1 HIS 80 N 0.0038 -0.0154 -0.0009 2 HIS 80 CA 0.0037 -0.0161 -0.0004 3 HIS 80 C 0.0041 -0.0161 0.0008 4 HIS 80 O 0.0041 -0.0164 0.0013 5 HIS 80 CB 0.0036 -0.0160 -0.0007 6 HIS 80 CG 0.0033 -0.0159 -0.0017 7 HIS 80 CD2 0.0031 -0.0157 -0.0025 8 HIS 80 ND1 0.0030 -0.0162 -0.0021 9 HIS 80 CE1 0.0027 -0.0161 -0.0031 10 HIS 80 NE2 0.0028 -0.0158 -0.0034 11 PHE 81 N 0.0043 -0.0157 0.0011 12 PHE 81 CA 0.0047 -0.0156 0.0021 13 PHE 81 C 0.0047 -0.0159 0.0025 14 PHE 81 O 0.0051 -0.0157 0.0033 15 PHE 81 CB 0.0053 -0.0146 0.0023 16 PHE 81 CG 0.0055 -0.0144 0.0027 17 PHE 81 CD1 0.0056 -0.0147 0.0037 18 PHE 81 CD2 0.0055 -0.0139 0.0021 19 PHE 81 CE1 0.0058 -0.0146 0.0040 20 PHE 81 CE2 0.0057 -0.0137 0.0025 21 PHE 81 CZ 0.0059 -0.0140 0.0034 22 LYS 82 N 0.0043 -0.0164 0.0019 23 LYS 82 CA 0.0042 -0.0167 0.0021 24 LYS 82 C 0.0043 -0.0173 0.0031 25 LYS 82 O 0.0046 -0.0171 0.0037 26 LYS 82 CB 0.0037 -0.0173 0.0014 27 LYS 82 CG 0.0037 -0.0167 0.0004 28 LYS 82 CD 0.0036 -0.0168 0.0003 29 LYS 82 CE 0.0031 -0.0179 0.0002 30 LYS 82 NZ 0.0028 -0.0179 -0.0005 31 GLU 83 N -0.0003 -0.0088 -0.0017 32 GLU 83 CA -0.0021 -0.0084 -0.0009 33 GLU 83 C -0.0029 -0.0077 -0.0002 34 GLU 83 O -0.0045 -0.0079 0.0002 35 GLU 83 CB -0.0020 -0.0073 -0.0002 36 GLU 83 CG -0.0038 -0.0075 0.0002 37 GLU 83 CD -0.0044 -0.0092 -0.0007 38 GLU 83 OE1 -0.0034 -0.0098 -0.0014 39 GLU 83 OE2 -0.0059 -0.0099 -0.0006 40 ALA 84 N -0.0017 -0.0069 -0.0000 41 ALA 84 CA -0.0024 -0.0063 0.0005 42 ALA 84 C -0.0032 -0.0077 -0.0001 43 ALA 84 O -0.0047 -0.0077 0.0003 44 ALA 84 CB -0.0009 -0.0052 0.0008 45 TRP 85 N -0.0022 -0.0089 -0.0012 46 TRP 85 CA -0.0029 -0.0103 -0.0019 47 TRP 85 C -0.0048 -0.0111 -0.0018 48 TRP 85 O -0.0061 -0.0115 -0.0017 49 TRP 85 CB -0.0016 -0.0116 -0.0031 50 TRP 85 CG 0.0002 -0.0111 -0.0033 51 TRP 85 CD1 0.0017 -0.0104 -0.0034 52 TRP 85 CD2 0.0006 -0.0112 -0.0036 53 TRP 85 CE2 0.0025 -0.0106 -0.0038 54 TRP 85 CE3 -0.0004 -0.0119 -0.0037 55 TRP 85 NE1 0.0031 -0.0101 -0.0036 56 TRP 85 CZ2 0.0034 -0.0106 -0.0040 57 TRP 85 CZ3 0.0005 -0.0119 -0.0039 58 TRP 85 CH2 0.0024 -0.0112 -0.0041 59 LYS 86 N -0.0080 -0.0106 -0.0045 60 LYS 86 CA -0.0093 -0.0105 -0.0049 61 LYS 86 C -0.0116 -0.0086 -0.0055 62 LYS 86 O -0.0136 -0.0091 -0.0060 63 LYS 86 CB -0.0075 -0.0098 -0.0044 64 LYS 86 CG -0.0050 -0.0114 -0.0037 65 LYS 86 CD -0.0042 -0.0123 -0.0035 66 LYS 86 CE -0.0013 -0.0126 -0.0027 67 LYS 86 NZ -0.0001 -0.0102 -0.0024 68 HIS 87 N -0.0113 -0.0063 -0.0054 69 HIS 87 CA -0.0134 -0.0044 -0.0060 70 HIS 87 C -0.0157 -0.0059 -0.0066 71 HIS 87 O -0.0178 -0.0057 -0.0072 72 HIS 87 CB -0.0125 -0.0022 -0.0057 73 HIS 87 CG -0.0117 0.0003 -0.0055 74 HIS 87 CD2 -0.0095 0.0017 -0.0049 75 HIS 87 ND1 -0.0132 0.0015 -0.0059 76 HIS 87 CE1 -0.0120 0.0036 -0.0056 77 HIS 87 NE2 -0.0098 0.0038 -0.0050 78 ALA 88 N -0.0152 -0.0073 -0.0065 79 ALA 88 CA -0.0173 -0.0087 -0.0070 80 ALA 88 C -0.0184 -0.0109 -0.0074 81 ALA 88 O -0.0207 -0.0113 -0.0080 82 ALA 88 CB -0.0163 -0.0099 -0.0068 83 ILE 89 N -0.0137 -0.0097 -0.0066 84 ILE 89 CA -0.0135 -0.0098 -0.0059 85 ILE 89 C -0.0128 -0.0082 -0.0073 86 ILE 89 O -0.0133 -0.0085 -0.0080 87 ILE 89 CB -0.0124 -0.0100 -0.0035 88 ILE 89 CG1 -0.0133 -0.0119 -0.0022 89 ILE 89 CG2 -0.0118 -0.0096 -0.0029 90 ILE 89 CD1 -0.0123 -0.0119 -0.0001 91 GLN 90 N -0.0116 -0.0066 -0.0078 92 GLN 90 CA -0.0109 -0.0050 -0.0091 93 GLN 90 C -0.0121 -0.0050 -0.0114 94 GLN 90 O -0.0122 -0.0045 -0.0124 95 GLN 90 CB -0.0094 -0.0032 -0.0090 96 GLN 90 CG -0.0084 -0.0015 -0.0101 97 GLN 90 CD -0.0079 -0.0014 -0.0091 98 GLN 90 NE2 -0.0073 -0.0020 -0.0070 99 GLN 90 OE1 -0.0080 -0.0008 -0.0102 100 LYS 91 N -0.0131 -0.0057 -0.0123 101 LYS 91 CA -0.0143 -0.0058 -0.0144 102 LYS 91 C -0.0156 -0.0072 -0.0146 103 LYS 91 O -0.0161 -0.0069 -0.0161 104 LYS 91 CB -0.0151 -0.0062 -0.0153 105 LYS 91 CG -0.0166 -0.0067 -0.0174 106 LYS 91 CD -0.0163 -0.0053 -0.0191 107 LYS 91 CE -0.0171 -0.0049 -0.0213 108 LYS 91 NZ -0.0170 -0.0038 -0.0231 109 ALA 92 N -0.0135 -0.0079 -0.0122 110 ALA 92 CA -0.0126 -0.0050 -0.0096 111 ALA 92 C -0.0086 -0.0028 -0.0076 112 ALA 92 O -0.0061 -0.0013 -0.0063 113 ALA 92 CB -0.0170 -0.0028 -0.0076 114 LYS 93 N -0.0080 -0.0026 -0.0074 115 LYS 93 CA -0.0041 -0.0006 -0.0056 116 LYS 93 C 0.0006 -0.0022 -0.0070 117 LYS 93 O 0.0038 -0.0004 -0.0054 118 LYS 93 CB -0.0047 -0.0001 -0.0052 119 LYS 93 CG -0.0068 0.0033 -0.0021 120 LYS 93 CD -0.0049 0.0064 0.0007 121 LYS 93 CE 0.0005 0.0062 0.0006 122 LYS 93 NZ 0.0028 0.0090 0.0031 123 HIS 94 N 0.0010 -0.0056 -0.0101 124 HIS 94 CA 0.0052 -0.0073 -0.0117 125 HIS 94 C 0.0058 -0.0072 -0.0116 126 HIS 94 O 0.0097 -0.0074 -0.0118 127 HIS 94 CB 0.0053 -0.0110 -0.0150 128 HIS 94 CG 0.0048 -0.0113 -0.0153 129 HIS 94 CD2 0.0020 -0.0133 -0.0172 130 HIS 94 ND1 0.0073 -0.0093 -0.0135 131 HIS 94 CE1 0.0061 -0.0101 -0.0143 132 HIS 94 NE2 0.0029 -0.0126 -0.0165 133 MET 95 N 0.0079 -0.0029 -0.0103 134 MET 95 CA 0.0079 -0.0028 -0.0103 135 MET 95 C 0.0106 -0.0003 -0.0076 136 MET 95 O 0.0104 0.0023 -0.0052 137 MET 95 CB 0.0034 -0.0023 -0.0103 138 MET 95 CG 0.0024 -0.0044 -0.0124 139 MET 95 SD 0.0015 -0.0083 -0.0161 140 MET 95 CE 0.0048 -0.0106 -0.0179 141 PRO 96 N 0.0131 -0.0009 -0.0079 142 PRO 96 CA 0.0156 0.0015 -0.0054 143 PRO 96 C 0.0129 0.0034 -0.0039 144 PRO 96 O 0.0096 0.0026 -0.0050 145 PRO 96 CB 0.0192 -0.0004 -0.0068 146 PRO 96 CG 0.0173 -0.0033 -0.0098 147 PRO 96 CD 0.0141 -0.0040 -0.0107 148 ASP 97 N 0.0145 0.0060 -0.0012 149 ASP 97 CA 0.0126 0.0080 0.0004 150 ASP 97 C 0.0134 0.0063 -0.0011 151 ASP 97 O 0.0170 0.0057 -0.0013 152 ASP 97 CB 0.0144 0.0112 0.0036 153 ASP 97 CG 0.0125 0.0133 0.0054 154 ASP 97 OD1 0.0096 0.0124 0.0043 155 ASP 97 OD2 0.0140 0.0159 0.0080 156 PRO 98 N 0.0197 0.0127 0.0031 157 PRO 98 CA 0.0167 0.0140 0.0019 158 PRO 98 C 0.0137 0.0120 0.0020 159 PRO 98 O 0.0111 0.0131 0.0010 160 PRO 98 CB 0.0172 0.0143 0.0019 161 PRO 98 CG 0.0196 0.0121 0.0033 162 PRO 98 CD 0.0218 0.0121 0.0038 163 TRP 99 N 0.0139 0.0092 0.0032 164 TRP 99 CA 0.0111 0.0072 0.0035 165 TRP 99 C 0.0109 0.0066 0.0037 166 TRP 99 O 0.0092 0.0044 0.0042 167 TRP 99 CB 0.0111 0.0042 0.0047 168 TRP 99 CG 0.0101 0.0045 0.0044 169 TRP 99 CD1 0.0092 0.0070 0.0031 170 TRP 99 CD2 0.0100 0.0021 0.0053 171 TRP 99 CE2 0.0090 0.0033 0.0046 172 TRP 99 CE3 0.0107 -0.0009 0.0067 173 TRP 99 NE1 0.0085 0.0063 0.0033 174 TRP 99 CZ2 0.0086 0.0017 0.0052 175 TRP 99 CZ3 0.0104 -0.0026 0.0074 176 TRP 99 CH2 0.0093 -0.0013 0.0066 177 ALA 100 N 0.0126 0.0085 0.0033 178 ALA 100 CA 0.0129 0.0078 0.0036 179 ALA 100 C 0.0097 0.0075 0.0030 180 ALA 100 O 0.0091 0.0055 0.0037 181 ALA 100 CB 0.0151 0.0103 0.0031 182 GLU 101 N 0.0025 0.0111 0.0059 183 GLU 101 CA -0.0032 0.0108 0.0065 184 GLU 101 C -0.0061 0.0071 0.0072 185 GLU 101 O -0.0106 0.0057 0.0078 186 GLU 101 CB -0.0057 0.0164 0.0064 187 GLU 101 CG -0.0065 0.0185 0.0063 188 GLU 101 CD -0.0023 0.0225 0.0055 189 GLU 101 OE1 0.0023 0.0210 0.0052 190 GLU 101 OE2 -0.0037 0.0273 0.0053 191 PHE 102 N -0.0037 0.0054 0.0070 192 PHE 102 CA -0.0062 0.0016 0.0076 193 PHE 102 C -0.0052 -0.0041 0.0080 194 PHE 102 O -0.0077 -0.0077 0.0085 195 PHE 102 CB -0.0042 0.0024 0.0073 196 PHE 102 CG -0.0048 0.0080 0.0070 197 PHE 102 CD1 -0.0098 0.0102 0.0073 198 PHE 102 CD2 -0.0004 0.0111 0.0062 199 PHE 102 CE1 -0.0104 0.0154 0.0070 200 PHE 102 CE2 -0.0010 0.0163 0.0059 201 PHE 102 CZ -0.0060 0.0184 0.0063 202 HIS 103 N -0.0016 -0.0050 0.0076 203 HIS 103 CA -0.0008 -0.0100 0.0080 204 HIS 103 C -0.0004 -0.0146 0.0083 205 HIS 103 O -0.0033 -0.0185 0.0089 206 HIS 103 CB -0.0052 -0.0109 0.0085 207 HIS 103 CG -0.0051 -0.0072 0.0082 208 HIS 103 CD2 -0.0085 -0.0033 0.0082 209 HIS 103 ND1 -0.0009 -0.0071 0.0077 210 HIS 103 CE1 -0.0018 -0.0033 0.0075 211 HIS 103 NE2 -0.0064 -0.0010 0.0078 212 LEU 104 N -0.0004 -0.0037 0.0049 213 LEU 104 CA 0.0009 -0.0038 0.0031 214 LEU 104 C -0.0005 -0.0034 0.0014 215 LEU 104 O 0.0002 -0.0034 -0.0005 216 LEU 104 CB 0.0025 -0.0041 0.0040 217 LEU 104 CG 0.0041 -0.0045 0.0057 218 LEU 104 CD1 0.0054 -0.0047 0.0066 219 LEU 104 CD2 0.0056 -0.0046 0.0048 220 GLU 105 N -0.0025 -0.0032 0.0019 221 GLU 105 CA -0.0039 -0.0028 0.0003 222 GLU 105 C -0.0045 -0.0026 -0.0014 223 GLU 105 O -0.0052 -0.0024 -0.0031 224 GLU 105 CB -0.0058 -0.0026 0.0015 225 GLU 105 CG -0.0074 -0.0024 0.0024 226 GLU 105 CD -0.0067 -0.0027 0.0046 227 GLU 105 OE1 -0.0052 -0.0030 0.0056 228 GLU 105 OE2 -0.0076 -0.0026 0.0054 229 ASP 106 N -0.0043 -0.0027 -0.0010 230 ASP 106 CA -0.0049 -0.0024 -0.0027 231 ASP 106 C -0.0031 -0.0026 -0.0043 232 ASP 106 O -0.0034 -0.0024 -0.0059 233 ASP 106 CB -0.0055 -0.0024 -0.0016 234 ASP 106 CG -0.0077 -0.0022 -0.0005 235 ASP 106 OD1 -0.0090 -0.0019 -0.0012 236 ASP 106 OD2 -0.0081 -0.0022 0.0010 237 ILE 107 N 0.0012 0.0039 -0.0069 238 ILE 107 CA 0.0042 0.0035 -0.0092 239 ILE 107 C 0.0029 0.0061 -0.0110 240 ILE 107 O 0.0000 0.0072 -0.0095 241 ILE 107 CB 0.0062 0.0002 -0.0073 242 ILE 107 CG1 0.0075 -0.0023 -0.0057 243 ILE 107 CG2 0.0092 -0.0003 -0.0096 244 ILE 107 CD1 0.0090 -0.0056 -0.0033 245 ALA 108 N 0.0052 0.0070 -0.0141 246 ALA 108 CA 0.0043 0.0094 -0.0160 247 ALA 108 C 0.0041 0.0081 -0.0144 248 ALA 108 O 0.0065 0.0056 -0.0138 249 ALA 108 CB 0.0071 0.0103 -0.0197 250 THR 109 N 0.0012 0.0099 -0.0137 251 THR 109 CA 0.0006 0.0090 -0.0121 252 THR 109 C 0.0032 0.0088 -0.0143 253 THR 109 O 0.0041 0.0107 -0.0174 254 THR 109 CB -0.0031 0.0113 -0.0112 255 THR 109 CG2 -0.0038 0.0103 -0.0095 256 THR 109 OG1 -0.0056 0.0114 -0.0091 257 GLU 110 N 0.0012 0.0049 -0.0088 258 GLU 110 CA 0.0013 0.0050 -0.0089 259 GLU 110 C 0.0008 0.0050 -0.0087 260 GLU 110 O 0.0004 0.0048 -0.0084 261 GLU 110 CB 0.0017 0.0046 -0.0089 262 GLU 110 CG 0.0022 0.0046 -0.0092 263 GLU 110 CD 0.0026 0.0041 -0.0092 264 GLU 110 OE1 0.0026 0.0037 -0.0092 265 GLU 110 OE2 0.0028 0.0042 -0.0093 266 ARG 111 N 0.0008 0.0053 -0.0087 267 ARG 111 CA 0.0004 0.0054 -0.0086 268 ARG 111 C 0.0005 0.0051 -0.0085 269 ARG 111 O 0.0009 0.0051 -0.0087 270 ARG 111 CB 0.0003 0.0060 -0.0086 271 ARG 111 CG -0.0002 0.0062 -0.0085 272 ARG 111 CD -0.0003 0.0068 -0.0085 273 ARG 111 NE -0.0006 0.0070 -0.0085 274 ARG 111 CZ -0.0006 0.0075 -0.0085 275 ARG 111 NH1 -0.0004 0.0079 -0.0087 276 ARG 111 NH2 -0.0009 0.0075 -0.0085 277 ALA 112 N 0.0001 0.0048 -0.0083 278 ALA 112 CA 0.0002 0.0044 -0.0083 279 ALA 112 C -0.0003 0.0045 -0.0081 280 ALA 112 O -0.0007 0.0046 -0.0079 281 ALA 112 CB 0.0003 0.0038 -0.0082 282 THR 113 N -0.0030 0.0058 -0.0081 283 THR 113 CA -0.0011 0.0053 -0.0076 284 THR 113 C -0.0006 0.0072 -0.0079 285 THR 113 O -0.0021 0.0078 -0.0084 286 THR 113 CB -0.0015 0.0030 -0.0072 287 THR 113 CG2 0.0005 0.0025 -0.0066 288 THR 113 OG1 -0.0018 0.0012 -0.0068 289 ARG 114 N 0.0015 0.0082 -0.0077 290 ARG 114 CA 0.0022 0.0101 -0.0080 291 ARG 114 C 0.0035 0.0091 -0.0075 292 ARG 114 O 0.0051 0.0079 -0.0068 293 ARG 114 CB 0.0037 0.0119 -0.0080 294 ARG 114 CG 0.0049 0.0136 -0.0082 295 ARG 114 CD 0.0063 0.0155 -0.0083 296 ARG 114 NE 0.0081 0.0146 -0.0077 297 ARG 114 CZ 0.0097 0.0158 -0.0076 298 ARG 114 NH1 0.0098 0.0181 -0.0081 299 ARG 114 NH2 0.0113 0.0148 -0.0070 300 HIS 115 N 0.0027 0.0097 -0.0078 301 HIS 115 CA 0.0037 0.0091 -0.0074 302 HIS 115 C 0.0049 0.0113 -0.0077 303 HIS 115 O 0.0037 0.0130 -0.0083 304 HIS 115 CB 0.0019 0.0081 -0.0076 305 HIS 115 CG 0.0005 0.0061 -0.0074 306 HIS 115 CD2 -0.0014 0.0060 -0.0078 307 HIS 115 ND1 0.0011 0.0039 -0.0068 308 HIS 115 CE1 -0.0005 0.0025 -0.0068 309 HIS 115 NE2 -0.0020 0.0037 -0.0074 310 ARG 116 N 0.0085 0.0122 -0.0064 311 ARG 116 CA 0.0092 0.0134 -0.0077 312 ARG 116 C 0.0082 0.0122 -0.0066 313 ARG 116 O 0.0085 0.0108 -0.0043 314 ARG 116 CB 0.0123 0.0148 -0.0075 315 ARG 116 CG 0.0132 0.0166 -0.0094 316 ARG 116 CD 0.0163 0.0178 -0.0089 317 ARG 116 NE 0.0175 0.0167 -0.0064 318 ARG 116 CZ 0.0201 0.0172 -0.0051 319 ARG 116 NH1 0.0219 0.0187 -0.0062 320 ARG 116 NH2 0.0210 0.0160 -0.0029 321 TYR 117 N 0.0071 0.0128 -0.0083 322 TYR 117 CA 0.0059 0.0117 -0.0075 323 TYR 117 C 0.0078 0.0126 -0.0076 324 TYR 117 O 0.0087 0.0144 -0.0095 325 TYR 117 CB 0.0031 0.0114 -0.0093 326 TYR 117 CG 0.0017 0.0102 -0.0086 327 TYR 117 CD1 0.0008 0.0083 -0.0063 328 TYR 117 CD2 0.0012 0.0110 -0.0101 329 TYR 117 CE1 -0.0004 0.0072 -0.0057 330 TYR 117 CE2 -0.0001 0.0100 -0.0095 331 TYR 117 CZ -0.0009 0.0081 -0.0073 332 TYR 117 OH -0.0021 0.0070 -0.0066 333 ASN 118 N 0.0083 0.0115 -0.0056 334 ASN 118 CA 0.0097 0.0121 -0.0055 335 ASN 118 C 0.0076 0.0113 -0.0057 336 ASN 118 O 0.0063 0.0095 -0.0041 337 ASN 118 CB 0.0119 0.0116 -0.0030 338 ASN 118 CG 0.0137 0.0124 -0.0029 339 ASN 118 ND2 0.0163 0.0129 -0.0017 340 ASN 118 OD1 0.0127 0.0126 -0.0039 341 ALA 119 N 0.0062 0.0107 -0.0061 342 ALA 119 CA 0.0038 0.0087 -0.0067 343 ALA 119 C 0.0027 0.0080 -0.0045 344 ALA 119 O 0.0006 0.0063 -0.0043 345 ALA 119 CB 0.0037 0.0084 -0.0099 346 VAL 120 N 0.0042 0.0093 -0.0029 347 VAL 120 CA 0.0032 0.0087 -0.0006 348 VAL 120 C 0.0024 0.0083 0.0022 349 VAL 120 O 0.0005 0.0068 0.0035 350 VAL 120 CB 0.0051 0.0103 0.0001 351 VAL 120 CG1 0.0041 0.0097 0.0027 352 VAL 120 CG2 0.0058 0.0107 -0.0027 353 THR 121 N 0.0039 0.0095 0.0031 354 THR 121 CA 0.0033 0.0092 0.0057 355 THR 121 C 0.0020 0.0081 0.0049 356 THR 121 O 0.0010 0.0074 0.0070 357 THR 121 CB 0.0055 0.0111 0.0073 358 THR 121 CG2 0.0070 0.0124 0.0078 359 THR 121 OG1 0.0069 0.0121 0.0055 360 GLY 122 N 0.0059 0.0096 -0.0031 361 GLY 122 CA 0.0034 0.0085 -0.0033 362 GLY 122 C 0.0036 0.0077 -0.0020 363 GLY 122 O 0.0018 0.0063 -0.0013 364 GLU 123 N 0.0059 0.0086 -0.0017 365 GLU 123 CA 0.0065 0.0078 -0.0002 366 GLU 123 C 0.0067 0.0089 -0.0016 367 GLU 123 O 0.0077 0.0106 -0.0033 368 GLU 123 CB 0.0090 0.0076 0.0018 369 GLU 123 CG 0.0087 0.0060 0.0038 370 GLU 123 CD 0.0110 0.0057 0.0060 371 GLU 123 OE1 0.0132 0.0070 0.0057 372 GLU 123 OE2 0.0106 0.0040 0.0080 373 TRP 124 N 0.0059 0.0080 -0.0008 374 TRP 124 CA 0.0063 0.0089 -0.0018 375 TRP 124 C 0.0087 0.0090 -0.0003 376 TRP 124 O 0.0092 0.0077 0.0019 377 TRP 124 CB 0.0039 0.0079 -0.0021 378 TRP 124 CG 0.0016 0.0081 -0.0040 379 TRP 124 CD1 -0.0003 0.0070 -0.0037 380 TRP 124 CD2 0.0009 0.0095 -0.0065 381 TRP 124 CE2 -0.0014 0.0092 -0.0076 382 TRP 124 CE3 0.0020 0.0111 -0.0079 383 TRP 124 NE1 -0.0021 0.0076 -0.0058 384 TRP 124 CZ2 -0.0026 0.0103 -0.0100 385 TRP 124 CZ3 0.0008 0.0122 -0.0103 386 TRP 124 CH2 -0.0015 0.0118 -0.0114 387 LEU 125 N 0.0198 0.0056 -0.0014 388 LEU 125 CA 0.0215 0.0047 -0.0006 389 LEU 125 C 0.0176 0.0053 -0.0020 390 LEU 125 O 0.0157 0.0091 -0.0036 391 LEU 125 CB 0.0258 0.0081 -0.0001 392 LEU 125 CG 0.0276 0.0082 0.0004 393 LEU 125 CD1 0.0280 0.0031 0.0019 394 LEU 125 CD2 0.0323 0.0110 0.0012 395 ASP 126 N 0.0164 0.0017 -0.0014 396 ASP 126 CA 0.0127 0.0017 -0.0026 397 ASP 126 C 0.0148 0.0018 -0.0020 398 ASP 126 O 0.0182 -0.0005 -0.0003 399 ASP 126 CB 0.0091 -0.0026 -0.0026 400 ASP 126 CG 0.0105 -0.0069 -0.0010 401 ASP 126 OD1 0.0130 -0.0097 0.0005 402 ASP 126 OD2 0.0091 -0.0076 -0.0013 403 ASP 127 N 0.0128 0.0044 -0.0033 404 ASP 127 CA 0.0143 0.0046 -0.0029 405 ASP 127 C 0.0103 0.0059 -0.0045 406 ASP 127 O 0.0066 0.0070 -0.0060 407 ASP 127 CB 0.0187 0.0080 -0.0024 408 ASP 127 CG 0.0177 0.0132 -0.0041 409 ASP 127 OD1 0.0145 0.0141 -0.0053 410 ASP 127 OD2 0.0202 0.0163 -0.0041 411 GLU 128 N 0.0044 0.0067 -0.0090 412 GLU 128 CA 0.0037 0.0064 -0.0085 413 GLU 128 C 0.0029 0.0062 -0.0074 414 GLU 128 O 0.0024 0.0060 -0.0075 415 GLU 128 CB 0.0029 0.0060 -0.0095 416 GLU 128 CG 0.0036 0.0062 -0.0105 417 GLU 128 CD 0.0043 0.0065 -0.0100 418 GLU 128 OE1 0.0037 0.0063 -0.0097 419 GLU 128 OE2 0.0054 0.0070 -0.0099 420 VAL 129 N 0.0027 0.0063 -0.0064 421 VAL 129 CA 0.0019 0.0061 -0.0054 422 VAL 129 C 0.0012 0.0058 -0.0049 423 VAL 129 O 0.0015 0.0059 -0.0052 424 VAL 129 CB 0.0025 0.0065 -0.0042 425 VAL 129 CG1 0.0031 0.0067 -0.0046 426 VAL 129 CG2 0.0034 0.0069 -0.0037 427 LEU 130 N 0.0002 0.0055 -0.0043 428 LEU 