054 -0.0150 0.0006 3345 LEU 772 CB 0.0109 -0.0050 0.0012 3346 LEU 772 CG 0.0141 -0.0038 0.0013 3347 LEU 772 CD1 0.0104 0.0002 0.0015 3348 LEU 772 CD2 0.0205 -0.0014 0.0015 3349 THR 773 N -0.0028 -0.0011 0.0081 3350 THR 773 CA -0.0067 0.0006 0.0057 3351 THR 773 C -0.0081 0.0017 0.0056 3352 THR 773 O -0.0065 0.0016 0.0080 3353 THR 773 CB -0.0091 0.0032 0.0075 3354 THR 773 CG2 -0.0092 0.0054 0.0118 3355 THR 773 OG1 -0.0128 0.0047 0.0049 3356 ASP 774 N -0.0113 0.0026 0.0027 3357 ASP 774 CA -0.0130 0.0036 0.0023 3358 ASP 774 C -0.0138 0.0062 0.0063 3359 ASP 774 O -0.0135 0.0064 0.0074 3360 ASP 774 CB -0.0165 0.0045 -0.0013 3361 ASP 774 CG -0.0156 0.0019 -0.0055 3362 ASP 774 OD1 -0.0127 -0.0003 -0.0056 3363 ASP 774 OD2 -0.0179 0.0021 -0.0087 3364 GLU 775 N -0.0150 0.0081 0.0085 3365 GLU 775 CA -0.0158 0.0105 0.0125 3366 GLU 775 C -0.0122 0.0094 0.0156 3367 GLU 775 O -0.0123 0.0105 0.0179 3368 GLU 775 CB -0.0175 0.0126 0.0142 3369 GLU 776 N -0.0070 0.0073 0.0155 3370 GLU 776 CA -0.0056 0.0056 0.0174 3371 GLU 776 C -0.0051 0.0038 0.0157 3372 GLU 776 O -0.0045 0.0033 0.0168 3373 GLU 776 CB -0.0043 0.0038 0.0186 3374 GLU 776 CG -0.0043 0.0052 0.0210 3375 GLU 776 CD -0.0031 0.0034 0.0219 3376 GLU 776 OE1 -0.0017 0.0018 0.0237 3377 GLU 776 OE2 -0.0035 0.0036 0.0208 3378 VAL 777 N -0.0055 0.0030 0.0129 3379 VAL 777 CA -0.0051 0.0014 0.0110 3380 VAL 777 C -0.0061 0.0030 0.0106 3381 VAL 777 O -0.0056 0.0021 0.0109 3382 VAL 777 CB -0.0054 0.0002 0.0081 3383 VAL 777 CG1 -0.0054 -0.0010 0.0060 3384 VAL 777 CG2 -0.0041 -0.0018 0.0086 3385 ASP 778 N -0.0077 0.0054 0.0099 3386 ASP 778 CA -0.0087 0.0071 0.0095 3387 ASP 778 C -0.0082 0.0077 0.0124 3388 ASP 778 O -0.0083 0.0079 0.0123 3389 ASP 778 CB -0.0104 0.0097 0.0084 3390 ASP 778 CG -0.0110 0.0092 0.0052 3391 ASP 778 OD1 -0.0101 0.0070 0.0044 3392 ASP 778 OD2 -0.0125 0.0109 0.0036 3393 GLU 779 N -0.0106 0.0095 0.0109 3394 GLU 779 CA -0.0104 0.0094 0.0136 3395 GLU 779 C -0.0085 0.0075 0.0144 3396 GLU 779 O -0.0082 0.0073 0.0161 3397 GLU 779 CB -0.0111 0.0102 0.0152 3398 GLU 779 CG -0.0110 0.0103 0.0181 3399 GLU 779 CD -0.0117 0.0111 0.0188 3400 GLU 779 OE1 -0.0133 0.0127 0.0181 3401 GLU 779 OE2 -0.0107 0.0102 0.0201 3402 MET 780 N -0.0072 0.0061 0.0132 3403 MET 780 CA -0.0053 0.0042 0.0137 3404 MET 780 C -0.0051 0.0039 0.0130 3405 MET 780 O -0.0043 0.0032 0.0145 3406 MET 780 CB -0.0040 0.0028 0.0123 3407 MET 780 CG -0.0038 0.0026 0.0133 3408 MET 780 SD -0.0025 0.0011 0.0113 3409 MET 