1 GLY 5 N -0.0009 0.0034 -0.0012 2 GLY 5 CA -0.0019 0.0037 -0.0006 3 GLY 5 C -0.0027 0.0045 -0.0014 4 GLY 5 O -0.0027 0.0048 -0.0021 5 LEU 6 N -0.0033 0.0046 -0.0011 6 LEU 6 CA -0.0040 0.0053 -0.0018 7 LEU 6 C -0.0038 0.0054 -0.0022 8 LEU 6 O -0.0035 0.0050 -0.0015 9 LEU 6 CB -0.0051 0.0056 -0.0011 10 LEU 6 CG -0.0060 0.0064 -0.0018 11 LEU 6 CD1 -0.0057 0.0066 -0.0027 12 LEU 6 CD2 -0.0071 0.0066 -0.0011 13 TYR 7 N -0.0033 0.0039 -0.0023 14 TYR 7 CA -0.0033 0.0044 -0.0028 15 TYR 7 C -0.0040 0.0053 -0.0035 16 TYR 7 O -0.0042 0.0057 -0.0038 17 TYR 7 CB -0.0020 0.0043 -0.0033 18 TYR 7 CG -0.0013 0.0035 -0.0027 19 TYR 7 CD1 -0.0008 0.0028 -0.0022 20 TYR 7 CD2 -0.0011 0.0034 -0.0027 21 TYR 7 CE1 -0.0002 0.0020 -0.0016 22 TYR 7 CE2 -0.0004 0.0026 -0.0021 23 TYR 7 CZ 0.0000 0.0019 -0.0016 24 TYR 7 OH 0.0007 0.0011 -0.0011 25 ARG 8 N -0.0044 0.0057 -0.0037 26 ARG 8 CA -0.0051 0.0067 -0.0044 27 ARG 8 C -0.0046 0.0071 -0.0051 28 ARG 8 O -0.0044 0.0069 -0.0049 29 ARG 8 CB -0.0064 0.0067 -0.0039 30 ARG 8 CG -0.0072 0.0077 -0.0046 31 ARG 8 CD -0.0084 0.0077 -0.0041 32 ARG 8 NE -0.0091 0.0074 -0.0034 33 ARG 8 CZ -0.0097 0.0068 -0.0026 34 ARG 8 NH1 -0.0097 0.0066 -0.0024 35 ARG 8 NH2 -0.0103 0.0065 -0.0021 36 MET 9 N -0.0081 0.0056 -0.0040 37 MET 9 CA -0.0079 0.0065 -0.0043 38 MET 9 C -0.0084 0.0072 -0.0046 39 MET 9 O -0.0083 0.0074 -0.0047 40 MET 9 CB -0.0068 0.0067 -0.0044 41 MET 9 CG -0.0065 0.0077 -0.0048 42 MET 9 SD -0.0052 0.0080 -0.0048 43 MET 9 CE -0.0050 0.0077 -0.0047 44 THR 10 N -0.0091 0.0078 -0.0049 45 THR 10 CA -0.0096 0.0086 -0.0052 46 THR 10 C -0.0093 0.0094 -0.0055 47 THR 10 O -0.0093 0.0094 -0.0055 48 THR 10 CB -0.0107 0.0084 -0.0052 49 THR 10 CG2 -0.0111 0.0082 -0.0051 50 THR 10 OG1 -0.0112 0.0092 -0.0055 51 TYR 11 N -0.0119 0.0080 -0.0045 52 TYR 11 CA -0.0119 0.0087 -0.0042 53 TYR 11 C -0.0118 0.0092 -0.0039 54 TYR 11 O -0.0115 0.0090 -0.0040 55 TYR 11 CB -0.0114 0.0087 -0.0040 56 TYR 11 CG -0.0106 0.0088 -0.0038 57 TYR 11 CD1 -0.0101 0.0083 -0.0039 58 TYR 11 CD2 -0.0104 0.0095 -0.0035 59 TYR 11 CE1 -0.0094 0.0083 -0.0037 60 TYR 11 CE2 -0.0097 0.0096 -0.0033 61 TYR 11 CZ -0.0092 0.0090 -0.0034 62 TYR 11 OH -0.0085 0.0091 -0.0032 63 ILE 12 N -0.0119 0.0099 -0.0037 64 ILE 12 CA -0.0118 0.0104 -0.0034 65 ILE 12 C -0.0114 0.0110 -0.0031 66 ILE 12 O -0.0113 0.0109 -0.0031 67 ILE 12 CB -0.0125 0.0108 -0.0035 68 ILE 12 CG1 -0.0129 0.0112 -0.0034 69 ILE 12 CG2 -0.0130 0.0103 -0.0038 70 ILE 12 CD1 -0.0137 0.0113 -0.0036 71 SER 13 N -0.0123 0.0104 -0.0022 72 SER 13 CA -0.0118 0.0113 -0.0014 73 SER 13 C -0.0118 0.0120 -0.0010 74 SER 13 O -0.0119 0.0116 -0.0013 75 SER 13 CB -0.0106 0.0108 -0.0010 76 SER 13 OG -0.0098 0.0108 -0.0006 77 ARG 14 N -0.0116 0.0130 -0.0003 78 ARG 14 CA -0.0116 0.0138 0.0002 79 ARG 14 C -0.0103 0.0139 0.0010 80 ARG 14 O -0.0098 0.0142 0.0014 81 ARG 14 CB -0.0124 0.0149 0.0005 82 ARG 14 CG -0.0136 0.0149 -0.0002 83 ARG 14 CD -0.0144 0.0161 0.0000 84 ARG 14 NE -0.0156 0.0160 -0.0006 85 ARG 14 CZ -0.0163 0.0159 -0.0011 86 ARG 14 NH1 -0.0160 0.0158 -0.0010 87 ARG 14 NH2 -0.0174 0.0159 -0.0017 88 ALA 15 N -0.0106 0.0128 0.0017 89 ALA 15 CA -0.0102 0.0127 0.0020 90 ALA 15 C -0.0099 0.0136 0.0018 91 ALA 15 O -0.0103 0.0142 0.0013 92 ALA 15 CB -0.0106 0.0121 0.0019 93 VAL 16 N -0.0093 0.0137 0.0022 94 VAL 16 CA -0.0090 0.0145 0.0020 95 VAL 16 C -0.0096 0.0146 0.0016 96 VAL 16 O -0.0100 0.0139 0.0016 97 VAL 16 CB -0.0082 0.0145 0.0026 98 VAL 16 CG1 -0.0076 0.0147 0.0029 99 VAL 16 CG2 -0.0082 0.0137 0.0029 100 PRO 17 N -0.0103 0.0175 0.0001 101 PRO 17 CA -0.0115 0.0169 -0.0013 102 PRO 17 C -0.0118 0.0154 -0.0004 103 PRO 17 O -0.0130 0.0142 -0.0012 104 PRO 17 CB -0.0111 0.0189 -0.0024 105 PRO 17 CG -0.0096 0.0204 -0.0014 106 PRO 17 CD -0.0091 0.0196 -0.0000 107 GLY 18 N -0.0106 0.0155 0.0013 108 GLY 18 CA -0.0107 0.0143 0.0021 109 GLY 18 C -0.0110 0.0123 0.0034 110 GLY 18 O -0.0107 0.0114 0.0046 111 LEU 19 N -0.0110 0.0092 0.0035 112 LEU 19 CA -0.0110 0.0080 0.0041 113 LEU 19 C -0.0111 0.0059 0.0037 114 LEU 19 O -0.0112 0.0053 0.0023 115 LEU 19 CB -0.0110 0.0087 0.0029 116 LEU 19 CG -0.0110 0.0081 0.0037 117 LEU 19 CD1 -0.0109 0.0095 0.0052 118 LEU 19 CD2 -0.0111 0.0079 0.0020 119 GLY 20 N -0.0111 0.0047 0.0050 120 GLY 20 CA -0.0112 0.0026 0.0048 121 GLY 20 C -0.0113 0.0015 0.0051 122 GLY 20 O -0.0112 0.0024 0.0051 123 TYR 21 N -0.0092 -0.0024 0.0055 124 TYR 21 CA -0.0090 -0.0020 0.0051 125 TYR 21 C -0.0104 -0.0012 0.0063 126 TYR 21 O -0.0105 -0.0000 0.0060 127 TYR 21 CB -0.0083 -0.0039 0.0049 128 TYR 21 CG -0.0068 -0.0045 0.0035 129 TYR 21 CD1 -0.0064 -0.0057 0.0034 130 TYR 21 CD2 -0.0058 -0.0039 0.0022 131 TYR 21 CE1 -0.0050 -0.0062 0.0021 132 TYR 21 CE2 -0.0044 -0.0045 0.0009 133 TYR 21 CZ -0.0040 -0.0057 0.0008 134 TYR 21 OH -0.0027 -0.0062 -0.0005 135 ASN 22 N -0.0115 -0.0018 0.0077 136 ASN 22 CA -0.0128 -0.0011 0.0089 137 ASN 22 C -0.0133 0.0011 0.0088 138 ASN 22 O -0.0138 0.0021 0.0089 139 ASN 22 CB -0.0138 -0.0022 0.0104 140 ASN 22 CG -0.0133 -0.0043 0.0107 141 ASN 22 ND2 -0.0139 -0.0054 0.0117 142 ASN 22 OD1 -0.0125 -0.0050 0.0100 143 ASP 23 N -0.0117 0.0037 0.0073 144 ASP 23 CA -0.0120 0.0049 0.0071 145 ASP 23 C -0.0117 0.0051 0.0062 146 ASP 23 O -0.0119 0.0058 0.0063 147 ASP 23 CB -0.0120 0.0055 0.0069 148 ASP 23 CG -0.0124 0.0055 0.0079 149 ASP 23 OD1 -0.0128 0.0061 0.0086 150 ASP 23 OD2 -0.0123 0.0049 0.0080 151 LEU 24 N -0.0113 0.0046 0.0053 152 LEU 24 CA -0.0110 0.0048 0.0044 153 LEU 24 C -0.0110 0.0045 0.0047 154 LEU 24 O -0.0111 0.0051 0.0044 155 LEU 24 CB -0.0105 0.0041 0.0035 156 LEU 24 CG -0.0104 0.0046 0.0028 157 LEU 24 CD1 -0.0100 0.0038 0.0020 158 LEU 24 CD2 -0.0105 0.0057 0.0023 159 ARG 25 N -0.0109 0.0028 0.0050 160 ARG 25 CA -0.0110 0.0026 0.0053 161 ARG 25 C -0.0119 0.0036 0.0063 162 ARG 25 O -0.0120 0.0041 0.0063 163 ARG 25 CB -0.0109 0.0010 0.0058 164 ARG 25 CG -0.0114 0.0004 0.0071 165 ARG 25 CD -0.0112 -0.0011 0.0076 166 ARG 25 NE -0.0113 -0.0022 0.0082 167 ARG 25 CZ -0.0107 -0.0034 0.0078 168 ARG 25 NH1 -0.0100 -0.0039 0.0067 169 ARG 25 NH2 -0.0108 -0.0043 0.0084 170 ASP 26 N -0.0124 0.0039 0.0073 171 ASP 26 CA -0.0132 0.0050 0.0082 172 ASP 26 C -0.0132 0.0065 0.0074 173 ASP 26 O -0.0136 0.0072 0.0077 174 ASP 26 CB -0.0138 0.0051 0.0092 175 ASP 26 CG -0.0146 0.0060 0.0103 176 ASP 26 OD1 -0.0149 0.0058 0.0109 177 ASP 26 OD2 -0.0150 0.0070 0.0105 178 ILE 27 N -0.0129 0.0065 0.0057 179 ILE 27 CA -0.0132 0.0077 0.0046 180 ILE 27 C -0.0127 0.0074 0.0035 181 ILE 27 O -0.0131 0.0082 0.0030 182 ILE 27 CB -0.0133 0.0082 0.0039 183 ILE 27 CG1 -0.0139 0.0086 0.0050 184 ILE 27 CG2 -0.0136 0.0093 0.0026 185 ILE 27 CD1 -0.0137 0.0084 0.0046 186 MET 28 N -0.0119 0.0062 0.0029 187 MET 28 CA -0.0113 0.0059 0.0018 188 MET 28 C -0.0114 0.0058 0.0023 189 MET 28 O -0.0115 0.0064 0.0016 190 MET 28 CB -0.0104 0.0046 0.0013 191 MET 28 CG -0.0097 0.0042 -0.0001 192 MET 28 SD -0.0096 0.0041 -0.0003 193 MET 28 CE -0.0093 0.0028 0.0013 194 GLY 29 N -0.0115 0.0053 0.0025 195 GLY 29 CA -0.0110 0.0049 0.0025 196 GLY 29 C -0.0121 0.0057 0.0022 197 GLY 29 O -0.0120 0.0055 0.0012 198 LYS 30 N -0.0132 0.0066 0.0032 199 LYS 30 CA -0.0144 0.0074 0.0030 200 LYS 30 C -0.0151 0.0077 0.0012 201 LYS 30 O -0.0155 0.0079 0.0005 202 LYS 30 CB -0.0154 0.0084 0.0044 203 LYS 30 CG -0.0148 0.0082 0.0062 204 LYS 30 CD -0.0159 0.0092 0.0075 205 LYS 30 CE -0.0154 0.0091 0.0094 206 LYS 30 NZ -0.0164 0.0100 0.0106 207 SER 31 N -0.0140 0.0072 0.0007 208 SER 31 CA -0.0140 0.0079 -0.0004 209 SER 31 C -0.0135 0.0079 -0.0012 210 SER 31 O -0.0138 0.0086 -0.0018 211 SER 31 CB -0.0135 0.0077 -0.0008 212 SER 31 OG -0.0125 0.0069 -0.0009 213 GLU 32 N -0.0126 0.0071 -0.0011 214 GLU 32 CA -0.0121 0.0071 -0.0018 215 GLU 32 C -0.0127 0.0075 -0.0016 216 GLU 32 O -0.0128 0.0081 -0.0024 217 GLU 32 CB -0.0111 0.0061 -0.0017 218 GLU 32 CG -0.0102 0.0060 -0.0027 219 GLU 32 CD -0.0093 0.0050 -0.0024 220 GLU 32 OE1 -0.0093 0.0044 -0.0016 221 GLU 32 OE2 -0.0086 0.0048 -0.0031 222 VAL 33 N -0.0136 0.0081 -0.0013 223 VAL 33 CA -0.0144 0.0085 -0.0017 224 VAL 33 C -0.0148 0.0087 -0.0019 225 VAL 33 O -0.0150 0.0094 -0.0023 226 VAL 33 CB -0.0151 0.0079 -0.0017 227 VAL 33 CG1 -0.0160 0.0082 -0.0021 228 VAL 33 CG2 -0.0149 0.0080 -0.0017 229 ASN 34 N -0.0149 0.0080 -0.0017 230 ASN 34 CA -0.0153 0.0081 -0.0019 231 ASN 34 C -0.0148 0.0088 -0.0019 232 ASN 34 O -0.0151 0.0093 -0.0023 233 ASN 34 CB -0.0155 0.0072 -0.0016 234 ASN 34 CG -0.0162 0.0067 -0.0016 235 ASN 34 ND2 -0.0159 0.0062 -0.0013 236 ASN 34 OD1 -0.0170 0.0066 -0.0018 237 ASN 35 N -0.0136 0.0087 -0.0024 238 ASN 35 CA -0.0129 0.0095 -0.0026 239 ASN 35 C -0.0129 0.0104 -0.0026 240 ASN 35 O -0.0127 0.0112 -0.0027 241 ASN 35 CB -0.0118 0.0091 -0.0027 242 ASN 35 CG -0.0117 0.0085 -0.0026 243 ASN 35 ND2 -0.0110 0.0087 -0.0028 244 ASN 35 OD1 -0.0123 0.0078 -0.0025 245 SER 36 N -0.0132 0.0101 -0.0026 246 SER 36 CA -0.0135 0.0109 -0.0026 247 SER 36 C -0.0143 0.0115 -0.0025 248 SER 36 O -0.0143 0.0125 -0.0026 249 SER 36 CB -0.0137 0.0104 -0.0025 250 SER 36 OG -0.0147 0.0101 -0.0024 251 HIS 37 N -0.0159 0.0113 -0.0032 252 HIS 37 CA -0.0167 0.0118 -0.0033 253 HIS 37 C -0.0155 0.0121 -0.0026 254 HIS 37 O -0.0159 0.0132 -0.0022 255 HIS 37 CB -0.0177 0.0105 -0.0044 256 HIS 37 CG -0.0181 0.0106 -0.0046 257 HIS 37 CD2 -0.0179 0.0095 -0.0050 258 HIS 37 ND1 -0.0189 0.0120 -0.0042 259 HIS 37 CE1 -0.0192 0.0118 -0.0045 260 HIS 37 NE2 -0.0186 0.0103 -0.0050 261 VAL 38 N -0.0141 0.0110 -0.0025 262 VAL 38 CA -0.0130 0.0112 -0.0019 263 VAL 38 C -0.0118 0.0123 -0.0008 264 VAL 38 O -0.0113 0.0131 -0.0002 265 VAL 38 CB -0.0120 0.0096 -0.0023 266 VAL 38 CG1 -0.0113 0.0097 -0.0019 267 VAL 38 CG2 -0.0130 0.0083 -0.0034 268 GLY 39 N -0.0119 0.0111 -0.0023 269 GLY 39 CA -0.0114 0.0117 -0.0015 270 GLY 39 C -0.0102 0.0113 -0.0016 271 GLY 39 O -0.0093 0.0118 -0.0009 272 LEU 40 N -0.0100 0.0105 -0.0024 273 LEU 40 CA -0.0089 0.0101 -0.0026 274 LEU 40 C -0.0093 0.0100 -0.0028 275 LEU 40 O -0.0102 0.0098 -0.0032 276 LEU 40 CB -0.0084 0.0092 -0.0033 277 LEU 40 CG -0.0081 0.0092 -0.0033 278 LEU 40 CD1 -0.0080 0.0083 -0.0043 279 LEU 40 CD2 -0.0069 0.0095 -0.0027 280 THR 41 N -0.0094 0.0102 -0.0052 281 THR 41 CA -0.0093 0.0096 -0.0057 282 THR 41 C -0.0090 0.0096 -0.0062 283 THR 41 O -0.0089 0.0102 -0.0063 284 THR 41 CB -0.0092 0.0095 -0.0060 285 THR 41 CG2 -0.0094 0.0094 -0.0054 286 THR 41 OG1 -0.0089 0.0101 -0.0063 287 GLY 42 N -0.0089 