130 CA -0.0006 0.0052 -0.0038 429 LEU 130 C -0.0006 0.0054 -0.0023 430 LEU 130 O -0.0008 0.0054 -0.0018 431 LEU 130 CB -0.0019 0.0047 -0.0042 432 LEU 130 CG -0.0019 0.0045 -0.0057 433 LEU 130 CD1 -0.0032 0.0039 -0.0060 434 LEU 130 CD2 -0.0015 0.0046 -0.0063 435 ILE 131 N -0.0010 -0.0002 -0.0026 436 ILE 131 CA -0.0005 -0.0013 -0.0020 437 ILE 131 C 0.0001 -0.0009 -0.0030 438 ILE 131 O 0.0004 -0.0000 -0.0041 439 ILE 131 CB 0.0007 -0.0027 -0.0019 440 ILE 131 CG1 0.0019 -0.0025 -0.0033 441 ILE 131 CG2 0.0002 -0.0031 -0.0011 442 ILE 131 CD1 0.0031 -0.0038 -0.0033 443 LYS 132 N 0.0001 -0.0016 -0.0024 444 LYS 132 CA 0.0008 -0.0016 -0.0031 445 LYS 132 C 0.0019 -0.0030 -0.0028 446 LYS 132 O 0.0015 -0.0039 -0.0016 447 LYS 132 CB -0.0002 -0.0009 -0.0028 448 LYS 132 CG -0.0010 0.0007 -0.0034 449 LYS 132 CD -0.0021 0.0012 -0.0028 450 LYS 132 CE -0.0030 0.0028 -0.0034 451 LYS 132 NZ -0.0041 0.0034 -0.0029 452 MET 133 N 0.0032 -0.0033 -0.0037 453 MET 133 CA 0.0042 -0.0048 -0.0035 454 MET 133 C 0.0051 -0.0048 -0.0043 455 MET 133 O 0.0055 -0.0040 -0.0055 456 MET 133 CB 0.0051 -0.0052 -0.0039 457 MET 133 CG 0.0059 -0.0068 -0.0032 458 MET 133 SD 0.0075 -0.0073 -0.0043 459 MET 133 CE 0.0070 -0.0077 -0.0034 460 ALA 134 N 0.0072 -0.0071 0.0034 461 ALA 134 CA 0.0055 -0.0059 -0.0019 462 ALA 134 C 0.0072 -0.0114 -0.0082 463 ALA 134 O 0.0105 -0.0171 -0.0072 464 ALA 134 CB 0.0059 -0.0052 0.0019 465 SER 135 N 0.0049 -0.0097 -0.0146 466 SER 135 CA 0.0062 -0.0146 -0.0211 467 SER 135 C 0.0084 -0.0187 -0.0214 468 SER 135 O 0.0105 -0.0240 -0.0253 469 SER 135 CB 0.0028 -0.0111 -0.0282 470 SER 135 OG -0.0003 -0.0054 -0.0278 471 GLN 136 N 0.0080 -0.0164 -0.0173 472 GLN 136 CA 0.0099 -0.0199 -0.0173 473 GLN 136 C 0.0123 -0.0214 -0.0095 474 GLN 136 O 0.0112 -0.0172 -0.0042 475 GLN 136 CB 0.0070 -0.0159 -0.0206 476 GLN 136 CG 0.0051 -0.0156 -0.0289 477 GLN 136 CD 0.0078 -0.0221 -0.0331 478 GLN 136 NE2 0.0064 -0.0215 -0.0380 479 GLN 136 OE1 0.0110 -0.0274 -0.0319 480 PRO 137 N 0.0109 -0.0254 0.0049 481 PRO 137 CA 0.0105 -0.0250 0.0033 482 PRO 137 C 0.0112 -0.0243 0.0005 483 PRO 137 O 0.0110 -0.0241 -0.0004 484 PRO 137 CB 0.0075 -0.0253 0.0036 485 PRO 137 CG 0.0064 -0.0255 0.0042 486 PRO 137 CD 0.0085 -0.0258 0.0056 487 PHE 138 N 0.0120 -0.0239 -0.0007 488 PHE 138 CA 0.0127 -0.0232 -0.0034 489 PHE 138 C 0.0106 -0.0229 -0.0051 490 PHE 138 O 0.0111 -0.0222 -0.0074 491 PHE 138 CB 0.0153 -0.0229 -0.0038 492 PHE 138 CG 0.0151 -0.0230 -0.0036 493 PHE 138 CD1 0.0152 -0.0236 -0.0013 494 PHE 138 CD2 0.0148 -0.0224 -0.0058 495 PHE 138 CE1 0.0150 -0.0236 -0.0011 496 PHE 138 CE2 0.0146 -0.0225 -0.0056 497 PHE 138 CZ 0.0147 -0.0231 -0.0033 498 GLY 139 N 0.0083 -0.0233 -0.0042 499 GLY 139 CA 0.0063 -0.0230 -0.0057 500 GLY 139 C 0.0040 -0.0235 -0.0041 501 GLY 139 O 0.0042 -0.0241 -0.0018 502 ARG 140 N -0.0211 0.0364 0.0158 503 ARG 140 CA -0.0168 0.0208 0.0154 504 ARG 140 C -0.0115 0.0321 0.0182 505 ARG 140 O -0.0208 0.0484 0.0173 506 ARG 140 CB -0.0348 0.0063 0.0084 507 ARG 140 CG -0.0533 0.0165 0.0040 508 ARG 140 CD -0.0686 0.0001 -0.0024 509 ARG 140 NE -0.0775 -0.0102 -0.0061 510 ARG 140 CZ -0.0973 -0.0126 -0.0123 511 ARG 140 NH1 -0.1109 -0.0056 -0.0156 512 ARG 140 NH2 -0.1037 -0.0222 -0.0153 513 GLY 141 N 0.0038 0.0235 0.0218 514 GLY 141 CA 0.0089 0.0306 0.0241 515 GLY 141 C -0.0029 0.0189 0.0193 516 GLY 141 O -0.0203 0.0129 0.0135 517 ALA 142 N 0.0067 0.0156 0.0218 518 ALA 142 CA -0.0024 0.0027 0.0176 519 ALA 142 C 0.0015 -0.0208 0.0162 520 ALA 142 O -0.0101 -0.0336 0.0113 521 ALA 142 CB 0.0055 0.0087 0.0207 522 MET 143 N 0.0037 -0.0200 0.0147 523 MET 143 CA 0.0044 -0.0213 0.0123 524 MET 143 C 0.0025 -0.0224 0.0109 525 MET 143 O 0.0024 -0.0235 0.0090 526 MET 143 CB 0.0069 -0.0212 0.0119 527 MET 143 CG 0.0092 -0.0203 0.0129 528 MET 143 SD 0.0102 -0.0209 0.0116 529 MET 143 CE 0.0114 -0.0223 0.0090 530 ARG 144 N 0.0009 -0.0221 0.0117 531 ARG 144 CA -0.0007 -0.0232 0.0103 532 ARG 144 C -0.0033 -0.0230 0.0113 533 ARG 144 O -0.0038 -0.0219 0.0133 534 ARG 144 CB 0.0004 -0.0233 0.0098 535 ARG 144 CG 0.0030 -0.0238 0.0085 536 ARG 144 CD 0.0039 -0.0240 0.0079 537 ARG 144 NE 0.0041 -0.0228 0.0099 538 ARG 144 CZ 0.0047 -0.0227 0.0099 539 ARG 144 NH1 0.0052 -0.0237 0.0081 540 ARG 144 NH2 0.0049 -0.0215 0.0118 541 GLU 145 N -0.0051 -0.0241 0.0099 542 GLU 145 CA -0.0078 -0.0241 0.0104 543 GLU 145 C -0.0083 -0.0245 0.0098 544 GLU 145 O -0.0071 -0.0252 0.0083 545 GLU 145 CB -0.0094 -0.0252 0.0090 546 GLU 145 CG -0.0103 -0.0246 0.0101 547 GLU 145 CD -0.0113 -0.0257 0.0085 548 GLU 145 OE1 -0.0121 -0.0269 0.0067 549 GLU 145 OE2 -0.0115 -0.0255 0.0089 550 CYS 146 N 0.0070 -0.0246 0.0022 551 CYS 146 CA 0.0081 -0.0226 0.0043 552 CYS 146 C 0.0078 -0.0204 0.0033 553 CYS 146 O 0.0070 -0.0191 0.0012 554 CYS 146 CB 0.0086 -0.0212 0.0052 555 CYS 146 SG 0.0088 -0.0237 0.0061 556 PHE 147 N 0.0086 -0.0198 0.0049 557 PHE 147 CA 0.0085 -0.0178 0.0043 558 PHE 147 C 0.0096 -0.0157 0.0065 559 PHE 147 O 0.0105 -0.0165 0.0088 560 PHE 147 CB 0.0083 -0.0193 0.0041 561 PHE 147 CG 0.0071 -0.0214 0.0020 562 PHE 147 CD1 0.0071 -0.0241 0.0023 563 PHE 147 CD2 0.0062 -0.0206 -0.0004 564 PHE 147 CE1 0.0061 -0.0260 0.0004 565 PHE 147 CE2 0.0051 -0.0226 -0.0023 566 PHE 147 CZ 0.0051 -0.0253 -0.0019 567 ARG 148 N 0.0095 -0.0130 0.0057 568 ARG 148 CA 0.0105 -0.0108 0.0076 569 ARG 148 C 0.0109 -0.0110 0.0086 570 ARG 148 O 0.0102 -0.0114 0.0071 571 ARG 148 CB 0.0101 -0.0079 0.0063 572 ARG 148 CG 0.0098 -0.0074 0.0055 573 ARG 148 CD 0.0098 -0.0043 0.0050 574 ARG 148 NE 0.0097 -0.0038 0.0046 575 ARG 148 CZ 0.0087 -0.0037 0.0023 576 ARG 148 NH1 0.0077 -0.0040 0.0001 577 ARG 148 NH2 0.0086 -0.0032 0.0021 578 THR 149 N 0.0060 -0.0054 0.0040 579 THR 149 CA 0.0057 -0.0047 0.0037 580 THR 149 C 0.0048 -0.0039 0.0048 581 THR 149 O 0.0046 -0.0042 0.0061 582 THR 149 CB 0.0063 -0.0057 0.0037 583 THR 149 CG2 0.0060 -0.0050 0.0032 584 THR 149 OG1 0.0071 -0.0066 0.0028 585 LYS 150 N 0.0042 -0.0028 0.0044 586 LYS 150 CA 0.0034 -0.0019 0.0054 587 LYS 150 C 0.0033 -0.0019 0.0053 588 LYS 150 O 0.0035 -0.0016 0.0042 589 LYS 150 CB 0.0026 -0.0006 0.0050 590 LYS 150 CG 0.0018 0.0002 0.0061 591 LYS 150 CD 0.0011 0.0014 0.0059 592 LYS 150 CE 0.0004 0.0017 0.0072 593 LYS 150 NZ 0.0008 0.0006 0.0084 594 LYS 151 N 0.0032 -0.0022 0.0065 595 LYS 151 CA 0.0030 -0.0020 0.0067 596 LYS 151 C 0.0021 -0.0007 0.0071 597 LYS 151 O 0.0015 -0.0004 0.0081 598 LYS 151 CB 0.0033 -0.0030 0.0078 599 LYS 151 CG 0.0033 -0.0030 0.0078 600 LYS 151 CD 0.0038 -0.0042 0.0087 601 LYS 151 CE 0.0034 -0.0043 0.0102 602 LYS 151 NZ 0.0025 -0.0033 0.0109 603 LEU 152 N -0.0022 0.0027 0.0050 604 LEU 152 CA -0.0034 0.0025 0.0047 605 LEU 152 C -0.0019 0.0021 0.0044 606 LEU 152 O -0.0009 0.0008 0.0032 607 LEU 152 CB -0.0050 0.0013 0.0033 608 LEU 152 CG -0.0066 0.0015 0.0034 609 LEU 152 CD1 -0.0082 0.0003 0.0020 610 LEU 152 CD2 -0.0077 0.0031 0.0049 611 SER 153 N -0.0015 0.0031 0.0055 612 SER 153 CA -0.0009 0.0029 0.0053 613 SER 153 C -0.0028 0.0033 0.0056 614 SER 153 O -0.0046 0.0033 0.0053 615 SER 153 CB 0.0012 0.0037 0.0063 616 SER 153 OG 0.0010 0.0052 0.0078 617 ASN 154 N -0.0024 0.0039 0.0062 618 ASN 154 CA -0.0041 0.0045 0.0067 619 ASN 154 C -0.0059 0.0035 0.0055 620 ASN 154 O -0.0078 0.0040 0.0058 621 ASN 154 CB -0.0048 0.0061 0.0082 622 ASN 154 CG -0.0035 0.0073 0.0096 623 ASN 154 ND2 -0.0037 0.0077 0.0099 624 ASN 154 OD1 -0.0022 0.0079 0.0104 625 PHE 155 N -0.0157 -0.0143 0.0007 626 PHE 155 CA -0.0107 -0.0077 0.0015 627 PHE 155 C -0.0071 -0.0010 0.0052 628 PHE 155 O -0.0013 0.0044 0.0030 629 PHE 155 CB -0.0134 -0.0073 0.0068 630 PHE 155 CG -0.0142 -0.0114 0.0022 631 PHE 155 CD1 -0.0092 -0.0081 -0.0015 632 PHE 155 CD2 -0.0199 -0.0186 0.0016 633 PHE 155 CE1 -0.0100 -0.0119 -0.0058 634 PHE 155 CE2 -0.0207 -0.0224 -0.0026 635 PHE 155 CZ -0.0157 -0.0191 -0.0064 636 LEU 156 N -0.0105 -0.0012 0.0107 637 LEU 156 CA -0.0076 0.0050 0.0148 638 LEU 156 C -0.0047 0.0052 0.0100 639 LEU 156 O 0.0003 0.0110 0.0099 640 LEU 156 CB -0.0126 0.0050 0.0235 641 LEU 156 CG -0.0159 0.0051 0.0293 642 LEU 156 CD1 -0.0231 -0.0006 0.0335 643 LEU 156 CD2 -0.0132 0.0126 0.0356 644 HIS 157 N -0.0078 -0.0011 0.0062 645 HIS 157 CA -0.0057 -0.0016 0.0018 646 HIS 157 C -0.0054 -0.0071 -0.0068 647 HIS 157 O -0.0095 -0.0127 -0.0079 648 HIS 157 CB -0.0101 -0.0037 0.0065 649 HIS 157 CG -0.0098 0.0021 0.0144 650 HIS 157 CD2 -0.0053 0.0085 0.0160 651 HIS 157 ND1 -0.0146 0.0016 0.0220 652 HIS 157 CE1 -0.0131 0.0074 0.0278 653 HIS 157 NE2 -0.0074 0.0117 0.0244 654 ALA 158 N -0.0065 0.0045 0.0006 655 ALA 158 CA -0.0057 0.0049 0.0032 656 ALA 158 C -0.0048 0.0062 0.0035 657 ALA 158 O -0.0051 0.0061 0.0021 658 ALA 158 CB -0.0069 0.0028 0.0049 659 GLN 159 N -0.0036 0.0074 0.0054 660 GLN 159 CA -0.0027 0.0086 0.0060 661 GLN 159 C -0.0036 0.0072 0.0066 662 GLN 159 O -0.0042 0.0059 0.0085 663 GLN 159 CB -0.0015 0.0099 0.0083 664 GLN 159 CG -0.0000 0.0122 0.0076 665 GLN 159 CD 0.0012 0.0135 0.0099 666 GLN 159 NE2 0.0012 0.0130 0.0115 667 GLN 159 OE1 0.0022 0.0148 0.0102 668 GLN 160 N -0.0038 0.0074 0.0050 669 GLN 160 CA -0.0045 0.0062 0.0057 670 GLN 160 C -0.0035 0.0070 0.0080 671 GLN 160 O -0.0038 0.0060 0.0101 672 GLN 160 CB -0.0048 0.0062 0.0034 673 GLN 160 CG -0.0059 0.0052 0.0012 674 GLN 160 CD -0.0075 0.0028 0.0012 675 GLN 160 NE2 -0.0084 0.0019 -0.0004 676 GLN 160 OE1 -0.0079 0.0019 0.0027 677 TRP 161 N -0.0010 0.0106 0.0029 678 TRP 161 CA 0.0002 0.0091 0.0025 679 TRP 161 C 0.0024 0.0110 0.0037 680 TRP 161 O 0.0015 0.0133 0.0045 681 TRP 161 CB -0.0023 0.0083 0.0017 682 TRP 161 CG -0.0010 0.0070 0.0014 683 TRP 161 CD1 0.0014 0.0050 0.0010 684 TRP 161 CD2 -0.0020 0.0076 0.0015 685 TRP 161 CE2 -0.0001 0.0059 0.0011 686 TRP 161 CE3 -0.0043 0.0094 0.0018 687 TRP 161 NE1 0.0019 0.0044 0.0008 688 TRP 161 CZ2 -0.0005 0.0060 0.0010 689 TRP 161 CZ3 -0.0046 0.0095 0.0018 690 TRP 161 CH2 -0.0027 0.0078 0.0014 691 LYS 162 N 0.0052 0.0099 0.0038 692 LYS 162 CA 0.0076 0.0116 0.0049 693 LYS 162 C 0.0075 0.0123 0.0052 694 LYS 162 O 0.0093 0.0139 0.0062 695 LYS 162 CB 0.0107 0.0101 0.0049 696 LYS 162 CG 0.0111 0.0091 0.0045 697 LYS 162 CD 0.0131 0.0063 0.0037 698 LYS 162 CE 0.0130 0.0050 0.0032 699 LYS 162 NZ 0.0160 0.0037 0.0031 700 GLY 163 N 0.0054 0.0112 0.0043 701 GLY 163 CA 0.0052 0.0117 0.0045 702 GLY 163 C 0.0025 0.0136 0.0048 703 GLY 163 O 0.0019 0.0137 0.0047 704 ALA 164 N 0.0070 0.0057 0.0085 705 ALA 164 CA 0.0064 0.0053 0.0093 706 ALA 164 C 0.0067 0.0055 0.0089 707 ALA 164 O 0.0063 0.0051 0.0094 708 ALA 164 CB 0.0057 0.0061 0.0102 709 SER 165 N 0.0074 0.0060 0.0081 710 SER 165 CA 0.0077 0.0062 0.0077 711 SER 165 C 0.0084 0.0054 0.0067 712 SER 165 O 0.0088 0.0057 0.0062 713 SER 165 CB 0.0078 0.0076 0.0075 714 SER 165 OG 0.0072 0.0083 0.0084 715 ASN 166 N 0.0085 0.0045 0.0065 716 ASN 166 CA 0.0091 0.0037 0.0056 717 ASN 166 C 0.0089 0.0027 0.0059 718 ASN 166 O 0.0084 0.0020 0.0066 719 ASN 166 CB 0.0094 0.0031 0.0053 720 ASN 166 CG 0.0098 0.0041 0.0049 721 ASN 166 ND2 0.0097 0.0039 0.0049 722 ASN 166 OD1 0.0101 0.0051 0.0045 723 TYR 167 N 0.0076 -0.0058 0.0068 724 TYR 167 CA 0.0063 -0.0072 0.0071 725 TYR 167 C 0.0053 -0.0078 0.0056 726 TYR 167 O 0.0056 -0.0073 0.0048 727 TYR 167 CB 0.0061 -0.0079 0.0089 728 TYR 167 CG 0.0068 -0.0076 0.0105 729 TYR 167 CD1 0.0082 -0.0065 0.0111 730 TYR 167 CD2 0.0062 -0.0085 0.0114 731 TYR 167 CE1 0.0089 -0.0062 0.0126 732 TYR 167 CE2 0.0068 -0.0083 0.0129 733 TYR 167 CZ 0.0082 -0.0071 0.0135 734 TYR 167 OH 0.0089 -0.0069 0.0149 735 VAL 168 N 0.0041 -0.0089 0.0053 736 VAL 168 CA 0.0029 -0.0097 0.0041 737 VAL 168 C 0.0020 -0.0109 0.0053 738 VAL 168 O 0.0016 -0.0116 0.0065 739 VAL 168 CB 0.0022 -0.0100 0.0028 740 VAL 168 CG1 0.0010 -0.0109 0.0016 741 VAL 168 CG2 0.0032 -0.0087 0.0017 742 ALA 169 N 0.0016 -0.0112 0.0049 743 ALA 169 CA 0.0006 -0.0124 0.0058 744 ALA 169 C -0.0007 -0.0133 0.0044 745 ALA 169 O -0.0007 -0.0128 0.0029 746 ALA 169 CB 0.0011 -0.0121 0.0066 747 LYS 170 N -0.0032 -0.0167 0.0060 748 LYS 170 CA -0.0028 -0.0165 0.0064 749 LYS 170 C -0.0025 -0.0153 0.0066 750 LYS 170 O -0.0031 -0.0145 0.0063 751 LYS 170 CB -0.0033 -0.0168 0.0059 752 LYS 170 CG -0.0034 -0.0181 0.0058 753 LYS 170 CD -0.0038 -0.0184 0.0055 754 LYS 170 CE -0.0045 -0.0193 0.0050 755 LYS 170 NZ -0.0045 -0.0199 0.0049 756 ARG 171 N -0.0016 -0.0151 0.0073 757 ARG 171 CA -0.0013 -0.0140 0.0076 758 ARG 171 C -0.0009 -0.0138 0.0079 759 ARG 171 O -0.0004 -0.0146 0.0082 760 ARG 171 CB -0.0006 -0.0138 0.0081 761 ARG 171 CG -0.0002 -0.0126 0.0085 762 ARG 171 CD 0.0000 -0.0122 0.0087 763 ARG 171 NE 0.0004 -0.0111 0.0090 764 ARG 171 CZ -0.0000 -0.0101 0.0088 765 ARG 171 NH1 -0.0009 -0.0101 0.0081 766 ARG 171 NH2 0.0004 -0.0092 0.0091 767 TYR 172 N -0.0010 -0.0128 0.0079 768 TYR 172 CA -0.0006 -0.0126 0.0082 769 TYR 172 C 0.0005 -0.0126 0.0090 770 TYR 172 O 0.0008 -0.0121 0.0093 771 TYR 172 CB -0.0009 -0.0114 0.0080 772 TYR 172 CG -0.0017 -0.0115 0.0074 773 TYR 172 CD1 -0.0017 -0.0118 0.0074 774 TYR 172 CD2 -0.0026 -0.0114 0.0068 775 TYR 172 CE1 -0.0025 -0.0119 0.0068 776 TYR 172 CE2 -0.0034 -0.0115 0.0062 777 TYR 172 CZ -0.0033 -0.0117 0.0062 778 TYR 172 OH -0.0041 -0.0118 0.0056 779 ILE 173 N -0.0111 -0.0178 0.0161 780 ILE 173 CA 0.0001 -0.0173 0.0088 781 ILE 173 C 0.0027 -0.0142 0.0080 782 ILE 173 O 0.0092 -0.0054 0.0063 783 ILE 173 CB 0.0037 -0.0293 0.0029 784 ILE 173 CG1 0.0026 -0.0313 0.0031 785 ILE 173 CG2 0.0151 -0.0293 -0.0047 786 ILE 173 CD1 0.0017 -0.0444 -0.0002 787 GLU 174 N -0.0025 -0.0215 0.0094 788 GLU 174 CA -0.0012 -0.0184 0.0094 789 GLU 174 C -0.0093 -0.0106 0.0171 790 GLU 174 O -0.0183 -0.0126 0.0225 791 GLU 174 CB -0.0023 -0.0298 0.0068 792 GLU 174 CG 0.0025 -0.0400 0.0006 793 GLU 174 CD 0.0142 -0.0388 -0.0069 794 GLU 174 OE1 0.0175 -0.0408 -0.0097 795 GLU 174 OE2 0.0201 -0.0358 -0.0100 796 PRO 175 N -0.0062 -0.0017 0.0177 797 PRO 175 CA -0.0134 0.0066 0.0249 798 PRO 175 C -0.0236 -0.0002 0.0297 799 PRO 175 O -0.0237 -0.0091 0.0272 800 PRO 175 CB -0.0071 0.0145 0.0230 801 PRO 175 CG 0.0040 0.0146 0.0156 802 PRO 175 CD 0.0045 0.0023 0.0117 803 VAL 176 N 0.0019 0.0065 0.0104 804 VAL 176 CA 0.0005 0.0079 0.0087 805 VAL 176 C -0.0007 0.0102 0.0068 806 VAL 176 O -0.0010 0.0101 0.0066 807 VAL 176 CB -0.0014 0.0055 0.0078 808 VAL 176 CG1 -0.0001 0.0032 0.0096 809 VAL 176 CG2 -0.0032 0.0036 0.0066 810 ASP 177 N -0.0016 0.0122 0.0054 811 ASP 177 CA -0.0031 0.0142 0.0034 812 ASP 177 C -0.0055 0.0122 0.0018 813 ASP 177 O -0.0065 0.0098 0.0017 814 ASP 177 CB -0.0035 0.0167 0.0022 815 ASP 177 CG -0.0055 0.0184 -0.0001 816 ASP 177 OD1 -0.0073 0.0184 -0.0017 817 ASP 177 OD2 -0.0054 0.0197 -0.0004 818 ARG 178 N -0.0065 0.0132 0.0006 819 ARG 178 N -0.0065 0.0131 0.0007 820 ARG 178 CA -0.0087 0.0112 -0.0007 821 ARG 178 CA -0.0087 0.0112 -0.0007 822 ARG 178 C -0.0109 0.0107 -0.0026 823 ARG 178 C -0.0108 0.0105 -0.0024 824 ARG 178 O -0.0126 0.0084 -0.0034 825 ARG 178 O -0.0122 0.0080 -0.0029 826 ARG 178 CB -0.0092 0.0126 -0.0016 827 ARG 178 CB -0.0095 0.0129 -0.0020 828 ARG 178 CG -0.0070 0.0129 0.0003 829 ARG 178 CG -0.0074 0.0147 -0.0007 830 ARG 178 CD -0.0072 0.0151 -0.0006 831 ARG 178 CD -0.0080 0.0144 -0.0012 832 ARG 178 NE -0.0090 0.0137 -0.0018 833 ARG 178 NE -0.0066 0.0126 0.0007 834 ARG 178 CZ -0.0112 0.0144 -0.0041 835 ARG 178 CZ -0.0074 0.0106 0.0006 836 ARG 178 NH1 -0.0119 0.0164 -0.0053 837 ARG 178 NH1 -0.0097 0.0102 -0.0014 838 ARG 178 NH2 -0.0128 0.0129 -0.0050 839 ARG 178 NH2 -0.0059 0.0090 0.0025 840 ASP 179 N -0.0072 0.0102 -0.0006 841 ASP 179 CA -0.0081 0.0104 -0.0030 842 ASP 179 C -0.0081 0.0097 -0.0031 843 ASP 179 O -0.0088 0.0094 -0.0051 844 ASP 179 CB -0.0084 0.0131 -0.0039 845 ASP 179 CG -0.0094 0.0132 -0.0066 846 ASP 179 OD1 -0.0098 0.0131 -0.0078 847 ASP 179 OD2 -0.0097 0.0134 -0.0075 848 VAL 180 N -0.0074 0.0094 -0.0011 849 VAL 180 CA -0.0074 0.0084 -0.0012 850 VAL 180 C -0.0077 