780 CE -0.0003 -0.0012 0.0120 3410 ILE 781 N -0.0057 0.0044 0.0107 3411 ILE 781 CA -0.0056 0.0042 0.0098 3412 ILE 781 C -0.0065 0.0053 0.0117 3413 ILE 781 O -0.0058 0.0046 0.0125 3414 ILE 781 CB -0.0064 0.0049 0.0071 3415 ILE 781 CG1 -0.0054 0.0037 0.0052 3416 ILE 781 CG2 -0.0062 0.0047 0.0063 3417 ILE 781 CD1 -0.0036 0.0018 0.0045 3418 ARG 782 N -0.0087 0.0052 0.0093 3419 ARG 782 CA -0.0093 0.0067 0.0104 3420 ARG 782 C -0.0085 0.0059 0.0125 3421 ARG 782 O -0.0085 0.0062 0.0129 3422 ARG 782 CB -0.0102 0.0086 0.0111 3423 ARG 782 CG -0.0111 0.0104 0.0115 3424 ARG 782 CD -0.0116 0.0119 0.0131 3425 ARG 782 NE -0.0107 0.0110 0.0152 3426 ARG 782 CZ -0.0102 0.0106 0.0167 3427 ARG 782 NH1 -0.0105 0.0111 0.0164 3428 ARG 782 NH2 -0.0094 0.0097 0.0184 3429 GLU 783 N -0.0077 0.0051 0.0139 3430 GLU 783 CA -0.0069 0.0044 0.0159 3431 GLU 783 C -0.0062 0.0028 0.0155 3432 GLU 783 O -0.0060 0.0028 0.0165 3433 GLU 783 CB -0.0063 0.0036 0.0173 3434 GLU 783 CG -0.0053 0.0025 0.0192 3435 GLU 783 CD -0.0047 0.0019 0.0206 3436 GLU 783 OE1 -0.0052 0.0033 0.0219 3437 GLU 783 OE2 -0.0038 0.0002 0.0204 3438 ALA 784 N -0.0057 0.0013 0.0138 3439 ALA 784 CA -0.0049 -0.0002 0.0134 3440 ALA 784 C -0.0055 0.0004 0.0119 3441 ALA 784 O -0.0050 -0.0008 0.0116 3442 ALA 784 CB -0.0041 -0.0022 0.0123 3443 ASP 785 N -0.0110 0.0040 0.0113 3444 ASP 785 CA -0.0104 0.0040 0.0104 3445 ASP 785 C -0.0109 0.0036 0.0118 3446 ASP 785 O -0.0121 0.0047 0.0123 3447 ASP 785 CB -0.0109 0.0057 0.0089 3448 ASP 785 CG -0.0100 0.0056 0.0076 3449 ASP 785 OD1 -0.0089 0.0043 0.0078 3450 ASP 785 OD2 -0.0104 0.0070 0.0064 3451 ILE 786 N -0.0100 0.0020 0.0125 3452 ILE 786 CA -0.0103 0.0014 0.0139 3453 ILE 786 C -0.0101 0.0017 0.0130 3454 ILE 786 O -0.0109 0.0022 0.0138 3455 ILE 786 CB -0.0094 -0.0005 0.0150 3456 ILE 786 CG1 -0.0098 -0.0007 0.0161 3457 ILE 786 CG2 -0.0095 -0.0012 0.0163 3458 ILE 786 CD1 -0.0087 -0.0024 0.0165 3459 ASP 787 N -0.0088 0.0015 0.0114 3460 ASP 787 CA -0.0084 0.0017 0.0105 3461 ASP 787 C -0.0095 0.0035 0.0097 3462 ASP 787 O -0.0098 0.0039 0.0096 3463 ASP 787 CB -0.0068 0.0009 0.0091 3464 ASP 787 CG -0.0066 0.0020 0.0073 3465 ASP 787 OD1 -0.0069 0.0031 0.0062 3466 ASP 787 OD2 -0.0062 0.0017 0.0070 3467 GLY 788 N -0.0071 0.0071 0.0094 3468 GLY 788 CA -0.0082 0.0084 0.0086 3469 GLY 788 C -0.0081 0.0086 0.0066 3470 GLY 788 O -0.0091 0.0097 0.0059 3471 ASP 789 N -0.0070 0.0077 0.0056 3472 ASP 789 CA -0.0068 0.0079 0.0037 3473 ASP 789 C -0.0071 0.0083 0.0026 