0.0090 -0.0067 288 GLY 42 CA -0.0087 0.0091 -0.0072 289 GLY 42 C -0.0087 0.0083 -0.0074 290 GLY 42 O -0.0089 0.0078 -0.0073 291 LEU 43 N -0.0082 0.0089 -0.0089 292 LEU 43 CA -0.0076 0.0078 -0.0085 293 LEU 43 C -0.0081 0.0085 -0.0079 294 LEU 43 O -0.0087 0.0097 -0.0083 295 LEU 43 CB -0.0069 0.0071 -0.0101 296 LEU 43 CG -0.0062 0.0058 -0.0100 297 LEU 43 CD1 -0.0056 0.0046 -0.0089 298 LEU 43 CD2 -0.0056 0.0053 -0.0117 299 LEU 44 N -0.0078 0.0076 -0.0067 300 LEU 44 CA -0.0082 0.0081 -0.0059 301 LEU 44 C -0.0075 0.0070 -0.0061 302 LEU 44 O -0.0068 0.0057 -0.0059 303 LEU 44 CB -0.0085 0.0082 -0.0041 304 LEU 44 CG -0.0088 0.0083 -0.0029 305 LEU 44 CD1 -0.0095 0.0097 -0.0034 306 LEU 44 CD2 -0.0090 0.0083 -0.0012 307 CYS 45 N -0.0079 0.0077 -0.0056 308 CYS 45 CA -0.0071 0.0072 -0.0049 309 CYS 45 C -0.0078 0.0076 -0.0031 310 CYS 45 O -0.0093 0.0083 -0.0029 311 CYS 45 CB -0.0071 0.0073 -0.0063 312 CYS 45 SG -0.0064 0.0069 -0.0053 313 PHE 46 N -0.0068 0.0070 -0.0019 314 PHE 46 CA -0.0074 0.0072 -0.0000 315 PHE 46 C -0.0068 0.0069 0.0003 316 PHE 46 O -0.0054 0.0062 -0.0001 317 PHE 46 CB -0.0067 0.0068 0.0014 318 PHE 46 CG -0.0073 0.0070 0.0033 319 PHE 46 CD1 -0.0089 0.0078 0.0037 320 PHE 46 CD2 -0.0062 0.0064 0.0047 321 PHE 46 CE1 -0.0093 0.0080 0.0055 322 PHE 46 CE2 -0.0066 0.0065 0.0064 323 PHE 46 CZ -0.0082 0.0073 0.0068 324 GLY 47 N -0.0061 0.0078 0.0059 325 GLY 47 CA -0.0067 0.0087 0.0065 326 GLY 47 C -0.0084 0.0100 0.0074 327 GLY 47 O -0.0096 0.0100 0.0069 328 ASN 48 N -0.0084 0.0112 0.0086 329 ASN 48 CA -0.0099 0.0126 0.0095 330 ASN 48 C -0.0099 0.0131 0.0101 331 ASN 48 O -0.0115 0.0138 0.0101 332 ASN 48 CB -0.0119 0.0125 0.0086 333 ASN 48 CG -0.0133 0.0140 0.0097 334 ASN 48 ND2 -0.0152 0.0142 0.0092 335 ASN 48 OD1 -0.0126 0.0149 0.0109 336 SER 49 N -0.0110 0.0131 0.0042 337 SER 49 CA -0.0111 0.0134 0.0046 338 SER 49 C -0.0119 0.0132 0.0038 339 SER 49 O -0.0125 0.0136 0.0040 340 SER 49 CB -0.0115 0.0142 0.0055 341 SER 49 OG -0.0106 0.0143 0.0064 342 ILE 50 N -0.0118 0.0126 0.0028 343 ILE 50 CA -0.0125 0.0124 0.0020 344 ILE 50 C -0.0118 0.0116 0.0013 345 ILE 50 O -0.0112 0.0112 0.0010 346 ILE 50 CB -0.0135 0.0124 0.0015 347 ILE 50 CG1 -0.0145 0.0132 0.0021 348 ILE 50 CG2 -0.0139 0.0119 0.0004 349 ILE 50 CD1 -0.0155 0.0133 0.0016 350 PHE 51 N -0.0117 0.0108 -0.0007 351 PHE 51 CA -0.0113 0.0104 -0.0014 352 PHE 51 C -0.0119 0.0106 -0.0027 353 PHE 51 O -0.0128 0.0113 -0.0027 354 PHE 51 CB -0.0114 0.0105 -0.0008 355 PHE 51 CG -0.0106 0.0101 0.0002 356 PHE 51 CD1 -0.0097 0.0094 0.0001 357 PHE 51 CD2 -0.0109 0.0105 0.0014 358 PHE 51 CE1 -0.0090 0.0090 0.0011 359 PHE 51 CE2 -0.0103 0.0102 0.0024 360 PHE 51 CZ -0.0093 0.0094 0.0022 361 LEU 52 N -0.0114 0.0101 -0.0036 362 LEU 52 CA -0.0119 0.0103 -0.0048 363 LEU 52 C -0.0114 0.0098 -0.0053 364 LEU 52 O -0.0105 0.0091 -0.0054 365 LEU 52 CB -0.0119 0.0101 -0.0056 366 LEU 52 CG -0.0120 0.0100 -0.0069 367 LEU 52 CD1 -0.0131 0.0107 -0.0073 368 LEU 52 CD2 -0.0117 0.0096 -0.0076 369 GLN 53 N -0.0099 0.0098 -0.0056 370 GLN 53 CA -0.0097 0.0096 -0.0057 371 GLN 53 C -0.0100 0.0101 -0.0065 372 GLN 53 O -0.0105 0.0107 -0.0066 373 GLN 53 CB -0.0100 0.0097 -0.0048 374 GLN 53 CG -0.0099 0.0096 -0.0049 375 GLN 53 CD -0.0100 0.0095 -0.0040 376 GLN 53 NE2 -0.0097 0.0092 -0.0040 377 GLN 53 OE1 -0.0104 0.0098 -0.0034 378 ILE 54 N -0.0096 0.0099 -0.0070 379 ILE 54 CA -0.0098 0.0103 -0.0077 380 ILE 54 C -0.0098 0.0102 -0.0075 381 ILE 54 O -0.0093 0.0096 -0.0073 382 ILE 54 CB -0.0094 0.0100 -0.0086 383 ILE 54 CG1 -0.0095 0.0104 -0.0093 384 ILE 54 CG2 -0.0088 0.0093 -0.0085 385 ILE 54 CD1 -0.0092 0.0102 -0.0102 386 LEU 55 N -0.0078 0.0086 -0.0061 387 LEU 55 CA -0.0080 0.0087 -0.0056 388 LEU 55 C -0.0079 0.0091 -0.0057 389 LEU 55 O -0.0077 0.0094 -0.0060 390 LEU 55 CB -0.0081 0.0090 -0.0052 391 LEU 55 CG -0.0083 0.0086 -0.0050 392 LEU 55 CD1 -0.0082 0.0089 -0.0049 393 LEU 55 CD2 -0.0085 0.0085 -0.0045 394 GLU 56 N -0.0080 0.0090 -0.0054 395 GLU 56 CA -0.0079 0.0093 -0.0055 396 GLU 56 C -0.0082 0.0094 -0.0050 397 GLU 56 O -0.0083 0.0091 -0.0047 398 GLU 56 CB -0.0078 0.0091 -0.0058 399 GLU 56 CG -0.0076 0.0089 -0.0063 400 GLU 56 CD -0.0075 0.0088 -0.0067 401 GLU 56 OE1 -0.0076 0.0086 -0.0065 402 GLU 56 OE2 -0.0073 0.0089 -0.0071 403 GLY 57 N -0.0062 0.0059 -0.0020 404 GLY 57 CA -0.0060 0.0058 -0.0013 405 GLY 57 C -0.0046 0.0055 -0.0007 406 GLY 57 O -0.0040 0.0054 -0.0004 407 SER 58 N -0.0042 0.0055 -0.0005 408 SER 58 CA -0.0028 0.0052 0.0001 409 SER 58 C -0.0017 0.0052 -0.0010 410 SER 58 O -0.0020 0.0053 -0.0022 411 SER 58 CB -0.0027 0.0051 0.0006 412 SER 58 OG -0.0027 0.0052 -0.0005 413 ARG 59 N -0.0021 -0.0008 0.0010 414 ARG 59 CA -0.0009 -0.0004 0.0001 415 ARG 59 C -0.0001 0.0001 -0.0010 416 ARG 59 O -0.0000 0.0008 -0.0023 417 ARG 59 CB 0.0002 -0.0010 0.0009 418 ARG 59 CG 0.0010 -0.0007 0.0002 419 ARG 59 CD 0.0020 -0.0014 0.0011 420 ARG 59 NE 0.0032 -0.0019 0.0017 421 ARG 59 CZ 0.0041 -0.0026 0.0027 422 ARG 59 NH1 0.0038 -0.0029 0.0033 423 ARG 59 NH2 0.0053 -0.0030 0.0032 424 GLN 60 N 0.0006 -0.0003 -0.0005 425 GLN 60 CA 0.0016 0.0001 -0.0015 426 GLN 60 C 0.0006 0.0009 -0.0025 427 GLN 60 O 0.0011 0.0015 -0.0038 428 GLN 60 CB 0.0025 -0.0005 -0.0006 429 GLN 60 CG 0.0037 -0.0001 -0.0015 430 GLN 60 CD 0.0029 0.0002 -0.0020 431 GLN 60 NE2 0.0029 -0.0003 -0.0010 432 GLN 60 OE1 0.0024 0.0010 -0.0031 433 ALA 61 N -0.0027 0.0048 -0.0021 434 ALA 61 CA -0.0029 0.0050 -0.0023 435 ALA 61 C -0.0030 0.0052 -0.0026 436 ALA 61 O -0.0030 0.0054 -0.0028 437 ALA 61 CB -0.0032 0.0049 -0.0021 438 ILE 62 N -0.0032 0.0051 -0.0025 439 ILE 62 CA -0.0033 0.0053 -0.0027 440 ILE 62 C -0.0030 0.0054 -0.0029 441 ILE 62 O -0.0030 0.0056 -0.0032 442 ILE 62 CB -0.0035 0.0052 -0.0025 443 ILE 62 CG1 -0.0038 0.0051 -0.0023 444 ILE 62 CG2 -0.0036 0.0054 -0.0028 445 ILE 62 CD1 -0.0039 0.0050 -0.0021 446 SER 63 N -0.0019 0.0026 0.0006 447 SER 63 CA -0.0015 0.0020 0.0001 448 SER 63 C -0.0015 0.0022 -0.0010 449 SER 63 O -0.0014 0.0020 -0.0015 450 SER 63 CB -0.0009 0.0012 0.0003 451 SER 63 OG -0.0009 0.0010 0.0013 452 HIS 64 N -0.0018 0.0025 -0.0013 453 HIS 64 CA -0.0019 0.0027 -0.0023 454 HIS 64 C -0.0023 0.0034 -0.0026 455 HIS 64 O -0.0022 0.0034 -0.0034 456 HIS 64 CB -0.0020 0.0030 -0.0026 457 HIS 64 CG -0.0023 0.0035 -0.0034 458 HIS 64 CD2 -0.0028 0.0042 -0.0036 459 HIS 64 ND1 -0.0021 0.0032 -0.0043 460 HIS 64 CE1 -0.0024 0.0038 -0.0050 461 HIS 64 NE2 -0.0029 0.0044 -0.0045 462 THR 65 N -0.0040 0.0051 -0.0029 463 THR 65 CA -0.0044 0.0059 -0.0030 464 THR 65 C -0.0044 0.0060 -0.0030 465 THR 65 O -0.0044 0.0065 -0.0035 466 THR 65 CB -0.0050 0.0063 -0.0024 467 THR 65 CG2 -0.0054 0.0071 -0.0023 468 THR 65 OG1 -0.0050 0.0066 -0.0027 469 TYR 66 N -0.0044 0.0054 -0.0024 470 TYR 66 CA -0.0044 0.0054 -0.0024 471 TYR 66 C -0.0039 0.0052 -0.0032 472 TYR 66 O -0.0039 0.0056 -0.0035 473 TYR 66 CB -0.0045 0.0048 -0.0017 474 TYR 66 CG -0.0046 0.0048 -0.0015 475 TYR 66 CD1 -0.0050 0.0055 -0.0015 476 TYR 66 CD2 -0.0043 0.0041 -0.0014 477 TYR 66 CE1 -0.0051 0.0055 -0.0014 478 TYR 66 CE2 -0.0043 0.0041 -0.0013 479 TYR 66 CZ -0.0048 0.0048 -0.0013 480 TYR 66 OH -0.0048 0.0048 -0.0011 481 HIS 67 N -0.0037 0.0033 0.0001 482 HIS 67 CA -0.0029 0.0030 -0.0010 483 HIS 67 C -0.0032 0.0038 -0.0021 484 HIS 67 O -0.0029 0.0039 -0.0029 485 HIS 67 CB -0.0023 0.0022 -0.0010 486 HIS 67 CG -0.0016 0.0020 -0.0022 487 HIS 67 CD2 -0.0011 0.0019 -0.0030 488 HIS 67 ND1 -0.0013 0.0019 -0.0026 489 HIS 67 CE1 -0.0007 0.0017 -0.0036 490 HIS 67 NE2 -0.0006 0.0017 -0.0039 491 ARG 68 N -0.0038 0.0045 -0.0021 492 ARG 68 CA -0.0041 0.0053 -0.0030 493 ARG 68 C -0.0046 0.0060 -0.0031 494 ARG 68 O -0.0046 0.0064 -0.0041 495 ARG 68 CB -0.0046 0.0058 -0.0029 496 ARG 68 CG -0.0041 0.0055 -0.0034 497 ARG 68 CD -0.0046 0.0060 -0.0031 498 ARG 68 NE -0.0055 0.0069 -0.0030 499 ARG 68 CZ -0.0062 0.0073 -0.0022 500 ARG 68 NH1 -0.0060 0.0068 -0.0014 501 ARG 68 NH2 -0.0069 0.0082 -0.0021 502 ILE 69 N -0.0051 0.0067 -0.0023 503 ILE 69 CA -0.0053 0.0073 -0.0019 504 ILE 69 C -0.0052 0.0068 -0.0019 505 ILE 69 O -0.0053 0.0073 -0.0020 506 ILE 69 CB -0.0057 0.0074 -0.0009 507 ILE 69 CG1 -0.0058 0.0082 -0.0009 508 ILE 69 CG2 -0.0059 0.0076 -0.0003 509 ILE 69 CD1 -0.0062 0.0085 0.0001 510 LEU 70 N -0.0051 0.0059 -0.0018 511 LEU 70 CA -0.0050 0.0054 -0.0018 512 LEU 70 C -0.0047 0.0055 -0.0027 513 LEU 70 O -0.0047 0.0054 -0.0027 514 LEU 70 CB -0.0048 0.0043 -0.0016 515 LEU 70 CG -0.0051 0.0040 -0.0006 516 LEU 70 CD1 -0.0049 0.0030 -0.0005 517 LEU 70 CD2 -0.0053 0.0042 -0.0001 518 GLN 71 N -0.0052 0.0059 0.0005 519 GLN 71 CA -0.0044 0.0065 -0.0001 520 GLN 71 C -0.0042 0.0079 0.0000 521 GLN 71 O -0.0036 0.0085 -0.0004 522 GLN 71 CB -0.0036 0.0059 -0.0010 523 GLN 71 CG -0.0037 0.0045 -0.0012 524 GLN 71 CD -0.0029 0.0039 -0.0020 525 GLN 71 NE2 -0.0022 0.0040 -0.0027 526 GLN 71 OE1 -0.0029 0.0033 -0.0022 527 ASP 72 N -0.0046 0.0083 0.0005 528 ASP 72 CA -0.0045 0.0097 0.0007 529 ASP 72 C -0.0048 0.0104 0.0011 530 ASP 72 O -0.0056 0.0100 0.0018 531 ASP 72 CB -0.0049 0.0099 0.0012 532 ASP 72 CG -0.0044 0.0110 0.0009 533 ASP 72 OD1 -0.0043 0.0120 0.0010 534 ASP 72 OD2 -0.0041 0.0108 0.0006 535 PRO 73 N -0.0034 0.0120 0.0051 536 PRO 73 CA -0.0032 0.0128 0.0034 537 PRO 73 C -0.0047 0.0128 0.0024 538 PRO 73 O -0.0047 0.0134 0.0009 539 PRO 73 CB -0.0025 0.0131 0.0030 540 PRO 73 CG -0.0030 0.0124 0.0043 541 PRO 73 CD -0.0038 0.0117 0.0055 542 ARG 74 N -0.0061 0.0122 0.0030 543 ARG 74 CA -0.0076 0.0122 0.0021 544 ARG 74 C -0.0078 0.0122 0.0018 545 ARG 74 O -0.0091 0.0122 0.0010 546 ARG 74 CB -0.0091 0.0114 0.0029 547 ARG 74 CG -0.0093 0.0114 0.0029 548 ARG 74 CD -0.0110 0.0108 0.0033 549 ARG 74 NE -0.0110 0.0100 0.0050 550 ARG 74 CZ -0.0105 0.0099 0.0058 551 ARG 74 NH1 -0.0099 0.0103 0.0051 552 ARG 74 NH2 -0.0105 0.0092 0.0074 553 HIS 75 N -0.0072 0.0125 0.0007 554 HIS 75 CA -0.0081 0.0125 0.0004 555 HIS 75 C -0.0081 0.0128 0.0004 556 HIS 75 O -0.0074 0.0128 0.0006 557 HIS 75 CB -0.0085 0.0116 0.0003 558 HIS 75 CG -0.0081 0.0109 0.0004 559 HIS 75 CD2 -0.0074 0.0109 0.0006 560 HIS 75 ND1 -0.0084 0.0101 0.0003 561 HIS 75 CE1 -0.0080 0.0096 0.0004 562 HIS 75 NE2 -0.0073 0.0101 0.0006 563 HIS 76 N -0.0088 0.0130 0.0002 564 HIS 76 CA -0.0089 0.0134 0.0001 565 HIS 76 C -0.0097 0.0132 -0.0002 566 HIS 76 O -0.0102 0.0129 -0.0003 567 HIS 76 CB -0.0087 0.0143 0.0002 568 HIS 76 CG -0.0092 0.0149 0.0000 569 HIS 76 CD2 -0.0097 0.0156 -0.0001 570 HIS 76 ND1 -0.0094 0.0147 -0.0000 571 HIS 76 CE1 -0.0099 0.0153 -0.0002 572 HIS 76 NE2 -0.0101 0.0159 -0.0002 573 SER 77 N -0.0082 0.0113 -0.0031 574 SER 77 CA -0.0094 0.0110 -0.0031 575 SER 77 C -0.0099 0.0098 -0.0030 576 SER 77 O -0.0110 0.0097 -0.0030 577 SER 77 CB -0.0103 0.0121 -0.0031 578 SER 77 OG -0.0099 0.0132 -0.0031 579 ALA 78 N -0.0091 0.0088 -0.0030 580 ALA 78 CA -0.0095 0.0076 -0.0030 581 ALA 78 C -0.0103 0.0070 -0.0029 582 ALA 78 O -0.0101 0.0071 -0.0029 583 ALA 78 CB -0.0083 0.0068 -0.0030 584 GLU 79 N -0.0076 0.0086 -0.0046 585 GLU 79 CA -0.0081 0.0078 -0.0041 586 GLU 79 C -0.0084 0.0070 -0.0037 587 GLU 79 O -0.0087 0.0073 -0.0037 588 GLU 79 CB -0.0090 0.0083 -0.0039 589 GLU 79 CG -0.0088 0.0088 -0.0042 590 GLU 79 CD -0.0097 0.0094 -0.0040 591 GLU 79 OE1 -0.0097 0.0103 -0.0043 592 GLU 79 OE2 -0.0104 0.0089 -0.0035 593 ILE 80 N -0.0082 0.0061 -0.0034 594 ILE 80 CA -0.0085 0.0052 -0.0030 595 ILE 80 C -0.0096 0.0051 -0.0024 596 ILE 80 O -0.0098 0.0049 -0.0023 597 ILE 80 CB -0.0078 0.0042 -0.0030 598 ILE 80 CG1 -0.0067 0.0044 -0.0035 599 ILE 80 CG2 -0.0080 0.0034 -0.0025 600 ILE 80 CD1 -0.0059 0.0036 -0.0036 601 ILE 81 N -0.0087 0.0107 -0.0050 602 ILE 81 CA -0.0099 0.0104 -0.0048 603 ILE 81 C -0.0097 0.0093 -0.0035 604 ILE 81 O -0.0095 0.0091 -0.0033 605 ILE 81 CB -0.0117 0.0105 -0.0051 606 ILE 81 CG1 -0.0121 0.0116 -0.0065 607 ILE 81 CG2 -0.0129 0.0098 -0.0044 608 ILE 81 CD1 -0.0137 0.0118 -0.0069 609 ALA 82 N -0.0096 0.0085 -0.0025 610 ALA 82 CA -0.0095 0.0074 -0.0012 611 ALA 82 C -0.0087 0.0067 -0.0003 612 ALA 82 O -0.0088 0.0069 -0.0006 613 ALA 82 CB -0.0112 0.0068 -0.0007 614 PHE 83 N -0.0050 0.0035 0.0002 615 PHE 83 CA -0.0046 0.0031 -0.0000 616 PHE 83 C -0.0047 0.0023 0.0004 617 PHE 83 O -0.0046 0.0017 0.0006 618 PHE 83 CB -0.0038 0.0029 -0.0006 619 PHE 83 CG -0.0033 0.0025 -0.0009 620 PHE 83 CD1 -0.0031 0.0017 -0.0007 621 PHE 83 CD2 -0.0030 0.0030 -0.0013 622 PHE 83 CE1 -0.0026 0.0013 -0.0009 623 PHE 83 CE2 -0.0025 0.0026 -0.0016 624 PHE 83 CZ -0.0023 0.0018 -0.0014 625 ASP 84 N -0.0050 0.0023 0.0007 626 ASP 84 CA -0.0053 0.0015 0.0012 627 ASP 84 C -0.0052 0.0014 0.0012 628 ASP 84 O -0.0051 0.0019 0.0009 629 ASP 84 CB -0.0061 0.0017 0.0018 630 ASP 84 CG -0.0065 0.0026 0.0018 631 ASP 84 OD1 -0.0064 0.0031 0.0015 632 ASP 84 OD2 -0.0069 0.0027 0.0021 633 PRO 85 N -0.0041 0.0024 -0.0018 634 PRO 85 CA -0.0042 0.0027 -0.0018 635 PRO 85 C -0.0047 0.0035 -0.0010 636 PRO 85 O -0.0049 0.0034 -0.0002 637 PRO 85 CB -0.0039 0.0018 -0.0016 638 PRO 85 CG -0.0037 0.0010 -0.0012 639 PRO 85 CD -0.0039 0.0014 -0.0012 640 VAL 86 N -0.0049 0.0042 -0.0012 641 VAL 86 CA -0.0054 0.0050 -0.0006 642 VAL 86 C -0.0055 0.0051 -0.0005 643 VAL 86 O -0.0052 0.0047 -0.0011 644 VAL 86 CB -0.0057 0.0059 -0.0010 645 VAL 86 CG1 -0.0057 0.0059 -0.0007 646 VAL 86 CG2 -0.0054 0.0061 -0.0022 647 LEU 87 N -0.0042 0.0055 -0.0018 648 LEU 87 CA -0.0044 0.0063 -0.0016 649 LEU 87 C -0.0049 0.0076 -0.0024 650 LEU 87 O -0.0051 0.0079 -0.0032 651 LEU 87 CB -0.0043 0.0066 -0.0001 652 LEU 87 CG -0.0043 0.0069 0.0005 653 LEU 87 CD1 -0.0042 0.0072 0.0021 654 LEU 87 CD2 -0.0047 0.0081 -0.0002 655 GLN 88 N -0.0051 0.0083 -0.0023 656 GLN 88 CA -0.0056 0.0096 -0.0030 657 GLN 88 C -0.0057 0.0097 -0.0035 658 GLN 88 O -0.0054 0.0091 -0.0030 659 GLN 88 CB -0.0058 0.0108 -0.0020 660 GLN 88 CG -0.0056 0.0108 -0.0007 661 GLN 88 CD -0.0059 0.0120 0.0003 662 GLN 88 NE2 -0.0058 0.0123 0.0013 663 GLN 88 OE1 -0.0061 0.0127 0.0000 664 ARG 89 N -0.0060 0.0109 -0.0067 665 ARG 89 CA -0.0064 0.0102 -0.0078 666 ARG 89 C -0.0069 0.0093 -0.0089 667 ARG 89 O -0.0073 0.0091 -0.0087 668 ARG 89 CB -0.0074 0.0096 -0.0070 669 ARG 89 CG -0.0073 0.0103 -0.0054 670 ARG 89 CD -0.0084 0.0095 -0.0047 671 ARG 89 NE -0.0083 0.0096 -0.0048 672 ARG 89 CZ -0.0081 0.0102 -0.0037 673 ARG 89 NH1 -0.0081 0.0107 -0.0023 674 ARG 89 NH2 -0.0080 0.0102 -0.0039 675 GLU 90 N -0.0069 0.0089 -0.0102 676 GLU 90 CA -0.0075 0.0080 -0.0114 677 GLU 90 C -0.0085 0.0070 -0.0118 678 GLU 90 O -0.0091 0.0061 -0.0127 679 GLU 90 CB -0.0065 0.0083 -0.0129 680 GLU 90 CG -0.0055 0.0092 -0.0127 681 GLU 90 CD -0.0049 0.0092 -0.0141 682 GLU 90 OE1 -0.0042 0.0094 -0.0151 683 GLU 90 OE2 -0.0051 0.0090 -0.0142 684 PHE 91 N -0.0073 0.0087 -0.0116 685 PHE 91 CA -0.0077 0.0077 -0.0110 686 PHE 91 C -0.0082 0.0076 -0.0098 687 PHE 91 O -0.0086 0.0074 -0.0090 688 PHE 91 CB -0.0077 0.0078 -0.0109 689 PHE 91 CG -0.0072 0.0078 -0.0121 690 PHE 91 CD1 -0.0071 0.0068 -0.0126 691 PHE 91 CD2 -0.0068 0.0089 -0.0126 692 PHE 91 CE1 -0.0067 0.0068 -0.0137 693 PHE 91 CE2 -0.0063 0.0090 -0.0136 694 PHE 91 CZ -0.0063 0.0079 -0.0141 695 VAL 92 N -0.0082 0.0077 -0.0098 696 VAL 92 CA -0.0087 0.0077 -0.0087 697 VAL 92 C -0.0092 0.0065 -0.0081 698 VAL 92 O -0.0096 0.0066 -0.0070 699 VAL 92 CB -0.0086 0.0079 -0.0089 700 VAL 92 CG1 -0.0083 0.0071 -0.0099 701 VAL 92 CG2 -0.0091 0.0078 -0.0078 702 GLN 93 N -0.0067 0.0071 -0.0097 703 GLN 93 CA -0.0069 0.0054 -0.0088 704 GLN 93 C -0.0076 0.0051 -0.0074 705 GLN 93 O -0.0082 0.0044 -0.0061 706 GLN 93 CB -0.0062 0.0039 -0.0100 707 GLN 93 CG -0.0053 0.0044 -0.0117 708 GLN 93 CD -0.0049 0.0051 -0.0127 709 GLN 93 NE2 -0.0046 0.0065 -0.0137 710 GLN 93 OE1 -0.0049 0.0045 -0.0125 711 TRP 94 N -0.0076 0.0056 -0.0076 712 TRP 94 CA -0.0081 0.0051 -0.0064 713 TRP 94 C -0.0089 0.0067 -0.0054 714 TRP 94 O -0.0087 0.0082 -0.0061 715 TRP 94 CB -0.0076 0.0045 -0.0072 716 TRP 94 CG -0.0068 0.0031 -0.0084 717 TRP 94 CD1 -0.0060 0.0033 -0.0101 718 TRP 94 CD2 -0.0068 0.0013 -0.0081 719 TRP 94 CE2 -0.0059 0.0005 -0.0095 720 TRP 94 CE3 -0.0074 0.0002 -0.0066 721 TRP 94 NE1 -0.0055 0.0018 -0.0107 722 TRP 94 CZ2 -0.0056 -0.0013 -0.0096 723 TRP 94 CZ3 -0.0071 -0.0016 -0.0067 724 TRP 94 CH2 -0.0062 -0.0023 -0.0082 725 SER 95 N -0.0092 0.0078 -0.0049 726 SER 95 CA -0.0097 0.0083 -0.0044 727 SER 95 C -0.0097 0.0083 -0.0043 728 SER 95 O -0.0100 0.0089 -0.0043 729 SER 95 CB -0.0101 0.0081 -0.0036 730 SER 95 OG -0.0103 0.0086 -0.0036 731 MET 96 N -0.0095 0.0075 -0.0042 732 MET 96 CA -0.0094 0.0073 -0.0042 733 MET 96 C -0.0090 0.0063 -0.0042 734 MET 96 O -0.0091 0.0058 -0.0038 735 MET 96 CB -0.0099 0.0075 -0.0036 736 MET 96 CG -0.0098 0.0079 -0.0039 737 MET 96 SD -0.0099 0.0089 -0.0044 738 MET 96 CE -0.0106 0.0094 -0.0036 739 LYS 97 N -0.0069 0.0066 -0.0049 740 LYS 97 CA -0.0060 0.0052 -0.0048 741 LYS 97 C -0.0063 0.0056 -0.0046 742 LYS 97 O -0.0070 0.0068 -0.0051 743 LYS 97 CB -0.0051 0.0045 -0.0065 744 LYS 97 CG -0.0041 0.0029 -0.0063 745 LYS 97 CD -0.0039 0.0021 -0.0046 746 LYS 97 CE -0.0028 0.0004 -0.0046 747 LYS 97 NZ -0.0025 -0.0004 -0.0029 748 LEU 98 N -0.0057 0.0045 -0.0037 749 LEU 98 CA -0.0059 0.0047 -0.0033 750 LEU 98 C -0.0050 0.0038 -0.0045 751 LEU 98 O -0.0042 0.0025 -0.0046 752 LEU 98 CB -0.0060 0.0043 -0.0014 753 LEU 98 CG -0.0066 0.0049 -0.0006 754 LEU 98 CD1 -0.0059 0.0041 -0.0012 755 LEU 98 CD2 -0.0076 0.0065 -0.0010 756 VAL 99 N -0.0008 0.0048 -0.0067 757 VAL 99 CA 0.0018 0.0038 -0.0070 758 VAL 99 C 0.0011 0.0030 -0.0046 759 VAL 99 O -0.0012 0.0039 -0.0045 760 VAL 99 CB 0.0025 0.0050 -0.0101 761 VAL 99 CG1 0.0046 0.0041 -0.0100 762 VAL 99 CG2 0.0040 0.0055 -0.0124 763 GLN 100 N 0.0029 0.0013 -0.0026 764 GLN 100 CA 0.0025 0.0003 -0.0003 765 GLN 100 C 0.0047 -0.0002 -0.0011 766 GLN 100 O 0.0072 -0.0005 -0.0027 767 GLN 100 CB 0.0030 -0.0013 0.0027 768 GLN 100 CG 0.0030 -0.0025 0.0052 769 GLN 100 CD 0.0010 -0.0030 0.0081 770 GLN 100 NE2 0.0002 -0.0036 0.0101 771 GLN 100 OE1 0.0002 -0.0028 0.0085 772 ILE 101 N 0.0076 0.0006 0.0030 773 ILE 101 CA 0.0126 -0.0003 0.0040 774 ILE 101 C 0.0157 -0.0044 0.0138 775 ILE 101 O 0.0161 -0.0057 0.0170 776 ILE 101 CB 0.0062 0.0016 0.0007 777 ILE 101 CG1 -0.0039 0.0006 0.0054 778 ILE 101 CG2 0.0054 0.0058 -0.0096 779 ILE 101 CD1 -0.0053 -0.0024 0.0132 780 ASP 102 N 0.0179 -0.0065 0.0186 781 ASP 102 CA 0.0208 -0.0105 0.0281 782 ASP 102 C 0.0290 -0.0119 0.0298 783 ASP 102 O 0.0275 -0.0136 0.0345 784 ASP 102 CB 0.0240 -0.0120 0.0312 785 ASP 102 CG 0.0305 -0.0098 0.0242 786 ASP 102 OD1 0.0331 -0.0072 0.0172 787 ASP 102 OD2 0.0331 -0.0106 0.0256 788 SER 105 N 0.0678 -0.0065 0.0407 789 SER 105 CA 0.0667 -0.0054 0.0272 790 SER 105 C 0.0741 -0.0045 0.0253 791 SER 105 O 0.0746 -0.0052 0.0342 792 SER 105 CB 0.0523 -0.0065 0.0231 793 SER 105 OG 0.0474 -0.0074 0.0274 794 PRO 106 N 0.0800 -0.0029 0.0137 795 PRO 106 CA 0.0865 -0.0019 0.0108 796 PRO 106 C 0.0767 -0.0030 0.0111 797 PRO 106 O 0.0651 -0.0039 0.0080 798 PRO 106 CB 0.0921 -0.0001 -0.0030 799 PRO 106 CG 0.0852 -0.0004 -0.0083 800 PRO 106 CD 0.0817 -0.0017 0.0032 801 GLU 107 N 0.0828 -0.0041 0.0202 802 GLU 107 CA 0.0725 -0.0036 0.0198 803 GLU 107 C 0.0659 -0.0041 0.0061 804 GLU 107 O 0.0551 -0.0036 0.0050 805 GLU 107 CB 0.0782 -0.0036 0.0240 806 GLU 107 CG 0.0893 -0.0047 0.0152 807 GLU 107 CD 0.0842 -0.0051 0.0039 808 GLU 107 OE1 0.0751 -0.0045 0.0063 809 GLU 107 OE2 0.0894 -0.0060 -0.0074 810 LYS 108 N 0.0721 -0.0050 -0.0043 811 LYS 108 CA 0.0659 -0.0055 -0.0176 812 LYS 108 C 0.0534 -0.0049 -0.0181 813 LYS 108 O 0.0438 -0.0049 -0.0253 814 LYS 108 CB 0.0759 -0.0066 -0.0282 815 LYS 108 CG 0.0868 -0.0073 -0.0309 816 LYS 108 CD 0.0811 -0.0074 -0.0369 817 LYS 108 CE 0.0717 -0.0077 -0.0486 818 LYS 108 NZ 0.0788 -0.0087 -0.0604 819 MET 109 N 0.0481 -0.0006 -0.0143 820 MET 109 CA 0.0347 0.0001 -0.0136 821 MET 109 C 0.0261 -0.0006 -0.0078 822 MET 109 O 0.0155 0.0011 -0.0126 823 MET 109 CB 0.0337 -0.0014 -0.0062 824 MET 109 CG 0.0337 0.0004 -0.0144 825 MET 109 SD 0.0347 -0.0016 -0.0055 826 MET 109 CE 0.0376 0.0009 -0.0179 827 ARG 110 N 0.0304 -0.0030 0.0023 828 ARG 110 CA 0.0228 -0.0037 0.0077 829 ARG 110 C 0.0225 -0.0018 -0.0009 830 ARG 110 O 0.0131 -0.0012 -0.0008 831 ARG 110 CB 0.0279 -0.0068 0.0207 832 ARG 110 CG 0.0296 -0.0088 0.0294 833 ARG 110 CD 0.0348 -0.0119 0.0421 834 ARG 110 NE 0.0474 -0.0132 0.0445 835 ARG 110 CZ 0.0583 -0.0140 0.0452 836 ARG 110 NH1 0.0586 -0.0138 0.0438 837 ARG 110 NH2 0.0692 -0.0152 0.0473 838 ARG 111 N 0.0239 -0.0060 -0.0086 839 ARG 111 CA 0.0230 -0.0050 -0.0156 840 ARG 111 C 0.0169 -0.0030 -0.0211 841 ARG 111 O 0.0119 -0.0014 -0.0240 842 ARG 111 CB 0.0309 -0.0065 -0.0200 843 ARG 111 CG 0.0310 -0.0059 -0.0266 844 ARG 111 CD 0.0299 -0.0060 -0.0232 845 ARG 111 NE 0.0373 -0.0079 -0.0217 846 ARG 111 CZ 0.0417 -0.0085 -0.0273 847 ARG 111 NH1 0.0397 -0.0072 -0.0349 848 ARG 111 NH2 0.0483 -0.0103 -0.0252 849 LEU 112 N 0.0171 -0.0029 -0.0226 850 LEU 112 CA 0.0112 -0.0009 -0.0275 851 LEU 112 C 0.0032 0.0007 -0.0235 852 LEU 112 O -0.0028 0.0025 -0.0275 853 LEU 112 CB 0.0135 -0.0013 -0.0293 854 LEU 112 CG 0.0211 -0.0027 -0.0341 855 LEU 112 CD1 0.0241 -0.0035 -0.0334 856 LEU 112 CD2 0.0200 -0.0015 -0.0428 857 TYR 113 N 0.0027 0.0027 -0.0160 858 TYR 113 CA -0.0024 0.0040 -0.0129 859 TYR 113 C -0.0049 0.0048 -0.0140 860 TYR 113 O -0.0098 0.0062 -0.0151 861 TYR 113 CB -0.0014 0.0035 -0.0066 862 TYR 113 CG -0.0021 0.0036 -0.0047 863 TYR 113 CD1 -0.0064 0.0049 -0.0065 864 TYR 113 CD2 0.0015 0.0025 -0.0010 865 TYR 113 CE1 -0.0071 0.0050 -0.0048 866 TYR 113 CE2 0.0008 0.0026 0.0008 867 TYR 113 CZ -0.0035 0.0039 -0.0011 868 TYR 113 OH -0.0043 0.0040 0.0006 869 LEU 114 N -0.0017 0.0039 -0.0138 870 LEU 114 CA -0.0037 0.0045 -0.0147 871 LEU 114 C -0.0058 0.0053 -0.0206 872 LEU 114 O -0.0098 0.0064 -0.0215 873 LEU 114 CB 0.0007 0.0032 -0.0135 874 LEU 114 CG -0.0010 0.0036 -0.0114 875 LEU 114 CD1 -0.0025 0.0038 -0.0052 876 LEU 114 CD2 0.0035 0.0024 -0.0123 877 LYS 115 N -0.0015 -0.0003 -0.0253 878 LYS 115 CA -0.0027 0.0009 -0.0313 879 LYS 115 C -0.0076 0.0047 -0.0317 880 LYS 115 O -0.0101 0.0068 -0.0357 881 LYS 115 CB 0.0009 -0.0016 -0.0341 882 LYS 115 CG -0.0005 -0.0003 -0.0400 883 LYS 115 CD 0.0032 -0.0029 -0.0447 884 LYS 115 CE 0.0078 -0.0065 -0.0432 885 LYS 115 NZ 0.0071 -0.0060 -0.0415 886 TYR 116 N -0.0090 0.0056 -0.0276 887 TYR 116 CA -0.0135 0.0090 -0.0280 888 TYR 116 C -0.0172 0.0115 -0.0235 889 TYR 116 O -0.0206 0.0141 -0.0224 890 TYR 116 CB -0.0128 0.0084 -0.0274 891 TYR 116 CG -0.0096 0.0062 -0.0321 892 TYR 116 CD1 -0.0112 0.0077 -0.0378 893 TYR 116 CD2 -0.0052 0.0028 -0.0309 894 TYR 116 CE1 -0.0083 0.0057 -0.0421 895 TYR 116 CE2 -0.0023 0.0008 -0.0352 896 TYR 116 CZ -0.0039 0.0023 -0.0408 897 TYR 116 OH -0.0011 0.0003 -0.0451 898 SER 117 N -0.0180 0.0088 -0.0210 899 SER 117 CA -0.0213 0.0110 -0.0170 900 SER 117 C -0.0221 0.0118 -0.0150 901 SER 117 O -0.0192 0.0106 -0.0155 902 SER 117 CB -0.0194 0.0114 -0.0128 903 SER 117 OG -0.0145 0.0099 -0.0113 904 GLY 118 N -0.0261 0.0139 -0.0127 905 GLY 118 CA -0.0273 0.0150 -0.0104 906 GLY 118 C -0.0260 0.0159 -0.0048 907 GLY 118 O -0.0268 0.0168 -0.0026 908 GLU 119 N -0.0248 0.0148 -0.0027 909 GLU 119 CA -0.0234 0.0160 0.0027 910 GLU 119 C -0.0178 0.0143 0.0037 911 GLU 119 O -0.0150 0.0124 0.0011 912 GLU 119 CB -0.0252 0.0175 0.0050 913 GLU 119 CG -0.0301 0.0200 0.0071 914 GLU 119 CD -0.0344 0.0204 0.0033 915 GLU 119 OE1 -0.0335 0.0187 -0.0009 916 GLU 119 OE2 -0.0387 0.0224 0.0046 917 VAL 120 N -0.0162 0.0150 0.0077 918 VAL 120 CA -0.0109 0.0134 0.0090 919 VAL 120 C -0.0084 0.0131 0.0108 920 VAL 120 O -0.0043 0.0111 0.0097 921 VAL 120 CB -0.0101 0.0144 0.0129 922 VAL 120 CG1 -0.0105 0.0137 0.0103 923 VAL 120 CG2 -0.0138 0.0170 0.0167 924 ALA 121 N -0.0148 0.0138 0.0087 925 ALA 121 CA -0.0136 0.0138 0.0091 926 ALA 121 C -0.0142 0.0130 0.0065 927 ALA 121 O -0.0158 0.0126 0.0046 928 ALA 121 CB -0.0149 0.0147 0.0117 929 PHE 122 N -0.0128 0.0129 0.0065 930 PHE 122 CA -0.0131 0.0122 0.0042 931 PHE 122 C -0.0159 0.0126 0.0045 932 PHE 122 O -0.0161 0.0131 0.0061 933 PHE 122 CB -0.0105 0.0119 0.0042 934 PHE 122 CG -0.0105 0.0112 0.0017 935 PHE 122 CD1 -0.0114 0.0105 -0.0009 936 PHE 122 CD2 -0.0095 0.0111 0.0019 937 PHE 122 CE1 -0.0113 0.0098 -0.0032 938 PHE 122 CE2 -0.0095 0.0104 -0.0004 939 PHE 122 CZ -0.0104 0.0098 -0.0029 940 MET 123 N -0.0168 0.0143 0.0020 941 MET 123 CA -0.0194 0.0151 0.0020 942 MET 123 C -0.0203 0.0141 -0.0010 943 MET 123 O -0.0221 0.0140 -0.0025 944 MET 123 CB -0.0218 0.0164 0.0031 945 MET 123 CG -0.0209 0.0173 0.0058 946 MET 123 SD -0.0239 0.0191 0.0077 947 MET 123 CE -0.0220 0.0200 0.0110 948 PRO 124 N -0.0191 0.0134 -0.0018 949 PRO 124 CA -0.0199 0.0123 -0.0046 950 PRO 124 C -0.0228 0.0130 -0.0051 951 PRO 124 O -0.0238 0.0122 -0.0075 952 PRO 124 CB -0.0174 0.0114 -0.0050 953 PRO 124 CG -0.0158 0.0122 -0.0022 954 PRO 124 CD -0.0172 0.0135 -0.0001 955 GLU 125 N -0.0222 0.0141 -0.0033 956 GLU 125 CA -0.0242 0.0146 -0.0037 957 GLU 125 C -0.0270 0.0147 -0.0047 958 GLU 125 O -0.0289 0.0149 -0.0054 959 GLU 125 CB -0.0243 0.0167 -0.0016 960 GLU 125 CG -0.0255 0.0186 -0.0002 961 GLU 125 CD -0.0235 0.0191 0.0012 962 GLU 125 OE1 -0.0211 0.0184 0.0015 963 GLU 125 OE2 -0.0244 0.0203 0.0020 964 THR 126 N -0.0274 0.0147 -0.0049 965 THR 126 CA -0.0300 0.0147 -0.0059 966 THR 126 C -0.0302 0.0126 -0.0082 967 THR 126 O -0.0323 0.0125 -0.0091 968 THR 126 CB -0.0305 0.0162 -0.0047 969 THR 126 CG2 -0.0306 0.0184 -0.0025 970 THR 126 OG1 -0.0284 0.0155 -0.0046 971 MET 127 N -0.0254 0.0149 -0.0121 972 MET 127 CA -0.0249 0.0136 -0.0144 973 MET 127 C -0.0255 0.0129 -0.0162 974 MET 127 O -0.0253 0.0131 -0.0156 975 MET 127 CB -0.0222 0.0127 -0.0144 976 MET 127 CG -0.0203 0.0123 -0.0140 977 MET 127 SD -0.0173 0.0120 -0.0127 978 MET 127 CE -0.0161 0.0103 -0.0153 979 THR 128 N -0.0262 0.0120 -0.0183 980 THR 128 CA -0.0271 0.0113 -0.0202 981 THR 128 C -0.0249 0.0102 -0.0209 982 THR 128 O -0.0228 0.0098 -0.0205 983 THR 128 CB -0.0284 0.0107 -0.0223 984 THR 128 CG2 -0.0301 0.0116 -0.0215 985 THR 128 OG1 -0.0266 0.0095 -0.0236 986 PRO 129 N -0.0216 0.0089 -0.0191 987 PRO 129 CA -0.0195 0.0077 -0.0198 988 PRO 129 C -0.0180 0.0062 -0.0216 989 PRO 129 O -0.0156 0.0054 -0.0214 990 PRO 129 CB -0.0208 0.0076 -0.0210 991 PRO 129 CG -0.0236 0.0086 -0.0211 992 PRO 129 CD -0.0240 0.0097 -0.0193 993 ALA 130 N -0.0193 0.0058 -0.0233 994 ALA 130 CA -0.0180 0.0043 -0.0250 995 ALA 130 C -0.0162 0.0044 -0.0236 996 ALA 130 O -0.0140 0.0033 -0.0241 997 ALA 130 CB -0.0199 0.0040 -0.0270 998 GLN 131 N -0.0197 0.0095 -0.0285 999 GLN 131 CA -0.0174 0.0088 -0.0265 1000 GLN 131 C -0.0151 0.0083 -0.0241 1001 GLN 131 O -0.0123 0.0069 -0.0236 1002 GLN 131 CB -0.0191 0.0103 -0.0246 1003 GLN 131 CG -0.0204 0.0104 -0.0267 1004 GLN 131 CD -0.0228 0.0122 -0.0251 1005 GLN 131 NE2 -0.0255 0.0131 -0.0271 1006 GLN 131 OE1 -0.0224 0.0129 -0.0220 1007 CYS 132 N -0.0163 0.0094 -0.0224 1008 CYS 132 CA -0.0142 0.0090 -0.0202 1009 CYS 132 C -0.0118 0.0071 -0.0221 1010 CYS 132 O -0.0091 0.0059 -0.0208 1011 CYS 132 CB -0.0162 0.0105 -0.0185 1012 CYS 132 SG -0.0182 0.0127 -0.0152 1013 LEU 133 N -0.0106 0.0105 -0.0242 1014 LEU 133 CA -0.0098 0.0094 -0.0245 1015 LEU 133 C -0.0086 0.0075 -0.0257 1016 LEU 133 O -0.0077 0.0061 -0.0250 1017 LEU 133 CB -0.0105 0.0105 -0.0259 1018 LEU 133 CG -0.0098 0.0094 -0.0266 1019 LEU 133 CD1 -0.0093 0.0086 -0.0245 1020 LEU 133 CD2 -0.0105 0.0106 -0.0279 1021 GLN 134 N -0.0086 0.0076 -0.0274 1022 GLN 134 CA -0.0075 0.0059 -0.0285 1023 GLN 134 C -0.0067 0.0045 -0.0270 1024 GLN 134 O -0.0056 0.0028 -0.0270 1025 GLN 134 CB -0.0078 0.0064 -0.0306 1026 GLN 134 CG -0.0082 0.0071 -0.0326 1027 GLN 134 CD -0.0072 0.0056 -0.0335 1028 GLN 134 NE2 -0.0075 0.0062 -0.0345 1029 GLN 134 OE1 -0.0061 0.0039 -0.0333 1030 PHE 135 N -0.0066 0.0077 -0.0269 1031 PHE 135 CA -0.0055 0.0063 -0.0247 1032 PHE 135 C -0.0047 0.0054 -0.0228 1033 PHE 135 O -0.0032 0.0035 -0.0220 1034 PHE 135 CB -0.0066 0.0076 -0.0230 1035 PHE 135 CG -0.0058 0.0066 -0.0202 1036 PHE 135 CD1 -0.0040 0.0044 -0.0200 1037 PHE 135 CD2 -0.0069 0.0079 -0.0179 1038 PHE 135 CE1 -0.0032 0.0036 -0.0174 1039 PHE 135 CE2 -0.0062 0.0070 -0.0153 1040 PHE 135 CZ -0.0043 0.0049 -0.0151 1041 MET 136 N -0.0058 0.0067 -0.0222 1042 MET 136 CA -0.0053 0.0060 -0.0204 1043 MET 136 C -0.0037 0.0042 -0.0217 1044 MET 136 O -0.0025 0.0027 -0.0203 1045 MET 136 CB -0.0068 0.0079 -0.0198 1046 MET 136 CG -0.0080 0.0092 -0.0172 1047 MET 136 SD -0.0069 0.0079 -0.0142 1048 MET 136 CE -0.0051 0.0057 -0.0135 1049 ILE 137 N -0.0030 0.0053 -0.0240 1050 ILE 137 CA -0.0019 0.0039 -0.0252 1051 ILE 137 C -0.0004 0.0017 -0.0255 1052 ILE 137 O 0.0006 0.0000 -0.0249 1053 ILE 137 CB -0.0021 0.0051 -0.0278 1054 ILE 137 CG1 -0.0034 0.0070 -0.0274 1055 ILE 137 CG2 -0.0007 0.0035 -0.0294 1056 ILE 137 CD1 -0.0037 0.0083 -0.0298 1057 ASP 138 N -0.0001 0.0016 -0.0265 1058 ASP 138 CA 0.0013 -0.0004 -0.0272 1059 ASP 138 C 0.0020 -0.0022 -0.0250 1060 ASP 138 O 0.0033 -0.0040 -0.0255 1061 ASP 138 CB 0.0014 0.0001 -0.0286 1062 ASP 138 CG 0.0011 0.0014 -0.0312 1063 ASP 138 OD1 0.0007 0.0022 -0.0318 1064 ASP 138 OD2 0.0012 0.0016 -0.0326 1065 ILE 139 N 0.0028 0.0021 -0.0251 1066 ILE 139 CA 0.0025 -0.0001 -0.0232 1067 ILE 139 C 0.0018 -0.0005 -0.0206 1068 ILE 139 O 0.0015 -0.0019 -0.0187 1069 ILE 139 CB 0.0023 0.0005 -0.0225 1070 ILE 139 CG1 0.0014 0.0028 -0.0204 1071 ILE 139 CG2 0.0029 0.0014 -0.0251 1072 ILE 139 CD1 0.0010 0.0030 -0.0191 1073 ASP 140 N 0.0017 0.0007 -0.0206 1074 ASP 140 CA 0.0011 0.0004 -0.0182 1075 ASP 140 C 0.0013 -0.0027 -0.0177 1076 ASP 140 O 0.0020 -0.0040 -0.0196 1077 ASP 140 CB 0.0010 0.0023 -0.0186 1078 ASP 140 CG 0.0002 0.0028 -0.0160 1079 ASP 140 OD1 -0.0004 0.0020 -0.0137 1080 ASP 140 OD2 0.0001 0.0040 -0.0161 1081 PRO 141 N -0.0008 -0.0020 -0.0166 1082 PRO 141 CA -0.0005 -0.0047 -0.0162 1083 PRO 141 C -0.0004 -0.0054 -0.0166 1084 PRO 141 O 0.0000 -0.0075 -0.0173 1085 PRO 141 CB -0.0011 -0.0051 -0.0135 1086 PRO 141 CG -0.0014 -0.0032 -0.0131 1087 PRO 141 CD -0.0013 -0.0009 -0.0145 1088 ALA 142 N -0.0007 -0.0037 -0.0161 1089 ALA 142 CA -0.0005 -0.0042 -0.0165 1090 ALA 142 C 0.0000 -0.0040 -0.0192 1091 ALA 142 O 0.0001 -0.0042 -0.0197 1092 ALA 142 CB -0.0011 -0.0024 -0.0149 1093 ARG 143 N 0.0001 -0.0046 -0.0205 1094 ARG 143 CA 0.0005 -0.0045 -0.0224 1095 ARG 143 C 0.0011 -0.0059 -0.0233 1096 ARG 143 O 0.0014 -0.0061 -0.0250 1097 ARG 143 CB 0.0002 -0.0027 -0.0232 1098 ARG 143 CG -0.0002 -0.0012 -0.0233 1099 ARG 143 CD -0.0003 0.0002 -0.0247 1100 ARG 143 NE -0.0007 0.0018 -0.0246 1101 ARG 143 CZ -0.0012 0.0028 -0.0233 1102 ARG 143 NH1 -0.0015 0.0026 -0.0218 1103 ARG 143 NH2 -0.0016 0.0042 -0.0234 1104 SER 144 N 0.0011 -0.0070 -0.0223 1105 SER 144 CA 0.0017 -0.0085 -0.0230 1106 SER 144 C 0.0018 -0.0079 -0.0246 1107 SER 144 O 0.0023 -0.0087 -0.0259 1108 SER 144 CB 0.0022 -0.0100 -0.0235 1109 SER 144 OG 0.0022 -0.0094 -0.0245 1110 GLY 5 N 0.0042 -0.0051 0.0012 1111 GLY 5 CA 0.0053 -0.0059 0.0027 1112 GLY 5 C 0.0061 -0.0068 0.0023 1113 GLY 5 O 0.0064 -0.0074 0.0007 1114 LEU 6 N 0.0064 -0.0069 0.0038 1115 LEU 6 CA 0.0071 -0.0077 0.0037 1116 LEU 6 C 0.0062 -0.0067 0.0039 1117 LEU 6 O 0.0053 -0.0056 0.0051 1118 LEU 6 CB 0.0084 -0.0088 0.0052 1119 LEU 6 CG 0.0096 -0.0101 0.0047 1120 LEU 6 