0.0057 -0.0022 851 VAL 180 O -0.0081 0.0050 -0.0036 852 VAL 180 CB -0.0065 0.0084 0.0013 853 VAL 180 CG1 -0.0064 0.0069 0.0014 854 VAL 180 CG2 -0.0063 0.0111 0.0021 855 TYR 181 N -0.0074 0.0042 -0.0016 856 TYR 181 CA -0.0077 0.0017 -0.0026 857 TYR 181 C -0.0087 0.0018 -0.0053 858 TYR 181 O -0.0091 0.0004 -0.0066 859 TYR 181 CB -0.0073 0.0003 -0.0015 860 TYR 181 CG -0.0064 -0.0006 0.0010 861 TYR 181 CD1 -0.0062 -0.0029 0.0014 862 TYR 181 CD2 -0.0057 0.0010 0.0029 863 TYR 181 CE1 -0.0053 -0.0038 0.0037 864 TYR 181 CE2 -0.0049 0.0002 0.0052 865 TYR 181 CZ -0.0047 -0.0022 0.0056 866 TYR 181 OH -0.0039 -0.0030 0.0079 867 PHE 182 N -0.0043 0.0064 -0.0050 868 PHE 182 CA -0.0056 0.0066 -0.0055 869 PHE 182 C -0.0057 0.0060 -0.0052 870 PHE 182 O -0.0068 0.0055 -0.0052 871 PHE 182 CB -0.0056 0.0079 -0.0063 872 PHE 182 CG -0.0057 0.0086 -0.0067 873 PHE 182 CD1 -0.0069 0.0086 -0.0071 874 PHE 182 CD2 -0.0045 0.0091 -0.0067 875 PHE 182 CE1 -0.0070 0.0092 -0.0074 876 PHE 182 CE2 -0.0046 0.0097 -0.0071 877 PHE 182 CZ -0.0058 0.0098 -0.0074 878 GLU 183 N -0.0046 0.0059 -0.0049 879 GLU 183 CA -0.0047 0.0053 -0.0045 880 GLU 183 C -0.0050 0.0040 -0.0038 881 GLU 183 O -0.0057 0.0033 -0.0037 882 GLU 183 CB -0.0034 0.0056 -0.0043 883 GLU 183 CG -0.0036 0.0053 -0.0042 884 GLU 183 CD -0.0045 0.0060 -0.0049 885 GLU 183 OE1 -0.0045 0.0071 -0.0055 886 GLU 183 OE2 -0.0052 0.0055 -0.0048 887 ASP 184 N -0.0045 0.0035 -0.0034 888 ASP 184 CA -0.0049 0.0022 -0.0028 889 ASP 184 C -0.0064 0.0019 -0.0030 890 ASP 184 O -0.0070 0.0010 -0.0027 891 ASP 184 CB -0.0041 0.0019 -0.0023 892 ASP 184 CG -0.0026 0.0019 -0.0019 893 ASP 184 OD1 -0.0023 0.0018 -0.0018 894 ASP 184 OD2 -0.0018 0.0020 -0.0017 895 VAL 185 N 0.0015 0.0041 -0.0043 896 VAL 185 CA -0.0001 0.0043 -0.0041 897 VAL 185 C -0.0009 0.0040 -0.0038 898 VAL 185 O -0.0020 0.0033 -0.0032 899 VAL 185 CB -0.0006 0.0057 -0.0050 900 VAL 185 CG1 -0.0023 0.0060 -0.0048 901 VAL 185 CG2 -0.0002 0.0058 -0.0052 902 ARG 186 N -0.0003 0.0045 -0.0042 903 ARG 186 CA -0.0009 0.0042 -0.0039 904 ARG 186 C -0.0009 0.0028 -0.0030 905 ARG 186 O -0.0020 0.0023 -0.0025 906 ARG 186 CB 0.0000 0.0048 -0.0045 907 ARG 186 CG -0.0003 0.0063 -0.0054 908 ARG 186 CD 0.0003 0.0068 -0.0059 909 ARG 186 NE 0.0006 0.0082 -0.0068 910 ARG 186 CZ 0.0018 0.0086 -0.0073 911 ARG 186 NH1 0.0030 0.0078 -0.0070 912 ARG 186 NH2 0.0019 0.0099 -0.0082 913 LEU 187 N 0.0004 0.0021 -0.0027 914 LEU 187 CA 0.0006 0.0006 -0.0018 915 LEU 187 C -0.0007 0.0001 -0.0012 916 LEU 187 O -0.0015 -0.0007 -0.0006 917 LEU 187 CB 0.0022 0.0001 -0.0018 918 LEU 187 CG 0.0029 -0.0013 -0.0010 919 LEU 187 CD1 0.0045 -0.0014 -0.0011 920 LEU 187 CD2 0.0019 -0.0023 -0.0001 921 GLN 188 N 0.0045 -0.0012 -0.0023 922 GLN 188 CA 0.0042 -0.0009 -0.0020 923 GLN 188 C 0.0034 -0.0006 -0.0011 924 GLN 188 O 0.0030 -0.0008 -0.0005 925 GLN 188 CB 0.0046 -0.0000 -0.0026 926 GLN 188 CG 0.0044 0.0002 -0.0024 927 GLN 188 CD 0.0050 0.0001 -0.0032 928 GLN 188 NE2 0.0050 0.0007 -0.0032 929 GLN 188 OE1 0.0055 -0.0004 -0.0038 930 MET 189 N 0.0032 0.0000 -0.0008 931 MET 189 CA 0.0024 0.0004 0.0000 932 MET 189 C 0.0020 -0.0005 0.0007 933 MET 189 O 0.0015 -0.0005 0.0014 934 MET 189 CB 0.0023 0.0014 0.0000 935 MET 189 CG 0.0028 0.0023 -0.0006 936 MET 189 SD 0.0025 0.0030 -0.0005 937 MET 189 CE 0.0031 0.0023 -0.0011 938 GLU 190 N 0.0023 -0.0013 0.0005 939 GLU 190 CA 0.0019 -0.0022 0.0011 940 GLU 190 C 0.0019 -0.0029 0.0013 941 GLU 190 O 0.0013 -0.0032 0.0020 942 GLU 190 CB 0.0023 -0.0030 0.0008 943 GLU 190 CG 0.0021 -0.0025 0.0009 944 GLU 190 CD 0.0014 -0.0026 0.0018 945 GLU 190 OE1 0.0011 -0.0033 0.0023 946 GLU 190 OE2 0.0012 -0.0021 0.0020 947 ALA 191 N 0.0007 -0.0075 0.0013 948 ALA 191 CA 0.0009 -0.0080 0.0006 949 ALA 191 C 0.0011 -0.0072 0.0011 950 ALA 191 O 0.0008 -0.0077 0.0011 951 ALA 191 CB 0.0017 -0.0082 -0.0009 952 LYS 192 N 0.0016 -0.0059 0.0016 953 LYS 192 CA 0.0018 -0.0050 0.0021 954 LYS 192 C 0.0008 -0.0053 0.0034 955 LYS 192 O 0.0007 -0.0053 0.0036 956 LYS 192 CB 0.0025 -0.0036 0.0025 957 LYS 192 CG 0.0029 -0.0025 0.0029 958 LYS 192 CD 0.0037 -0.0012 0.0030 959 LYS 192 CE 0.0041 -0.0001 0.0034 960 LYS 192 NZ 0.0047 -0.0003 0.0023 961 LEU 193 N 0.0002 -0.0055 0.0042 962 LEU 193 CA -0.0008 -0.0059 0.0054 963 LEU 193 C -0.0014 -0.0072 0.0050 964 LEU 193 O -0.0019 -0.0073 0.0056 965 LEU 193 CB -0.0015 -0.0061 0.0062 966 LEU 193 CG -0.0011 -0.0048 0.0069 967 LEU 193 CD1 -0.0019 -0.0051 0.0078 968 LEU 193 CD2 -0.0009 -0.0038 0.0078 969 TRP 194 N -0.0037 -0.0126 0.0033 970 TRP 194 CA -0.0043 -0.0138 0.0026 971 TRP 194 C -0.0038 -0.0141 0.0019 972 TRP 194 O -0.0044 -0.0148 0.0017 973 TRP 194 CB -0.0043 -0.0145 0.0019 974 TRP 194 CG -0.0054 -0.0146 0.0026 975 TRP 194 CD1 -0.0053 -0.0141 0.0030 976 TRP 194 CD2 -0.0067 -0.0153 0.0028 977 TRP 194 CE2 -0.0074 -0.0151 0.0035 978 TRP 194 CE3 -0.0073 -0.0160 0.0026 979 TRP 194 NE1 -0.0065 -0.0144 0.0036 980 TRP 194 CZ2 -0.0086 -0.0157 0.0039 981 TRP 194 CZ3 -0.0086 -0.0165 0.0030 982 TRP 194 CH2 -0.0093 -0.0164 0.0036 983 GLY 195 N -0.0025 -0.0136 0.0015 984 GLY 195 CA -0.0020 -0.0137 0.0009 985 GLY 195 C -0.0024 -0.0134 0.0016 986 GLY 195 O -0.0027 -0.0139 0.0012 987 GLU 196 N -0.0026 -0.0125 0.0027 988 GLU 196 CA -0.0031 -0.0121 0.0034 989 GLU 196 C -0.0044 -0.0129 0.0035 990 GLU 196 O -0.0048 -0.0131 0.0036 991 GLU 196 CB -0.0030 -0.0110 0.0045 992 GLU 196 CG -0.0017 -0.0101 0.0044 993 GLU 196 CD -0.0016 -0.0090 0.0054 994 GLU 196 OE1 -0.0026 -0.0089 0.0062 995 GLU 196 OE2 -0.0005 -0.0083 0.0053 996 GLU 197 N -0.0030 -0.0178 0.0032 997 GLU 197 CA -0.0021 -0.0170 0.0029 998 GLU 197 C -0.0022 -0.0153 0.0027 999 GLU 197 O -0.0011 -0.0146 0.0025 1000 GLU 197 CB -0.0027 -0.0174 0.0031 1001 GLU 197 CG -0.0018 -0.0166 0.0028 1002 GLU 197 CD -0.0002 -0.0171 0.0027 1003 GLU 197 OE1 0.0002 -0.0182 0.0027 1004 GLU 197 OE2 0.0006 -0.0164 0.0024 1005 TYR 198 N -0.0035 -0.0147 0.0028 1006 TYR 198 CA -0.0036 -0.0131 0.0027 1007 TYR 198 C -0.0026 -0.0128 0.0025 1008 TYR 198 O -0.0018 -0.0117 0.0022 1009 TYR 198 CB -0.0052 -0.0127 0.0028 1010 TYR 198 CG -0.0055 -0.0111 0.0027 1011 TYR 198 CD1 -0.0054 -0.0100 0.0025 1012 TYR 198 CD2 -0.0058 -0.0107 0.0027 1013 TYR 198 CE1 -0.0057 -0.0085 0.0024 1014 TYR 198 CE2 -0.0060 -0.0093 0.0025 1015 TYR 198 CZ -0.0060 -0.0082 0.0024 1016 TYR 198 OH -0.0062 -0.0067 0.0023 1017 ASN 199 N -0.0027 -0.0137 0.0026 1018 ASN 199 CA -0.0018 -0.0134 0.0024 1019 ASN 199 C -0.0001 -0.0134 0.0022 1020 ASN 199 O 0.0008 -0.0127 0.0020 1021 ASN 199 CB -0.0021 -0.0144 0.0026 1022 ASN 199 CG -0.0037 -0.0143 0.0028 1023 ASN 199 ND2 -0.0043 -0.0155 0.0031 1024 ASN 199 OD1 -0.0044 -0.0131 0.0028 1025 ARG 200 N -0.0013 -0.0168 0.0027 1026 ARG 200 CA -0.0008 -0.0168 0.0021 1027 ARG 200 C -0.0007 -0.0162 0.0018 1028 ARG 200 O -0.0003 -0.0162 0.0013 1029 ARG 200 CB -0.0008 -0.0169 0.0021 1030 ARG 200 CG -0.0007 -0.0176 0.0022 1031 ARG 200 CD -0.0007 -0.0176 0.0021 1032 ARG 200 NE -0.0008 -0.0182 0.0024 1033 ARG 200 CZ -0.0011 -0.0182 0.0028 1034 ARG 200 NH1 -0.0014 -0.0177 0.0031 1035 ARG 200 NH2 -0.0012 -0.0188 0.0031 1036 HIS 201 N -0.0010 -0.0157 0.0021 1037 HIS 201 CA -0.0009 -0.0151 0.0018 1038 HIS 201 C -0.0008 -0.0151 0.0017 1039 HIS 201 O -0.0008 -0.0145 0.0016 1040 HIS 201 CB -0.0012 -0.0145 0.0020 1041 HIS 201 CG -0.0011 -0.0144 0.0020 1042 HIS 201 CD2 -0.0010 -0.0139 0.0017 1043 HIS 201 ND1 -0.0012 -0.0148 0.0022 1044 HIS 201 CE1 -0.0012 -0.0145 0.0020 1045 HIS 201 NE2 -0.0010 -0.0140 0.0017 1046 LYS 202 N -0.0008 -0.0156 0.0018 1047 LYS 202 CA -0.0007 -0.0157 0.0017 1048 LYS 202 C -0.0010 -0.0153 0.0020 1049 LYS 202 O -0.0009 -0.0148 0.0018 1050 LYS 202 CB -0.0003 -0.0156 0.0012 1051 LYS 202 CG 0.0001 -0.0161 0.0009 1052 LYS 202 CD 0.0005 -0.0163 0.0004 1053 LYS 202 CE 0.0007 -0.0158 -0.0001 1054 LYS 202 NZ 0.0010 -0.0159 -0.0004 1055 PRO 203 N -0.0006 -0.0131 0.0107 1056 PRO 203 CA -0.0011 -0.0129 0.0093 1057 PRO 203 C -0.0003 -0.0119 0.0086 1058 PRO 203 O 0.0006 -0.0113 0.0092 1059 PRO 203 CB -0.0018 -0.0134 0.0090 1060 PRO 203 CG -0.0012 -0.0134 0.0100 1061 PRO 203 CD -0.0007 -0.0135 0.0111 1062 PRO 204 N -0.0006 -0.0115 0.0074 1063 PRO 204 CA 0.0002 -0.0105 0.0067 1064 PRO 204 C 0.0005 -0.0101 0.0066 1065 PRO 204 O 0.0014 -0.0093 0.0065 1066 PRO 204 CB -0.0004 -0.0104 0.0055 1067 PRO 204 CG -0.0015 -0.0114 0.0054 1068 PRO 204 CD -0.0015 -0.0121 0.0067 1069 LYS 205 N -0.0002 -0.0107 0.0065 1070 LYS 205 CA 0.0001 -0.0105 0.0064 1071 LYS 205 C -0.0004 -0.0113 0.0073 1072 LYS 205 O -0.0013 -0.0121 0.0073 1073 LYS 205 CB -0.0004 -0.0102 0.0051 1074 LYS 205 CG 0.0001 -0.0093 0.0041 1075 LYS 205 CD -0.0003 -0.0091 0.0029 1076 LYS 205 CE 0.0001 -0.0082 0.0019 1077 LYS 205 NZ -0.0003 -0.0080 0.0006 1078 GLN 206 N 0.0028 -0.0087 0.0003 1079 GLN 206 CA 0.0028 -0.0083 0.0005 1080 GLN 206 C 0.0036 -0.0080 -0.0006 1081 GLN 206 O 0.0042 -0.0079 -0.0014 1082 GLN 206 CB 0.0024 -0.0071 0.0012 1083 GLN 206 CG 0.0015 -0.0074 0.0023 1084 GLN 206 CD 0.0010 -0.0064 0.0031 1085 GLN 206 NE2 0.0003 -0.0064 0.0041 1086 GLN 206 OE1 0.0013 -0.0056 0.0029 1087 VAL 207 N 0.0036 -0.0080 -0.0006 1088 VAL 207 CA 0.0044 -0.0077 -0.0016 1089 VAL 207 C 0.0044 -0.0066 -0.0014 1090 VAL 207 O 0.0038 -0.0061 -0.0005 1091 VAL 207 CB 0.0046 -0.0089 -0.0020 1092 VAL 207 CG1 0.0045 -0.0101 -0.0021 1093 VAL 207 CG2 0.0040 -0.0091 -0.0013 1094 ASP 208 N 0.0051 -0.0061 -0.0022 1095 ASP 208 CA 0.0052 -0.0050 -0.0021 1096 ASP 208 C 0.0059 -0.0050 -0.0031 1097 ASP 208 O 0.0066 -0.0051 -0.0040 1098 ASP 208 CB 0.0052 -0.0037 -0.0019 1099 ASP 208 CG 0.0049 -0.0027 -0.0014 1100 ASP 208 OD1 0.0045 -0.0030 -0.0009 1101 ASP 208 OD2 0.0052 -0.0015 -0.0015 1102 ILE 209 N 0.0059 -0.0020 -0.0021 1103 ILE 209 CA 0.0063 -0.0020 -0.0028 1104 ILE 209 C 0.0067 -0.0008 -0.0027 1105 ILE 209 O 0.0065 -0.0003 -0.0018 1106 ILE 209 CB 0.0057 -0.0028 -0.0026 1107 ILE 209 CG1 0.0054 -0.0041 -0.0031 1108 ILE 209 CG2 0.0061 -0.0026 -0.0031 1109 ILE 209 CD1 0.0048 -0.0045 -0.0024 1110 MET 210 N 0.0074 -0.0004 -0.0036 1111 MET 210 CA 0.0079 0.0007 -0.0035 1112 MET 210 C 0.0077 0.0009 -0.0030 1113 MET 210 O 0.0075 0.0002 -0.0032 1114 MET 210 CB 0.0087 0.0010 -0.0046 1115 MET 210 CG 0.0090 0.0011 -0.0052 1116 MET 210 SD 0.0093 0.0023 -0.0047 1117 MET 210 CE 0.0085 0.0021 -0.0035 1118 GLN 211 N 0.0078 0.0019 -0.0023 1119 GLN 211 CA 0.0077 0.0022 -0.0018 1120 GLN 211 C 0.0083 0.0024 -0.0027 1121 GLN 211 O 0.0089 0.0029 -0.0035 1122 GLN 211 CB 0.0077 0.0032 -0.0009 1123 GLN 211 CG 0.0077 0.0037 -0.0005 1124 GLN 211 CD 0.0075 0.0046 0.0006 1125 GLN 211 NE2 0.0080 0.0056 0.0005 1126 GLN 211 OE1 0.0070 0.0043 0.0014 1127 MET 212 N 0.0006 0.0017 -0.0032 1128 MET 212 CA 0.0010 0.0019 -0.0037 1129 MET 212 C 0.0009 0.0022 -0.0033 1130 MET 212 O 0.0005 0.0020 -0.0028 1131 MET 212 CB 0.0011 0.0011 -0.0043 1132 MET 212 CG 0.0014 0.0012 -0.0048 1133 MET 212 SD 0.0014 0.0003 -0.0055 1134 MET 212 CE 0.0009 -0.0001 -0.0050 1135 CYS 213 N 0.0013 0.0028 -0.0036 1136 CYS 213 CA 0.0013 0.0032 -0.0032 1137 CYS 213 C 0.0017 0.0032 -0.0038 1138 CYS 213 O 0.0020 0.0030 -0.0045 1139 CYS 213 CB 0.0013 0.0039 -0.0027 1140 CYS 213 SG 0.0020 0.0047 -0.0032 1141 ILE 214 N 0.0017 0.0036 -0.0036 1142 ILE 214 CA 0.0021 0.0037 -0.0041 1143 ILE 214 C 0.0025 0.0046 -0.0040 1144 ILE 214 O 0.0023 0.0050 -0.0034 1145 ILE 214 CB 0.0019 0.0034 -0.0040 1146 ILE 214 CG1 0.0016 0.0025 -0.0042 1147 ILE 214 CG2 0.0023 0.0036 -0.0044 1148 ILE 214 CD1 0.0011 0.0021 -0.0038 1149 ILE 215 N -0.0048 0.0055 -0.0044 1150 ILE 215 CA -0.0051 0.0052 -0.0046 1151 ILE 215 C -0.0051 0.0052 -0.0046 1152 ILE 215 O -0.0050 0.0054 -0.0042 1153 ILE 215 CB -0.0055 0.0050 -0.0043 1154 ILE 215 CG1 -0.0056 0.0052 -0.0038 1155 ILE 215 CG2 -0.0055 0.0049 -0.0044 1156 ILE 215 CD1 -0.0061 0.0050 -0.0036 1157 GLU 216 N -0.0051 0.0050 -0.0049 1158 GLU 216 CA -0.0051 0.0050 -0.0050 1159 GLU 216 C -0.0055 0.0046 -0.0050 1160 GLU 216 O -0.0057 0.0044 -0.0053 1161 GLU 216 CB -0.0048 0.0050 -0.0054 1162 GLU 216 CG -0.0048 0.0049 -0.0055 1163 GLU 216 CD -0.0044 0.0050 -0.0059 1164 GLU 216 OE1 -0.0042 0.0050 -0.0062 1165 GLU 216 OE2 -0.0042 0.0051 -0.0059 1166 LEU 217 N -0.0058 0.0046 -0.0047 1167 LEU 217 CA -0.0062 0.0043 -0.0047 1168 LEU 217 C -0.0061 0.0042 -0.0050 1169 LEU 217 O -0.0061 0.0043 -0.0048 1170 LEU 217 CB -0.0064 0.0044 -0.0042 1171 LEU 217 CG -0.0066 0.0044 -0.0040 1172 LEU 217 CD1 -0.0070 0.0041 -0.0041 1173 LEU 217 CD2 -0.0063 0.0046 -0.0039 1174 LYS 218 N -0.0073 0.0032 -0.0063 1175 LYS 218 CA -0.0076 0.0030 -0.0055 1176 LYS 218 C -0.0079 0.0023 -0.0041 1177 LYS 218 O -0.0086 0.0026 -0.0031 1178 LYS 218 CB -0.0069 0.0022 -0.0061 1179 LYS 218 CG -0.0065 0.0029 -0.0075 1180 LYS 218 CD -0.0070 0.0039 -0.0074 1181 LYS 218 CE -0.0067 0.0047 -0.0088 1182 LYS 218 NZ -0.0059 0.0038 -0.0096 1183 ASP 219 N -0.0076 0.0013 -0.0039 1184 ASP 219 CA -0.0078 0.0004 -0.0026 1185 ASP 219 C -0.0086 0.0012 -0.0016 1186 ASP 219 O -0.0091 0.0009 -0.0004 1187 ASP 219 CB -0.0071 -0.0009 -0.0027 1188 ASP 219 CG -0.0064 -0.0018 -0.0034 1189 ASP 219 OD1 -0.0065 -0.0016 -0.0034 1190 ASP 219 OD2 -0.0058 -0.0028 -0.0038 1191 ARG 220 N -0.0088 0.0021 -0.0021 1192 ARG 220 CA -0.0095 0.0028 -0.0013 1193 ARG 220 C -0.0103 0.0038 -0.0006 1194 ARG 220 O -0.0102 0.0042 -0.0012 1195 ARG 220 CB -0.0095 0.0037 -0.0021 1196 ARG 220 CG -0.0090 0.0029 -0.0025 1197 ARG 220 CD -0.0091 0.0038 -0.0031 1198 ARG 220 NE -0.0085 0.0031 -0.0038 1199 ARG 220 CZ -0.0085 0.0038 -0.0044 1200 ARG 220 NH1 -0.0090 0.0051 -0.0044 1201 ARG 220 NH2 -0.0079 0.0031 -0.0050 1202 PRO 221 N -0.0249 0.0023 0.0028 1203 PRO 221 CA -0.0246 0.0029 0.0029 1204 PRO 221 C -0.0226 0.0059 0.0031 1205 PRO 221 O -0.0228 0.0082 0.0043 1206 PRO 221 CB -0.0278 0.0029 0.0045 1207 PRO 221 CG -0.0297 0.0013 0.0048 1208 PRO 221 CD -0.0280 0.0020 0.0042 1209 GLY 222 N -0.0205 0.0058 0.0020 1210 GLY 222 CA -0.0183 0.0084 0.0021 1211 GLY 222 C -0.0153 0.0086 0.0006 1212 GLY 222 O -0.0132 0.0105 0.0004 1213 LYS 223 N -0.0150 0.0067 -0.0004 1214 LYS 223 CA -0.0125 0.0070 -0.0016 1215 LYS 223 C -0.0115 0.0104 -0.0006 1216 LYS 223 O -0.0090 0.0117 -0.0013 1217 LYS 223 CB -0.0100 0.0058 -0.0035 1218 LYS 223 CG -0.0107 0.0026 -0.0046 1219 LYS 223 CD -0.0080 0.0016 -0.0064 1220 LYS 223 CE -0.0067 0.0039 -0.0061 1221 LYS 223 NZ -0.0036 0.0037 -0.0078 1222 PRO 224 N -0.0033 0.0057 -0.0003 1223 PRO 224 CA -0.0031 0.0044 0.0006 1224 PRO 224 C -0.0049 0.0036 0.0000 1225 PRO 224 O -0.0064 0.0031 -0.0006 1226 PRO 224 CB -0.0025 0.0029 0.0019 1227 PRO 224 CG -0.0032 0.0030 0.0014 1228 PRO 224 CD -0.0031 0.0050 0.0002 1229 LEU 225 N -0.0047 0.0035 0.0002 1230 LEU 225 CA -0.0062 0.0026 -0.0002 1231 LEU 225 C -0.0062 0.0006 0.0011 1232 LEU 225 O -0.0048 0.0001 0.0022 1233 LEU 225 CB -0.0061 0.0036 -0.0007 1234 LEU 225 CG -0.0061 0.0057 -0.0019 1235 LEU 225 CD1 -0.0058 0.0065 -0.0023 1236 LEU 225 CD2 -0.0079 0.0059 -0.0032 1237 PHE 226 N -0.0079 -0.0006 0.0008 1238 PHE 226 CA -0.0082 -0.0025 0.0018 1239 PHE 226 C -0.0097 -0.0030 0.0012 1240 PHE 226 O -0.0111 -0.0024 0.0000 1241 PHE 226 CB -0.0088 -0.0038 0.0023 1242 PHE 226 CG -0.0073 -0.0035 0.0030 1243 PHE 226 CD1 -0.0070 -0.0020 0.0023 1244 PHE 226 CD2 -0.0063 -0.0048 0.0044 1245 PHE 226 CE1 -0.0056 -0.0018 0.0030 1246 PHE 226 CE2 -0.0050 -0.0046 0.0051 1247 PHE 226 CZ -0.0046 -0.0031 0.0043 1248 HIS 227 N -0.0023 -0.0065 0.0054 1249 HIS 227 CA -0.0022 -0.0065 0.0050 1250 HIS 227 C -0.0015 -0.0066 0.0047 1251 HIS 227 O -0.0012 -0.0066 0.0046 1252 HIS 227 CB -0.0027 -0.0065 0.0044 1253 HIS 227 CG -0.0034 -0.0064 0.0045 1254 HIS 227 CD2 -0.0037 -0.0064 0.0048 1255 HIS 227 ND1 -0.0039 -0.0064 0.0044 1256 HIS 227 CE1 -0.0044 -0.0063 0.0046 1257 HIS 227 NE2 -0.0044 -0.0063 0.0049 1258 LEU 228 N -0.0013 -0.0066 0.0046 1259 LEU 228 CA -0.0006 -0.0066 0.0044 1260 LEU 228 C -0.0006 -0.0066 0.0039 1261 LEU 228 