3474 ASP 789 O -0.0069 0.0085 0.0010 3475 ASP 789 CB -0.0054 0.0066 0.0030 3476 ASP 789 CG -0.0045 0.0055 0.0033 3477 ASP 789 OD1 -0.0047 0.0056 0.0046 3478 ASP 789 OD2 -0.0034 0.0046 0.0024 3479 GLY 790 N -0.0075 0.0086 0.0036 3480 GLY 790 CA -0.0078 0.0090 0.0027 3481 GLY 790 C -0.0066 0.0079 0.0022 3482 GLY 790 O -0.0067 0.0082 0.0014 3483 GLN 791 N -0.0045 0.0044 0.0021 3484 GLN 791 CA -0.0040 0.0039 0.0019 3485 GLN 791 C -0.0041 0.0027 0.0028 3486 GLN 791 O -0.0044 0.0023 0.0035 3487 GLN 791 CB -0.0030 0.0037 0.0009 3488 GLN 791 CG -0.0029 0.0048 -0.0000 3489 GLN 791 CD -0.0019 0.0046 -0.0011 3490 GLN 791 NE2 -0.0017 0.0055 -0.0019 3491 GLN 791 OE1 -0.0013 0.0038 -0.0011 3492 VAL 792 N -0.0039 0.0023 0.0029 3493 VAL 792 CA -0.0039 0.0012 0.0037 3494 VAL 792 C -0.0029 0.0003 0.0032 3495 VAL 792 O -0.0025 0.0005 0.0026 3496 VAL 792 CB -0.0046 0.0014 0.0043 3497 VAL 792 CG1 -0.0046 0.0003 0.0051 3498 VAL 792 CG2 -0.0056 0.0024 0.0048 3499 ASN 793 N -0.0026 -0.0006 0.0034 3500 ASN 793 CA -0.0016 -0.0016 0.0030 3501 ASN 793 C -0.0018 -0.0024 0.0037 3502 ASN 793 O -0.0025 -0.0022 0.0045 3503 ASN 793 CB -0.0012 -0.0022 0.0029 3504 ASN 793 CG -0.0018 -0.0026 0.0039 3505 ASN 793 ND2 -0.0020 -0.0021 0.0038 3506 ASN 793 OD1 -0.0021 -0.0033 0.0047 3507 TYR 794 N -0.0013 -0.0028 0.0005 3508 TYR 794 CA -0.0005 -0.0039 0.0014 3509 TYR 794 C -0.0010 -0.0046 0.0036 3510 TYR 794 O -0.0012 -0.0050 0.0046 3511 TYR 794 CB 0.0014 -0.0051 0.0006 3512 TYR 794 CG 0.0024 -0.0063 0.0016 3513 TYR 794 CD1 0.0024 -0.0062 0.0014 3514 TYR 794 CD2 0.0034 -0.0076 0.0028 3515 TYR 794 CE1 0.0033 -0.0074 0.0023 3516 TYR 794 CE2 0.0042 -0.0088 0.0037 3517 TYR 794 CZ 0.0042 -0.0086 0.0035 3518 TYR 794 OH 0.0051 -0.0098 0.0044 3519 GLU 795 N -0.0013 -0.0048 0.0044 3520 GLU 795 CA -0.0018 -0.0054 0.0065 3521 GLU 795 C -0.0035 -0.0045 0.0074 3522 GLU 795 O -0.0037 -0.0050 0.0088 3523 GLU 795 CB -0.0019 -0.0056 0.0070 3524 GLU 795 CG -0.0001 -0.0067 0.0065 3525 GLU 795 CD 0.0006 -0.0062 0.0044 3526 GLU 795 OE1 -0.0003 -0.0049 0.0033 3527 GLU 795 OE2 0.0021 -0.0071 0.0038 3528 GLU 796 N -0.0047 -0.0031 0.0066 3529 GLU 796 CA -0.0064 -0.0022 0.0074 3530 GLU 796 C -0.0063 -0.0021 0.0070 3531 GLU 796 O -0.0073 -0.0019 0.0083 3532 GLU 796 CB -0.0077 -0.0007 0.0064 3533 GLU 796 CG -0.0080 -0.0007 0.0069 3534 GLU 796 CD -0.0088 0.0006 0.0055 3535 GLU 796 OE1 -0.0090 0.0015 0.0041 3536 GLU 796 OE2 -0.0092 0.0008 0.0057 3537 PHE 797 N -0.0055 -0.0010 0.0044 