CD1 0.0100 -0.0108 0.0027 1121 LEU 6 CD2 0.0108 -0.0111 0.0062 1122 TYR 7 N 0.0048 -0.0050 0.0009 1123 TYR 7 CA 0.0043 -0.0047 0.0013 1124 TYR 7 C 0.0055 -0.0055 0.0013 1125 TYR 7 O 0.0066 -0.0060 0.0005 1126 TYR 7 CB 0.0033 -0.0038 0.0002 1127 TYR 7 CG 0.0018 -0.0030 0.0005 1128 TYR 7 CD1 0.0008 -0.0026 0.0016 1129 TYR 7 CD2 0.0014 -0.0026 -0.0002 1130 TYR 7 CE1 -0.0006 -0.0018 0.0019 1131 TYR 7 CE2 0.0001 -0.0018 0.0001 1132 TYR 7 CZ -0.0009 -0.0014 0.0011 1133 TYR 7 OH -0.0022 -0.0007 0.0014 1134 ARG 8 N 0.0053 -0.0056 0.0022 1135 ARG 8 CA 0.0063 -0.0063 0.0023 1136 ARG 8 C 0.0056 -0.0058 0.0021 1137 ARG 8 O 0.0045 -0.0053 0.0029 1138 ARG 8 CB 0.0069 -0.0070 0.0039 1139 ARG 8 CG 0.0080 -0.0078 0.0040 1140 ARG 8 CD 0.0085 -0.0085 0.0056 1141 ARG 8 NE 0.0092 -0.0090 0.0061 1142 ARG 8 CZ 0.0090 -0.0092 0.0075 1143 ARG 8 NH1 0.0081 -0.0090 0.0087 1144 ARG 8 NH2 0.0097 -0.0097 0.0077 1145 MET 9 N 0.0052 -0.0069 0.0023 1146 MET 9 CA 0.0052 -0.0066 0.0019 1147 MET 9 C 0.0062 -0.0074 0.0018 1148 MET 9 O 0.0070 -0.0078 0.0012 1149 MET 9 CB 0.0052 -0.0057 0.0008 1150 MET 9 CG 0.0054 -0.0054 0.0002 1151 MET 9 SD 0.0051 -0.0042 -0.0009 1152 MET 9 CE 0.0046 -0.0038 -0.0008 1153 THR 10 N 0.0061 -0.0078 0.0023 1154 THR 10 CA 0.0070 -0.0085 0.0022 1155 THR 10 C 0.0070 -0.0081 0.0017 1156 THR 10 O 0.0063 -0.0077 0.0020 1157 THR 10 CB 0.0070 -0.0094 0.0033 1158 THR 10 CG2 0.0060 -0.0091 0.0041 1159 THR 10 OG1 0.0078 -0.0101 0.0032 1160 TYR 11 N 0.0062 -0.0090 0.0026 1161 TYR 11 CA 0.0068 -0.0093 0.0030 1162 TYR 11 C 0.0074 -0.0093 0.0034 1163 TYR 11 O 0.0073 -0.0089 0.0033 1164 TYR 11 CB 0.0070 -0.0088 0.0032 1165 TYR 11 CG 0.0075 -0.0080 0.0035 1166 TYR 11 CD1 0.0082 -0.0080 0.0039 1167 TYR 11 CD2 0.0071 -0.0073 0.0033 1168 TYR 11 CE1 0.0086 -0.0073 0.0042 1169 TYR 11 CE2 0.0075 -0.0066 0.0036 1170 TYR 11 CZ 0.0082 -0.0066 0.0040 1171 TYR 11 OH 0.0086 -0.0059 0.0043 1172 ILE 12 N 0.0080 -0.0097 0.0037 1173 ILE 12 CA 0.0086 -0.0097 0.0041 1174 ILE 12 C 0.0093 -0.0095 0.0045 1175 ILE 12 O 0.0093 -0.0095 0.0045 1176 ILE 12 CB 0.0087 -0.0106 0.0041 1177 ILE 12 CG1 0.0089 -0.0112 0.0042 1178 ILE 12 CG2 0.0081 -0.0108 0.0037 1179 ILE 12 CD1 0.0090 -0.0121 0.0042 1180 SER 13 N 0.0101 -0.0095 0.0070 1181 SER 13 CA 0.0113 -0.0094 0.0088 1182 SER 13 C 0.0121 -0.0092 0.0100 1183 SER 13 O 0.0117 -0.0087 0.0096 1184 SER 13 CB 0.0112 -0.0076 0.0092 1185 SER 13 OG 0.0124 -0.0070 0.0110 1186 ARG 14 N 0.0134 -0.0097 0.0116 1187 ARG 14 CA 0.0143 -0.0096 0.0129 1188 ARG 14 C 0.0150 -0.0079 0.0143 1189 ARG 14 O 0.0153 -0.0076 0.0149 1190 ARG 14 CB 0.0152 -0.0117 0.0137 1191 ARG 14 CG 0.0147 -0.0134 0.0124 1192 ARG 14 CD 0.0157 -0.0154 0.0132 1193 ARG 14 NE 0.0152 -0.0170 0.0121 1194 ARG 14 CZ 0.0151 -0.0172 0.0119 1195 ARG 14 NH1 0.0154 -0.0159 0.0127 1196 ARG 14 NH2 0.0146 -0.0187 0.0108 1197 ALA 15 N 0.0150 -0.0091 0.0162 1198 ALA 15 CA 0.0148 -0.0075 0.0180 1199 ALA 15 C 0.0167 -0.0078 0.0190 1200 ALA 15 O 0.0180 -0.0092 0.0182 1201 ALA 15 CB 0.0127 -0.0067 0.0175 1202 VAL 16 N 0.0168 -0.0065 0.0208 1203 VAL 16 CA 0.0184 -0.0065 0.0220 1204 VAL 16 C 0.0175 -0.0064 0.0214 1205 VAL 16 O 0.0155 -0.0057 0.0208 1206 VAL 16 CB 0.0189 -0.0051 0.0241 1207 VAL 16 CG1 0.0203 -0.0054 0.0247 1208 VAL 16 CG2 0.0168 -0.0035 0.0247 1209 PRO 17 N 0.0206 -0.0084 0.0206 1210 PRO 17 CA 0.0180 -0.0090 0.0185 1211 PRO 17 C 0.0148 -0.0080 0.0208 1212 PRO 17 O 0.0118 -0.0084 0.0192 1213 PRO 17 CB 0.0210 -0.0097 0.0170 1214 PRO 17 CG 0.0248 -0.0093 0.0190 1215 PRO 17 CD 0.0249 -0.0087 0.0208 1216 GLY 18 N 0.0152 -0.0067 0.0246 1217 GLY 18 CA 0.0124 -0.0057 0.0269 1218 GLY 18 C 0.0090 -0.0050 0.0284 1219 GLY 18 O 0.0072 -0.0039 0.0313 1220 LEU 19 N 0.0064 -0.0053 0.0254 1221 LEU 19 CA 0.0044 -0.0048 0.0263 1222 LEU 19 C 0.0001 -0.0038 0.0258 1223 LEU 19 O -0.0012 -0.0034 0.0231 1224 LEU 19 CB 0.0058 -0.0052 0.0236 1225 LEU 19 CG 0.0091 -0.0060 0.0256 1226 LEU 19 CD1 0.0097 -0.0061 0.0240 1227 LEU 19 CD2 0.0086 -0.0059 0.0300 1228 GLY 20 N -0.0020 -0.0032 0.0286 1229 GLY 20 CA -0.0061 -0.0022 0.0285 1230 GLY 20 C -0.0080 -0.0017 0.0290 1231 GLY 20 O -0.0062 -0.0022 0.0290 1232 TYR 21 N -0.0123 -0.0019 0.0334 1233 TYR 21 CA -0.0135 -0.0006 0.0322 1234 TYR 21 C -0.0131 -0.0014 0.0348 1235 TYR 21 O -0.0126 -0.0016 0.0336 1236 TYR 21 CB -0.0168 0.0022 0.0318 1237 TYR 21 CG -0.0174 0.0033 0.0285 1238 TYR 21 CD1 -0.0177 0.0035 0.0288 1239 TYR 21 CD2 -0.0177 0.0042 0.0250 1240 TYR 21 CE1 -0.0183 0.0045 0.0258 1241 TYR 21 CE2 -0.0183 0.0052 0.0219 1242 TYR 21 CZ -0.0186 0.0054 0.0223 1243 TYR 21 OH -0.0192 0.0064 0.0193 1244 ASN 22 N -0.0132 -0.0019 0.0385 1245 ASN 22 CA -0.0128 -0.0027 0.0413 1246 ASN 22 C -0.0098 -0.0052 0.0406 1247 ASN 22 O -0.0094 -0.0055 0.0407 1248 ASN 22 CB -0.0134 -0.0029 0.0453 1249 ASN 22 CG -0.0166 -0.0004 0.0463 1250 ASN 22 ND2 -0.0171 -0.0004 0.0490 1251 ASN 22 OD1 -0.0185 0.0015 0.0447 1252 ASP 23 N -0.0051 -0.0061 0.0367 1253 ASP 23 CA -0.0023 -0.0073 0.0365 1254 ASP 23 C -0.0020 -0.0070 0.0343 1255 ASP 23 O -0.0006 -0.0077 0.0349 1256 ASP 23 CB -0.0002 -0.0080 0.0355 1257 ASP 23 CG 0.0002 -0.0086 0.0380 1258 ASP 23 OD1 0.0018 -0.0096 0.0400 1259 ASP 23 OD2 -0.0010 -0.0081 0.0379 1260 LEU 24 N -0.0033 -0.0060 0.0318 1261 LEU 24 CA -0.0031 -0.0057 0.0296 1262 LEU 24 C -0.0045 -0.0054 0.0309 1263 LEU 24 O -0.0033 -0.0057 0.0305 1264 LEU 24 CB -0.0045 -0.0046 0.0268 1265 LEU 24 CG -0.0027 -0.0050 0.0248 1266 LEU 24 CD1 -0.0042 -0.0038 0.0220 1267 LEU 24 CD2 0.0002 -0.0060 0.0240 1268 ARG 25 N -0.0075 -0.0033 0.0324 1269 ARG 25 CA -0.0086 -0.0028 0.0333 1270 ARG 25 C -0.0066 -0.0055 0.0357 1271 ARG 25 O -0.0058 -0.0059 0.0351 1272 ARG 25 CB -0.0122 -0.0008 0.0353 1273 ARG 25 CG -0.0144 0.0022 0.0325 1274 ARG 25 CD -0.0180 0.0043 0.0345 1275 ARG 25 NE -0.0198 0.0069 0.0318 1276 ARG 25 CZ -0.0214 0.0080 0.0322 1277 ARG 25 NH1 -0.0214 0.0067 0.0351 1278 ARG 25 NH2 -0.0230 0.0104 0.0296 1279 ASP 26 N -0.0057 -0.0074 0.0385 1280 ASP 26 CA -0.0036 -0.0101 0.0407 1281 ASP 26 C -0.0002 -0.0117 0.0381 1282 ASP 26 O 0.0011 -0.0130 0.0385 1283 ASP 26 CB -0.0032 -0.0118 0.0439 1284 ASP 26 CG -0.0015 -0.0144 0.0467 1285 ASP 26 OD1 -0.0026 -0.0142 0.0482 1286 ASP 26 OD2 0.0008 -0.0166 0.0474 1287 ILE 27 N -0.0001 -0.0123 0.0319 1288 ILE 27 CA 0.0021 -0.0137 0.0294 1289 ILE 27 C 0.0022 -0.0124 0.0270 1290 ILE 27 O 0.0037 -0.0138 0.0260 1291 ILE 27 CB 0.0027 -0.0137 0.0280 1292 ILE 27 CG1 0.0030 -0.0155 0.0302 1293 ILE 27 CG2 0.0047 -0.0145 0.0251 1294 ILE 27 CD1 0.0032 -0.0150 0.0293 1295 MET 28 N 0.0006 -0.0097 0.0262 1296 MET 28 CA 0.0005 -0.0083 0.0240 1297 MET 28 C 0.0007 -0.0091 0.0250 1298 MET 28 O 0.0020 -0.0099 0.0233 1299 MET 28 CB -0.0015 -0.0053 0.0236 1300 MET 28 CG -0.0013 -0.0037 0.0205 1301 MET 28 SD -0.0006 -0.0031 0.0179 1302 MET 28 CE -0.0031 0.0003 0.0178 1303 GLY 29 N 0.0005 -0.0071 0.0241 1304 GLY 29 CA 0.0003 -0.0057 0.0226 1305 GLY 29 C 0.0004 -0.0103 0.0208 1306 GLY 29 O 0.0001 -0.0101 0.0168 1307 LYS 30 N 0.0007 -0.0144 0.0239 1308 LYS 30 CA 0.0008 -0.0189 0.0226 1309 LYS 30 C 0.0006 -0.0214 0.0175 1310 LYS 30 O 0.0004 -0.0226 0.0142 1311 LYS 30 CB 0.0013 -0.0229 0.0269 1312 LYS 30 CG 0.0015 -0.0213 0.0317 1313 LYS 30 CD 0.0019 -0.0252 0.0359 1314 LYS 30 CE 0.0022 -0.0237 0.0406 1315 LYS 30 NZ 0.0026 -0.0275 0.0449 1316 SER 31 N 0.0006 -0.0185 0.0161 1317 SER 31 CA 0.0014 -0.0192 0.0138 1318 SER 31 C 0.0028 -0.0177 0.0112 1319 SER 31 O 0.0035 -0.0192 0.0089 1320 SER 31 CB 0.0013 -0.0182 0.0147 1321 SER 31 OG 0.0013 -0.0152 0.0159 1322 GLU 32 N 0.0031 -0.0149 0.0114 1323 GLU 32 CA 0.0044 -0.0135 0.0090 1324 GLU 32 C 0.0047 -0.0150 0.0076 1325 GLU 32 O 0.0056 -0.0156 0.0051 1326 GLU 32 CB 0.0046 -0.0102 0.0098 1327 GLU 32 CG 0.0054 -0.0081 0.0089 1328 GLU 32 CD 0.0052 -0.0051 0.0106 1329 GLU 32 OE1 0.0048 -0.0044 0.0117 1330 GLU 32 OE2 0.0054 -0.0035 0.0107 1331 VAL 33 N 0.0052 -0.0171 0.0077 1332 VAL 33 CA 0.0056 -0.0197 0.0049 1333 VAL 33 C 0.0045 -0.0220 0.0036 1334 VAL 33 O 0.0061 -0.0231 0.0011 1335 VAL 33 CB 0.0038 -0.0209 0.0051 1336 VAL 33 CG1 0.0033 -0.0240 0.0025 1337 VAL 33 CG2 0.0057 -0.0190 0.0054 1338 ASN 34 N 0.0016 -0.0227 0.0052 1339 ASN 34 CA 0.0003 -0.0250 0.0040 1340 ASN 34 C 0.0023 -0.0242 0.0031 1341 ASN 34 O 0.0028 -0.0261 0.0008 1342 ASN 34 CB -0.0031 -0.0256 0.0062 1343 ASN 34 CG -0.0054 -0.0271 0.0066 1344 ASN 34 ND2 -0.0055 -0.0255 0.0083 1345 ASN 34 OD1 -0.0070 -0.0298 0.0053 1346 ASN 35 N 0.0041 -0.0217 0.0032 1347 ASN 35 CA 0.0063 -0.0208 0.0023 1348 ASN 35 C 0.0087 -0.0208 0.0009 1349 ASN 35 O 0.0106 -0.0213 -0.0003 1350 ASN 35 CB 0.0061 -0.0180 0.0033 1351 ASN 35 CG 0.0040 -0.0181 0.0044 1352 ASN 35 ND2 0.0046 -0.0170 0.0044 1353 ASN 35 OD1 0.0019 -0.0193 0.0052 1354 SER 36 N 0.0087 -0.0204 0.0011 1355 SER 36 CA 0.0109 -0.0207 -0.0003 1356 SER 36 C 0.0113 -0.0237 -0.0014 1357 SER 36 O 0.0134 -0.0243 -0.0028 1358 SER 36 CB 0.0106 -0.0198 0.0002 1359 SER 36 OG 0.0130 -0.0190 -0.0009 1360 HIS 37 N 0.0101 -0.0274 -0.0026 1361 HIS 37 CA 0.0099 -0.0303 -0.0043 1362 HIS 37 C 0.0103 -0.0290 -0.0035 1363 HIS 37 O 0.0123 -0.0308 -0.0042 1364 HIS 37 CB 0.0061 -0.0320 -0.0060 1365 HIS 37 CG 0.0058 -0.0352 -0.0079 1366 HIS 37 CD2 0.0049 -0.0354 -0.0082 1367 HIS 37 ND1 0.0065 -0.0386 -0.0097 1368 HIS 37 CE1 0.0060 -0.0408 -0.0111 1369 HIS 37 NE2 0.0050 -0.0389 -0.0102 1370 VAL 38 N 0.0085 -0.0259 -0.0020 1371 VAL 38 CA 0.0083 -0.0246 -0.0013 1372 VAL 38 C 0.0118 -0.0226 0.0005 1373 VAL 38 O 0.0132 -0.0230 0.0005 1374 VAL 38 CB 0.0043 -0.0223 -0.0007 1375 VAL 38 CG1 0.0047 -0.0196 0.0009 1376 VAL 38 CG2 0.0010 -0.0246 -0.0026 1377 GLY 39 N 0.0103 -0.0215 0.0001 1378 GLY 39 CA 0.0119 -0.0205 0.0014 1379 GLY 39 C 0.0115 -0.0182 0.0020 1380 GLY 39 O 0.0124 -0.0169 0.0029 1381 LEU 40 N 0.0101 -0.0175 0.0014 1382 LEU 40 CA 0.0096 -0.0152 0.0018 1383 LEU 40 C 0.0100 -0.0150 0.0021 1384 LEU 40 O 0.0099 -0.0165 0.0016 1385 LEU 40 CB 0.0074 -0.0144 0.0008 1386 LEU 40 CG 0.0068 -0.0135 0.0007 1387 LEU 40 CD1 0.0046 -0.0130 -0.0005 1388 LEU 40 CD2 0.0077 -0.0116 0.0019 1389 THR 41 N 0.0099 -0.0140 0.0032 1390 THR 41 CA 0.0099 -0.0132 0.0033 1391 THR 41 C 0.0092 -0.0123 0.0035 1392 THR 41 O 0.0089 -0.0123 0.0035 1393 THR 41 CB 0.0109 -0.0128 0.0033 1394 THR 41 CG2 0.0115 -0.0137 0.0032 1395 THR 41 OG1 0.0114 -0.0125 0.0034 1396 GLY 42 N 0.0091 -0.0116 0.0036 1397 GLY 42 CA 0.0086 -0.0107 0.0037 1398 GLY 42 C 0.0079 -0.0103 0.0038 