O -0.0009 -0.0066 0.0040 1262 LEU 228 CB -0.0002 -0.0066 0.0050 1263 LEU 228 CG 0.0006 -0.0067 0.0049 1264 LEU 228 CD1 0.0008 -0.0067 0.0050 1265 LEU 228 CD2 0.0010 -0.0067 0.0054 1266 GLU 229 N -0.0003 -0.0067 0.0033 1267 GLU 229 CA -0.0002 -0.0067 0.0028 1268 GLU 229 C 0.0005 -0.0067 0.0025 1269 GLU 229 O 0.0008 -0.0068 0.0026 1270 GLU 229 CB -0.0007 -0.0067 0.0022 1271 GLU 229 CG -0.0014 -0.0066 0.0024 1272 GLU 229 CD -0.0018 -0.0066 0.0019 1273 GLU 229 OE1 -0.0017 -0.0066 0.0013 1274 GLU 229 OE2 -0.0022 -0.0066 0.0020 1275 HIS 230 N 0.0058 0.0029 0.0068 1276 HIS 230 CA 0.0085 0.0027 0.0056 1277 HIS 230 C 0.0079 0.0035 0.0031 1278 HIS 230 O 0.0059 0.0044 0.0015 1279 HIS 230 CB 0.0106 0.0026 0.0044 1280 HIS 230 CG 0.0138 0.0020 0.0042 1281 HIS 230 CD2 0.0161 0.0011 0.0057 1282 HIS 230 ND1 0.0149 0.0024 0.0023 1283 HIS 230 CE1 0.0178 0.0017 0.0026 1284 HIS 230 NE2 0.0186 0.0009 0.0046 1285 TYR 231 N 0.0097 0.0033 0.0029 1286 TYR 231 CA 0.0093 0.0040 0.0006 1287 TYR 231 C 0.0104 0.0046 -0.0023 1288 TYR 231 O 0.0127 0.0042 -0.0025 1289 TYR 231 CB 0.0111 0.0034 0.0013 1290 TYR 231 CG 0.0112 0.0041 -0.0012 1291 TYR 231 CD1 0.0087 0.0049 -0.0021 1292 TYR 231 CD2 0.0139 0.0040 -0.0027 1293 TYR 231 CE1 0.0088 0.0055 -0.0043 1294 TYR 231 CE2 0.0140 0.0047 -0.0050 1295 TYR 231 CZ 0.0115 0.0054 -0.0058 1296 TYR 231 OH 0.0116 0.0060 -0.0081 1297 ILE 232 N 0.0088 0.0056 -0.0045 1298 ILE 232 CA 0.0096 0.0063 -0.0075 1299 ILE 232 C 0.0096 0.0068 -0.0094 1300 ILE 232 O 0.0073 0.0074 -0.0097 1301 ILE 232 CB 0.0075 0.0070 -0.0086 1302 ILE 232 CG1 0.0068 0.0065 -0.0062 1303 ILE 232 CG2 0.0087 0.0076 -0.0114 1304 ILE 232 CD1 0.0090 0.0061 -0.0063 1305 GLU 233 N 0.0135 0.0204 -0.0242 1306 GLU 233 CA 0.0155 0.0171 -0.0230 1307 GLU 233 C 0.0142 0.0138 -0.0224 1308 GLU 233 O 0.0108 0.0134 -0.0229 1309 GLU 233 CB 0.0151 0.0163 -0.0228 1310 GLU 233 CG 0.0116 0.0139 -0.0229 1311 GLU 233 CD 0.0112 0.0136 -0.0229 1312 GLU 233 OE1 0.0142 0.0138 -0.0224 1313 GLU 233 OE2 0.0080 0.0133 -0.0234 1314 GLY 234 N 0.0168 0.0114 -0.0213 1315 GLY 234 CA 0.0162 0.0084 -0.0207 1316 GLY 234 C 0.0194 0.0082 -0.0201 1317 GLY 234 O 0.0218 0.0107 -0.0203 1318 LYS 235 N 0.0193 0.0051 -0.0193 1319 LYS 235 CA 0.0223 0.0045 -0.0186 1320 LYS 235 C 0.0220 0.0072 -0.0194 1321 LYS 235 O 0.0190 0.0073 -0.0199 1322 LYS 235 CB 0.0222 0.0005 -0.0177 1323 LYS 235 CG 0.0254 -0.0005 -0.0168 1324 LYS 235 CD 0.0264 -0.0046 -0.0156 1325 LYS 235 CE 0.0244 -0.0071 -0.0154 1326 LYS 235 NZ 0.0267 -0.0078 -0.0148 1327 TYR 236 N 0.0126 0.0221 -0.0156 1328 TYR 236 CA 0.0119 0.0205 -0.0149 1329 TYR 236 C 0.0109 0.0199 -0.0158 1330 TYR 236 O 0.0102 0.0203 -0.0172 1331 TYR 236 CB 0.0112 0.0196 -0.0150 1332 TYR 236 CG 0.0105 0.0179 -0.0141 1333 TYR 236 CD1 0.0092 0.0169 -0.0149 1334 TYR 236 CD2 0.0111 0.0173 -0.0125 1335 TYR 236 CE1 0.0086 0.0153 -0.0141 1336 TYR 236 CE2 0.0104 0.0157 -0.0117 1337 TYR 236 CZ 0.0092 0.0148 -0.0125 1338 TYR 236 OH 0.0085 0.0132 -0.0117 1339 ILE 237 N 0.0109 0.0191 -0.0148 1340 ILE 237 CA 0.0101 0.0186 -0.0155 1341 ILE 237 C 0.0094 0.0169 -0.0146 1342 ILE 237 O 0.0099 0.0163 -0.0131 1343 ILE 237 CB 0.0108 0.0195 -0.0153 1344 ILE 237 CG1 0.0118 0.0212 -0.0159 1345 ILE 237 CG2 0.0100 0.0191 -0.0162 1346 ILE 237 CD1 0.0112 0.0220 -0.0177 1347 LYS 238 N 0.0081 0.0160 -0.0155 1348 LYS 238 CA 0.0074 0.0144 -0.0148 1349 LYS 238 C 0.0074 0.0145 -0.0148 1350 LYS 238 O 0.0069 0.0149 -0.0161 1351 LYS 238 CB 0.0060 0.0134 -0.0157 1352 LYS 238 CG 0.0059 0.0136 -0.0161 1353 LYS 238 CD 0.0047 0.0122 -0.0165 1354 LYS 238 CE 0.0047 0.0121 -0.0162 1355 LYS 238 NZ 0.0036 0.0106 -0.0163 1356 TYR 239 N 0.0063 0.0121 -0.0067 1357 TYR 239 CA 0.0063 0.0120 -0.0065 1358 TYR 239 C 0.0060 0.0114 -0.0066 1359 TYR 239 O 0.0059 0.0112 -0.0068 1360 TYR 239 CB 0.0065 0.0121 -0.0059 1361 TYR 239 CG 0.0068 0.0128 -0.0058 1362 TYR 239 CD1 0.0069 0.0132 -0.0060 1363 TYR 239 CD2 0.0069 0.0130 -0.0055 1364 TYR 239 CE1 0.0071 0.0137 -0.0060 1365 TYR 239 CE2 0.0072 0.0135 -0.0055 1366 TYR 239 CZ 0.0073 0.0139 -0.0057 1367 TYR 239 OH 0.0075 0.0145 -0.0056 1368 ASN 240 N 0.0059 0.0110 -0.0064 1369 ASN 240 CA 0.0056 0.0104 -0.0065 1370 ASN 240 C 0.0055 0.0102 -0.0066 1371 ASN 240 O 0.0057 0.0104 -0.0064 1372 ASN 240 CB 0.0056 0.0100 -0.0060 1373 ASN 240 CG 0.0058 0.0100 -0.0054 1374 ASN 240 ND2 0.0059 0.0101 -0.0050 1375 ASN 240 OD1 0.0057 0.0099 -0.0053 1376 SER 241 N 0.0052 0.0097 -0.0069 1377 SER 241 CA 0.0051 0.0094 -0.0069 1378 SER 241 C 0.0050 0.0089 -0.0065 1379 SER 241 O 0.0051 0.0088 -0.0061 1380 SER 241 CB 0.0049 0.0093 -0.0076 1381 SER 241 OG 0.0047 0.0088 -0.0077 1382 ASN 242 N 0.0020 0.0040 0.0012 1383 ASN 242 CA 0.0025 0.0034 0.0012 1384 ASN 242 C 0.0016 0.0042 0.0012 1385 ASN 242 O 0.0018 0.0038 0.0013 1386 ASN 242 CB 0.0022 0.0015 0.0015 1387 ASN 242 CG 0.0006 0.0011 0.0018 1388 ASN 242 ND2 0.0006 0.0000 0.0020 1389 ASN 242 OD1 -0.0006 0.0018 0.0020 1390 SER 243 N 0.0007 0.0055 0.0013 1391 SER 243 CA -0.0003 0.0064 0.0013 1392 SER 243 C -0.0001 0.0082 0.0011 1393 SER 243 O -0.0010 0.0090 0.0011 1394 SER 243 CB -0.0021 0.0060 0.0017 1395 SER 243 OG -0.0027 0.0069 0.0017 1396 GLY 244 N 0.0011 0.0088 0.0008 1397 GLY 244 CA 0.0016 0.0104 0.0005 1398 GLY 244 C 0.0014 0.0114 0.0004 1399 GLY 244 O 0.0020 0.0127 0.0001 1400 PHE 245 N 0.0120 0.0185 -0.0021 1401 PHE 245 CA 0.0117 0.0192 -0.0021 1402 PHE 245 C 0.0116 0.0197 -0.0012 1403 PHE 245 O 0.0115 0.0198 -0.0009 1404 PHE 245 CB 0.0114 0.0197 -0.0029 1405 PHE 245 CG 0.0110 0.0206 -0.0026 1406 PHE 245 CD1 0.0108 0.0209 -0.0027 1407 PHE 245 CD2 0.0107 0.0211 -0.0024 1408 PHE 245 CE1 0.0104 0.0217 -0.0025 1409 PHE 245 CE2 0.0104 0.0219 -0.0022 1410 PHE 245 CZ 0.0102 0.0222 -0.0023 1411 VAL 246 N 0.0115 0.0199 -0.0008 1412 VAL 246 CA 0.0113 0.0205 0.0000 1413 VAL 246 C 0.0110 0.0211 -0.0001 1414 VAL 246 O 0.0111 0.0209 -0.0004 1415 VAL 246 CB 0.0115 0.0201 0.0009 1416 VAL 246 CG1 0.0118 0.0195 0.0009 1417 VAL 246 CG2 0.0113 0.0207 0.0017 1418 ARG 247 N 0.0106 0.0219 0.0001 1419 ARG 247 CA 0.0103 0.0225 -0.0000 1420 ARG 247 C 0.0104 0.0223 0.0003 1421 ARG 247 O 0.0105 0.0222 0.0011 1422 ARG 247 CB 0.0099 0.0233 0.0004 1423 ARG 247 CG 0.0097 0.0238 -0.0002 1424 ARG 247 CD 0.0093 0.0243 -0.0008 1425 ARG 247 NE 0.0090 0.0251 -0.0004 1426 ARG 247 CZ 0.0086 0.0258 -0.0008 1427 ARG 247 NH1 0.0085 0.0258 -0.0017 1428 ARG 247 NH2 0.0083 0.0265 -0.0003 1429 ASP 248 N 0.0156 0.0286 0.0212 1430 ASP 248 CA 0.0159 0.0251 0.0197 1431 ASP 248 C 0.0177 0.0201 0.0183 1432 ASP 248 O 0.0208 0.0173 0.0186 1433 ASP 248 CB 0.0189 0.0263 0.0218 1434 ASP 248 CG 0.0176 0.0314 0.0235 1435 ASP 248 OD1 0.0134 0.0333 0.0223 1436 ASP 248 OD2 0.0208 0.0335 0.0262 1437 ASP 249 N 0.0158 0.0189 0.0167 1438 ASP 249 CA 0.0171 0.0142 0.0152 1439 ASP 249 C 0.0131 0.0132 0.0126 1440 ASP 249 O 0.0090 0.0144 0.0111 1441 ASP 249 CB 0.0215 0.0138 0.0173 1442 ASP 249 CG 0.0215 0.0181 0.0193 1443 ASP 249 OD1 0.0195 0.0183 0.0184 1444 ASP 249 OD2 0.0234 0.0213 0.0218 1445 ASN 250 N 0.0142 0.0109 0.0121 1446 ASN 250 CA 0.0106 0.0101 0.0099 1447 ASN 250 C 0.0078 0.0148 0.0106 1448 ASN 250 O 0.0092 0.0170 0.0124 1449 ASN 250 CB 0.0127 0.0071 0.0095 1450 ASN 250 CG 0.0138 0.0018 0.0077 1451 ASN 250 ND2 0.0156 -0.0011 0.0072 1452 ASN 250 OD1 0.0131 0.0004 0.0066 1453 ILE 251 N -0.0024 0.0129 0.0118 1454 ILE 251 CA -0.0029 0.0143 0.0111 1455 ILE 251 C -0.0030 0.0128 0.0091 1456 ILE 251 O -0.0030 0.0114 0.0075 1457 ILE 251 CB -0.0038 0.0169 0.0103 1458 ILE 251 CG1 -0.0037 0.0188 0.0126 1459 ILE 251 CG2 -0.0045 0.0179 0.0082 1460 ILE 251 CD1 -0.0045 0.0214 0.0119 1461 ARG 252 N -0.0031 0.0132 0.0091 1462 ARG 252 CA -0.0033 0.0122 0.0070 1463 ARG 252 C -0.0042 0.0145 0.0055 1464 ARG 252 O -0.0045 0.0165 0.0065 1465 ARG 252 CB -0.0027 0.0109 0.0081 1466 ARG 252 CG -0.0019 0.0083 0.0091 1467 ARG 252 CD -0.0014 0.0067 0.0094 1468 ARG 252 NE -0.0018 0.0062 0.0069 1469 ARG 252 CZ -0.0021 0.0070 0.0064 1470 ARG 252 NH1 -0.0021 0.0082 0.0081 1471 ARG 252 NH2 -0.0025 0.0065 0.0040 1472 LEU 253 N -0.0047 0.0140 0.0029 1473 LEU 253 CA -0.0055 0.0161 0.0013 1474 LEU 253 C -0.0057 0.0167 0.0012 1475 LEU 253 O -0.0063 0.0189 0.0009 1476 LEU 253 CB -0.0060 0.0154 -0.0014 1477 LEU 253 CG -0.0058 0.0146 -0.0018 1478 LEU 253 CD1 -0.0065 0.0146 -0.0046 1479 LEU 253 CD2 -0.0059 0.0162 -0.0001 1480 THR 254 N -0.0046 0.0032 -0.0012 1481 THR 254 CA -0.0048 0.0040 -0.0005 1482 THR 254 C -0.0050 0.0050 0.0007 1483 THR 254 O -0.0059 0.0058 0.0009 1484 THR 254 CB -0.0038 0.0034 -0.0003 1485 THR 254 CG2 -0.0039 0.0042 0.0006 1486 THR 254 OG1 -0.0039 0.0027 -0.0014 1487 PRO 255 N -0.0041 0.0050 0.0014 1488 PRO 255 CA -0.0043 0.0060 0.0026 1489 PRO 255 C -0.0056 0.0067 0.0024 1490 PRO 255 O -0.0063 0.0076 0.0030 1491 PRO 255 CB -0.0032 0.0057 0.0032 1492 PRO 255 CG -0.0022 0.0047 0.0027 1493 PRO 255 CD -0.0029 0.0042 0.0014 1494 GLN 256 N -0.0059 0.0063 0.0015 1495 GLN 256 CA -0.0071 0.0069 0.0013 1496 GLN 256 C -0.0083 0.0072 0.0008 1497 GLN 256 O -0.0092 0.0081 0.0011 1498 GLN 256 CB -0.0071 0.0062 0.0004 1499 GLN 256 CG -0.0058 0.0056 0.0007 1500 GLN 256 CD -0.0053 0.0062 0.0020 1501 GLN 256 NE2 -0.0040 0.0058 0.0025 1502 GLN 256 OE1 -0.0060 0.0071 0.0026 1503 ALA 257 N -0.0098 0.0026 0.0028 1504 ALA 257 CA -0.0084 0.0023 0.0027 1505 ALA 257 C -0.0081 0.0009 0.0028 1506 ALA 257 O -0.0074 0.0004 0.0028 1507 ALA 257 CB -0.0075 0.0031 0.0027 1508 PHE 258 N -0.0087 0.0001 0.0028 1509 PHE 258 CA -0.0085 -0.0013 0.0029 1510 PHE 258 C -0.0090 -0.0020 0.0029 1511 PHE 258 O -0.0083 -0.0028 0.0030 1512 PHE 258 CB -0.0091 -0.0019 0.0029 1513 PHE 258 CG -0.0092 -0.0033 0.0030 1514 PHE 258 CD1 -0.0081 -0.0041 0.0030 1515 PHE 258 CD2 -0.0104 -0.0040 0.0031 1516 PHE 258 CE1 -0.0082 -0.0055 0.0031 1517 PHE 258 CE2 -0.0105 -0.0053 0.0031 1518 PHE 258 CZ -0.0094 -0.0061 0.0031 1519 SER 259 N -0.0102 -0.0016 0.0030 1520 SER 259 CA -0.0108 -0.0022 0.0030 1521 SER 259 C -0.0099 -0.0019 0.0030 1522 SER 259 O -0.0096 -0.0027 0.0030 1523 SER 259 CB -0.0122 -0.0017 0.0030 1524 SER 259 OG -0.0130 -0.0021 0.0031 1525 HIS 260 N -0.0159 -0.0030 0.0047 1526 HIS 260 CA -0.0150 -0.0017 0.0039 1527 HIS 260 C -0.0133 -0.0027 0.0031 1528 HIS 260 O -0.0128 -0.0025 0.0027 1529 HIS 260 CB -0.0147 0.0002 0.0035 1530 HIS 260 CG -0.0141 0.0018 0.0030 1531 HIS 260 CD2 -0.0139 0.0019 0.0029 1532 HIS 260 ND1 -0.0136 0.0035 0.0025 1533 HIS 260 CE1 -0.0132 0.0046 0.0021 1534 HIS 260 NE2 -0.0134 0.0036 0.0023 1535 PHE 261 N -0.0125 -0.0038 0.0027 1536 PHE 261 CA -0.0109 -0.0048 0.0018 1537 PHE 261 C -0.0111 -0.0063 0.0022 1538 PHE 261 O -0.0101 -0.0065 0.0016 1539 PHE 261 CB -0.0101 -0.0059 0.0015 1540 PHE 261 CG -0.0087 -0.0073 0.0008 1541 PHE 261 CD1 -0.0071 -0.0067 -0.0003 1542 PHE 261 CD2 -0.0089 -0.0092 0.0012 1543 PHE 261 CE1 -0.0057 -0.0080 -0.0009 1544 PHE 261 CE2 -0.0076 -0.0105 0.0006 1545 PHE 261 CZ -0.0060 -0.0099 -0.0005 1546 THR 262 N -0.0125 -0.0073 0.0031 1547 THR 262 CA -0.0128 -0.0087 0.0035 1548 THR 262 C -0.0131 -0.0077 0.0035 1549 THR 262 O -0.0126 -0.0085 0.0033 1550 THR 262 CB -0.0142 -0.0100 0.0045 1551 THR 262 CG2 -0.0139 -0.0110 0.0044 1552 THR 262 OG1 -0.0157 -0.0088 0.0053 1553 PHE 263 N -0.0122 -0.0100 0.0036 1554 PHE 263 CA -0.0117 -0.0081 0.0036 1555 PHE 263 C -0.0100 -0.0073 0.0018 1556 PHE 263 O -0.0093 -0.0070 0.0010 1557 PHE 263 CB -0.0123 -0.0061 0.0051 1558 PHE 263 CG -0.0117 -0.0042 0.0052 1559 PHE 263 CD1 -0.0122 -0.0043 0.0058 1560 PHE 263 CD2 -0.0108 -0.0022 0.0047 1561 PHE 263 CE1 -0.0117 -0.0025 0.0058 1562 PHE 263 CE2 -0.0103 -0.0004 0.0048 1563 PHE 263 CZ -0.0108 -0.0006 0.0053 1564 GLU 264 N -0.0094 -0.0071 0.0010 1565 GLU 264 CA -0.0078 -0.0062 -0.0007 1566 GLU 264 C -0.0070 -0.0080 -0.0023 1567 GLU 264 O -0.0060 -0.0074 -0.0034 1568 GLU 264 CB -0.0073 -0.0055 -0.0011 1569 GLU 264 CG -0.0078 -0.0036 0.0003 1570 GLU 264 CD -0.0065 -0.0018 -0.0006 1571 GLU 264 OE1 -0.0054 -0.0023 -0.0023 1572 GLU 264 OE2 -0.0067 0.0001 0.0003 1573 ARG 265 N -0.0075 -0.0100 -0.0025 1574 ARG 265 CA -0.0068 -0.0117 -0.0041 1575 ARG 265 C -0.0068 -0.0123 -0.0043 1576 ARG 265 O -0.0057 -0.0129 -0.0059 1577 ARG 265 CB -0.0074 -0.0137 -0.0040 1578 ARG 265 CG -0.0067 -0.0156 -0.0056 1579 ARG 265 CD -0.0053 -0.0152 -0.0073 1580 ARG 265 NE -0.0046 -0.0169 -0.0089 1581 ARG 265 CZ -0.0040 -0.0172 -0.0098 1582 ARG 265 NH1 -0.0041 -0.0159 -0.0092 1583 ARG 265 NH2 -0.0034 -0.0188 -0.0112 1584 SER 266 N -0.0087 -0.0144 -0.0035 1585 SER 266 CA -0.0085 -0.0143 -0.0037 1586 SER 266 C -0.0075 -0.0119 -0.0042 1587 SER 266 O -0.0073 -0.0116 -0.0043 1588 SER 266 CB -0.0098 -0.0150 -0.0015 1589 SER 266 OG -0.0100 -0.0131 0.0003 1590 GLY 267 N -0.0067 -0.0102 -0.0045 1591 GLY 267 CA -0.0057 -0.0078 -0.0048 1592 GLY 267 C -0.0062 -0.0064 -0.0027 1593 GLY 267 O -0.0056 -0.0051 -0.0029 1594 HIS 268 N -0.0073 -0.0068 -0.0006 1595 HIS 268 CA -0.0079 -0.0056 0.0016 1596 HIS 268 C -0.0085 -0.0065 0.0022 1597 HIS 268 O -0.0089 -0.0054 0.0039 1598 HIS 268 CB -0.0071 -0.0029 0.0018 1599 HIS 268 CG -0.0065 -0.0018 0.0015 1600 HIS 268 CD2 -0.0067 -0.0029 0.0011 1601 HIS 268 ND1 -0.0057 0.0006 0.0016 1602 HIS 268 CE1 -0.0054 0.0010 0.0013 1603 HIS 268 NE2 -0.0060 -0.0011 0.0010 1604 GLN 269 N -0.0072 -0.0057 0.0008 1605 GLN 269 CA -0.0075 -0.0062 0.0012 1606 GLN 269 C -0.0080 -0.0067 0.0018 1607 GLN 269 O -0.0085 -0.0070 0.0024 1608 GLN 269 CB -0.0071 -0.0069 0.0008 1609 GLN 269 CG -0.0067 -0.0065 0.0004 1610 GLN 269 CD -0.0063 -0.0072 0.0001 1611 GLN 269 NE2 -0.0066 -0.0075 0.0004 1612 GLN 269 OE1 -0.0057 -0.0075 -0.0005 1613 LEU 270 N -0.0080 -0.0068 0.0018 1614 LEU 270 CA -0.0084 -0.0072 0.0024 1615 LEU 270 C -0.0084 -0.0069 0.0023 1616 LEU 270 O -0.0080 -0.0065 0.0018 1617 LEU 270 CB -0.0083 -0.0083 0.0024 1618 LEU 270 CG -0.0077 -0.0088 0.0019 1619 LEU 270 CD1 -0.0077 -0.0090 0.0019 1620 LEU 270 CD2 -0.0076 -0.0097 0.0018 1621 ILE 271 N -0.0089 -0.0071 0.0028 1622 ILE 271 CA -0.0089 -0.0070 0.0028 1623 ILE 271 C -0.0093 -0.0078 0.0033 1624 ILE 271 O -0.0097 -0.0081 0.0039 1625 ILE 271 CB -0.0092 -0.0061 0.0030 1626 ILE 271 CG1 -0.0092 -0.0059 0.0029 1627 ILE 271 CG2 -0.0100 -0.0059 0.0037 1628 ILE 271 CD1 -0.0094 -0.0049 0.0030 1629 VAL 272 N -0.0043 -0.0016 0.0028 1630 VAL 272 CA -0.0029 -0.0006 0.0024 1631 VAL 272 C -0.0023 -0.0009 0.0008 1632 VAL 272 O -0.0022 -0.0011 0.0002 1633 VAL 272 CB -0.0022 0.0004 0.0034 1634 VAL 272 CG1 -0.0008 0.0014 0.0030 1635 VAL 272 CG2 -0.0029 0.0007 0.0050 1636 VAL 273 N -0.0019 -0.0010 -0.0001 1637 VAL 273 CA -0.0013 -0.0013 -0.0017 1638 VAL 273 C 0.0000 -0.0004 -0.0021 1639 VAL 273 O 0.0005 0.0005 -0.0011 1640 VAL 273 CB -0.0022 -0.0024 -0.0026 1641 VAL 273 CG1 -0.0034 -0.0033 -0.0023 1642 VAL 273 CG2 -0.0025 -0.0025 -0.0022 1643 ASP 274 N 0.0005 -0.0007 -0.0035 1644 ASP 274 CA 0.0018 0.0001 -0.0041 1645 ASP 274 C 0.0028 0.0011 -0.0038 1646 ASP 274 O 0.0037 0.0021 -0.0033 1647 ASP 274 CB 0.0019 0.0005 -0.0034 1648 ASP 274 CG 0.0028 0.0007 -0.0045 1649 ASP 274 OD1 0.0032 0.0004 -0.0059 1650 ASP 274 OD2 0.0031 0.0012 -0.0040 1651 ILE 275 N 0.0031 0.0055 -0.0065 1652 ILE 275 CA 0.0043 0.0066 -0.0061 1653 ILE 275 C 0.0051 0.0075 -0.0074 1654 ILE 275 O 0.0048 0.0073 -0.0089 1655 ILE 275 CB 0.0042 0.0065 -0.0059 1656 ILE 275 CG1 0.0033 0.0055 -0.0046 1657 ILE 275 CG2 0.0053 0.0077 -0.0053 1658 ILE 275 CD1 0.0035 0.0057 -0.0030 1659 GLN 276 N 0.0061 0.0085 -0.0070 1660 GLN 276 CA 0.0068 0.0093 -0.0082 1661 GLN 276 C 0.0080 0.0104 -0.0073 1662 GLN 276 O 0.0081 0.0105 -0.0059 1663 GLN 276 CB 0.0064 0.0089 -0.0089 1664 GLN 276 CG 0.0062 0.0086 -0.0077 1665 GLN 276 CD 0.0055 0.0080 -0.0084 1666 GLN 276 NE2 0.0046 0.0070 -0.0076 1667 GLN 276 OE1 0.0058 0.0083 -0.0096 1668 GLY 277 N 0.0089 0.0114 -0.0083 1669 GLY 277 CA 0.0100 0.0125 -0.0077 1670 GLY 277 C 0.0109 0.0134 -0.0085 1671 GLY 277 O 0.0107 0.0134 -0.0100 1672 VAL 