3538 PHE 797 CA -0.0049 -0.0010 0.0033 3539 PHE 797 C -0.0037 -0.0016 0.0047 3540 PHE 797 O -0.0040 -0.0015 0.0047 3541 PHE 797 CB -0.0036 -0.0008 0.0014 3542 PHE 797 CG -0.0032 -0.0006 0.0001 3543 PHE 797 CD1 -0.0046 0.0000 -0.0010 3544 PHE 797 CD2 -0.0013 -0.0011 -0.0000 3545 PHE 797 CE1 -0.0041 0.0002 -0.0022 3546 PHE 797 CE2 -0.0008 -0.0009 -0.0012 3547 PHE 797 CZ -0.0022 -0.0003 -0.0023 3548 VAL 798 N -0.0024 -0.0022 0.0058 3549 VAL 798 CA -0.0013 -0.0028 0.0072 3550 VAL 798 C -0.0027 -0.0029 0.0088 3551 VAL 798 O -0.0026 -0.0030 0.0094 3552 VAL 798 CB 0.0003 -0.0035 0.0080 3553 VAL 798 CG1 0.0012 -0.0042 0.0097 3554 VAL 798 CG2 0.0019 -0.0035 0.0064 3555 GLN 799 N -0.0041 -0.0027 0.0096 3556 GLN 799 CA -0.0056 -0.0027 0.0111 3557 GLN 799 C -0.0067 -0.0022 0.0104 3558 GLN 799 O -0.0070 -0.0024 0.0115 3559 GLN 799 CB -0.0070 -0.0024 0.0117 3560 GLN 799 CG -0.0061 -0.0028 0.0124 3561 GLN 799 CD -0.0048 -0.0036 0.0141 3562 GLN 799 NE2 -0.0055 -0.0038 0.0157 3563 GLN 799 OE1 -0.0031 -0.0040 0.0139 3564 MET 800 N -0.0044 0.0004 0.0084 3565 MET 800 CA -0.0042 -0.0000 0.0079 3566 MET 800 C -0.0048 0.0010 0.0074 3567 MET 800 O -0.0047 0.0008 0.0064 3568 MET 800 CB -0.0037 -0.0007 0.0091 3569 MET 800 CG -0.0035 -0.0011 0.0087 3570 MET 800 SD -0.0041 -0.0001 0.0091 3571 MET 800 CE -0.0041 0.0002 0.0109 3572 MET 801 N -0.0053 0.0020 0.0081 3573 MET 801 CA -0.0059 0.0030 0.0077 3574 MET 801 C -0.0063 0.0035 0.0064 3575 MET 801 O -0.0065 0.0038 0.0055 3576 MET 801 CB -0.0064 0.0039 0.0089 3577 MET 801 CG -0.0061 0.0035 0.0101 3578 MET 801 SD -0.0060 0.0032 0.0097 3579 MET 801 CE -0.0068 0.0047 0.0095 3580 THR 802 N -0.0064 0.0037 0.0064 3581 THR 802 CA -0.0068 0.0042 0.0052 3582 THR 802 C -0.0062 0.0032 0.0043 3583 THR 802 O -0.0060 0.0029 0.0042 3584 THR 802 CB -0.0072 0.0049 0.0057 3585 THR 802 CG2 -0.0076 0.0058 0.0068 3586 THR 802 OG1 -0.0067 0.0042 0.0062 3587 ALA 803 N -0.0242 0.0048 0.0017 3588 ALA 803 CA -0.0079 0.0029 -0.0091 3589 ALA 803 C -0.0079 0.0045 -0.0175 3590 ALA 803 O -0.0180 0.0058 -0.0117 3591 ALA 803 CB 0.0086 -0.0033 0.0019 3592 LYS 804 N 0.0039 0.0042 -0.0309 3593 LYS 804 CA 0.0057 0.0057 -0.0410 3594 LYS 804 C 0.0106 0.0022 -0.0290 3595 LYS 804 O 0.0030 0.0042 -0.0300 3596 LYS 804 CB 0.0196 0.0053 -0.0564 3597 LYS 804 CG 0.0190 0.0074 -0.0668 3598 LYS 804 CD 0.0004 0.0131 -0.0724 3599 LYS 804 CE -0.0044 0.0132 -0.0671 3600 LYS 804 NZ -0.0179 0.0136 -0.0520 3601 LYS 804 OXT 0.0221 -0.0028 -0.0181