1399 GLY 42 O 0.0081 -0.0105 0.0038 1400 LEU 43 N 0.0073 -0.0086 0.0047 1401 LEU 43 CA 0.0065 -0.0078 0.0050 1402 LEU 43 C 0.0068 -0.0083 0.0056 1403 LEU 43 O 0.0077 -0.0093 0.0055 1404 LEU 43 CB 0.0062 -0.0069 0.0036 1405 LEU 43 CG 0.0053 -0.0059 0.0036 1406 LEU 43 CD1 0.0044 -0.0051 0.0044 1407 LEU 43 CD2 0.0052 -0.0054 0.0022 1408 LEU 44 N 0.0061 -0.0077 0.0064 1409 LEU 44 CA 0.0062 -0.0081 0.0071 1410 LEU 44 C 0.0055 -0.0073 0.0069 1411 LEU 44 O 0.0047 -0.0063 0.0069 1412 LEU 44 CB 0.0061 -0.0084 0.0087 1413 LEU 44 CG 0.0060 -0.0087 0.0097 1414 LEU 44 CD1 0.0070 -0.0098 0.0095 1415 LEU 44 CD2 0.0056 -0.0087 0.0112 1416 CYS 45 N 0.0049 -0.0056 0.0081 1417 CYS 45 CA 0.0043 -0.0049 0.0077 1418 CYS 45 C 0.0049 -0.0056 0.0091 1419 CYS 45 O 0.0061 -0.0070 0.0092 1420 CYS 45 CB 0.0045 -0.0052 0.0055 1421 CYS 45 SG 0.0041 -0.0048 0.0050 1422 PHE 46 N 0.0041 -0.0046 0.0102 1423 PHE 46 CA 0.0045 -0.0051 0.0116 1424 PHE 46 C 0.0040 -0.0046 0.0108 1425 PHE 46 O 0.0029 -0.0034 0.0102 1426 PHE 46 CB 0.0039 -0.0045 0.0137 1427 PHE 46 CG 0.0043 -0.0048 0.0152 1428 PHE 46 CD1 0.0056 -0.0063 0.0153 1429 PHE 46 CD2 0.0033 -0.0037 0.0165 1430 PHE 46 CE1 0.0059 -0.0066 0.0167 1431 PHE 46 CE2 0.0036 -0.0041 0.0179 1432 PHE 46 CZ 0.0049 -0.0055 0.0180 1433 GLY 47 N 0.0060 -0.0047 0.0126 1434 GLY 47 CA 0.0060 -0.0051 0.0119 1435 GLY 47 C 0.0077 -0.0067 0.0120 1436 GLY 47 O 0.0087 -0.0078 0.0116 1437 ASN 48 N 0.0080 -0.0067 0.0125 1438 ASN 48 CA 0.0096 -0.0081 0.0127 1439 ASN 48 C 0.0111 -0.0087 0.0142 1440 ASN 48 O 0.0123 -0.0101 0.0138 1441 ASN 48 CB 0.0098 -0.0095 0.0107 1442 ASN 48 CG 0.0113 -0.0108 0.0108 1443 ASN 48 ND2 0.0119 -0.0122 0.0093 1444 ASN 48 OD1 0.0119 -0.0106 0.0122 1445 SER 49 N 0.0114 -0.0082 0.0134 1446 SER 49 CA 0.0123 -0.0086 0.0145 1447 SER 49 C 0.0124 -0.0094 0.0136 1448 SER 49 O 0.0135 -0.0104 0.0140 1449 SER 49 CB 0.0136 -0.0094 0.0156 1450 SER 49 OG 0.0144 -0.0109 0.0149 1451 ILE 50 N 0.0114 -0.0091 0.0123 1452 ILE 50 CA 0.0114 -0.0098 0.0114 1453 ILE 50 C 0.0103 -0.0086 0.0110 1454 ILE 50 O 0.0092 -0.0077 0.0106 1455 ILE 50 CB 0.0114 -0.0109 0.0097 1456 ILE 50 CG1 0.0124 -0.0120 0.0100 1457 ILE 50 CG2 0.0115 -0.0117 0.0089 1458 ILE 50 CD1 0.0136 -0.0134 0.0102 1459 PHE 51 N 0.0101 -0.0092 0.0104 1460 PHE 51 CA 0.0094 -0.0086 0.0100 1461 PHE 51 C 0.0097 -0.0093 0.0084 1462 PHE 51 O 0.0107 -0.0105 0.0083 1463 PHE 51 CB 0.0096 -0.0084 0.0114 1464 PHE 51 CG 0.0093 -0.0076 0.0129 1465 PHE 51 CD1 0.0100 -0.0081 0.0141 1466 PHE 51 CD2 0.0082 -0.0063 0.0132 1467 PHE 51 CE1 0.0097 -0.0074 0.0155 1468 PHE 51 CE2 0.0079 -0.0055 0.0147 1469 PHE 51 CZ 0.0086 -0.0061 0.0158 1470 LEU 52 N 0.0089 -0.0087 0.0073 1471 LEU 52 CA 0.0090 -0.0092 0.0058 1472 LEU 52 C 0.0084 -0.0084 0.0058 1473 LEU 52 O 0.0073 -0.0073 0.0056 1474 LEU 52 CB 0.0087 -0.0092 0.0042 1475 LEU 52 CG 0.0085 -0.0094 0.0026 1476 LEU 52 CD1 0.0095 -0.0107 0.0024 1477 LEU 52 CD2 0.0081 -0.0093 0.0011 1478 GLN 53 N 0.0077 -0.0094 0.0045 1479 GLN 53 CA 0.0078 -0.0095 0.0045 1480 GLN 53 C 0.0083 -0.0097 0.0040 1481 GLN 53 O 0.0086 -0.0101 0.0039 1482 GLN 53 CB 0.0077 -0.0099 0.0050 1483 GLN 53 CG 0.0078 -0.0100 0.0050 1484 GLN 53 CD 0.0075 -0.0102 0.0057 1485 GLN 53 NE2 0.0074 -0.0101 0.0057 1486 GLN 53 OE1 0.0074 -0.0104 0.0061 1487 ILE 54 N 0.0083 -0.0094 0.0036 1488 ILE 54 CA 0.0087 -0.0096 0.0032 1489 ILE 54 C 0.0088 -0.0098 0.0033 1490 ILE 54 O 0.0085 -0.0095 0.0035 1491 ILE 54 CB 0.0088 -0.0091 0.0026 1492 ILE 54 CG1 0.0088 -0.0090 0.0024 1493 ILE 54 CG2 0.0092 -0.0093 0.0021 1494 ILE 54 CD1 0.0090 -0.0087 0.0017 1495 LEU 55 N 0.0076 -0.0092 0.0025 1496 LEU 55 CA 0.0078 -0.0097 0.0023 1497 LEU 55 C 0.0082 -0.0096 0.0025 1498 LEU 55 O 0.0082 -0.0093 0.0028 1499 LEU 55 CB 0.0074 -0.0098 0.0020 1500 LEU 55 CG 0.0070 -0.0101 0.0016 1501 LEU 55 CD1 0.0065 -0.0100 0.0014 1502 LEU 55 CD2 0.0073 -0.0106 0.0014 1503 GLU 56 N 0.0086 -0.0100 0.0025 1504 GLU 56 CA 0.0090 -0.0100 0.0027 1505 GLU 56 C 0.0092 -0.0105 0.0024 1506 GLU 56 O 0.0093 -0.0109 0.0022 1507 GLU 56 CB 0.0095 -0.0100 0.0030 1508 GLU 56 CG 0.0095 -0.0094 0.0034 1509 GLU 56 CD 0.0099 -0.0093 0.0036 1510 GLU 56 OE1 0.0101 -0.0097 0.0035 1511 GLU 56 OE2 0.0100 -0.0089 0.0040 1512 GLY 57 N 0.0067 -0.0096 0.0029 1513 GLY 57 CA 0.0069 -0.0101 0.0025 1514 GLY 57 C 0.0061 -0.0084 0.0029 1515 GLY 57 O 0.0057 -0.0069 0.0039 1516 SER 58 N 0.0060 -0.0086 0.0021 1517 SER 58 CA 0.0053 -0.0070 0.0023 1518 SER 58 C 0.0041 -0.0055 0.0012 1519 SER 58 O 0.0039 -0.0058 -0.0003 1520 SER 58 CB 0.0054 -0.0077 0.0017 1521 SER 58 OG 0.0051 -0.0083 -0.0004 1522 ARG 59 N -0.0033 -0.0022 -0.0007 1523 ARG 59 CA -0.0034 -0.0015 -0.0012 1524 ARG 59 C -0.0028 -0.0008 -0.0028 1525 ARG 59 O -0.0021 -0.0009 -0.0035 1526 ARG 59 CB -0.0048 -0.0004 -0.0004 1527 ARG 59 CG -0.0051 -0.0001 -0.0004 1528 ARG 59 CD -0.0065 0.0009 0.0004 1529 ARG 59 NE -0.0069 0.0023 -0.0003 1530 ARG 59 CZ -0.0081 0.0034 0.0002 1531 ARG 59 NH1 -0.0090 0.0033 0.0014 1532 ARG 59 NH2 -0.0085 0.0046 -0.0005 1533 GLN 60 N -0.0029 0.0001 -0.0034 1534 GLN 60 CA -0.0024 0.0009 -0.0050 1535 GLN 60 C -0.0010 -0.0002 -0.0058 1536 GLN 60 O -0.0003 0.0001 -0.0069 1537 GLN 60 CB -0.0028 0.0018 -0.0054 1538 GLN 60 CG -0.0021 0.0026 -0.0070 1539 GLN 60 CD -0.0023 0.0036 -0.0078 1540 GLN 60 NE2 -0.0016 0.0042 -0.0092 1541 GLN 60 OE1 -0.0031 0.0040 -0.0071 1542 ALA 61 N 0.0030 -0.0037 -0.0019 1543 ALA 61 CA 0.0037 -0.0046 -0.0026 1544 ALA 61 C 0.0038 -0.0047 -0.0026 1545 ALA 61 O 0.0041 -0.0048 -0.0036 1546 ALA 61 CB 0.0042 -0.0055 -0.0020 1547 ILE 62 N 0.0035 -0.0046 -0.0016 1548 ILE 62 CA 0.0036 -0.0046 -0.0016 1549 ILE 62 C 0.0032 -0.0038 -0.0025 1550 ILE 62 O 0.0034 -0.0040 -0.0031 1551 ILE 62 CB 0.0033 -0.0046 -0.0003 1552 ILE 62 CG1 0.0038 -0.0056 0.0004 1553 ILE 62 CG2 0.0031 -0.0043 -0.0003 1554 ILE 62 CD1 0.0036 -0.0057 0.0016 1555 SER 63 N 0.0005 -0.0021 -0.0021 1556 SER 63 CA 0.0002 -0.0016 -0.0025 1557 SER 63 C 0.0007 -0.0015 -0.0034 1558 SER 63 O 0.0009 -0.0015 -0.0037 1559 SER 63 CB -0.0007 -0.0010 -0.0025 1560 SER 63 OG -0.0012 -0.0011 -0.0017 1561 HIS 64 N 0.0009 -0.0014 -0.0039 1562 HIS 64 CA 0.0015 -0.0013 -0.0047 1563 HIS 64 C 0.0023 -0.0018 -0.0048 1564 HIS 64 O 0.0026 -0.0017 -0.0053 1565 HIS 64 CB 0.0015 -0.0011 -0.0052 1566 HIS 64 CG 0.0018 -0.0007 -0.0061 1567 HIS 64 CD2 0.0016 -0.0002 -0.0067 1568 HIS 64 ND1 0.0025 -0.0009 -0.0066 1569 HIS 64 CE1 0.0026 -0.0006 -0.0074 1570 HIS 64 NE2 0.0021 -0.0001 -0.0075 1571 THR 65 N 0.0042 -0.0038 -0.0024 1572 THR 65 CA 0.0051 -0.0045 -0.0025 1573 THR 65 C 0.0050 -0.0045 -0.0023 1574 THR 65 O 0.0056 -0.0048 -0.0029 1575 THR 65 CB 0.0056 -0.0054 -0.0016 1576 THR 65 CG2 0.0065 -0.0062 -0.0016 1577 THR 65 OG1 0.0058 -0.0055 -0.0019 1578 TYR 66 N 0.0042 -0.0043 -0.0015 1579 TYR 66 CA 0.0041 -0.0042 -0.0013 1580 TYR 66 C 0.0039 -0.0035 -0.0024 1581 TYR 66 O 0.0043 -0.0036 -0.0028 1582 TYR 66 CB 0.0032 -0.0039 -0.0003 1583 TYR 66 CG 0.0030 -0.0040 0.0000 1584 TYR 66 CD1 0.0037 -0.0048 0.0005 1585 TYR 66 CD2 0.0022 -0.0032 -0.0001 1586 TYR 66 CE1 0.0036 -0.0048 0.0007 1587 TYR 66 CE2 0.0021 -0.0032 0.0002 1588 TYR 66 CZ 0.0028 -0.0040 0.0006 1589 TYR 66 OH 0.0026 -0.0040 0.0008 1590 HIS 67 N 0.0022 -0.0031 -0.0001 1591 HIS 67 CA 0.0020 -0.0024 -0.0013 1592 HIS 67 C 0.0027 -0.0029 -0.0023 1593 HIS 67 O 0.0028 -0.0027 -0.0032 1594 HIS 67 CB 0.0014 -0.0016 -0.0014 1595 HIS 67 CG 0.0012 -0.0010 -0.0026 1596 HIS 67 CD2 0.0011 -0.0006 -0.0033 1597 HIS 67 ND1 0.0012 -0.0007 -0.0033 1598 HIS 67 CE1 0.0010 -0.0001 -0.0043 1599 HIS 67 NE2 0.0010 -0.0000 -0.0044 1600 ARG 68 N 0.0033 -0.0036 -0.0024 1601 ARG 68 CA 0.0041 -0.0042 -0.0033 1602 ARG 68 C 0.0046 -0.0048 -0.0033 1603 ARG 68 O 0.0050 -0.0050 -0.0042 1604 ARG 68 CB 0.0046 -0.0048 -0.0033 1605 ARG 68 CG 0.0054 -0.0054 -0.0044 1606 ARG 68 CD 0.0059 -0.0060 -0.0043 1607 ARG 68 NE 0.0055 -0.0059 -0.0033 1608 ARG 68 CZ 0.0059 -0.0066 -0.0027 1609 ARG 68 NH1 0.0067 -0.0075 -0.0029 1610 ARG 68 NH2 0.0054 -0.0063 -0.0019 1611 ILE 69 N 0.0056 -0.0036 -0.0009 1612 ILE 69 CA 0.0060 -0.0035 0.0001 1613 ILE 69 C 0.0054 -0.0038 0.0008 1614 ILE 69 O 0.0057 -0.0037 0.0015 1615 ILE 69 CB 0.0063 -0.0034 0.0006 1616 ILE 69 CG1 0.0072 -0.0029 0.0002 1617 ILE 69 CG2 0.0062 -0.0035 0.0018 1618 ILE 69 CD1 0.0075 -0.0028 0.0007 1619 LEU 70 N 0.0044 -0.0043 0.0008 1620 LEU 70 CA 0.0038 -0.0046 0.0015 1621 LEU 70 C 0.0038 -0.0046 0.0014 1622 LEU 70 O 0.0035 -0.0048 0.0021 1623 LEU 70 CB 0.0028 -0.0051 0.0013 1624 LEU 70 CG 0.0025 -0.0053 0.0020 1625 LEU 70 CD1 0.0015 -0.0057 0.0017 1626 LEU 70 CD2 0.0025 -0.0053 0.0031 1627 GLN 71 N 0.0020 -0.0052 0.0059 1628 GLN 71 CA 0.0031 -0.0046 0.0068 1629 GLN 71 C 0.0062 -0.0029 0.0095 1630 GLN 71 O 0.0073 -0.0028 0.0110 1631 GLN 71 CB 0.0028 -0.0026 0.0036 1632 GLN 71 CG -0.0001 -0.0037 0.0005 1633 GLN 71 CD -0.0024 -0.0069 0.0013 1634 GLN 71 NE2 -0.0035 -0.0072 -0.0002 1635 GLN 71 OE1 -0.0032 -0.0092 0.0032 1636 ASP 72 N 0.0076 -0.0017 0.0100 1637 ASP 72 CA 0.0107 0.0003 0.0121 1638 ASP 72 C 0.0114 -0.0016 0.0159 1639 ASP 72 O 0.0104 -0.0037 0.0173 1640 ASP 72 CB 0.0119 0.0021 0.0115 1641 ASP 72 CG 0.0149 0.0053 0.0119 1642 ASP 72 OD1 0.0168 0.0055 0.0146 1643 ASP 72 OD2 0.0154 0.0076 0.0094 1644 PRO 73 N 0.0183 0.0011 0.0278 1645 PRO 73 CA 0.0187 0.0010 0.0256 1646 PRO 73 C 0.0174 -0.0003 0.0242 1647 PRO 73 O 0.0178 -0.0003 0.0224 1648 PRO 73 CB 0.0187 0.0011 0.0257 1649 PRO 73 CG 0.0185 0.0012 0.0270 1650 PRO 73 CD 0.0185 0.0015 0.0288 1651 ARG 74 N 0.0160 -0.0013 0.0251 1652 ARG 74 CA 0.0148 -0.0025 0.0239 1653 ARG 74 C 0.0152 -0.0024 0.0228 1654 ARG 74 O 0.0144 -0.0033 0.0213 1655 ARG 74 CB 0.0132 -0.0035 0.0253 1656 ARG 74 CG 0.0118 -0.0049 0.0243 1657 ARG 74 CD 0.0101 -0.0060 0.0252 1658 ARG 74 NE 0.0099 -0.0058 0.0274 1659 ARG 74 CZ 0.0102 -0.0053 0.0284 1660 ARG 74 NH1 0.0108 -0.0051 0.0274 1661 ARG 74 NH2 0.0100 -0.0051 0.0304 1662 HIS 75 N 0.0146 -0.0033 0.0178 1663 HIS 75 CA 0.0144 -0.0049 0.0170 1664 HIS 75 C 0.0149 -0.0063 0.0170 1665 HIS 75 O 0.0153 -0.0060 0.0175 1666 HIS 75 CB 0.0129 -0.0047 0.0156 1667 HIS 75 CG 0.0121 -0.0043 0.0149 1668 HIS 75 CD2 0.0111 -0.0030 0.0143 1669 HIS 75 ND1 0.0123 -0.0053 0.0147 1670 HIS 75 CE1 0.0114 -0.0046 0.0140 1671 HIS 75 NE2 0.0107 -0.0032 0.0138 1672 HIS 76 N 0.0148 -0.0079 0.0164 1673 HIS 76 CA 0.0154 -0.0094 0.0164 1674 HIS 76 C 0.0147 -0.0108 0.0152 1675 HIS 76 O 0.0141 -0.0108 0.0146 