278 N 0.0085 0.0072 -0.0167 1673 VAL 278 CA 0.0086 0.0087 -0.0164 1674 VAL 278 C 0.0075 0.0084 -0.0137 1675 VAL 278 O 0.0069 0.0090 -0.0118 1676 VAL 278 CB 0.0092 0.0118 -0.0170 1677 VAL 278 CG1 0.0093 0.0133 -0.0169 1678 VAL 278 CG2 0.0102 0.0121 -0.0197 1679 GLY 279 N 0.0074 0.0074 -0.0135 1680 GLY 279 CA 0.0063 0.0067 -0.0109 1681 GLY 279 C 0.0056 0.0047 -0.0096 1682 GLY 279 O 0.0058 0.0026 -0.0108 1683 ASP 280 N 0.0048 0.0055 -0.0072 1684 ASP 280 CA 0.0041 0.0039 -0.0058 1685 ASP 280 C 0.0042 0.0054 -0.0055 1686 ASP 280 O 0.0034 0.0050 -0.0036 1687 ASP 280 CB 0.0030 0.0031 -0.0031 1688 ASP 280 CG 0.0029 0.0007 -0.0034 1689 ASP 280 OD1 0.0031 -0.0014 -0.0046 1690 ASP 280 OD2 0.0025 0.0011 -0.0023 1691 LEU 281 N 0.0067 0.0006 -0.0066 1692 LEU 281 CA 0.0068 0.0010 -0.0062 1693 LEU 281 C 0.0069 0.0015 -0.0057 1694 LEU 281 O 0.0074 0.0013 -0.0053 1695 LEU 281 CB 0.0073 0.0006 -0.0059 1696 LEU 281 CG 0.0072 0.0002 -0.0063 1697 LEU 281 CD1 0.0076 -0.0000 -0.0060 1698 LEU 281 CD2 0.0067 0.0005 -0.0067 1699 TYR 282 N 0.0066 0.0020 -0.0057 1700 TYR 282 CA 0.0066 0.0025 -0.0054 1701 TYR 282 C 0.0068 0.0029 -0.0048 1702 TYR 282 O 0.0067 0.0030 -0.0048 1703 TYR 282 CB 0.0061 0.0029 -0.0057 1704 TYR 282 CG 0.0058 0.0025 -0.0062 1705 TYR 282 CD1 0.0061 0.0019 -0.0063 1706 TYR 282 CD2 0.0053 0.0027 -0.0066 1707 TYR 282 CE1 0.0059 0.0016 -0.0067 1708 TYR 282 CE2 0.0051 0.0024 -0.0071 1709 TYR 282 CZ 0.0054 0.0018 -0.0072 1710 TYR 282 OH 0.0052 0.0015 -0.0077 1711 THR 283 N 0.0070 0.0031 -0.0044 1712 THR 283 CA 0.0072 0.0036 -0.0039 1713 THR 283 C 0.0072 0.0040 -0.0036 1714 THR 283 O 0.0072 0.0039 -0.0037 1715 THR 283 CB 0.0077 0.0032 -0.0035 1716 THR 283 CG2 0.0081 0.0029 -0.0033 1717 THR 283 OG1 0.0079 0.0037 -0.0030 1718 ASP 284 N 0.0068 -0.0003 -0.0000 1719 ASP 284 CA 0.0057 -0.0007 -0.0001 1720 ASP 284 C 0.0048 -0.0011 -0.0006 1721 ASP 284 O 0.0042 -0.0012 -0.0015 1722 ASP 284 CB 0.0058 -0.0006 -0.0009 1723 ASP 284 CG 0.0047 -0.0011 -0.0009 1724 ASP 284 OD1 0.0042 -0.0014 0.0000 1725 ASP 284 OD2 0.0045 -0.0011 -0.0018 1726 PRO 285 N 0.0046 -0.0012 -0.0000 1727 PRO 285 CA 0.0036 -0.0016 -0.0004 1728 PRO 285 C 0.0025 -0.0021 0.0001 1729 PRO 285 O 0.0025 -0.0022 0.0008 1730 PRO 285 CB 0.0039 -0.0015 0.0002 1731 PRO 285 CG 0.0050 -0.0011 0.0009 1732 PRO 285 CD 0.0052 -0.0011 0.0011 1733 GLN 286 N 0.0016 -0.0025 -0.0004 1734 GLN 286 CA 0.0005 -0.0030 0.0001 1735 GLN 286 C -0.0001 -0.0033 0.0004 1736 GLN 286 O 0.0000 -0.0032 -0.0002 1737 GLN 286 CB -0.0003 -0.0032 -0.0009 1738 GLN 286 CG -0.0014 -0.0038 -0.0004 1739 GLN 286 CD -0.0013 -0.0038 0.0007 1740 GLN 286 NE2 -0.0008 -0.0036 0.0005 1741 GLN 286 OE1 -0.0016 -0.0041 0.0017 1742 ILE 287 N -0.0031 -0.0052 0.0034 1743 ILE 287 CA -0.0027 -0.0048 0.0028 1744 ILE 287 C -0.0031 -0.0040 0.0031 1745 ILE 287 O -0.0035 -0.0043 0.0036 1746 ILE 287 CB -0.0023 -0.0054 0.0024 1747 ILE 287 CG1 -0.0019 -0.0061 0.0022 1748 ILE 287 CG2 -0.0019 -0.0049 0.0018 1749 ILE 287 CD1 -0.0015 -0.0069 0.0018 1750 HIS 288 N -0.0030 -0.0032 0.0028 1751 HIS 288 CA -0.0032 -0.0025 0.0029 1752 HIS 288 C -0.0028 -0.0024 0.0023 1753 HIS 288 O -0.0023 -0.0023 0.0016 1754 HIS 288 CB -0.0035 -0.0016 0.0029 1755 HIS 288 CG -0.0040 -0.0016 0.0036 1756 HIS 288 CD2 -0.0040 -0.0014 0.0036 1757 HIS 288 ND1 -0.0045 -0.0019 0.0043 1758 HIS 288 CE1 -0.0048 -0.0019 0.0047 1759 HIS 288 NE2 -0.0046 -0.0015 0.0043 1760 THR 289 N -0.0029 -0.0024 0.0024 1761 THR 289 CA -0.0025 -0.0023 0.0019 1762 THR 289 C -0.0027 -0.0014 0.0019 1763 THR 289 O -0.0032 -0.0011 0.0025 1764 THR 289 CB -0.0023 -0.0031 0.0019 1765 THR 289 CG2 -0.0022 -0.0040 0.0020 1766 THR 289 OG1 -0.0028 -0.0032 0.0026 1767 GLU 290 N -0.0020 -0.0014 0.0028 1768 GLU 290 CA -0.0012 0.0001 0.0027 1769 GLU 290 C -0.0014 0.0001 0.0031 1770 GLU 290 O -0.0013 0.0013 0.0039 1771 GLU 290 CB -0.0001 0.0003 0.0011 1772 GLU 290 CG 0.0007 0.0012 0.0006 1773 GLU 290 CD 0.0017 0.0014 -0.0009 1774 GLU 290 OE1 0.0018 0.0004 -0.0018 1775 GLU 290 OE2 0.0025 0.0027 -0.0011 1776 THR 291 N -0.0017 -0.0011 0.0025 1777 THR 291 CA -0.0019 -0.0012 0.0028 1778 THR 291 C -0.0029 -0.0014 0.0043 1779 THR 291 O -0.0030 -0.0007 0.0050 1780 THR 291 CB -0.0018 -0.0024 0.0017 1781 THR 291 CG2 -0.0009 -0.0025 0.0002 1782 THR 291 OG1 -0.0027 -0.0039 0.0020 1783 GLY 292 N -0.0037 -0.0023 0.0048 1784 GLY 292 CA -0.0048 -0.0026 0.0062 1785 GLY 292 C -0.0055 -0.0039 0.0063 1786 GLY 292 O -0.0063 -0.0042 0.0074 1787 THR 293 N -0.0072 -0.0112 0.0023 1788 THR 293 CA -0.0074 -0.0117 0.0028 1789 THR 293 C -0.0066 -0.0114 0.0030 1790 THR 293 O -0.0068 -0.0115 0.0030 1791 THR 293 CB -0.0075 -0.0126 0.0036 1792 THR 293 CG2 -0.0066 -0.0125 0.0043 1793 THR 293 OG1 -0.0079 -0.0131 0.0040 1794 ASP 294 N -0.0056 -0.0109 0.0032 1795 ASP 294 CA -0.0048 -0.0106 0.0035 1796 ASP 294 C -0.0047 -0.0097 0.0026 1797 ASP 294 O -0.0052 -0.0094 0.0018 1798 ASP 294 CB -0.0038 -0.0105 0.0041 1799 ASP 294 CG -0.0037 -0.0103 0.0039 1800 ASP 294 OD1 -0.0044 -0.0102 0.0033 1801 ASP 294 OD2 -0.0029 -0.0101 0.0044 1802 PHE 295 N -0.0039 -0.0094 0.0027 1803 PHE 295 CA -0.0036 -0.0085 0.0020 1804 PHE 295 C -0.0044 -0.0084 0.0012 1805 PHE 295 O -0.0044 -0.0077 0.0005 1806 PHE 295 CB -0.0032 -0.0079 0.0017 1807 PHE 295 CG -0.0023 -0.0079 0.0024 1808 PHE 295 CD1 -0.0016 -0.0080 0.0030 1809 PHE 295 CD2 -0.0022 -0.0079 0.0024 1810 PHE 295 CE1 -0.0008 -0.0080 0.0037 1811 PHE 295 CE2 -0.0014 -0.0079 0.0031 1812 PHE 295 CZ -0.0007 -0.0080 0.0037 1813 GLY 296 N -0.0052 -0.0153 -0.0006 1814 GLY 296 CA -0.0059 -0.0154 0.0081 1815 GLY 296 C -0.0066 -0.0085 0.0113 1816 GLY 296 O -0.0066 -0.0029 0.0070 1817 ASP 297 N -0.0072 -0.0090 0.0193 1818 ASP 297 CA -0.0079 -0.0028 0.0235 1819 ASP 297 C -0.0077 -0.0029 0.0209 1820 ASP 297 O -0.0082 0.0029 0.0225 1821 ASP 297 CB -0.0086 -0.0040 0.0328 1822 ASP 297 CG -0.0090 -0.0029 0.0360 1823 ASP 297 OD1 -0.0089 0.0010 0.0317 1824 ASP 297 OD2 -0.0093 -0.0060 0.0428 1825 GLY 298 N -0.0070 -0.0095 0.0169 1826 GLY 298 CA -0.0067 -0.0097 0.0138 1827 GLY 298 C -0.0065 -0.0044 0.0064 1828 GLY 298 O -0.0064 -0.0031 0.0041 1829 ASN 299 N -0.0066 -0.0026 0.0065 1830 ASN 299 CA -0.0057 -0.0016 0.0056 1831 ASN 299 C -0.0053 -0.0001 0.0064 1832 ASN 299 O -0.0052 0.0003 0.0066 1833 ASN 299 CB -0.0052 -0.0019 0.0042 1834 ASN 299 CG -0.0044 -0.0013 0.0030 1835 ASN 299 ND2 -0.0041 -0.0018 0.0017 1836 ASN 299 OD1 -0.0041 -0.0004 0.0033 1837 LEU 300 N -0.0051 0.0007 0.0069 1838 LEU 300 CA -0.0047 0.0021 0.0076 1839 LEU 300 C -0.0037 0.0031 0.0066 1840 LEU 300 O -0.0033 0.0044 0.0071 1841 LEU 300 CB -0.0051 0.0024 0.0089 1842 LEU 300 CG -0.0060 0.0018 0.0101 1843 LEU 300 CD1 -0.0063 0.0024 0.0114 1844 LEU 300 CD2 -0.0061 0.0019 0.0105 1845 GLY 301 N -0.0034 0.0026 0.0052 1846 GLY 301 CA -0.0024 0.0035 0.0041 1847 GLY 301 C -0.0021 0.0042 0.0043 1848 GLY 301 O -0.0026 0.0037 0.0047 1849 VAL 302 N -0.0007 0.0111 0.0051 1850 VAL 302 CA -0.0012 0.0100 0.0050 1851 VAL 302 C 0.0000 0.0087 0.0068 1852 VAL 302 O -0.0004 0.0072 0.0069 1853 VAL 302 CB -0.0015 0.0117 0.0040 1854 VAL 302 CG1 -0.0029 0.0126 0.0021 1855 VAL 302 CG2 0.0000 0.0136 0.0050 1856 ARG 303 N 0.0015 0.0093 0.0083 1857 ARG 303 CA 0.0027 0.0080 0.0100 1858 ARG 303 C 0.0021 0.0056 0.0103 1859 ARG 303 O 0.0023 0.0039 0.0111 1860 ARG 303 CB 0.0044 0.0092 0.0114 1861 ARG 303 CG 0.0052 0.0115 0.0115 1862 ARG 303 CD 0.0067 0.0127 0.0128 1863 ARG 303 NE 0.0064 0.0134 0.0121 1864 ARG 303 CZ 0.0070 0.0127 0.0130 1865 ARG 303 NH1 0.0079 0.0113 0.0146 1866 ARG 303 NH2 0.0066 0.0135 0.0123 1867 GLY 304 N 0.0012 0.0053 0.0094 1868 GLY 304 CA 0.0005 0.0030 0.0095 1869 GLY 304 C -0.0009 0.0016 0.0085 1870 GLY 304 O -0.0010 -0.0004 0.0091 1871 MET 305 N -0.0009 0.0042 0.0055 1872 MET 305 CA -0.0013 0.0038 0.0057 1873 MET 305 C -0.0011 0.0033 0.0058 1874 MET 305 O -0.0013 0.0029 0.0060 1875 MET 305 CB -0.0017 0.0040 0.0058 1876 MET 305 CG -0.0018 0.0045 0.0057 1877 MET 305 SD -0.0022 0.0047 0.0058 1878 MET 305 CE -0.0025 0.0053 0.0057 1879 ALA 306 N -0.0007 0.0032 0.0057 1880 ALA 306 CA -0.0004 0.0026 0.0058 1881 ALA 306 C -0.0002 0.0025 0.0058 1882 ALA 306 O -0.0003 0.0020 0.0059 1883 ALA 306 CB -0.0000 0.0026 0.0057 1884 LEU 307 N 0.0000 0.0028 0.0056 1885 LEU 307 CA 0.0003 0.0027 0.0056 1886 LEU 307 C -0.0002 0.0026 0.0057 1887 LEU 307 O -0.0001 0.0022 0.0058 1888 LEU 307 CB 0.0006 0.0031 0.0053 1889 LEU 307 CG 0.0011 0.0031 0.0051 1890 LEU 307 CD1 0.0013 0.0036 0.0049 1891 LEU 307 CD2 0.0014 0.0027 0.0051 1892 PHE 308 N -0.0002 0.0059 0.0007 1893 PHE 308 CA -0.0012 0.0058 0.0012 1894 PHE 308 C -0.0020 0.0040 0.0016 1895 PHE 308 O -0.0019 0.0031 0.0016 1896 PHE 308 CB -0.0025 0.0072 0.0017 1897 PHE 308 CG -0.0037 0.0070 0.0023 1898 PHE 308 CD1 -0.0034 0.0075 0.0022 1899 PHE 308 CD2 -0.0051 0.0063 0.0031 1900 PHE 308 CE1 -0.0045 0.0072 0.0027 1901 PHE 308 CE2 -0.0062 0.0060 0.0036 1902 PHE 308 CZ -0.0059 0.0065 0.0035 1903 PHE 309 N -0.0027 0.0035 0.0020 1904 PHE 309 CA -0.0036 0.0019 0.0026 1905 PHE 309 C -0.0026 0.0003 0.0021 1906 PHE 309 O -0.0032 -0.0011 0.0025 1907 PHE 309 CB -0.0047 0.0018 0.0031 1908 PHE 309 CG -0.0061 0.0030 0.0037 1909 PHE 309 CD1 -0.0072 0.0028 0.0043 1910 PHE 309 CD2 -0.0063 0.0045 0.0038 1911 PHE 309 CE1 -0.0085 0.0039 0.0049 1912 PHE 309 CE2 -0.0076 0.0056 0.0043 1913 PHE 309 CZ -0.0087 0.0053 0.0049 1914 TYR 310 N -0.0011 0.0003 0.0014 1915 TYR 310 CA -0.0001 -0.0012 0.0009 1916 TYR 310 C -0.0000 -0.0017 0.0009 1917 TYR 310 O -0.0001 -0.0033 0.0010 1918 TYR 310 CB 0.0016 -0.0008 0.0001 1919 TYR 310 CG 0.0027 -0.0024 -0.0004 1920 TYR 310 CD1 0.0026 -0.0038 -0.0002 1921 TYR 310 CD2 0.0038 -0.0024 -0.0009 1922 TYR 310 CE1 0.0036 -0.0052 -0.0007 1923 TYR 310 CE2 0.0048 -0.0038 -0.0014 1924 TYR 310 CZ 0.0047 -0.0052 -0.0012 1925 TYR 310 OH 0.0057 -0.0066 -0.0017 1926 SER 311 N -0.0030 0.0089 0.0019 1927 SER 311 CA -0.0031 0.0081 0.0021 1928 SER 311 C -0.0049 0.0080 0.0025 1929 SER 311 O -0.0052 0.0072 0.0028 1930 SER 311 CB -0.0022 0.0091 0.0016 1931 SER 311 OG -0.0006 0.0094 0.0012 1932 HIS 312 N -0.0062 0.0088 0.0025 1933 HIS 312 CA -0.0079 0.0089 0.0028 1934 HIS 312 C -0.0087 0.0073 0.0035 1935 HIS 312 O -0.0086 0.0066 0.0037 1936 HIS 312 CB -0.0089 0.0102 0.0026 1937 HIS 312 CG -0.0107 0.0103 0.0030 1938 HIS 312 CD2 -0.0121 0.0100 0.0033 1939 HIS 312 ND1 -0.0112 0.0107 0.0030 1940 HIS 312 CE1 -0.0129 0.0106 0.0033 1941 HIS 312 NE2 -0.0134 0.0102 0.0035 1942 ALA 313 N -0.0094 0.0067 0.0038 1943 ALA 313 CA -0.0104 0.0053 0.0045 1944 ALA 313 C -0.0122 0.0059 0.0047 1945 ALA 313 O -0.0126 0.0066 0.0045 1946 ALA 313 CB -0.0099 0.0040 0.0048 1947 CYS 314 N -0.0191 0.0097 0.0013 1948 CYS 314 CA -0.0198 0.0102 0.0020 1949 CYS 314 C -0.0195 0.0096 0.0015 1950 CYS 314 O -0.0195 0.0086 0.0007 1951 CYS 314 CB -0.0213 0.0099 0.0024 1952 CYS 314 SG -0.0219 0.0110 0.0034 1953 ASN 315 N -0.0192 0.0104 0.0019 1954 ASN 315 CA -0.0188 0.0101 0.0015 1955 ASN 315 C -0.0198 0.0102 0.0020 1956 ASN 315 O -0.0209 0.0104 0.0026 1957 ASN 315 CB -0.0173 0.0109 0.0014 1958 ASN 315 CG -0.0173 0.0122 0.0023 1959 ASN 315 ND2 -0.0163 0.0128 0.0023 1960 ASN 315 OD1 -0.0180 0.0127 0.0029 1961 ARG 316 N -0.0195 0.0101 0.0018 1962 ARG 316 CA -0.0204 0.0102 0.0022 1963 ARG 316 C -0.0208 0.0114 0.0032 1964 ARG 316 O -0.0218 0.0116 0.0038 1965 ARG 316 CB -0.0199 0.0098 0.0018 1966 ARG 316 CG -0.0186 0.0106 0.0018 1967 ARG 316 CD -0.0181 0.0101 0.0012 1968 ARG 316 NE -0.0178 0.0089 0.0003 1969 ARG 316 CZ -0.0166 0.0087 -0.0004 1970 ARG 316 NH1 -0.0156 0.0095 -0.0003 1971 ARG 316 NH2 -0.0165 0.0075 -0.0012 1972 ILE 317 N -0.0159 0.0083 0.0038 1973 ILE 317 CA -0.0151 0.0066 0.0047 1974 ILE 317 C -0.0158 0.0065 0.0051 1975 ILE 317 O -0.0147 0.0058 0.0050 1976 ILE 317 CB -0.0155 0.0051 0.0060 1977 ILE 317 CG1 -0.0147 0.0052 0.0055 1978 ILE 317 CG2 -0.0145 0.0033 0.0069 1979 ILE 317 CD1 -0.0150 0.0037 0.0068 1980 CYS 318 N -0.0178 0.0072 0.0056 1981 CYS 318 CA -0.0186 0.0074 0.0059 1982 CYS 318 C -0.0175 0.0083 0.0046 1983 CYS 318 O -0.0170 0.0077 0.0047 1984 CYS 318 CB -0.0208 0.0083 0.0063 1985 CYS 318 SG -0.0224 0.0073 0.0079 1986 GLU 319 N -0.0172 0.0098 0.0033 1987 GLU 319 CA -0.0161 0.0108 0.0020 1988 GLU 319 C -0.0140 0.0098 0.0017 1989 GLU 319 O -0.0132 0.0098 0.0013 1990 GLU 319 CB -0.0163 0.0126 0.0007 1991 GLU 319 CG -0.0181 0.0140 0.0006 1992 GLU 319 CD -0.0189 0.0152 0.0001 1993 GLU 319 OE1 -0.0177 0.0157 -0.0009 1994 GLU 319 OE2 -0.0207 0.0155 0.0008 1995 SER 320 N -0.0113 0.0081 0.0014 1996 SER 320 CA -0.0088 0.0064 0.0004 1997 SER 320 C -0.0081 0.0042 0.0005 1998 SER 320 O -0.0058 0.0033 -0.0007 1999 SER 320 CB -0.0089 0.0051 0.0007 2000 SER 320 OG -0.0103 0.0027 0.0022 2001 MET 321 N -0.0099 0.0031 0.0019 2002 MET 321 CA -0.0094 0.0011 0.0021 2003 MET 321 C -0.0094 0.0026 0.0017 2004 MET 321 O -0.0092 0.0011 0.0019 2005 MET 321 CB -0.0113 -0.0011 0.0038 2006 MET 321 CG -0.0106 -0.0034 0.0039 2007 MET 321 SD -0.0126 -0.0061 0.0059 2008 MET 321 CE -0.0118 -0.0077 0.0058 2009 GLY 322 N -0.0097 0.0054 0.0011 2010 GLY 322 CA -0.0096 0.0070 0.0007 2011 GLY 322 C -0.0119 0.0069 0.0021 2012 GLY 322 O -0.0116 0.0070 0.0019 2013 LEU 323 N -0.0126 0.0023 0.0012 2014 LEU 323 CA -0.0127 0.0024 0.0014 2015 LEU 323 C -0.0123 0.0034 0.0021 2016 LEU 323 O -0.0126 0.0038 0.0028 2017 LEU 323 CB -0.0137 0.0019 0.0017 2018 LEU 323 CG -0.0143 0.0009 0.0011 2019 LEU 323 CD1 -0.0152 0.0005 0.0015 2020 LEU 323 CD2 -0.0136 0.0005 0.0002 2021 ALA 324 N -0.0116 0.0037 0.0019 2022 ALA 324 CA -0.0112 0.0046 0.0025 2023 ALA 324 C -0.0119 0.0047 0.0032 2024 ALA 324 O -0.0123 0.0042 0.0030 2025 ALA 324 CB -0.0102 0.0049 0.0020 2026 PRO 325 N -0.0120 0.0055 0.0040 2027 PRO 325 CA -0.0127 0.0056 0.0048 2028 PRO 325 C -0.0122 0.0058 0.0047 2029 PRO 325 O -0.0114 0.0063 0.0044 2030 PRO 325 CB -0.0127 0.0064 0.0056 2031 PRO 325 CG -0.0118 0.0068 0.0054 2032 PRO 325 CD -0.0115 0.0062 0.0044 2033 PHE 326 N -0.0010 0.0056 0.0056 2034 PHE 326 CA -0.0008 0.0053 0.0053 2035 PHE 326 C -0.0007 0.0044 0.0050 2036 PHE 326 O -0.0005 0.0042 0.0048 2037 PHE 326 CB -0.0003 0.0058 0.0047 2038 PHE 326 CG -0.0001 0.0056 0.0044 2039 PHE 326 CD1 -0.0002 0.0059 0.0047 2040 PHE 326 CD2 0.0003 0.0050 0.0039 2041 PHE 326 CE1 -0.0000 0.0057 0.0044 2042 PHE 326 CE2 0.0005 0.0048 0.0036 2043 PHE 326 CZ 0.0004 0.0051 0.0039 2044 ASP 327 N -0.0008 0.0038 0.0051 2045 ASP 327 CA -0.0007 0.0029 0.0049 2046 ASP 327 C -0.0001 0.0028 0.0041 2047 ASP 327 O 0.0001 0.0027 0.0039 2048 ASP 327 CB -0.0011 0.0024 0.0052 2049 ASP 327 CG -0.0017 0.0025 0.0059 2050 ASP 327 OD1 -0.0018 0.0031 0.0062 2051 ASP 327 OD2 -0.0020 0.0020 0.0063 2052 LEU 328 N 0.0001 0.0026 0.0038 2053 LEU 328 CA 0.0007 0.0024 0.0031 2054 LEU 328 C 0.0007 0.0015 0.0030 2055 LEU 328 O 0.0003 0.0011 0.0034 2056 LEU 328 CB 0.0010 0.0029 0.0028 2057 LEU 328 CG 0.0011 0.0039 0.0028 2058 LEU 328 CD1 0.0014 0.0043 0.0025 2059 LEU 328 CD2 0.0014 0.0041 0.0025 2060 SER 329 N 0.0044 0.0035 -0.0003 2061 SER 329 CA 0.0056 -0.0043 -0.0016 2062 SER 329 C 0.0056 -0.0037 -0.0017 2063 SER 329 O 0.0053 0.0028 -0.0019 2064 SER 329 CB 0.0094 -0.0073 -0.0088 2065 SER 329 OG 0.0120 -0.0044 -0.0145 2066 PRO 330 N 0.0060 -0.0106 -0.0014 2067 PRO 330 CA 0.0062 -0.0102 -0.0020 2068 PRO 330 C 0.0093 -0.0061 -0.0089 2069 PRO 330 O 0.0088 -0.0010 -0.0086 2070 PRO 330 CB 0.0066 -0.0191 -0.0015 2071 PRO 330 CG 0.0048 -0.0230 0.0028 2072 PRO 330 CD 0.0055 -0.0186 0.0007 2073 ARG 331 N 0.0125 -0.0083 -0.0151 2074 ARG 331 CA 0.0156 -0.0045 -0.0219 2075 ARG 331 C 0.0151 0.0044 -0.0221 2076 ARG 331 O 0.0159 0.0092 -0.0244 2077 ARG 331 CB 0.0190 -0.0086 -0.0282 2078 ARG 331 CG 0.0203 -0.0169 -0.0296 2079 ARG 331 CD 0.0240 -0.0199 -0.0369 2080 ARG 331 NE 0.0264 -0.0137 -0.0425 2081 ARG 331 CZ 0.0295 -0.0143 -0.0488 2082 ARG 331 NH1 0.0308 -0.0208 -0.0505 2083 ARG 331 NH2 0.0314 -0.0083 -0.0536 2084 