1676 HIS 76 CB 0.0168 -0.0100 0.0177 1677 HIS 76 CG 0.0172 -0.0108 0.0179 1678 HIS 76 CD2 0.0181 -0.0123 0.0181 1679 HIS 76 ND1 0.0168 -0.0100 0.0177 1680 HIS 76 CE1 0.0173 -0.0110 0.0179 1681 HIS 76 NE2 0.0181 -0.0124 0.0182 1682 SER 77 N 0.0123 -0.0083 0.0096 1683 SER 77 CA 0.0114 -0.0104 0.0086 1684 SER 77 C 0.0095 -0.0098 0.0071 1685 SER 77 O 0.0089 -0.0109 0.0064 1686 SER 77 CB 0.0124 -0.0120 0.0093 1687 SER 77 OG 0.0141 -0.0127 0.0107 1688 ALA 78 N 0.0086 -0.0082 0.0064 1689 ALA 78 CA 0.0068 -0.0077 0.0049 1690 ALA 78 C 0.0057 -0.0097 0.0038 1691 ALA 78 O 0.0061 -0.0110 0.0040 1692 ALA 78 CB 0.0061 -0.0056 0.0045 1693 GLU 79 N 0.0077 -0.0057 0.0005 1694 GLU 79 CA 0.0067 -0.0063 0.0009 1695 GLU 79 C 0.0057 -0.0062 0.0011 1696 GLU 79 O 0.0058 -0.0063 0.0011 1697 GLU 79 CB 0.0071 -0.0075 0.0013 1698 GLU 79 CG 0.0066 -0.0080 0.0016 1699 GLU 79 CD 0.0070 -0.0092 0.0020 1700 GLU 79 OE1 0.0080 -0.0095 0.0019 1701 GLU 79 OE2 0.0062 -0.0099 0.0023 1702 ILE 80 N 0.0047 -0.0059 0.0011 1703 ILE 80 CA 0.0036 -0.0058 0.0013 1704 ILE 80 C 0.0030 -0.0069 0.0018 1705 ILE 80 O 0.0028 -0.0074 0.0020 1706 ILE 80 CB 0.0028 -0.0049 0.0011 1707 ILE 80 CG1 0.0034 -0.0038 0.0006 1708 ILE 80 CG2 0.0017 -0.0047 0.0012 1709 ILE 80 CD1 0.0028 -0.0030 0.0004 1710 ILE 81 N 0.0081 -0.0070 -0.0002 1711 ILE 81 CA 0.0076 -0.0079 0.0003 1712 ILE 81 C 0.0065 -0.0076 0.0008 1713 ILE 81 O 0.0060 -0.0078 0.0011 1714 ILE 81 CB 0.0080 -0.0088 0.0004 1715 ILE 81 CG1 0.0089 -0.0094 0.0001 1716 ILE 81 CG2 0.0072 -0.0096 0.0010 1717 ILE 81 CD1 0.0094 -0.0102 0.0001 1718 ALA 82 N 0.0062 -0.0071 0.0008 1719 ALA 82 CA 0.0051 -0.0068 0.0013 1720 ALA 82 C 0.0049 -0.0059 0.0011 1721 ALA 82 O 0.0055 -0.0057 0.0007 1722 ALA 82 CB 0.0046 -0.0077 0.0018 1723 PHE 83 N 0.0001 -0.0028 0.0033 1724 PHE 83 CA 0.0002 -0.0029 0.0025 1725 PHE 83 C -0.0002 -0.0026 0.0039 1726 PHE 83 O -0.0014 -0.0015 0.0043 1727 PHE 83 CB -0.0007 -0.0020 0.0009 1728 PHE 83 CG -0.0006 -0.0021 0.0000 1729 PHE 83 CD1 -0.0012 -0.0015 0.0007 1730 PHE 83 CD2 0.0002 -0.0027 -0.0014 1731 PHE 83 CE1 -0.0012 -0.0015 -0.0002 1732 PHE 83 CE2 0.0003 -0.0027 -0.0023 1733 PHE 83 CZ -0.0004 -0.0021 -0.0016 1734 ASP 84 N 0.0007 -0.0034 0.0047 1735 ASP 84 CA 0.0004 -0.0032 0.0061 1736 ASP 84 C 0.0012 -0.0040 0.0060 1737 ASP 84 O 0.0023 -0.0049 0.0053 1738 ASP 84 CB 0.0007 -0.0036 0.0079 1739 ASP 84 CG 0.0021 -0.0048 0.0080 1740 ASP 84 OD1 0.0025 -0.0052 0.0071 1741 ASP 84 OD2 0.0027 -0.0055 0.0091 1742 PRO 85 N 0.0019 -0.0028 0.0062 1743 PRO 85 CA 0.0032 -0.0037 0.0061 1744 PRO 85 C 0.0046 -0.0042 0.0076 1745 PRO 85 O 0.0044 -0.0037 0.0090 1746 PRO 85 CB 0.0024 -0.0031 0.0063 1747 PRO 85 CG 0.0009 -0.0019 0.0069 1748 PRO 85 CD 0.0007 -0.0017 0.0071 1749 VAL 86 N 0.0059 -0.0052 0.0071 1750 VAL 86 CA 0.0074 -0.0059 0.0083 1751 VAL 86 C 0.0084 -0.0065 0.0084 1752 VAL 86 O 0.0082 -0.0068 0.0072 1753 VAL 86 CB 0.0083 -0.0067 0.0077 1754 VAL 86 CG1 0.0076 -0.0061 0.0083 1755 VAL 86 CG2 0.0082 -0.0072 0.0057 1756 LEU 87 N 0.0118 -0.0043 0.0108 1757 LEU 87 CA 0.0148 -0.0060 0.0112 1758 LEU 87 C 0.0160 -0.0087 0.0096 1759 LEU 87 O 0.0171 -0.0110 0.0084 1760 LEU 87 CB 0.0171 -0.0044 0.0139 1761 LEU 87 CG 0.0205 -0.0059 0.0146 1762 LEU 87 CD1 0.0206 -0.0075 0.0133 1763 LEU 87 CD2 0.0222 -0.0038 0.0173 1764 GLN 88 N 0.0157 -0.0086 0.0095 1765 GLN 88 CA 0.0168 -0.0111 0.0081 1766 GLN 88 C 0.0147 -0.0108 0.0072 1767 GLN 88 O 0.0132 -0.0085 0.0082 1768 GLN 88 CB 0.0202 -0.0117 0.0096 1769 GLN 88 CG 0.0210 -0.0092 0.0121 1770 GLN 88 CD 0.0243 -0.0099 0.0135 1771 GLN 88 NE2 0.0252 -0.0116 0.0126 1772 GLN 88 OE1 0.0261 -0.0088 0.0154 1773 ARG 89 N 0.0145 -0.0107 0.0046 1774 ARG 89 CA 0.0134 -0.0107 0.0038 1775 ARG 89 C 0.0132 -0.0104 0.0036 1776 ARG 89 O 0.0139 -0.0104 0.0041 1777 ARG 89 CB 0.0128 -0.0120 0.0037 1778 ARG 89 CG 0.0131 -0.0125 0.0040 1779 ARG 89 CD 0.0122 -0.0136 0.0036 1780 ARG 89 NE 0.0126 -0.0143 0.0040 1781 ARG 89 CZ 0.0120 -0.0149 0.0036 1782 ARG 89 NH1 0.0110 -0.0148 0.0029 1783 ARG 89 NH2 0.0124 -0.0156 0.0041 1784 GLU 90 N 0.0122 -0.0101 0.0029 1785 GLU 90 CA 0.0119 -0.0098 0.0026 1786 GLU 90 C 0.0109 -0.0107 0.0021 1787 GLU 90 O 0.0106 -0.0107 0.0019 1788 GLU 90 CB 0.0117 -0.0085 0.0023 1789 GLU 90 CG 0.0127 -0.0076 0.0028 1790 GLU 90 CD 0.0130 -0.0069 0.0029 1791 GLU 90 OE1 0.0129 -0.0074 0.0029 1792 GLU 90 OE2 0.0134 -0.0058 0.0029 1793 PHE 91 N 0.0109 -0.0099 0.0022 1794 PHE 91 CA 0.0099 -0.0101 0.0025 1795 PHE 91 C 0.0100 -0.0110 0.0027 1796 PHE 91 O 0.0094 -0.0116 0.0031 1797 PHE 91 CB 0.0091 -0.0101 0.0027 1798 PHE 91 CG 0.0091 -0.0093 0.0025 1799 PHE 91 CD1 0.0086 -0.0085 0.0024 1800 PHE 91 CD2 0.0095 -0.0094 0.0024 1801 PHE 91 CE1 0.0085 -0.0077 0.0022 1802 PHE 91 CE2 0.0095 -0.0087 0.0022 1803 PHE 91 CZ 0.0090 -0.0078 0.0021 1804 VAL 92 N 0.0108 -0.0111 0.0026 1805 VAL 92 CA 0.0110 -0.0120 0.0028 1806 VAL 92 C 0.0103 -0.0123 0.0030 1807 VAL 92 O 0.0100 -0.0131 0.0033 1808 VAL 92 CB 0.0120 -0.0120 0.0025 1809 VAL 92 CG1 0.0121 -0.0111 0.0022 1810 VAL 92 CG2 0.0122 -0.0129 0.0027 1811 GLN 93 N 0.0090 -0.0092 0.0028 1812 GLN 93 CA 0.0078 -0.0089 0.0035 1813 GLN 93 C 0.0070 -0.0095 0.0046 1814 GLN 93 O 0.0064 -0.0101 0.0054 1815 GLN 93 CB 0.0070 -0.0076 0.0029 1816 GLN 93 CG 0.0078 -0.0069 0.0016 1817 GLN 93 CD 0.0079 -0.0063 0.0011 1818 GLN 93 NE2 0.0087 -0.0057 -0.0000 1819 GLN 93 OE1 0.0073 -0.0064 0.0016 1820 TRP 94 N 0.0069 -0.0095 0.0046 1821 TRP 94 CA 0.0060 -0.0099 0.0056 1822 TRP 94 C 0.0067 -0.0111 0.0062 1823 TRP 94 O 0.0076 -0.0114 0.0057 1824 TRP 94 CB 0.0053 -0.0090 0.0054 1825 TRP 94 CG 0.0047 -0.0078 0.0047 1826 TRP 94 CD1 0.0051 -0.0069 0.0036 1827 TRP 94 CD2 0.0036 -0.0072 0.0050 1828 TRP 94 CE2 0.0033 -0.0060 0.0041 1829 TRP 94 CE3 0.0027 -0.0077 0.0060 1830 TRP 94 NE1 0.0043 -0.0058 0.0032 1831 TRP 94 CZ2 0.0023 -0.0052 0.0041 1832 TRP 94 CZ3 0.0017 -0.0069 0.0060 1833 TRP 94 CH2 0.0015 -0.0057 0.0051 1834 SER 95 N 0.0090 -0.0104 0.0039 1835 SER 95 CA 0.0087 -0.0121 0.0043 1836 SER 95 C 0.0077 -0.0120 0.0053 1837 SER 95 O 0.0077 -0.0129 0.0053 1838 SER 95 CB 0.0083 -0.0131 0.0048 1839 SER 95 OG 0.0093 -0.0139 0.0039 1840 MET 96 N 0.0068 -0.0108 0.0061 1841 MET 96 CA 0.0059 -0.0102 0.0069 1842 MET 96 C 0.0053 -0.0085 0.0073 1843 MET 96 O 0.0049 -0.0082 0.0076 1844 MET 96 CB 0.0048 -0.0114 0.0079 1845 MET 96 CG 0.0045 -0.0116 0.0083 1846 MET 96 SD 0.0057 -0.0126 0.0073 1847 MET 96 CE 0.0059 -0.0146 0.0072 1848 LYS 97 N 0.0047 -0.0083 0.0083 1849 LYS 97 CA 0.0034 -0.0064 0.0084 1850 LYS 97 C 0.0030 -0.0062 0.0089 1851 LYS 97 O 0.0039 -0.0071 0.0084 1852 LYS 97 CB 0.0039 -0.0048 0.0067 1853 LYS 97 CG 0.0026 -0.0029 0.0069 1854 LYS 97 CD 0.0015 -0.0030 0.0085 1855 LYS 97 CE 0.0005 -0.0011 0.0084 1856 LYS 97 NZ -0.0007 -0.0013 0.0100 1857 LEU 98 N 0.0015 -0.0051 0.0100 1858 LEU 98 CA 0.0009 -0.0048 0.0106 1859 LEU 98 C 0.0003 -0.0027 0.0098 1860 LEU 98 O -0.0004 -0.0014 0.0098 1861 LEU 98 CB -0.0003 -0.0054 0.0126 1862 LEU 98 CG -0.0010 -0.0054 0.0135 1863 LEU 98 CD1 0.0002 -0.0062 0.0126 1864 LEU 98 CD2 -0.0018 -0.0066 0.0155 1865 VAL 99 N -0.0005 -0.0022 0.0088 1866 VAL 99 CA -0.0013 0.0002 0.0077 1867 VAL 99 C -0.0021 0.0002 0.0090 1868 VAL 99 O -0.0011 -0.0012 0.0087 1869 VAL 99 CB 0.0002 0.0008 0.0049 1870 VAL 99 CG1 0.0019 -0.0013 0.0042 1871 VAL 99 CG2 -0.0006 0.0033 0.0039 1872 GLN 100 N -0.0039 0.0018 0.0104 1873 GLN 100 CA -0.0048 0.0021 0.0116 1874 GLN 100 C -0.0049 0.0041 0.0099 1875 GLN 100 O -0.0048 0.0058 0.0082 1876 GLN 100 CB -0.0068 0.0027 0.0141 1877 GLN 100 CG -0.0068 0.0004 0.0163 1878 GLN 100 CD -0.0082 0.0010 0.0179 1879 GLN 100 NE2 -0.0091 -0.0002 0.0203 1880 GLN 100 OE1 -0.0085 0.0024 0.0170 1881 ILE 101 N -0.0045 0.0048 0.0128 1882 ILE 101 CA -0.0048 0.0065 0.0100 1883 ILE 101 C -0.0067 0.0087 0.0133 1884 ILE 101 O -0.0065 0.0086 0.0123 1885 ILE 101 CB -0.0021 0.0028 0.0073 1886 ILE 101 CG1 -0.0009 -0.0009 0.0111 1887 ILE 101 CG2 -0.0003 0.0009 0.0039 1888 ILE 101 CD1 0.0010 -0.0035 0.0092 1889 ASP 102 N -0.0087 0.0106 0.0171 1890 ASP 102 CA -0.0106 0.0127 0.0206 1891 ASP 102 C -0.0120 0.0162 0.0180 1892 ASP 102 O -0.0115 0.0155 0.0175 1893 ASP 102 CB -0.0126 0.0147 0.0246 1894 ASP 102 CG -0.0136 0.0174 0.0224 1895 ASP 102 OD1 -0.0137 0.0193 0.0180 1896 ASP 102 OD2 -0.0144 0.0178 0.0250 1897 SER 105 N -0.0152 0.0223 0.0135 1898 SER 105 CA -0.0153 0.0218 0.0103 1899 SER 105 C -0.0164 0.0226 0.0066 1900 SER 105 O -0.0160 0.0221 0.0060 1901 SER 105 CB -0.0127 0.0185 0.0098 1902 SER 105 OG -0.0115 0.0167 0.0076 1903 PRO 106 N -0.0177 0.0238 0.0040 1904 PRO 106 CA -0.0187 0.0245 0.0003 1905 PRO 106 C -0.0168 0.0217 -0.0020 1906 PRO 106 O -0.0147 0.0192 -0.0015 1907 PRO 106 CB -0.0202 0.0260 -0.0016 1908 PRO 106 CG -0.0193 0.0252 0.0005 1909 PRO 106 CD -0.0184 0.0248 0.0045 1910 GLU 107 N -0.0194 0.0225 -0.0033 1911 GLU 107 CA -0.0170 0.0205 -0.0062 1912 GLU 107 C -0.0151 0.0191 -0.0093 1913 GLU 107 O -0.0127 0.0170 -0.0115 1914 GLU 107 CB -0.0184 0.0224 -0.0089 1915 GLU 107 CG -0.0205 0.0252 -0.0120 1916 GLU 107 CD -0.0189 0.0244 -0.0166 1917 GLU 107 OE1 -0.0170 0.0227 -0.0181 1918 GLU 107 OE2 -0.0195 0.0254 -0.0187 1919 LYS 108 N -0.0161 0.0201 -0.0095 1920 LYS 108 CA -0.0142 0.0187 -0.0122 1921 LYS 108 C -0.0112 0.0152 -0.0105 1922 LYS 108 O -0.0088 0.0132 -0.0131 1923 LYS 108 CB -0.0161 0.0206 -0.0124 1924 LYS 108 CG -0.0143 0.0193 -0.0150 1925 LYS 108 CD -0.0141 0.0186 -0.0123 1926 LYS 108 CE -0.0127 0.0176 -0.0150 1927 LYS 108 NZ -0.0134 0.0180 -0.0129 1928 MET 109 N -0.0093 0.0138 -0.0079 1929 MET 109 CA -0.0073 0.0102 -0.0065 1930 MET 109 C -0.0059 0.0080 -0.0069 1931 MET 109 O -0.0038 0.0051 -0.0080 1932 MET 109 CB -0.0080 0.0099 -0.0021 1933 MET 109 CG -0.0079 0.0096 -0.0016 1934 MET 109 SD -0.0084 0.0088 0.0036 1935 MET 109 CE -0.0102 0.0116 0.0036 1936 ARG 110 N -0.0070 0.0094 -0.0061 1937 ARG 110 CA -0.0057 0.0077 -0.0068 1938 ARG 110 C -0.0047 0.0074 -0.0112 1939 ARG 110 O -0.0028 0.0048 -0.0123 1940 ARG 110 CB -0.0072 0.0095 -0.0050 1941 ARG 110 CG -0.0079 0.0092 -0.0004 1942 ARG 110 CD -0.0099 0.0119 0.0011 1943 ARG 110 NE -0.0118 0.0143 0.0035 1944 ARG 110 CZ -0.0139 0.0176 0.0033 1945 ARG 110 NH1 -0.0144 0.0191 0.0009 1946 ARG 110 NH2 -0.0156 0.0196 0.0056 1947 ARG 111 N -0.0084 0.0089 -0.0130 1948 ARG 111 CA -0.0071 0.0089 -0.0176 1949 ARG 111 C -0.0040 0.0062 -0.0181 1950 ARG 111 O -0.0016 0.0046 -0.0209 1951 ARG 111 CB -0.0097 0.0120 -0.0198 1952 ARG 111 CG -0.0087 0.0124 -0.0247 1953 ARG 111 CD -0.0088 0.0131 -0.0269 1954 ARG 111 NE -0.0119 0.0164 -0.0282 1955 ARG 111 CZ -0.0128 0.0182 -0.0316 1956 ARG 111 NH1 -0.0109 0.0172 -0.0342 1957 ARG 111 NH2 -0.0158 0.0213 -0.0325 1958 LEU 112 N -0.0042 0.0055 -0.0154 1959 LEU 112 CA -0.0013 0.0028 -0.0155 1960 LEU 112 C 0.0015 -0.0002 -0.0141 1961 LEU 112 O 0.0044 -0.0024 -0.0160 1962 LEU 112 CB -0.0022 0.0029 -0.0127 1963 LEU 112 CG -0.0048 0.0058 -0.0141 1964 LEU 112 CD1 -0.0046 0.0051 -0.0123 1965 LEU 112 CD2 -0.0045 0.0068 -0.0190 1966 TYR 113 N 0.0004 -0.0007 -0.0115 1967 TYR 113 CA 0.0025 -0.0029 -0.0105 1968 TYR 113 C 0.0036 -0.0039 -0.0134 1969 TYR 113 O 0.0057 -0.0059 -0.0141 1970 TYR 113 CB 0.0019 -0.0024 -0.0078 1971 TYR 113 CG 0.0020 -0.0027 -0.0044 1972 TYR 113 CD1 0.0039 -0.0047 -0.0036 1973 TYR 113 CD2 0.0003 -0.0011 -0.0021 1974 TYR 113 CE1 0.0040 -0.0050 -0.0005 1975 TYR 113 CE2 0.0004 -0.0014 0.0010 1976 TYR 113 CZ 0.0023 -0.0033 0.0018 1977 TYR 113 OH 0.0024 -0.0037 0.0048 1978 LEU 114 N 0.0023 -0.0024 -0.0150 1979 LEU 114 CA 0.0032 -0.0032 -0.0178 1980 LEU 114 C 0.0041 -0.0039 -0.0206 1981 LEU 114 O 0.0057 -0.0054 -0.0223 1982 LEU 114 CB 0.0014 -0.0012 -0.0190 1983 LEU 114 CG 0.0022 -0.0019 -0.0209 1984 LEU 114 CD1 0.0030 -0.0029 -0.0185 1985 LEU 114 CD2 0.0002 0.0001 -0.0229 1986 LYS 115 N 0.0006 -0.0006 -0.0191 1987 LYS 115 CA 0.0023 -0.0011 -0.0215 1988 LYS 115 C 0.0055 -0.0037 -0.0205 1989 LYS 115 O 0.0078 -0.0046 -0.0230 1990 LYS 115 CB 0.0006 0.0002 -0.0214 1991 LYS 115 CG 0.0014 0.0005 -0.0247 1992 LYS 115 CD 0.0008 0.0008 -0.0238 1993 LYS 115 CE -0.0020 0.0032 -0.0254 1994 LYS 115 NZ -0.0022 0.0034 -0.0252 1995 TYR 116 N 0.0057 -0.0049 -0.0170 1996 TYR 116 CA 0.0085 -0.0074 -0.0159 1997 TYR 116 C 0.0100 -0.0090 -0.0141 1998 TYR 116 O 0.0115 -0.0109 -0.0117 1999 TYR 116 CB 0.0081 -0.0078 -0.0134 2000 TYR 116 CG 0.0069 -0.0065 -0.0150 2001 TYR 116 CD1 0.0088 -0.0071 -0.0176 2002 TYR 116 CD2 0.0040 -0.0047 -0.0138 2003 TYR 116 CE1 0.0078 -0.0058 -0.0191 2004 TYR 116 CE2 0.0029 -0.0034 -0.0153 2005 TYR 116 CZ 0.0048 -0.0040 -0.0180 2006 TYR 116 OH 0.0037 -0.0028 -0.0194 2007 SER 117 N 0.0074 -0.0111 -0.0153 2008 SER 117 CA 0.0095 -0.0128 -0.0136 2009 SER 117 C 0.0099 -0.0137 -0.0149 2010 SER 117 O 0.0085 -0.0127 -0.0167 2011 SER 117 CB 0.0095 -0.0118 -0.0101 2012 SER 117 OG 0.0082 -0.0101 -0.0096 2013 GLY 118 N 0.0118 -0.0157 -0.0140 2014 GLY 118 CA 0.0125 -0.0168 -0.0149 2015 GLY 118 C 0.0128 -0.0163 -0.0124 2016 GLY 118 O 0.0135 -0.0173 -0.0128 2017 GLU 119 N 0.0110 -0.0164 -0.0098 2018 GLU 119 CA 0.0113 -0.0159 -0.0069 2019 GLU 119 C 0.0097 -0.0129 -0.0059 2020 GLU 119 O 0.0087 -0.0114 -0.0065 2021 GLU 119 CB 0.0126 -0.0174 -0.0044 2022 GLU 119 CG 0.0141 -0.0202 -0.0055 2023 GLU 119 CD 0.0156 -0.0224 -0.0044 2024 GLU 119 OE1 0.0154 -0.0219 -0.0039 2025 GLU 119 OE2 0.0169 -0.0246 -0.0039 2026 VAL 120 N 0.0096 -0.0122 -0.0042 2027 VAL 120 CA 0.0081 -0.0093 -0.0033 2028 VAL 120 C 0.0080 -0.0082 -0.0009 2029 VAL 120 O 0.0067 -0.0060 -0.0010 2030 VAL 120 CB 0.0081 -0.0089 -0.0023 2031 VAL 120 CG1 0.0076 -0.0090 -0.0050 2032 VAL 120 CG2 0.0098 -0.0111 -0.0003 2033 ALA 121 N 0.0089 -0.0112 0.0008 2034 ALA 121 CA 0.0088 -0.0105 0.0028 2035 ALA 121 C 0.0090 -0.0108 0.0025 2036 ALA 121 O 0.0094 -0.0119 0.0009 2037 ALA 121 CB 0.0101 -0.0113 0.0048 2038 PHE 122 N 0.0086 -0.0098 0.0040 2039 PHE 122 CA 0.0088 -0.0100 0.0039 2040 PHE 122 C 0.0104 -0.0118 0.0045 2041 PHE 122 O 0.0112 -0.0122 0.0064 2042 PHE 122 CB 0.0080 -0.0084 0.0055 2043 PHE 122 CG 0.0080 -0.0085 0.0053 2044 PHE 122 CD1 0.0080 -0.0092 0.0034 2045 PHE 122 CD2 0.0080 -0.0078 0.0072 2046 PHE 122 CE1 0.0080 -0.0092 0.0032 2047 PHE 122 CE2 0.0079 -0.0078 0.0070 2048 PHE 122 CZ 0.0079 -0.0085 0.0051 2049 MET 123 N 0.0113 -0.0133 0.0026 2050 MET 123 CA 0.0126 -0.0144 0.0029 2051 MET 123 C 0.0119 -0.0146 0.0020 2052 MET 123 O 0.0115 -0.0156 0.0007 2053 MET 123 CB 0.0136 -0.0160 0.0022 2054 MET 123 CG 0.0153 -0.0167 0.0034 2055 MET 123 SD 0.0164 -0.0186 0.0025 2056 MET 123 CE 0.0156 -0.0184 0.0020 2057 PRO 124 N 0.0116 -0.0135 0.0028 2058 PRO 124 CA 0.0108 -0.0134 0.0020 2059 PRO 124 C 0.0118 -0.0146 0.0019 2060 PRO 124 O 0.0111 -0.0149 0.0010 2061 PRO 124 CB 0.0101 -0.0117 0.0030 2062 PRO 124 CG 0.0110 -0.0110 0.0045 2063 PRO 124 CD 0.0121 -0.0122 0.0045 2064 GLU 125 N 0.0127 -0.0151 0.0026 2065 GLU 125 CA 0.0138 -0.0160 0.0025 2066 GLU 125 C 0.0139 -0.0171 0.0011 2067 GLU 125 O 0.0146 -0.0179 0.0008 2068 GLU 125 CB 0.0152 -0.0163 0.0037 2069 GLU 125 CG 0.0158 -0.0171 0.0033 2070 GLU 125 CD 0.0155 -0.0164 0.0040 2071 GLU 125 OE1 0.0151 -0.0153 0.0050 2072 GLU 125 OE2 0.0157 -0.0168 0.0036 2073 THR 126 N 0.0132 -0.0172 0.0002 2074 THR 126 CA 0.0131 -0.0182 -0.0013 2075 THR 126 C 0.0119 -0.0178 -0.0023 2076 THR 126 O 0.0116 -0.0186 -0.0036 2077 THR 126 CB 0.0132 -0.0185 -0.0018 2078 THR 126 CG2 0.0144 -0.0189 -0.0008 2079 THR 126 OG1 0.0120 -0.0176 -0.0018 2080 MET 127 N 0.0123 -0.0144 -0.0031 2081 MET 127 CA 0.0115 -0.0141 -0.0037 2082 MET 127 C 0.0111 -0.0142 -0.0041 2083 MET 127 O 0.0115 -0.0141 -0.0037 2084 MET 127 CB 0.0112 -0.0131 -0.0035 2085 MET 127 CG 0.0110 -0.0129 -0.0036 2086 MET 127 SD 0.0107 -0.0117 -0.0033 2087 MET 127 CE 0.0109 -0.0117 -0.0031 2088 THR 128 N 0.0105 -0.0145 -0.0048 2089 THR 128 CA 0.0101 -0.0145 -0.0052 2090 THR 128 C 0.0096 -0.0134 -0.0051 2091 THR 128 O 0.0095 -0.0128 -0.0049 2092 THR 128 CB 0.0095 -0.0151 -0.0059 2093 THR 128 CG2 0.0099 -0.0159 -0.0060 2094 THR 128 OG1 0.0089 -0.0145 -0.0063 2095 PRO 129 N 0.0084 -0.0110 -0.0046 2096 PRO 129 CA 0.0085 -0.0105 -0.0050 2097 PRO 129 C 0.0087 -0.0100 -0.0054 2098 PRO 129 O 0.0088 -0.0095 -0.0055 2099 PRO 129 CB 0.0083 -0.0109 -0.0055 2100 PRO 129 CG 0.0080 -0.0116 -0.0054 2101 PRO 129 CD 0.0081 -0.0116 -0.0047 2102 ALA 130 N 0.0086 -0.0102 -0.0056 2103 ALA 130 CA 0.0087 -0.0097 -0.0059 2104 ALA 130 C 0.0090 -0.0092 -0.0054 2105 ALA 130 O 0.0092 -0.0087 -0.0056 2106 ALA 130 CB 0.0085 -0.0100 -0.0061 2107 GLN 131 N 0.0111 -0.0113 -0.0095 2108 GLN 131 CA 0.0101 -0.0102 -0.0091 2109 GLN 131 C 0.0095 -0.0095 -0.0073 2110 GLN 131 O 0.0084 -0.0083 -0.0071 2111 GLN 131 CB 0.0105 -0.0107 -0.0092 2112 GLN 131 CG 0.0109 -0.0111 -0.0110 2113 GLN 131 CD 0.0115 -0.0118 -0.0110 2114 GLN 131 NE2 0.0118 -0.0121 -0.0126 2115 GLN 131 OE1 0.0119 -0.0121 -0.0095 2116 CYS 132 N 0.0103 -0.0103 -0.0060 2117 CYS 132 CA 0.0098 -0.0097 -0.0042 2118 CYS 132 C 0.0089 -0.0088 -0.0044 2119 CYS 132 O 0.0079 -0.0077 -0.0036 2120 CYS 132 CB 0.0108 -0.0108 -0.0029 2121 CYS 132 SG 0.0116 -0.0117 -0.0020 2122 LEU 133 N 0.0106 -0.0085 -0.0047 2123 LEU 133 CA 0.0101 -0.0084 -0.0043 2124 LEU 133 C 0.0088 -0.0076 -0.0052 2125 LEU 133 O 0.0078 -0.0073 -0.0046 2126 LEU 133 CB 0.0113 -0.0088 -0.0047 2127 LEU 133 CG 0.0109 -0.0087 -0.0045 2128 LEU 133 CD1 0.0102 -0.0089 -0.0029 2129 LEU 133 CD2 0.0122 -0.0092 -0.0049 2130 GLN 134 N 0.0090 -0.0072 -0.0067 2131 GLN 134 CA 0.0078 -0.0064 -0.0076 2132 GLN 134 C 0.0065 -0.0060 -0.0070 2133 GLN 134 O 0.0053 -0.0055 -0.0069 2134 GLN 134 CB 0.0083 -0.0061 -0.0092 2135 GLN 134 CG 0.0092 -0.0062 -0.0101 2136 GLN 134 CD 0.0084 -0.0058 -0.0101 2137 GLN 134 NE2 0.0091 -0.0062 -0.0101 2138 GLN 134 OE1 0.0070 -0.0053 -0.0101 2139 PHE 135 N 0.0079 -0.0058 -0.0071 2140 PHE 135 CA 0.0066 -0.0051 -0.0061 2141 PHE 135 C 0.0059 -0.0050 -0.0045 2142 PHE 135 O 0.0046 -0.0040 -0.0042 2143 PHE 135 CB 0.0072 -0.0057 -0.0055 2144 PHE 135 CG 0.0060 -0.0051 -0.0043 2145 PHE 135 CD1 0.0046 -0.0040 -0.0047 2146 PHE 135 CD2 0.0063 -0.0058 -0.0027 2147 PHE 135 CE1 0.0036 -0.0035 -0.0036 2148 PHE 135 CE2 0.0053 -0.0053 -0.0016 2149 PHE 135 CZ 0.0039 -0.0041 -0.0020 2150 MET 136 N 0.0068 -0.0059 -0.0036 2151 MET 136 CA 0.0062 -0.0058 -0.0019 2152 MET 136 C 0.0055 -0.0052 -0.0024 2153 MET 136 O 0.0045 -0.0048 -0.0013 2154 MET 136 CB 0.0074 -0.0071 -0.0008 2155 MET 136 CG 0.0077 -0.0075 0.0002 2156 MET 136 SD 0.0065 -0.0072 0.0023 2157 MET 136 CE 0.0065 -0.0075 0.0031 2158 ILE 137 N 0.0069 -0.0050 -0.0033 2159 ILE 137 CA 0.0060 -0.0044 -0.0038 2160 ILE 137 C 0.0041 -0.0031 -0.0046 2161 ILE 137 O 0.0027 -0.0024 -0.0039 2162 ILE 137 CB 0.0073 -0.0047 -0.0055 2163 ILE 137 CG1 0.0087 -0.0058 -0.0044 2164 ILE 137 CG2 0.0061 -0.0038 -0.0067 2165 ILE 137 CD1 0.0101 -0.0063 -0.0059 2166 ASP 138 N 0.0041 -0.0027 -0.0060 2167 ASP 138 CA 0.0025 -0.0015 -0.0071 2168 ASP 138 C 0.0008 -0.0009 -0.0056 2169 ASP 138 O -0.0007 0.0001 -0.0062 2170 ASP 138 CB 0.0029 -0.0014 -0.0089 2171 ASP 138 CG 0.0041 -0.0017 -0.0107 2172 ASP 138 OD1 0.0046 -0.0020 -0.0105 2173 ASP 138 OD2 0.0046 -0.0016 -0.0123 2174 ILE 139 N 0.0031 0.0000 -0.0038 2175 ILE 139 CA 0.0013 0.0002 -0.0025 2176 ILE 139 C 0.0011 -0.0009 -0.0011 2177 ILE 139 O -0.0003 -0.0011 0.0002 2178 ILE 139 CB 0.0007 0.0001 -0.0019 2179 ILE 139 CG1 0.0017 -0.0016 -0.0008 2180 ILE 139 CG2 0.0012 0.0010 -0.0033 2181 ILE 139 CD1 0.0007 -0.0019 0.0003 2182 ASP 140 N 0.0023 -0.0016 -0.0013 2183 ASP 140 CA 0.0021 -0.0026 -0.0001 2184 ASP 140 C 0.0006 -0.0017 0.0002 2185 ASP 140 O 0.0005 -0.0005 -0.0010 2186 ASP 140 CB 0.0038 -0.0034 -0.0006 2187 ASP 140 CG 0.0040 -0.0049 0.0009 2188 ASP 140 OD1 0.0027 -0.0051 0.0022 2189 ASP 140 OD2 0.0055 -0.0057 0.0006 2190 PRO 141 N 0.0014 -0.0016 0.0012 2191 PRO 141 CA 0.0002 -0.0009 0.0014 2192 PRO 141 C 0.0006 -0.0007 0.0009 2193 PRO 141 O -0.0002 0.0002 0.0006 2194 PRO 141 CB -0.0006 -0.0015 0.0029 2195 PRO 141 CG -0.0001 -0.0023 0.0034 2196 PRO 141 CD 0.0012 -0.0025 0.0024 2197 ALA 142 N 0.0017 -0.0016 0.0009 2198 ALA 142 CA 0.0021 -0.0015 0.0004 2199 ALA 142 C 0.0027 -0.0007 -0.0011 2200 ALA 142 O 0.0033 -0.0007 -0.0016 2201 ALA 142 CB 0.0031 -0.0027 0.0008 2202 ARG 143 N 0.0010 -0.0019 -0.0014 2203 ARG 143 CA 0.0014 -0.0012 -0.0029 2204 ARG 143 C 0.0002 -0.0001 -0.0036 2205 ARG 143 O 0.0004 0.0006 -0.0049 2206 ARG 143 CB 0.0027 -0.0016 -0.0036 2207 ARG 143 CG 0.0041 -0.0024 -0.0036 2208 ARG 143 CD 0.0053 -0.0028 -0.0043 2209 ARG 143 NE 0.0067 -0.0035 -0.0044 2210 ARG 143 CZ 0.0074 -0.0045 -0.0034 2211 ARG 143 NH1 0.0068 -0.0050 -0.0022 2212 ARG 143 NH2 0.0086 -0.0051 -0.0037 2213 SER 144 N -0.0010 0.0002 -0.0028 2214 SER 144 CA -0.0023 0.0012 -0.0033 2215 SER 144 C -0.0019 0.0018 -0.0047 2216 SER 144 O -0.0022 0.0027 -0.0057 2217 SER 144 CB -0.0031 0.0018 -0.0035 2218 SER 144 OG -0.0021 0.0017 -0.0043