GLU 332 N 0.0108 0.0005 -0.0069 2085 GLU 332 CA 0.0093 0.0034 -0.0077 2086 GLU 332 C 0.0067 0.0040 -0.0059 2087 GLU 332 O 0.0057 0.0058 -0.0064 2088 GLU 332 CB 0.0090 0.0050 -0.0086 2089 GLU 332 CG 0.0115 0.0050 -0.0107 2090 GLU 332 CD 0.0114 0.0056 -0.0110 2091 GLU 332 OE1 0.0094 0.0056 -0.0093 2092 GLU 332 OE2 0.0132 0.0060 -0.0128 2093 ARG 333 N 0.0054 0.0024 -0.0037 2094 ARG 333 CA 0.0029 0.0027 -0.0018 2095 ARG 333 C 0.0031 0.0021 -0.0015 2096 ARG 333 O 0.0015 0.0037 -0.0013 2097 ARG 333 CB 0.0019 0.0007 0.0005 2098 ARG 333 CG -0.0009 0.0012 0.0025 2099 ARG 333 CD -0.0027 0.0033 0.0025 2100 ARG 333 NE -0.0040 0.0059 0.0018 2101 ARG 333 CZ -0.0051 0.0083 0.0011 2102 ARG 333 NH1 -0.0051 0.0083 0.0010 2103 ARG 333 NH2 -0.0063 0.0106 0.0004 2104 ASP 334 N 0.0050 -0.0001 -0.0016 2105 ASP 334 CA 0.0053 -0.0008 -0.0014 2106 ASP 334 C 0.0060 0.0013 -0.0034 2107 ASP 334 O 0.0050 0.0021 -0.0031 2108 ASP 334 CB 0.0074 -0.0037 -0.0011 2109 ASP 334 CG 0.0066 -0.0060 0.0012 2110 ASP 334 OD1 0.0043 -0.0059 0.0030 2111 ASP 334 OD2 0.0081 -0.0079 0.0012 2112 ALA 335 N 0.0062 -0.0024 -0.0020 2113 ALA 335 CA 0.0060 -0.0009 -0.0039 2114 ALA 335 C 0.0017 0.0008 -0.0053 2115 ALA 335 O 0.0001 0.0012 -0.0055 2116 ALA 335 CB 0.0095 0.0007 -0.0068 2117 VAL 336 N -0.0001 0.0018 -0.0062 2118 VAL 336 CA -0.0042 0.0035 -0.0076 2119 VAL 336 C -0.0077 0.0020 -0.0048 2120 VAL 336 O -0.0106 0.0028 -0.0053 2121 VAL 336 CB -0.0050 0.0051 -0.0094 2122 VAL 336 CG1 -0.0097 0.0060 -0.0096 2123 VAL 336 CG2 -0.0027 0.0074 -0.0130 2124 ASN 337 N -0.0074 -0.0004 -0.0018 2125 ASN 337 CA -0.0105 -0.0021 0.0011 2126 ASN 337 C -0.0100 -0.0031 0.0023 2127 ASN 337 O -0.0130 -0.0038 0.0038 2128 ASN 337 CB -0.0103 -0.0043 0.0040 2129 ASN 337 CG -0.0113 -0.0034 0.0030 2130 ASN 337 ND2 -0.0097 -0.0050 0.0047 2131 ASN 337 OD1 -0.0136 -0.0013 0.0007 2132 GLN 338 N -0.0139 -0.0061 0.0093 2133 GLN 338 CA -0.0149 -0.0078 0.0134 2134 GLN 338 C -0.0177 -0.0097 0.0123 2135 GLN 338 O -0.0197 -0.0118 0.0154 2136 GLN 338 CB -0.0112 -0.0057 0.0163 2137 GLN 338 CG -0.0118 -0.0072 0.0212 2138 GLN 338 CD -0.0091 -0.0055 0.0231 2139 GLN 338 NE2 -0.0102 -0.0071 0.0262 2140 GLN 338 OE1 -0.0059 -0.0029 0.0216 2141 ASN 339 N -0.0180 -0.0090 0.0081 2142 ASN 339 CA -0.0205 -0.0105 0.0067 2143 ASN 339 C -0.0193 -0.0103 0.0099 2144 ASN 339 O -0.0164 -0.0081 0.0094 2145 ASN 339 CB -0.0247 -0.0137 0.0068 2146 ASN 339 CG -0.0264 -0.0140 0.0027 2147 ASN 339 ND2 -0.0300 -0.0164 0.0010 2148 ASN 339 OD1 -0.0245 -0.0122 0.0009 2149 GLN 344 N 0.0166 0.0025 0.0155 2150 GLN 344 CA 0.0139 0.0021 0.0100 2151 GLN 344 C 0.0140 -0.0030 0.0087 2152 GLN 344 O 0.0161 -0.0066 0.0120 2153 GLN 344 CB 0.0123 0.0016 0.0066 2154 GLN 344 CG 0.0132 -0.0041 0.0069 2155 GLN 344 CD 0.0117 -0.0044 0.0038 2156 GLN 344 NE2 0.0122 -0.0094 0.0036 2157 GLN 344 OE1 0.0101 -0.0001 0.0017 2158 SER 345 N 0.0116 -0.0034 0.0040 2159 SER 345 CA 0.0114 -0.0081 0.0023 2160 SER 345 C 0.0084 -0.0077 -0.0035 2161 SER 345 O 0.0067 -0.0035 -0.0059 2162 SER 345 CB 0.0128 -0.0078 0.0053 2163 SER 345 OG 0.0116 -0.0030 0.0039 2164 ALA 346 N 0.0079 -0.0123 -0.0059 2165 ALA 346 CA 0.0052 -0.0124 -0.0112 2166 ALA 346 C 0.0048 -0.0091 -0.0112 2167 ALA 346 O 0.0054 -0.0116 -0.0106 2168 ALA 346 CB 0.0048 -0.0186 -0.0135 2169 LYS 347 N -0.0085 0.0027 0.0032 2170 LYS 347 CA -0.0089 0.0065 0.0040 2171 LYS 347 C -0.0117 0.0069 0.0020 2172 LYS 347 O -0.0128 0.0039 0.0002 2173 LYS 347 CB -0.0095 0.0098 0.0046 2174 LYS 347 CG -0.0067 0.0095 0.0068 2175 LYS 347 CD -0.0067 0.0133 0.0080 2176 LYS 347 CE -0.0088 0.0135 0.0064 2177 ILE 349 N -0.0011 -0.0044 -0.0002 2178 ILE 349 CA -0.0009 -0.0036 -0.0041 2179 ILE 349 C -0.0005 -0.0041 -0.0025 2180 ILE 349 O 0.0020 -0.0059 0.0005 2181 ILE 349 CB 0.0031 -0.0044 -0.0077 2182 ILE 349 CG1 0.0019 -0.0033 -0.0106 2183 ILE 349 CG2 0.0046 -0.0043 -0.0108 2184 ILE 349 CD1 0.0059 -0.0045 -0.0125 2185 LEU 350 N -0.0030 -0.0026 -0.0046 2186 LEU 350 CA -0.0029 -0.0029 -0.0035 2187 LEU 350 C 0.0015 -0.0043 -0.0053 2188 LEU 350 O 0.0042 -0.0048 -0.0081 2189 LEU 350 CB -0.0068 -0.0008 -0.0055 2190 LEU 350 CG -0.0115 0.0007 -0.0037 2191 LEU 350 CD1 -0.0150 0.0027 -0.0060 2192 LEU 350 CD2 -0.0122 -0.0003 0.0016 2193 ARG 351 N 0.0022 -0.0050 -0.0037 2194 ARG 351 CA 0.0063 -0.0064 -0.0051 2195 ARG 351 C 0.0054 -0.0055 -0.0071 2196 ARG 351 O 0.0082 -0.0060 -0.0099 2197 ARG 351 CB 0.0091 -0.0085 -0.0009 2198 ARG 351 CG 0.0098 -0.0094 0.0017 2199 ARG 351 CD 0.0139 -0.0117 0.0044 2200 ARG 351 NE 0.0138 -0.0124 0.0076 2201 ARG 351 CZ 0.0133 -0.0133 0.0123 2202 ARG 351 NH1 0.0128 -0.0135 0.0144 2203 ARG 351 NH2 0.0133 -0.0138 0.0148 2204 GLY 352 N 0.0034 -0.0052 -0.0058 2205 GLY 352 CA 0.0043 -0.0045 -0.0071 2206 GLY 352 C 0.0049 -0.0062 -0.0059 2207 GLY 352 O 0.0053 -0.0056 -0.0067 2208 THR 353 N 0.0050 -0.0083 -0.0038 2209 THR 353 CA 0.0056 -0.0101 -0.0025 2210 THR 353 C 0.0031 -0.0100 -0.0008 2211 THR 353 O 0.0034 -0.0113 0.0003 2212 THR 353 CB 0.0071 -0.0126 -0.0011 2213 THR 353 CG2 0.0098 -0.0129 -0.0027 2214 THR 353 OG1 0.0054 -0.0129 0.0004 2215 GLU 354 N 0.0007 -0.0085 -0.0006 2216 GLU 354 CA -0.0018 -0.0084 0.0011 2217 GLU 354 C -0.0020 -0.0079 0.0008 2218 GLU 354 O -0.0015 -0.0063 -0.0012 2219 GLU 354 CB -0.0042 -0.0066 0.0011 2220 GLU 354 CG -0.0045 -0.0073 0.0019 2221 GLU 354 CD -0.0030 -0.0064 0.0000 2222 GLU 354 OE1 -0.0036 -0.0042 -0.0017 2223 GLU 354 OE2 -0.0014 -0.0078 0.0002 2224 GLU 355 N -0.0020 -0.0074 -0.0027 2225 GLU 355 CA 0.0015 -0.0079 -0.0043 2226 GLU 355 C -0.0000 -0.0064 -0.0034 2227 GLU 355 O -0.0040 -0.0064 -0.0016 2228 GLU 355 CB 0.0028 -0.0131 -0.0059 2229 GLU 355 CG 0.0036 -0.0153 -0.0067 2230 GLU 355 CD 0.0076 -0.0183 -0.0091 2231 GLU 355 OE1 0.0112 -0.0165 -0.0103 2232 GLU 355 OE2 0.0071 -0.0224 -0.0097 2233 LYS 356 N 0.0032 -0.0051 -0.0046 2234 LYS 356 CA 0.0023 -0.0034 -0.0038 2235 LYS 356 C 0.0007 -0.0075 -0.0039 2236 LYS 356 O 0.0026 -0.0113 -0.0055 2237 LYS 356 CB 0.0064 -0.0007 -0.0051 2238 LYS 356 CG 0.0055 0.0019 -0.0042 2239 LYS 356 CD 0.0098 0.0039 -0.0057 2240 LYS 356 CE 0.0122 0.0001 -0.0076 2241 LYS 356 NZ 0.0164 0.0021 -0.0090 2242 CYS 357 N -0.0028 -0.0068 -0.0022 2243 CYS 357 CA -0.0045 -0.0104 -0.0021 2244 CYS 357 C -0.0010 -0.0113 -0.0039 2245 CYS 357 O 0.0003 -0.0081 -0.0038 2246 CYS 357 CB -0.0087 -0.0087 0.0001 2247 CYS 357 SG -0.0111 -0.0127 0.0004 2248 GLY 358 N -0.0019 -0.0115 -0.0060 2249 GLY 358 CA 0.0030 -0.0109 -0.0110 2250 GLY 358 C 0.0150 -0.0109 -0.0226 2251 GLY 358 O 0.0184 -0.0012 -0.0287 2252 LEU 496 N 0.0064 -0.0148 -0.0203 2253 LEU 496 CA 0.0034 -0.0158 -0.0171 2254 LEU 496 C 0.0017 -0.0134 -0.0143 2255 LEU 496 O 0.0004 -0.0113 -0.0120 2256 LEU 496 CB 0.0020 -0.0205 -0.0173 2257 LEU 496 CG 0.0001 -0.0227 -0.0158 2258 LEU 496 CD1 0.0016 -0.0225 -0.0176 2259 LEU 496 CD2 -0.0012 -0.0272 -0.0159 2260 PRO 497 N 0.0018 -0.0136 -0.0146 2261 PRO 497 CA 0.0002 -0.0114 -0.0118 2262 PRO 497 C 0.0011 -0.0068 -0.0112 2263 PRO 497 O 0.0036 -0.0049 -0.0134 2264 PRO 497 CB 0.0008 -0.0124 -0.0130 2265 PRO 497 CG 0.0035 -0.0136 -0.0166 2266 PRO 497 CD 0.0034 -0.0158 -0.0172 2267 ARG 498 N -0.0010 -0.0050 -0.0080 2268 ARG 498 CA -0.0006 -0.0006 -0.0069 2269 ARG 498 C -0.0021 0.0013 -0.0045 2270 ARG 498 O -0.0045 -0.0005 -0.0024 2271 ARG 498 CB -0.0018 0.0001 -0.0053 2272 ARG 498 CG 0.0004 0.0010 -0.0075 2273 ARG 498 CD -0.0011 0.0006 -0.0059 2274 ARG 498 NE 0.0005 -0.0007 -0.0082 2275 ARG 498 CZ -0.0002 -0.0009 -0.0075 2276 ARG 498 NH1 -0.0025 0.0002 -0.0044 2277 ARG 498 NH2 0.0014 -0.0021 -0.0098 2278 ALA 499 N -0.0043 -0.0009 -0.0062 2279 ALA 499 CA -0.0047 -0.0003 -0.0051 2280 ALA 499 C -0.0051 0.0001 -0.0043 2281 ALA 499 O -0.0048 0.0003 -0.0045 2282 ALA 499 CB -0.0039 0.0006 -0.0050 2283 SER 500 N -0.0058 0.0003 -0.0033 2284 SER 500 CA -0.0063 0.0007 -0.0025 2285 SER 500 C -0.0058 0.0019 -0.0018 2286 SER 500 O -0.0062 0.0022 -0.0010 2287 SER 500 CB -0.0075 0.0002 -0.0017 2288 SER 500 OG -0.0079 -0.0009 -0.0023 2289 ALA 501 N -0.0050 0.0025 -0.0021 2290 ALA 501 CA -0.0045 0.0036 -0.0015 2291 ALA 501 C -0.0035 0.0041 -0.0020 2292 ALA 501 O -0.0030 0.0037 -0.0029 2293 ALA 501 CB -0.0041 0.0040 -0.0014 2294 VAL 502 N -0.0029 0.0025 -0.0027 2295 VAL 502 CA -0.0024 0.0060 -0.0031 2296 VAL 502 C -0.0027 0.0073 -0.0064 2297 VAL 502 O -0.0026 0.0094 -0.0079 2298 VAL 502 CB -0.0017 0.0079 -0.0003 2299 VAL 502 CG1 -0.0017 0.0075 0.0000 2300 VAL 502 CG2 -0.0012 0.0115 -0.0007 2301 ALA 503 N -0.0031 0.0062 -0.0076 2302 ALA 503 CA -0.0034 0.0075 -0.0108 2303 ALA 503 C -0.0040 0.0067 -0.0136 2304 ALA 503 O -0.0039 0.0088 -0.0157 2305 ALA 503 CB -0.0037 0.0063 -0.0114 2306 LEU 504 N -0.0045 0.0036 -0.0137 2307 LEU 504 CA -0.0050 0.0026 -0.0163 2308 LEU 504 C -0.0047 0.0044 -0.0161 2309 LEU 504 O -0.0050 0.0051 -0.0186 2310 LEU 504 CB -0.0056 -0.0011 -0.0162 2311 LEU 504 CG -0.0060 -0.0030 -0.0167 2312 LEU 504 CD1 -0.0063 -0.0064 -0.0151 2313 LEU 504 CD2 -0.0066 -0.0032 -0.0203 2314 GLU 505 N 0.0022 0.0022 -0.0189 2315 GLU 505 CA 0.0002 0.0018 -0.0144 2316 GLU 505 C -0.0038 0.0038 -0.0146 2317 GLU 505 O -0.0048 0.0034 -0.0119 2318 GLU 505 CB -0.0008 0.0013 -0.0115 2319 GLU 505 CG -0.0030 0.0009 -0.0068 2320 GLU 505 CD -0.0000 -0.0017 -0.0036 2321 GLU 505 OE1 0.0038 -0.0031 -0.0050 2322 GLU 505 OE2 -0.0015 -0.0022 0.0005 2323 VAL 506 N -0.0061 0.0060 -0.0178 2324 VAL 506 CA -0.0097 0.0080 -0.0186 2325 VAL 506 C -0.0081 0.0077 -0.0199 2326 VAL 506 O -0.0101 0.0082 -0.0183 2327 VAL 506 CB -0.0121 0.0104 -0.0222 2328 VAL 506 CG1 -0.0154 0.0125 -0.0234 2329 VAL 506 CG2 -0.0142 0.0109 -0.0205 2330 GLN 507 N -0.0045 0.0069 -0.0228 2331 GLN 507 CA -0.0027 0.0063 -0.0239 2332 GLN 507 C -0.0015 0.0044 -0.0198 2333 GLN 507 O -0.0022 0.0045 -0.0192 2334 GLN 507 CB 0.0012 0.0056 -0.0275 2335 GLN 507 CG 0.0003 0.0076 -0.0322 2336 GLN 507 CD 0.0032 0.0073 -0.0357 2337 GLN 507 NE2 0.0028 0.0075 -0.0357 2338 GLN 507 OE1 0.0059 0.0068 -0.0384 2339 ARG 508 N -0.0020 -0.0070 -0.0088 2340 ARG 508 CA -0.0014 -0.0053 -0.0060 2341 ARG 508 C -0.0036 -0.0063 -0.0046 2342 ARG 508 O -0.0046 -0.0058 -0.0017 2343 ARG 508 CB 0.0015 -0.0033 -0.0068 2344 ARG 508 CG 0.0023 -0.0013 -0.0038 2345 ARG 508 CD 0.0051 0.0005 -0.0047 2346 ARG 508 NE 0.0050 -0.0003 -0.0063 2347 ARG 508 CZ 0.0041 -0.0003 -0.0048 2348 ARG 508 NH1 0.0031 0.0004 -0.0016 2349 ARG 508 NH2 0.0042 -0.0010 -0.0065 2350 LEU 509 N -0.0042 -0.0078 -0.0067 2351 LEU 509 CA -0.0062 -0.0089 -0.0056 2352 LEU 509 C -0.0092 -0.0105 -0.0042 2353 LEU 509 O -0.0108 -0.0107 -0.0018 2354 LEU 509 CB -0.0062 -0.0101 -0.0083 2355 LEU 509 CG -0.0034 -0.0085 -0.0096 2356 LEU 509 CD1 -0.0033 -0.0100 -0.0129 2357 LEU 509 CD2 -0.0030 -0.0071 -0.0072 2358 ASN 510 N -0.0099 -0.0118 -0.0056 2359 ASN 510 CA -0.0126 -0.0133 -0.0043 2360 ASN 510 C -0.0129 -0.0120 -0.0010 2361 ASN 510 O -0.0150 -0.0127 0.0012 2362 ASN 510 CB -0.0130 -0.0148 -0.0066 2363 ASN 510 CG -0.0135 -0.0166 -0.0097 2364 ASN 510 ND2 -0.0133 -0.0176 -0.0121 2365 ASN 510 OD1 -0.0140 -0.0171 -0.0100 2366 ALA 511 N -0.0129 -0.0161 0.0053 2367 ALA 511 CA -0.0140 -0.0138 0.0091 2368 ALA 511 C -0.0138 -0.0131 0.0087 2369 ALA 511 O -0.0148 -0.0138 0.0119 2370 ALA 511 CB -0.0140 -0.0092 0.0098 2371 LEU 512 N -0.0126 -0.0118 0.0049 2372 LEU 512 CA -0.0124 -0.0113 0.0041 2373 LEU 512 C -0.0128 -0.0157 0.0051 2374 LEU 512 O -0.0126 -0.0194 0.0036 2375 LEU 512 CB -0.0109 -0.0099 -0.0006 2376 LEU 512 CG -0.0104 -0.0098 -0.0023 2377 LEU 512 CD1 -0.0111 -0.0066 0.0004 2378 LEU 512 CD2 -0.0089 -0.0085 -0.0071 2379 ASP 513 N -0.0136 -0.0153 0.0076 2380 ASP 513 CA -0.0140 -0.0193 0.0086 2381 ASP 513 C -0.0129 -0.0209 0.0045 2382 ASP 513 O -0.0126 -0.0195 0.0038 2383 ASP 513 CB -0.0151 -0.0182 0.0123 2384 ASP 513 CG -0.0156 -0.0223 0.0136 2385 ASP 513 OD1 -0.0157 -0.0262 0.0132 2386 ASP 513 OD2 -0.0160 -0.0216 0.0150 2387 LEU 514 N 0.0191 -0.0347 -0.0330 2388 LEU 514 CA 0.0115 -0.0305 -0.0190 2389 LEU 514 C 0.0110 -0.0190 -0.0205 2390 LEU 514 O 0.0144 -0.0077 -0.0296 2391 LEU 514 CB 0.0064 -0.0227 -0.0106 2392 LEU 514 CG 0.0049 -0.0330 -0.0053 2393 LEU 514 CD1 0.0015 -0.0224 -0.0009 2394 LEU 514 CD2 -0.0002 -0.0444 0.0072 2395 GLU 515 N 0.0068 -0.0220 -0.0116 2396 GLU 515 CA 0.0047 -0.0104 -0.0100 2397 GLU 515 C -0.0024 0.0012 0.0015 2398 GLU 515 O -0.0081 0.0026 0.0125 2399 GLU 515 CB 0.0039 -0.0191 -0.0063 2400 GLU 515 CG 0.0031 -0.0082 -0.0073 2401 GLU 515 CD -0.0030 -0.0111 0.0054 2402 GLU 515 OE1 -0.0085 -0.0155 0.0174 2403 GLU 515 OE2 -0.0022 -0.0089 0.0035 2404 LYS 516 N -0.0019 0.0096 -0.0012 2405 LYS 516 CA -0.0084 0.0193 0.0095 2406 LYS 516 C -0.0146 0.0096 0.0237 2407 LYS 516 O -0.0212 0.0157 0.0354 2408 LYS 516 CB -0.0112 0.0348 0.0115 2409 LYS 516 CG -0.0059 0.0465 -0.0016 2410 LYS 516 CD -0.0099 0.0636 0.0025 2411 LYS 516 CE -0.0129 0.0654 0.0080 2412 LYS 516 NZ -0.0068 0.0633 -0.0035 2413 LYS 517 N 0.0212 -0.0241 0.0262 2414 LYS 517 CA 0.0227 -0.0178 0.0185 2415 LYS 517 C 0.0239 -0.0214 0.0213 2416 LYS 517 O 0.0191 -0.0257 0.0295 2417 LYS 517 CB 0.0134 -0.0081 0.0157 2418 LYS 517 CG 0.0125 -0.0032 0.0113 2419 LYS 517 CD 0.0228 -0.0034 0.0033 2420 LYS 517 CE 0.0264 0.0019 -0.0051 2421 LYS 517 NZ 0.0367 0.0015 -0.0128 2422 ILE 518 N 0.0304 -0.0196 0.0142 2423 ILE 518 CA 0.0324 -0.0222 0.0153 2424 ILE 518 C 0.0323 -0.0139 0.0067 2425 ILE 518 O 0.0325 -0.0073 -0.0004 2426 ILE 518 CB 0.0428 -0.0310 0.0162 2427 ILE 518 CG1 0.0521 -0.0302 0.0080 2428 ILE 518 CG2 0.0420 -0.0396 0.0258 2429 ILE 518 CD1 0.0578 -0.0264 -0.0005 2430 GLY 519 N 0.0320 -0.0144 0.0074 2431 GLY 519 CA 0.0309 -0.0065 0.0001 2432 GLY 519 C 0.0198 0.0012 0.0009 2433 GLY 519 O 0.0183 0.0092 -0.0062 2434 LYS 520 N 0.0119 0.0016 0.0037 2435 LYS 520 CA 0.0115 0.0016 0.0036 2436 LYS 520 C 0.0102 0.0030 0.0046 2437 LYS 520 O 0.0100 0.0033 0.0048 2438 LYS 520 CB 0.0135 0.0013 0.0039 2439 LYS 520 CG 0.0149 -0.0001 0.0029 2440 LYS 520 CD 0.0141 -0.0014 0.0013 2441 LYS 520 CE 0.0157 -0.0028 0.0003 2442 LYS 520 NZ 0.0155 -0.0035 -0.0005 2443 SER 521 N 0.0092 0.0040 0.0053 2444 SER 521 CA 0.0080 0.0054 0.0064 2445 SER 521 C 0.0058 0.0054 0.0057 2446 SER 521 O 0.0053 0.0053 0.0055 2447 SER 521 CB 0.0087 0.0066 0.0079 2448 SER 521 OG 0.0075 0.0080 0.0090 2449 ILE 522 N 0.0045 0.0056 0.0055 2450 ILE 522 CA 0.0023 0.0059 0.0051 2451 ILE 522 C 0.0016 0.0074 0.0064 2452 ILE 522 O 0.0004 0.0076 0.0062 2453 ILE 522 CB 0.0012 0.0057 0.0045 2454 ILE 522 CG1 0.0017 0.0041 0.0030 2455 ILE 522 CG2 -0.0011 0.0062 0.0043 2456 ILE 522 CD1 0.0012 0.0039 0.0026 2457 LEU 523 N 0.0011 0.0056 0.0048 2458 LEU 523 CA 0.0010 0.0053 0.0063 2459 LEU 523 C 0.0021 0.0065 0.0076 2460 LEU 523 O 0.0020 0.0063 0.0093 2461 LEU 523 CB 0.0008 0.0050 0.0056 2462 LEU 523 CG 0.0006 0.0045 0.0070 2463 LEU 523 CD1 -0.0004 0.0029 0.0078 2464 LEU 523 CD2 0.0005 0.0045 0.0062 2465 GLY 524 N 0.0029 0.0079 0.0069 2466 GLY 524 CA 0.0039 0.0092 0.0080 2467 GLY 524 C 0.0040 0.0092 0.0091 2468 GLY 524 O 0.0045 0.0095 0.0106 2469 LYS 525 N 0.0037 0.0087 0.0082 2470 LYS 525 CA 0.0036 0.0086 0.0092 2471 LYS 525 C 0.0029 0.0073 0.0107 2472 LYS 525 O 0.0032 0.0075 0.0121 2473 LYS 525 CB 0.0033 0.0082 0.0079 2474 LYS 525 CG 0.0040 0.0094 0.0064 2475 LYS 525 CD 0.0035 0.0090 0.0052 2476 LYS 525 CE 0.0043 0.0103 0.0040 2477 LYS 525 NZ 0.0047 0.0110 0.0028 2478 VAL 526 N 0.0036 0.0070 0.0073 2479 VAL 526 CA 0.0035 0.0065 0.0078 2480 VAL 526 C 0.0038 0.0064 0.0083 2481 VAL 526 O 0.0041 0.0063 0.0088 2482 VAL 526 CB 0.0031 0.0059 0.0075 2483 VAL 526 CG1 0.0030 0.0053 0.0080 2484 VAL 526 CG2 0.0028 0.0059 0.0071 2485 HIS 527 N 0.0038 0.0066 0.0082 2486 HIS 527 CA 0.0041 0.0066 0.0086 2487 HIS 527 C 0.0046 0.0071 0.0090 2488 HIS 527 O 0.0049 0.0070 0.0095 2489 HIS 527 CB 0.0041 0.0068 0.0083 2490 HIS 527 CG 0.0037 0.0062 0.0082 2491 HIS 527 CD2 0.0032 0.0061 0.0077 2492 HIS 527 ND1 0.0037 0.0058 0.0087 2493 HIS 527 CE1 0.0033 0.0054 0.0084 2494 HIS 527 NE2 0.0030 0.0055 0.0079 2495 LEU 528 N 0.0048 0.0076 0.0087 2496 LEU 528 CA 0.0052 0.0080 0.0090 2497 LEU 528 C 0.0053 0.0078 0.0094 2498 LEU 528 O 0.0057 0.0078 0.0099 2499 LEU 528 CB 0.0053 0.0086 0.0085 2500 LEU 528 CG 0.0058 0.0091 0.0087 2501 LEU 528 CD1 0.0061 0.0093 0.0091 2502 LEU 528 CD2 0.0058 0.0097 0.0082 2503 ALA 529 N 0.0062 0.0062 0.0092 2504 ALA 529 CA 0.0081 0.0068 0.0087 2505 ALA 529 C 0.0091 0.0055 0.0073 2506 ALA 529 O 0.0104 0.0054 0.0066 2507 ALA 529 CB 0.0087 0.0083 0.0095 2508 MET 530 N 0.0083 0.0046 0.0070 2509 MET 530 CA 0.0090 0.0032 0.0057 2510 MET 530 C 0.0090 0.0021 0.0049 2511 MET 530 O 0.0103 0.0015 0.0038 2512 MET 530 CB 0.0080 0.0023 0.0055 2513 MET 530 CG 0.0090 0.0014 0.0044 2514 MET 530 SD 0.0099 0.0025 0.0047 2515 MET 530 CE 0.0082 0.0016 0.0049 2516 VAL 531 N 0.0075 0.0016 0.0053 2517 VAL 531 CA 0.0073 0.0006 0.0046 2518 VAL 531 C 0.0089 0.0013 0.0043 2519 VAL 531 O 0.0098 0.0004 0.0033 2520 VAL 531 CB 0.0055 0.0004 0.0053 2521 VAL 531 CG1 0.0055 -0.0005 0.0047 2522 VAL 531 CG2 0.0040 -0.0005 0.0054 2523 ARG 532 N 0.0066 0.0006 0.0040 2524 ARG 532 CA 0.0070 0.0009 0.0049 2525 ARG 532 C 0.0090 0.0007 0.0043 2526 ARG 532 O 0.0092 0.0007 0.0043 2527 ARG 532 CB 0.0069 0.0015 0.0071 2528 ARG 532 CG 0.0050 0.0017 0.0077 2529 ARG 532 CD 0.0048 0.0023 0.0098 2530 ARG 532 NE 0.0027 0.0024 0.0104 2531 ARG 532 CZ 0.0021 0.0028 0.0116 2532 ARG 532 NH1 0.0034 0.0030 0.0125 2533 ARG 532 NH2 0.0002 0.0029 0.0120 2534 TYR 533 N 0.0104 0.0006 0.0038 2535 TYR 533 CA 0.0122 0.0004 0.0031 2536 TYR 533 C 0.0119 -0.0002 0.0011 2537 TYR 533 O 0.0128 -0.0003 0.0007 2538 TYR 533 CB 0.0137 0.0004 0.0030 2539 TYR 533 CG 0.0149 0.0009 0.0047 2540 TYR 533 CD1 0.0156 0.0012 0.0057 2541 TYR 533 CD2 0.0154 0.0011 0.0054 2542 TYR 533 CE1 0.0166 0.0017 0.0074 2543 TYR 533 CE2 0.0165 0.0016 0.0070 2544 TYR 533 CZ 0.0171 0.0018 0.0080 2545 TYR 533 OH 0.0182 0.0023 0.0096 2546 HIS 534 N 0.0107 -0.0005 -0.0000 2547 HIS 534 CA 0.0102 -0.0010 -0.0018 2548 HIS 534 C 0.0093 -0.0010 -0.0015 2549 HIS 534 O 0.0100 -0.0012 -0.0023 2550 HIS 534 CB 0.0087 -0.0014 -0.0029 2551 HIS 534 CG 0.0097 -0.0017 -0.0041 2552 HIS 534 CD2 0.0095 -0.0017 -0.0042 2553 HIS 534 ND1 0.0110 -0.0021 -0.0055 2554 HIS 534 CE1 0.0116 -0.0023 -0.0064 2555 HIS 534 NE2 0.0107 -0.0021 -0.0056 2556 GLU 535 N 0.0048 -0.0054 -0.0037 2557 GLU 535 CA 0.0027 -0.0061 -0.0040 2558 GLU 535 C 0.0028 -0.0061 -0.0039 2559 GLU 535 O 0.0014 -0.0062 -0.0049 2560 GLU 535 CB 0.0014 -0.0073 -0.0024 2561 GLU 535 CG -0.0006 -0.0082 -0.0022 2562 GLU 535 CD -0.0022 -0.0091 -0.0015 2563 GLU 535 OE1 -0.0017 -0.0096 0.0000 2564 GLU 535 OE2 -0.0041 -0.0094 -0.0025 2565 GLY 536 N 0.0044 -0.0060 -0.0027 2566 GLY 536 CA 0.0046 -0.0060 -0.0024 2567 GLY 536 C 0.0056 -0.0049 -0.0040 2568 GLY 536 O 0.0057 -0.0049 -0.0039 2569 GLY 537 N 0.0062 -0.0040 -0.0056 2570 GLY 537 CA 0.0071 -0.0029 -0.0072 2571 GLY 537 C 0.0094 -0.0022 -0.0067 2572 GLY 537 O 0.0101 -0.0014 -0.0078 2573 ARG 538 N 0.0082 -0.0036 -0.0013 2574 ARG 538 CA 0.0092 -0.0029 -0.0009 2575 ARG 538 C 0.0098 -0.0023 -0.0015 2576 ARG 538 O 0.0105 -0.0016 -0.0017 2577 ARG 538 CB 0.0094 -0.0030 0.0004 2578 ARG 538 CG 0.0104 -0.0023 0.0009 2579 ARG 538 CD 0.0109 -0.0019 0.0006 2580 ARG 538 NE 0.0118 -0.0013 0.0011 2581 ARG 538 CZ 0.0121 -0.0013 0.0021 2582 ARG 538 NH1 0.0114 -0.0020 0.0026 2583 ARG 538 NH2 0.0130 -0.0007 0.0026 2584 PHE 539 N 0.0094 -0.0025 -0.0018 2585 PHE 539 CA 0.0099 -0.0020 -0.0023 2586 PHE 539 C 0.0096 -0.0019 -0.0036 2587 PHE 539 O 0.0097 -0.0017 -0.0041 2588 PHE 539 CB 0.0097 -0.0023 -0.0017 2589 PHE 539 CG 0.0100 -0.0023 -0.0004 2590 PHE 539 CD1 0.0109 -0.0017 0.0001 2591 PHE 539 CD2 0.0095 -0.0030 0.0004 2592 PHE 539 CE1 0.0112 -0.0018 0.0013 2593 PHE 539 CE2 0.0097 -0.0030 0.0016 2594 PHE 539 CZ 0.0106 -0.0024 0.0020 2595 CYS 540 N 0.0091 -0.0021 -0.0042 2596 CYS 540 CA 0.0087 -0.0021 -0.0054 2597 CYS 540 C 0.0094 -0.0015 -0.0061 2598 CYS 540 O 0.0097 -0.0013 -0.0058 2599 CYS 540 CB 0.0077 -0.0029 -0.0056 2600 CYS 540 SG 0.0071 -0.0031 -0.0070 2601 GLU 541 N -0.0302 0.0116 0.0183 2602 GLU 541 CA -0.0243 0.0108 0.0176 2603 GLU 541 C -0.0187 0.0104 0.0170 2604 GLU 541 O -0.0195 0.0093 0.0170 2605 GLU 541 CB -0.0247 0.0051 0.0168 2606 GLU 541 CG -0.0284 -0.0011 0.0163 2607 GLU 541 CD -0.0265 -0.0067 0.0152 2608 GLU 541 OE1 -0.0254 -0.0055 0.0153 2609 GLU 541 OE2 -0.0265 -0.0122 0.0144 2610 LYS 542 N -0.0129 0.0113 0.0166 2611 LYS 542 CA -0.0072 0.0128 0.0163 2612 LYS 542 C -0.0057 0.0078 0.0154 2613 LYS 542 O -0.0027 0.0094 0.0154 2614 LYS 542 CB -0.0014 0.0140 0.0159 2615 LYS 542 CG -0.0018 0.0199 0.0169 2616 LYS 542 CD 0.0047 0.0219 0.0165 2617 LYS 542 CE 0.0074 0.0168 0.0155 2618 LYS 542 NZ 0.0034 0.0159 0.0158 2619 GLY 543 N -0.0077 0.0018 0.0147 2620 GLY 543 CA -0.0059 -0.0032 0.0138 2621 GLY 543 C -0.0113 -0.0063 0.0138 2622 GLY 543 O -0.0107 -0.0118 0.0130 2623 GLU 544 N -0.0253 -0.0121 0.0094 2624 GLU 544 CA -0.0215 -0.0069 0.0051 2625 GLU 544 C -0.0212 -0.0060 0.0047 2626 GLU 544 O -0.0236 -0.0098 0.0075 2627 GLU 544 CB -0.0161 -0.0094 0.0001 2628 GLU 544 CG -0.0150 -0.0065 -0.0013 2629 GLU 544 CD -0.0192 -0.0083 0.0030 2630 GLU 544 OE1 -0.0196 -0.0148 0.0041 2631 GLU 544 OE2 -0.0219 -0.0031 0.0051 2632 GLU 545 N -0.0182 -0.0008 0.0012 2633 GLU 545 CA -0.0169 0.0006 -0.0002 2634 GLU 545 C -0.0114 -0.0027 -0.0053 2635 GLU 545 O -0.0079 -0.0022 -0.0088 2636 GLU 545 CB -0.0174 0.0089 -0.0006 2637 GLU 545 CG -0.0168 0.0110 -0.0014 2638 GLU 545 CD -0.0214 0.0090 0.0032 2639 GLU 545 OE1 -0.0256 0.0079 0.0075 2640 GLU 545 OE2 -0.0207 0.0087 0.0026 2641 TRP 546 N -0.0106 -0.0061 -0.0056 2642 TRP 546 CA -0.0057 -0.0103 -0.0101 2643 TRP 546 C -0.0012 -0.0052 -0.0150 2644 TRP 546 O -0.0020 0.0010 -0.0149 2645 TRP 546 CB -0.0062 -0.0149 -0.0090 2646 TRP 546 CG -0.0071 -0.0107 -0.0086 2647 TRP 546 CD1 -0.0117 -0.0072 -0.0045 2648 TRP 546 CD2 -0.0033 -0.0096 -0.0125 2649 TRP 546 CE2 -0.0058 -0.0053 -0.0104 2650 TRP 546 CE3 0.0020 -0.0117 -0.0175 2651 TRP 546 NE1 -0.0110 -0.0040 -0.0056 2652 TRP 546 CZ2 -0.0032 -0.0032 -0.0132 2653 TRP 546 CZ3 0.0046 -0.0096 -0.0203 2654 TRP 546 CH2 0.0020 -0.0054 -0.0181 2655 ASP 547 N 0.0125 -0.0060 -0.0213 2656 ASP 547 CA 0.0118 -0.0051 -0.0257 2657 ASP 547 C 0.0064 -0.0054 -0.0221 2658 ASP 547 O 0.0085 -0.0064 -0.0174 2659 ASP 547 CB 0.0194 -0.0054 -0.0269 2660 ASP 547 CG 0.0193 -0.0045 -0.0321 2661 ASP 547 OD1 0.0133 -0.0036 -0.0347 2662 ASP 547 OD2 0.0254 -0.0046 -0.0336 2663 GLN 548 N -0.0006 -0.0046 -0.0243 2664 GLN 548 CA -0.0062 -0.0047 -0.0212 2665 GLN 548 C -0.0051 -0.0043 -0.0240 2666 GLN 548 O -0.0065 -0.0050 -0.0199 2667 GLN 548 CB -0.0139 -0.0039 -0.0231 2668 GLN 548 CG -0.0151 -0.0040 -0.0218 2669 GLN 548 CD -0.0232 -0.0034 -0.0225 2670 GLN 548 NE2 -0.0250 -0.0038 -0.0198 2671 GLN 548 OE1 -0.0277 -0.0025 -0.0255 2672 GLU 549 N -0.0027 -0.0032 -0.0308 2673 GLU 549 CA -0.0018 -0.0027 -0.0340 2674 GLU 549 C 0.0036 -0.0039 -0.0297 2675 GLU 549 O 0.0018 -0.0041 -0.0274 2676 GLU 549 CB 0.0007 -0.0014 -0.0420 2677 GLU 549 CG -0.0033 -0.0004 -0.0464 2678 GLU 549 CD 0.0004 -0.0006 -0.0462 2679 GLU 549 OE1 0.0064 -0.0005 -0.0495 2680 GLU 549 OE2 -0.0028 -0.0011 -0.0428 2681 SER 550 N 0.0103 -0.0038 -0.0184 2682 SER 550 CA 0.0126 -0.0030 -0.0154 2683 SER 550 C 0.0112 -0.0032 -0.0112 2684 SER 550 O 0.0115 -0.0030 -0.0084 2685 SER 550 CB 0.0169 -0.0019 -0.0160 2686 SER 550 OG 0.0182 -0.0017 -0.0198 2687 ALA 551 N 0.0097 -0.0036 -0.0107 2688 ALA 551 CA 0.0081 -0.0039 -0.0068 2689 ALA 551 C 0.0048 -0.0047 -0.0056 2690 ALA 551 O 0.0047 -0.0046 -0.0022 2691 ALA 551 CB 0.0067 -0.0042 -0.0070 2692 VAL 552 N 0.0022 -0.0055 -0.0084 2693 VAL 552 CA -0.0010 -0.0063 -0.0074 2694 VAL 552 C 0.0004 -0.0059 -0.0068 2695 VAL 552 O -0.0011 -0.0062 -0.0043 2696 VAL 552 CB -0.0041 -0.0072 -0.0107 2697 VAL 552 CG1 -0.0068 -0.0079 -0.0105 2698 VAL 552 CG2 -0.0063 -0.0078 -0.0103 2699 PHE 553 N 0.0058 -0.0022 -0.0006 2700 PHE 553 CA 0.0048 -0.0019 0.0000 2701 PHE 553 C 0.0047 0.0000 0.0015 2702 PHE 553 O 0.0030 0.0004 0.0026 2703 PHE 553 CB 0.0061 -0.0025 -0.0010 2704 PHE 553 CG 0.0055 -0.0020 -0.0004 2705 PHE 553 CD1 0.0065 -0.0003 0.0004 2706 PHE 553 CD2 0.0041 -0.0032 -0.0006 2707 PHE 553 CE1 0.0060 0.0001 0.0010 2708 PHE 553 CE2 0.0036 -0.0028 -0.0001 2709 PHE 553 CZ 0.0045 -0.0011 0.0007 2710 HIS 554 N 0.0063 0.0013 0.0017 2711 HIS 554 CA 0.0063 0.0032 0.0031 2712 HIS 554 C 0.0051 0.0039 0.0041 2713 HIS 554 O 0.0042 0.0050 0.0054 2714 HIS 554 CB 0.0085 0.0044 0.0029 2715 HIS 554 CG 0.0095 0.0043 0.0023 2716 HIS 554 CD2 0.0111 0.0036 0.0011 2717 HIS 554 ND1 0.0088 0.0048 0.0030 2718 HIS 554 CE1 0.0099 0.0045 0.0023 2719 HIS 554 NE2 0.0113 0.0038 0.0011 2720 LEU 555 N 0.0051 0.0030 0.0035 2721 LEU 555 CA 0.0038 0.0035 0.0045 2722 LEU 555 C 0.0016 0.0028 0.0050 2723 LEU 555 O 0.0004 0.0037 0.0063 2724 LEU 555 CB 0.0043 0.0027 0.0036 2725 LEU 555 CG 0.0034 0.0033 0.0045 2726 LEU 555 CD1 0.0045 0.0053 0.0055 2727 LEU 555 CD2 0.0037 0.0022 0.0036 2728 GLU 556 N 0.0071 0.0024 0.0045 2729 GLU 556 CA 0.0048 0.0015 0.0055 2730 GLU 556 C 0.0039 0.0033 0.0070 2731 GLU 556 O 0.0022 0.0037 0.0083 2732 GLU 556 CB 0.0045 -0.0007 0.0048 2733 GLU 556 CG 0.0040 -0.0030 0.0041 2734 GLU 556 CD 0.0050 -0.0048 0.0026 2735 GLU 556 OE1 0.0051 -0.0050 0.0025 2736 GLU 556 OE2 0.0058 -0.0060 0.0016 2737 HIS 557 N 0.0050 0.0043 0.0067 2738 HIS 557 CA 0.0041 0.0060 0.0081 2739 HIS 557 C 0.0040 0.0081 0.0091 2740 HIS 557 O 0.0025 0.0090 0.0105 2741 HIS 557 CB 0.0054 0.0068 0.0075 2742 HIS 557 CG 0.0049 0.0052 0.0072 2743 HIS 557 CD2 0.0061 0.0044 0.0060 2744 HIS 557 ND1 0.0029 0.0042 0.0081 2745 HIS 557 CE1 0.0029 0.0028 0.0075 2746 HIS 557 NE2 0.0048 0.0029 0.0062 2747 ALA 558 N 0.0056 0.0089 0.0084 2748 ALA 558 CA 0.0055 0.0108 0.0093 2749 ALA 558 C 0.0037 0.0101 0.0102 2750 ALA 558 O 0.0026 0.0116 0.0115 2751 ALA 558 CB 0.0076 0.0115 0.0082 2752 ALA 559 N 0.0061 0.0130 0.0089 2753 ALA 559 CA 0.0055 0.0142 0.0085 2754 ALA 559 C 0.0049 0.0141 0.0072 2755 ALA 559 O 0.0045 0.0149 0.0068 2756 ALA 559 CB 0.0055 0.0148 0.0088 2757 ASN 560 N 0.0049 0.0132 0.0066 2758 ASN 560 CA 0.0043 0.0130 0.0053 2759 ASN 560 C 0.0043 0.0126 0.0051 2760 ASN 560 O 0.0038 0.0127 0.0041 2761 ASN 560 CB 0.0043 0.0121 0.0047 2762 ASN 560 CG 0.0043 0.0125 0.0049 2763 ASN 560 ND2 0.0045 0.0116 0.0048 2764 ASN 560 OD1 0.0040 0.0136 0.0051 2765 LEU 561 N 0.0048 0.0123 0.0059 2766 LEU 561 CA 0.0048 0.0121 0.0057 2767 LEU 561 C 0.0048 0.0131 0.0063 2768 LEU 561 O 0.0049 0.0130 0.0064 2769 LEU 561 CB 0.0054 0.0109 0.0062 2770 LEU 561 CG 0.0054 0.0097 0.0055 2771 LEU 561 CD1 0.0060 0.0086 0.0061 2772 LEU 561 CD2 0.0048 0.0096 0.0043 2773 GLY 562 N 0.0130 0.0150 0.0097 2774 GLY 562 CA 0.0135 0.0130 0.0089 2775 GLY 562 C 0.0114 0.0116 0.0085 2776 GLY 562 O 0.0117 0.0096 0.0077 2777 GLU 563 N 0.0093 0.0125 0.0089 2778 GLU 563 CA 0.0072 0.0114 0.0086 2779 GLU 563 C 0.0072 0.0116 0.0087 2780 GLU 563 O 0.0068 0.0134 0.0094 2781 GLU 563 CB 0.0049 0.0123 0.0090 2782 GLU 563 CG 0.0043 0.0112 0.0086 2783 GLU 563 CD 0.0046 0.0087 0.0076 2784 GLU 563 OE1 0.0031 0.0075 0.0072 2785 GLU 563 OE2 0.0062 0.0080 0.0073 2786 SER 81 N 0.0254 -0.0408 -0.0098 2787 SER 81 CA 0.0276 -0.0352 -0.0165 2788 SER 81 C 0.0221 -0.0227 -0.0231 2789 SER 81 O 0.0276 -0.0169 -0.0324 2790 SER 81 CB 0.0406 -0.0393 -0.0229 2791 SER 81 OG 0.0443 -0.0485 -0.0178 2792 GLU 82 N 0.0108 -0.0185 -0.0180 2793 GLU 82 CA 0.0044 -0.0067 -0.0234 2794 GLU 82 C -0.0076 -0.0030 -0.0173 2795 GLU 82 O -0.0156 0.0054 -0.0185 2796 GLU 82 CB 0.0034 -0.0030 -0.0259 2797 GLU 82 CG -0.0014 -0.0090 -0.0169 2798 GLU 82 CD 0.0006 -0.0072 -0.0201 2799 GLU 82 OE1 -0.0014 -0.0129 -0.0135 2800 GLU 82 OE2 0.0043 0.0001 -0.0292 2801 GLU 83 N -0.0091 -0.0091 -0.0108 2802 GLU 83 CA -0.0202 -0.0057 -0.0053 2803 GLU 83 C -0.0231 0.0049 -0.0122 2804 GLU 83 O -0.0334 0.0107 -0.0094 2805 GLU 83 CB -0.0201 -0.0149 0.0027 2806 GLU 83 CG -0.0112 -0.0177 -0.0017 2807 GLU 83 CD -0.0165 -0.0137 -0.0012 2808 GLU 83 OE1 -0.0271 -0.0108 0.0045 2809 GLU 83 OE2 -0.0101 -0.0134 -0.0064 2810 GLU 84 N -0.0094 0.0038 -0.0049 2811 GLU 84 CA -0.0095 0.0058 -0.0027 2812 GLU 84 C -0.0067 0.0068 -0.0021 2813 GLU 84 O -0.0065 0.0081 -0.0007 2814 GLU 84 CB -0.0103 0.0065 -0.0017 2815 GLU 84 CG -0.0127 0.0053 -0.0026 2816 GLU 84 CD -0.0117 0.0040 -0.0043 2817 GLU 84 OE1 -0.0096 0.0033 -0.0054 2818 GLU 84 OE2 -0.0131 0.0037 -0.0044 2819 ILE 85 N -0.0044 0.0062 -0.0031 2820 ILE 85 CA -0.0017 0.0071 -0.0026 2821 ILE 85 C -0.0008 0.0067 -0.0032 2822 ILE 85 O 0.0004 0.0079 -0.0021 2823 ILE 85 CB 0.0004 0.0066 -0.0035 2824 ILE 85 CG1 -0.0007 0.0069 -0.0030 2825 ILE 85 CG2 0.0032 0.0078 -0.0027 2826 ILE 85 CD1 0.0002 0.0088 -0.0010 2827 ARG 86 N -0.0015 0.0049 -0.0050 2828 ARG 86 CA -0.0010 0.0044 -0.0057 2829 ARG 86 C -0.0023 0.0056 -0.0041 2830 ARG 86 O -0.0010 0.0064 -0.0035 2831 ARG 86 CB -0.0020 0.0023 -0.0078 2832 ARG 86 CG -0.0006 0.0010 -0.0096 2833 ARG 86 CD 0.0000 -0.0007 -0.0115 2834 ARG 86 NE 0.0005 -0.0023 -0.0134 2835 ARG 86 CZ -0.0014 -0.0033 -0.0142 2836 ARG 86 NH1 -0.0040 -0.0029 -0.0133 2837 ARG 86 NH2 -0.0007 -0.0047 -0.0159 2838 GLU 87 N -0.0021 0.0066 0.0009 2839 GLU 87 CA -0.0018 0.0064 0.0012 2840 GLU 87 C -0.0016 0.0061 0.0023 2841 GLU 87 O -0.0010 0.0058 0.0026 2842 GLU 87 CB -0.0025 0.0067 0.0009 2843 GLU 87 CG -0.0022 0.0066 0.0011 2844 GLU 87 CD -0.0014 0.0065 0.0003 2845 GLU 87 OE1 -0.0011 0.0066 -0.0004 2846 GLU 87 OE2 -0.0010 0.0064 0.0004 2847 ALA 88 N -0.0022 0.0061 0.0030 2848 ALA 88 CA -0.0020 0.0057 0.0040 2849 ALA 88 C -0.0010 0.0054 0.0042 2850 ALA 88 O -0.0005 0.0050 0.0049 2851 ALA 88 CB -0.0028 0.0058 0.0047 2852 PHE 89 N -0.0007 0.0055 0.0036 2853 PHE 89 CA 0.0003 0.0051 0.0036 2854 PHE 89 C 0.0012 0.0049 0.0035 2855 PHE 89 O 0.0019 0.0045 0.0040 2856 PHE 89 CB 0.0005 0.0053 0.0028 2857 PHE 89 CG 0.0014 0.0050 0.0029 2858 PHE 89 CD1 0.0022 0.0049 0.0022 2859 PHE 89 CD2 0.0014 0.0048 0.0036 2860 PHE 89 CE1 0.0031 0.0046 0.0023 2861 PHE 89 CE2 0.0023 0.0045 0.0037 2862 PHE 89 CZ 0.0031 0.0044 0.0030 2863 ARG 90 N -0.0009 0.0049 -0.0006 2864 ARG 90 CA 0.0004 0.0056 0.0004 2865 ARG 90 C 0.0013 0.0040 0.0006 2866 ARG 90 O 0.0021 0.0044 0.0013 2867 ARG 90 CB 0.0017 0.0064 0.0014 2868 ARG 90 CG 0.0011 0.0085 0.0014 2869 ARG 90 CD 0.0023 0.0091 0.0023 2870 ARG 90 NE 0.0040 0.0093 0.0035 2871 ARG 90 CZ 0.0053 0.0093 0.0044 2872 ARG 90 NH1 0.0053 0.0091 0.0043 2873 ARG 90 NH2 0.0068 0.0096 0.0054 2874 VAL 91 N 0.0011 0.0021 0.0001 2875 VAL 91 CA 0.0018 0.0006 0.0003 2876 VAL 91 C 0.0007 0.0005 -0.0004 2877 VAL 91 O 0.0013 -0.0003 -0.0002 2878 VAL 91 CB 0.0019 -0.0015 -0.0000 2879 VAL 91 CG1 0.0028 -0.0014 0.0006 2880 VAL 91 CG2 0.0002 -0.0022 -0.0013 2881 PHE 92 N -0.0008 0.0015 -0.0012 2882 PHE 92 CA -0.0019 0.0016 -0.0020 2883 PHE 92 C -0.0021 0.0035 -0.0017 2884 PHE 92 O -0.0023 0.0036 -0.0018 2885 PHE 92 CB -0.0037 0.0011 -0.0032 2886 PHE 92 CG -0.0037 -0.0009 -0.0036 2887 PHE 92 CD1 -0.0034 -0.0026 -0.0038 2888 PHE 92 CD2 -0.0040 -0.0011 -0.0039 2889 PHE 92 CE1 -0.0034 -0.0044 -0.0042 2890 PHE 92 CE2 -0.0040 -0.0030 -0.0042 2891 PHE 92 CZ -0.0037 -0.0046 -0.0044 2892 ASP 93 N 0.0076 0.0060 0.0008 2893 ASP 93 CA 0.0078 0.0059 0.0007 2894 ASP 93 C 0.0088 0.0058 -0.0001 2895 ASP 93 O 0.0091 0.0065 -0.0005 2896 ASP 93 CB 0.0075 0.0068 0.0008 2897 ASP 93 CG 0.0077 0.0067 0.0006 2898 ASP 93 OD1 0.0080 0.0058 0.0005 2899 ASP 93 OD2 0.0076 0.0075 0.0006 2900 LYS 94 N 0.0092 0.0048 -0.0002 2901 LYS 94 CA 0.0100 0.0047 -0.0009 2902 LYS 94 C 0.0105 0.0050 -0.0013 2903 LYS 94 O 0.0110 0.0055 -0.0019 2904 LYS 94 CB 0.0103 0.0035 -0.0009 2905 LYS 94 CG 0.0103 0.0033 -0.0008 2906 LYS 94 CD 0.0104 0.0042 -0.0012 2907 LYS 94 CE 0.0113 0.0046 -0.0019 2908 LYS 94 NZ 0.0112 0.0057 -0.0021 2909 ASP 95 N 0.0103 0.0046 -0.0011 2910 ASP 95 CA 0.0107 0.0048 -0.0015 2911 ASP 95 C 0.0105 0.0059 -0.0015 2912 ASP 95 O 0.0109 0.0062 -0.0019 2913 ASP 95 CB 0.0106 0.0040 -0.0012 2914 ASP 95 CG 0.0098 0.0041 -0.0006 2915 ASP 95 OD1 0.0092 0.0047 -0.0002 2916 ASP 95 OD2 0.0097 0.0036 -0.0004 2917 GLY 96 N 0.0137 0.0096 0.0003 2918 GLY 96 CA 0.0139 0.0120 0.0021 2919 GLY 96 C 0.0118 0.0122 0.0040 2920 GLY 96 O 0.0121 0.0139 0.0052 2921 ASN 97 N 0.0098 0.0104 0.0043 2922 ASN 97 CA 0.0077 0.0105 0.0061 2923 ASN 97 C 0.0064 0.0115 0.0080 2924 ASN 97 O 0.0045 0.0114 0.0096 2925 ASN 97 CB 0.0061 0.0080 0.0055 2926 ASN 97 CG 0.0046 0.0065 0.0056 2927 ASN 97 ND2 0.0024 0.0052 0.0063 2928 ASN 97 OD1 0.0053 0.0066 0.0050 2929 GLY 98 N 0.0074 0.0124 0.0079 2930 GLY 98 CA 0.0064 0.0135 0.0097 2931 GLY 98 C 0.0047 0.0118 0.0098 2932 GLY 98 O 0.0035 0.0126 0.0114 2933 TYR 99 N 0.0046 0.0105 0.0114 2934 TYR 99 CA 0.0022 0.0081 0.0101 2935 TYR 99 C 0.0041 0.0054 0.0077 2936 TYR 99 O 0.0059 0.0048 0.0069 2937 TYR 99 CB -0.0013 0.0076 0.0103 2938 TYR 99 CG -0.0035 0.0101 0.0125 2939 TYR 99 CD1 -0.0028 0.0125 0.0142 2940 TYR 99 CD2 -0.0065 0.0101 0.0131 2941 TYR 99 CE1 -0.0048 0.0148 0.0162 2942 TYR 99 CE2 -0.0086 0.0124 0.0151 2943 TYR 99 CZ -0.0077 0.0147 0.0167 2944 TYR 99 OH -0.0098 0.0170 0.0188 2945 ILE 100 N 0.0036 0.0038 0.0065 2946 ILE 100 CA 0.0049 0.0009 0.0042 2947 ILE 100 C 0.0018 -0.0013 0.0031 2948 ILE 100 O -0.0010 -0.0015 0.0034 2949 ILE 100 CB 0.0062 0.0003 0.0035 2950 ILE 100 CG1 0.0090 0.0027 0.0048 2951 ILE 100 CG2 0.0078 -0.0026 0.0010 2952 ILE 100 CD1 0.0097 0.0026 0.0046 2953 SER 101 N 0.0024 -0.0029 0.0017 2954 SER 101 CA -0.0002 -0.0052 0.0005 2955 SER 101 C 0.0007 -0.0081 -0.0019 2956 SER 101 O 0.0037 -0.0085 -0.0026 2957 SER 101 CB -0.0004 -0.0053 0.0005 2958 SER 101 OG 0.0029 -0.0060 -0.0006 2959 ALA 102 N 0.0025 -0.0079 -0.0004 2960 ALA 102 CA 0.0025 -0.0082 -0.0007 2961 ALA 102 C 0.0033 -0.0086 -0.0027 2962 ALA 102 O 0.0038 -0.0080 -0.0033 2963 ALA 102 CB 0.0018 -0.0099 0.0003 2964 ALA 103 N 0.0036 -0.0097 -0.0036 2965 ALA 103 CA 0.0043 -0.0101 -0.0055 2966 ALA 103 C 0.0051 -0.0083 -0.0064 2967 ALA 103 O 0.0057 -0.0080 -0.0077 2968 ALA 103 CB 0.0044 -0.0115 -0.0062 2969 GLU 104 N 0.0051 -0.0070 -0.0058 2970 GLU 104 CA 0.0058 -0.0052 -0.0066 2971 GLU 104 C 0.0059 -0.0040 -0.0064 2972 GLU 104 O 0.0066 -0.0033 -0.0076 2973 GLU 104 CB 0.0057 -0.0041 -0.0059 2974 GLU 104 CG 0.0060 -0.0048 -0.0068 2975 GLU 104 CD 0.0057 -0.0039 -0.0059 2976 GLU 104 OE1 0.0051 -0.0035 -0.0043 2977 GLU 104 OE2 0.0062 -0.0035 -0.0068 2978 LEU 105 N 0.0035 -0.0070 -0.0107 2979 LEU 105 CA 0.0020 -0.0042 -0.0086 2980 LEU 105 C 0.0018 -0.0036 -0.0077 2981 LEU 105 O 0.0000 -0.0012 -0.0077 2982 LEU 105 CB 0.0028 -0.0041 -0.0055 2983 LEU 105 CG 0.0013 -0.0013 -0.0032 2984 LEU 105 CD1 -0.0007 0.0009 -0.0049 2985 LEU 105 CD2 0.0024 -0.0016 0.0001 2986 ARG 106 N 0.0035 -0.0056 -0.0068 2987 ARG 106 CA 0.0034 -0.0052 -0.0060 2988 ARG 106 C 0.0021 -0.0045 -0.0089 2989 ARG 106 O 0.0008 -0.0025 -0.0086 2990 ARG 106 CB 0.0057 -0.0078 -0.0048 2991 ARG 106 CG 0.0058 -0.0078 -0.0043 2992 ARG 106 CD 0.0052 -0.0059 -0.0012 2993 ARG 106 NE 0.0030 -0.0032 -0.0020 2994 ARG 106 CZ 0.0020 -0.0009 0.0002 2995 ARG 106 NH1 0.0029 -0.0010 0.0035 2996 ARG 106 NH2 -0.0000 0.0014 -0.0008 2997 HIS 107 N 0.0025 -0.0060 -0.0119 2998 HIS 107 CA 0.0012 -0.0054 -0.0149 2999 HIS 107 C -0.0011 -0.0024 -0.0155 3000 HIS 107 O -0.0024 -0.0010 -0.0163 3001 HIS 107 CB 0.0019 -0.0074 -0.0180 3002 HIS 107 CG 0.0005 -0.0067 -0.0212 3003 HIS 107 CD2 -0.0011 -0.0055 -0.0236 3004 HIS 107 ND1 0.0006 -0.0073 -0.0222 3005 HIS 107 CE1 -0.0008 -0.0064 -0.0252 3006 HIS 107 NE2 -0.0019 -0.0053 -0.0260 3007 VAL 108 N -0.0105 -0.0059 -0.0150 3008 VAL 108 CA -0.0124 -0.0037 -0.0155 3009 VAL 108 C -0.0126 -0.0000 -0.0135 3010 VAL 108 O -0.0151 0.0023 -0.0143 3011 VAL 108 CB -0.0113 -0.0051 -0.0153 3012 VAL 108 CG1 -0.0130 -0.0025 -0.0152 3013 VAL 108 CG2 -0.0117 -0.0085 -0.0176 3014 MET 109 N -0.0101 0.0006 -0.0108 3015 MET 109 CA -0.0101 0.0041 -0.0088 3016 MET 109 C -0.0117 0.0058 -0.0092 3017 MET 109 O -0.0127 0.0090 -0.0082 3018 MET 109 CB -0.0070 0.0042 -0.0059 3019 MET 109 CG -0.0052 0.0025 -0.0053 3020 MET 109 SD -0.0075 0.0030 -0.0071 3021 MET 109 CE -0.0061 0.0056 -0.0043 3022 THR 110 N -0.0120 0.0039 -0.0106 3023 THR 110 CA -0.0138 0.0055 -0.0113 3024 THR 110 C -0.0171 0.0059 -0.0139 3025 THR 110 O -0.0190 0.0085 -0.0142 3026 THR 110 CB -0.0126 0.0034 -0.0115 3027 THR 110 CG2 -0.0141 0.0054 -0.0116 3028 THR 110 OG1 -0.0095 0.0027 -0.0091 3029 ASN 111 N -0.0239 0.0060 -0.0196 3030 ASN 111 CA -0.0283 0.0054 -0.0215 3031 ASN 111 C -0.0299 0.0081 -0.0210 3032 ASN 111 O -0.0334 0.0102 -0.0214 3033 ASN 111 CB -0.0284 0.0008 -0.0236 3034 ASN 111 CG -0.0329 -0.0002 -0.0257 3035 ASN 111 ND2 -0.0338 -0.0038 -0.0276 3036 ASN 111 OD1 -0.0355 0.0021 -0.0257 3037 LEU 112 N -0.0272 0.0080 -0.0200 3038 LEU 112 CA -0.0286 0.0099 -0.0197 3039 LEU 112 C -0.0278 0.0144 -0.0174 3040 LEU 112 O -0.0281 0.0162 -0.0168 3041 LEU 112 CB -0.0263 0.0073 -0.0199 3042 LEU 112 CG -0.0268 0.0027 -0.0221 3043 LEU 112 CD1 -0.0262 0.0011 -0.0226 3044 LEU 112 CD2 -0.0311 0.0018 -0.0241 3045 GLY 113 N -0.0269 0.0164 -0.0163 3046 GLY 113 CA -0.0266 0.0208 -0.0142 3047 GLY 113 C -0.0230 0.0221 -0.0123 3048 GLY 113 O -0.0233 0.0257 -0.0109 3049 GLU 114 N -0.0379 0.0188 -0.0070 3050 GLU 114 CA -0.0315 0.0211 -0.0014 3051 GLU 114 C -0.0263 0.0235 0.0033 3052 GLU 114 O -0.0255 0.0201 0.0022 3053 GLU 114 CB -0.0269 0.0140 -0.0017 3054 GLU 114 CG -0.0316 0.0116 -0.0061 3055 GLU 114 CD -0.0299 0.0150 -0.0033 3056 GLU 114 OE1 -0.0233 0.0126 0.0001 3057 GLU 114 OE2 -0.0352 0.0200 -0.0045 3058 LYS 115 N -0.0228 0.0295 0.0086 3059 LYS 115 CA -0.0187 0.0333 0.0134 3060 LYS 115 C -0.0100 0.0298 0.0176 3061 LYS 115 O -0.0058 0.0340 0.0226 3062 LYS 115 CB -0.0208 0.0428 0.0165 3063 LYS 115 CG -0.0264 0.0461 0.0143 3064 LYS 115 CD -0.0346 0.0474 0.0093 3065 LYS 115 CE -0.0398 0.0480 0.0060 3066 LEU 116 N -0.0074 0.0219 0.0155 3067 LEU 116 CA 0.0007 0.0179 0.0192 3068 LEU 116 C 0.0028 0.0150 0.0192 3069 LEU 116 O -0.0018 0.0127 0.0149 3070 LEU 116 CB 0.0030 0.0104 0.0171 3071 LEU 116 CG 0.0005 0.0121 0.0162 3072 LEU 116 CD1 -0.0019 0.0046 0.0109 3073 LEU 116 CD2 0.0070 0.0140 0.0216 3074 THR 117 N -0.0001 0.0070 0.0231 3075 THR 117 CA 0.0048 0.0044 0.0239 3076 THR 117 C 0.0081 0.0001 0.0197 3077 THR 117 O 0.0069 -0.0007 0.0167 3078 THR 117 CB 0.0082 0.0053 0.0301 3079 THR 117 CG2 0.0047 0.0098 0.0343 3080 THR 117 OG1 0.0106 0.0042 0.0307 3081 ASP 118 N 0.0122 -0.0027 0.0194 3082 ASP 118 CA 0.0156 -0.0068 0.0156 3083 ASP 118 C 0.0188 -0.0078 0.0177 3084 ASP 118 O 0.0201 -0.0104 0.0142 3085 ASP 118 CB 0.0193 -0.0095 0.0150 3086 ASP 118 CG 0.0233 -0.0092 0.0205 3087 ASP 118 OD1 0.0228 -0.0065 0.0251 3088 ASP 118 OD2 0.0270 -0.0117 0.0203 3089 GLU 119 N 0.0200 -0.0057 0.0232 3090 GLU 119 CA 0.0226 -0.0062 0.0255 3091 GLU 119 C 0.0187 -0.0046 0.0238 3092 GLU 119 O 0.0204 -0.0064 0.0224 3093 GLU 119 CB 0.0247 -0.0042 0.0319 3094 GLU 119 CG 0.0279 -0.0048 0.0347 3095 GLU 119 CD 0.0324 -0.0091 0.0320 3096 GLU 119 OE1 0.0345 -0.0118 0.0294 3097 GLU 119 OE2 0.0339 -0.0098 0.0324 3098 GLU 120 N 0.0105 0.0031 0.0255 3099 GLU 120 CA 0.0071 0.0036 0.0236 3100 GLU 120 C 0.0065 0.0011 0.0184 3101 GLU 120 O 0.0058 0.0003 0.0165 3102 GLU 120 CB 0.0023 0.0065 0.0249 3103 GLU 120 CG 0.0014 0.0091 0.0291 3104 GLU 120 CD -0.0023 0.0120 0.0313 3105 GLU 120 OE1 -0.0017 0.0124 0.0326 3106 GLU 120 OE2 -0.0059 0.0138 0.0318 3107 VAL 121 N 0.0067 -0.0003 0.0162 3108 VAL 121 CA 0.0063 -0.0028 0.0112 3109 VAL 121 C 0.0106 -0.0054 0.0099 3110 VAL 121 O 0.0102 -0.0069 0.0068 3111 VAL 121 CB 0.0056 -0.0035 0.0093 3112 VAL 121 CG1 0.0066 -0.0065 0.0045 3113 VAL 121 CG2 0.0006 -0.0011 0.0095 3114 ASP 122 N 0.0149 -0.0060 0.0123 3115 ASP 122 CA 0.0192 -0.0083 0.0116 3116 ASP 122 C 0.0189 -0.0077 0.0124 3117 ASP 122 O 0.0208 -0.0098 0.0102 3118 ASP 122 CB 0.0235 -0.0085 0.0147 3119 ASP 122 CG 0.0250 -0.0102 0.0130 3120 ASP 122 OD1 0.0225 -0.0109 0.0095 3121 ASP 122 OD2 0.0288 -0.0107 0.0151 3122 GLU 123 N 0.0103 -0.0076 0.0076 3123 GLU 123 CA 0.0096 -0.0077 0.0072 3124 GLU 123 C 0.0075 -0.0081 0.0052 3125 GLU 123 O 0.0076 -0.0085 0.0039 3126 GLU 123 CB 0.0087 -0.0069 0.0097 3127 GLU 123 CG 0.0109 -0.0066 0.0115 3128 GLU 123 CD 0.0130 -0.0070 0.0104 3129 GLU 123 OE1 0.0145 -0.0066 0.0120 3130 GLU 123 OE2 0.0133 -0.0076 0.0081 3131 MET 124 N 0.0057 -0.0081 0.0050 3132 MET 124 CA 0.0040 -0.0086 0.0029 3133 MET 124 C 0.0056 -0.0094 0.0005 3134 MET 124 O 0.0050 -0.0098 -0.0012 3135 MET 124 CB 0.0022 -0.0085 0.0029 3136 MET 124 CG 0.0001 -0.0079 0.0047 3137 MET 124 SD -0.0015 -0.0077 0.0052 3138 MET 124 CE -0.0037 -0.0083 0.0026 3139 ILE 125 N 0.0075 -0.0095 0.0004 3140 ILE 125 CA 0.0090 -0.0102 -0.0018 3141 ILE 125 C 0.0104 -0.0104 -0.0023 3142 ILE 125 O 0.0103 -0.0110 -0.0043 3143 ILE 125 CB 0.0109 -0.0102 -0.0016 3144 ILE 125 CG1 0.0094 -0.0102 -0.0016 3145 ILE 125 CG2 0.0128 -0.0109 -0.0038 3146 ILE 125 CD1 0.0084 -0.0108 -0.0041 3147 ARG 126 N 0.0084 -0.0068 0.0002 3148 ARG 126 CA 0.0081 -0.0060 -0.0021 3149 ARG 126 C 0.0058 -0.0074 -0.0040 3150 ARG 126 O 0.0055 -0.0066 -0.0064 3151 ARG 126 CB 0.0089 -0.0057 -0.0012 3152 ARG 126 CG 0.0110 -0.0034 -0.0017 3153 ARG 126 CD 0.0118 -0.0032 -0.0006 3154 ARG 126 NE 0.0122 -0.0041 0.0023 3155 ARG 126 CZ 0.0117 -0.0051 0.0037 3156 ARG 126 NH1 0.0108 -0.0054 0.0024 3157 ARG 126 NH2 0.0122 -0.0059 0.0064 3158 GLU 127 N 0.0042 -0.0094 -0.0028 3159 GLU 127 CA 0.0020 -0.0108 -0.0045 3160 GLU 127 C 0.0016 -0.0104 -0.0062 3161 GLU 127 O 0.0007 -0.0102 -0.0087 3162 GLU 127 CB 0.0004 -0.0131 -0.0027 3163 GLU 127 CG -0.0019 -0.0146 -0.0043 3164 GLU 127 CD -0.0034 -0.0168 -0.0025 3165 GLU 127 OE1 -0.0037 -0.0177 -0.0013 3166 GLU 127 OE2 -0.0043 -0.0178 -0.0023 3167 ALA 128 N 0.0024 -0.0102 -0.0050 3168 ALA 128 CA 0.0021 -0.0099 -0.0065 3169 ALA 128 C 0.0036 -0.0076 -0.0083 3170 ALA 128 O 0.0030 -0.0072 -0.0105 3171 ALA 128 CB 0.0024 -0.0104 -0.0045 3172 ASP 129 N 0.0039 -0.0109 -0.0104 3173 ASP 129 CA -0.0007 -0.0057 -0.0076 3174 ASP 129 C -0.0064 -0.0044 -0.0095 3175 ASP 129 O -0.0114 -0.0052 -0.0133 3176 ASP 129 CB -0.0031 -0.0054 -0.0086 3177 ASP 129 CG -0.0088 -0.0003 -0.0065 3178 ASP 129 OD1 -0.0089 0.0038 -0.0023 3179 ASP 129 OD2 -0.0131 -0.0004 -0.0091 3180 ILE 130 N -0.0055 -0.0022 -0.0067 3181 ILE 130 CA -0.0106 -0.0007 -0.0080 3182 ILE 130 C -0.0165 0.0040 -0.0064 3183 ILE 130 O -0.0221 0.0044 -0.0093 3184 ILE 130 CB -0.0078 0.0003 -0.0053 3185 ILE 130 CG1 -0.0029 -0.0048 -0.0079 3186 ILE 130 CG2 -0.0132 0.0028 -0.0058 3187 ILE 130 CD1 -0.0061 -0.0085 -0.0136 3188 ASP 131 N -0.0151 0.0077 -0.0017 3189 ASP 131 CA -0.0204 0.0123 0.0001 3190 ASP 131 C -0.0252 0.0108 -0.0043 3191 ASP 131 O -0.0312 0.0134 -0.0050 3192 ASP 131 CB -0.0175 0.0155 0.0052 3193 ASP 131 CG -0.0129 0.0175 0.0100 3194 ASP 131 OD1 -0.0133 0.0220 0.0146 3195 ASP 131 OD2 -0.0089 0.0145 0.0091 3196 GLY 132 N -0.0346 0.0046 -0.0080 3197 GLY 132 CA -0.0384 0.0032 -0.0111 3198 GLY 132 C -0.0378 0.0075 -0.0076 3199 GLY 132 O -0.0419 0.0076 -0.0098 3200 ASP 133 N -0.0329 0.0110 -0.0022 3201 ASP 133 CA -0.0317 0.0149 0.0014 3202 ASP 133 C -0.0262 0.0106 0.0013 3203 ASP 133 O -0.0243 0.0134 0.0044 3204 ASP 133 CB -0.0291 0.0210 0.0074 3205 ASP 133 CG -0.0213 0.0189 0.0103 3206 ASP 133 OD1 -0.0179 0.0127 0.0076 3207 ASP 133 OD2 -0.0185 0.0236 0.0153 3208 GLY 134 N -0.0235 0.0039 -0.0022 3209 GLY 134 CA -0.0186 -0.0008 -0.0029 3210 GLY 134 C -0.0104 -0.0020 0.0009 3211 GLY 134 O -0.0059 -0.0063 0.0002 3212 GLN 135 N -0.0057 0.0026 0.0014 3213 GLN 135 CA -0.0027 0.0024 0.0028 3214 GLN 135 C -0.0013 0.0022 0.0033 3215 GLN 135 O -0.0028 0.0026 0.0030 3216 GLN 135 CB -0.0025 0.0042 0.0053 3217 GLN 135 CG -0.0040 0.0046 0.0050 3218 GLN 135 CD -0.0036 0.0063 0.0075 3219 GLN 135 NE2 -0.0051 0.0081 0.0090 3220 GLN 135 OE1 -0.0018 0.0059 0.0080 3221 VAL 136 N 0.0015 0.0016 0.0041 3222 VAL 136 CA 0.0032 0.0014 0.0047 3223 VAL 136 C 0.0044 0.0030 0.0075 3224 VAL 136 O 0.0062 0.0030 0.0085 3225 VAL 136 CB 0.0056 -0.0007 0.0033 3226 VAL 136 CG1 0.0074 -0.0009 0.0041 3227 VAL 136 CG2 0.0043 -0.0023 0.0005 3228 ASN 137 N 0.0035 0.0043 0.0088 3229 ASN 137 CA 0.0047 0.0058 0.0114 3230 ASN 137 C 0.0075 0.0050 0.0118 3231 ASN 137 O 0.0083 0.0033 0.0100 3232 ASN 137 CB 0.0025 0.0077 0.0127 3233 ASN 137 CG 0.0014 0.0074 0.0117 3234 ASN 137 ND2 -0.0014 0.0084 0.0115 3235 ASN 137 OD1 0.0029 0.0062 0.0110 3236 TYR 138 N 0.0040 -0.0016 0.0042 3237 TYR 138 CA 0.0052 -0.0005 0.0043 3238 TYR 138 C 0.0066 0.0000 0.0055 3239 TYR 138 O 0.0076 0.0012 0.0052 3240 TYR 138 CB 0.0049 -0.0010 0.0047 3241 TYR 138 CG 0.0061 0.0000 0.0048 3242 TYR 138 CD1 0.0064 0.0011 0.0034 3243 TYR 138 CD2 0.0070 -0.0001 0.0063 3244 TYR 138 CE1 0.0075 0.0021 0.0035 3245 TYR 138 CE2 0.0081 0.0009 0.0063 3246 TYR 138 CZ 0.0083 0.0020 0.0049 3247 TYR 138 OH 0.0094 0.0030 0.0050 3248 GLU 139 N 0.0066 -0.0008 0.0068 3249 GLU 139 CA 0.0079 -0.0004 0.0080 3250 GLU 139 C 0.0084 0.0006 0.0073 3251 GLU 139 O 0.0097 0.0017 0.0074 3252 GLU 139 CB 0.0076 -0.0016 0.0095 3253 GLU 139 CG 0.0066 -0.0028 0.0100 3254 GLU 139 CD 0.0058 -0.0041 0.0107 3255 GLU 139 OE1 0.0060 -0.0039 0.0108 3256 GLU 139 OE2 0.0049 -0.0052 0.0112 3257 GLU 140 N 0.0075 0.0003 0.0064 3258 GLU 140 CA 0.0080 0.0012 0.0057 3259 GLU 140 C 0.0085 0.0025 0.0043 3260 GLU 140 O 0.0095 0.0036 0.0041 3261 GLU 140 CB 0.0068 0.0005 0.0050 3262 GLU 140 CG 0.0065 -0.0005 0.0062 3263 GLU 140 CD 0.0051 -0.0014 0.0055 3264 GLU 140 OE1 0.0040 -0.0019 0.0047 3265 GLU 140 OE2 0.0051 -0.0015 0.0056 3266 PHE 141 N 0.0071 -0.0016 0.0049 3267 PHE 141 CA 0.0066 -0.0011 0.0048 3268 PHE 141 C 0.0071 -0.0014 0.0049 3269 PHE 141 O 0.0074 -0.0007 0.0047 3270 PHE 141 CB 0.0053 -0.0013 0.0048 3271 PHE 141 CG 0.0046 -0.0007 0.0047 3272 PHE 141 CD1 0.0043 0.0004 0.0045 3273 PHE 141 CD2 0.0042 -0.0013 0.0048 3274 PHE 141 CE1 0.0037 0.0010 0.0044 3275 PHE 141 CE2 0.0036 -0.0007 0.0047 3276 PHE 141 CZ 0.0033 0.0004 0.0045 3277 VAL 142 N 0.0073 -0.0025 0.0050 3278 VAL 142 CA 0.0078 -0.0030 0.0051 3279 VAL 142 C 0.0090 -0.0025 0.0050 3280 VAL 142 O 0.0093 -0.0021 0.0050 3281 VAL 142 CB 0.0078 -0.0043 0.0053 3282 VAL 142 CG1 0.0087 -0.0048 0.0054 3283 VAL 142 CG2 0.0066 -0.0048 0.0053 3284 GLN 143 N 0.0097 -0.0025 0.0051 3285 GLN 143 CA 0.0109 -0.0021 0.0050 3286 GLN 143 C 0.0109 -0.0008 0.0048 3287 GLN 143 O 0.0116 -0.0005 0.0048 3288 GLN 143 CB 0.0115 -0.0023 0.0050 3289 GLN 143 CG 0.0118 -0.0035 0.0052 3290 GLN 143 CD 0.0127 -0.0040 0.0053 3291 GLN 143 NE2 0.0127 -0.0051 0.0055 3292 GLN 143 OE1 0.0133 -0.0033 0.0052 3293 MET 144 N 0.0053 -0.0089 0.0056 3294 MET 144 CA 0.0054 -0.0081 0.0051 3295 MET 144 C 0.0055 -0.0068 0.0046 3296 MET 144 O 0.0058 -0.0058 0.0048 3297 MET 144 CB 0.0049 -0.0088 0.0042 3298 MET 144 CG 0.0048 -0.0081 0.0037 3299 MET 144 SD 0.0046 -0.0071 0.0023 3300 MET 144 CE 0.0039 -0.0082 0.0012 3301 MET 145 N 0.0052 -0.0068 0.0039 3302 MET 145 CA 0.0053 -0.0056 0.0033 3303 MET 145 C 0.0059 -0.0046 0.0042 3304 MET 145 O 0.0061 -0.0035 0.0040 3305 MET 145 CB 0.0049 -0.0058 0.0023 3306 MET 145 CG 0.0043 -0.0064 0.0012 3307 MET 145 SD 0.0043 -0.0055 0.0004 3308 MET 145 CE 0.0038 -0.0050 -0.0010 3309 THR 146 N 0.0061 -0.0052 0.0051 3310 THR 146 CA 0.0066 -0.0044 0.0060 3311 THR 146 C 0.0071 -0.0038 0.0070 3312 THR 146 O 0.0075 -0.0029 0.0075 3313 THR 146 CB 0.0066 -0.0051 0.0066 3314 THR 146 CG2 0.0062 -0.0055 0.0056 3315 THR 146 OG1 0.0066 -0.0063 0.0073 3316 ALA 147 N 0.0051 -0.0071 0.0091 3317 ALA 147 CA 0.0010 -0.0093 0.0109 3318 ALA 147 C 0.0012 -0.0108 0.0109 3319 ALA 147 O 0.0047 -0.0118 0.0094 3320 ALA 147 CB 0.0000 -0.0136 0.0115