1 HIS 80 N 0.0036 0.0007 0.0006 2 HIS 80 CA 0.0033 0.0017 0.0008 3 HIS 80 C 0.0026 0.0018 0.0002 4 HIS 80 O 0.0024 0.0025 0.0003 5 HIS 80 CB 0.0040 0.0020 0.0015 6 HIS 80 CG 0.0047 0.0019 0.0021 7 HIS 80 CD2 0.0051 0.0012 0.0021 8 HIS 80 ND1 0.0053 0.0024 0.0027 9 HIS 80 CE1 0.0059 0.0021 0.0032 10 HIS 80 NE2 0.0058 0.0014 0.0028 11 PHE 81 N 0.0022 0.0012 -0.0005 12 PHE 81 CA 0.0014 0.0012 -0.0011 13 PHE 81 C 0.0008 0.0011 -0.0017 14 PHE 81 O 0.0002 0.0010 -0.0023 15 PHE 81 CB 0.0016 0.0005 -0.0012 16 PHE 81 CG 0.0018 0.0009 -0.0009 17 PHE 81 CD1 0.0012 0.0015 -0.0012 18 PHE 81 CD2 0.0025 0.0006 -0.0004 19 PHE 81 CE1 0.0013 0.0018 -0.0009 20 PHE 81 CE2 0.0027 0.0010 -0.0001 21 PHE 81 CZ 0.0021 0.0016 -0.0003 22 LYS 82 N 0.0008 0.0011 -0.0016 23 LYS 82 CA 0.0002 0.0010 -0.0022 24 LYS 82 C -0.0006 0.0016 -0.0027 25 LYS 82 O -0.0012 0.0013 -0.0033 26 LYS 82 CB 0.0004 0.0012 -0.0020 27 LYS 82 CG 0.0010 0.0003 -0.0018 28 LYS 82 CD 0.0007 -0.0001 -0.0023 29 LYS 82 CE 0.0004 0.0006 -0.0022 30 LYS 82 NZ 0.0005 0.0001 -0.0024 31 GLU 83 N 0.0081 0.0015 -0.0059 32 GLU 83 CA 0.0087 0.0019 -0.0069 33 GLU 83 C 0.0066 0.0021 -0.0075 34 GLU 83 O 0.0067 0.0021 -0.0074 35 GLU 83 CB 0.0102 0.0026 -0.0089 36 GLU 83 CG 0.0119 0.0028 -0.0093 37 GLU 83 CD 0.0134 0.0020 -0.0073 38 GLU 83 OE1 0.0145 0.0017 -0.0065 39 GLU 83 OE2 0.0134 0.0017 -0.0065 40 ALA 84 N 0.0047 0.0023 -0.0080 41 ALA 84 CA 0.0026 0.0024 -0.0084 42 ALA 84 C 0.0018 0.0017 -0.0063 43 ALA 84 O 0.0011 0.0017 -0.0063 44 ALA 84 CB 0.0007 0.0028 -0.0092 45 TRP 85 N 0.0018 0.0010 -0.0045 46 TRP 85 CA 0.0013 0.0002 -0.0024 47 TRP 85 C 0.0028 0.0000 -0.0020 48 TRP 85 O 0.0020 -0.0002 -0.0014 49 TRP 85 CB 0.0016 -0.0005 -0.0006 50 TRP 85 CG -0.0000 -0.0005 -0.0007 51 TRP 85 CD1 0.0004 -0.0002 -0.0016 52 TRP 85 CD2 -0.0023 -0.0008 0.0002 53 TRP 85 CE2 -0.0032 -0.0007 -0.0002 54 TRP 85 CE3 -0.0037 -0.0013 0.0013 55 TRP 85 NE1 -0.0015 -0.0003 -0.0013 56 TRP 85 CZ2 -0.0054 -0.0009 0.0005 57 TRP 85 CZ3 -0.0059 -0.0015 0.0019 58 TRP 85 CH2 -0.0067 -0.0013 0.0015 59 LYS 86 N 0.0056 -0.0002 -0.0049 60 LYS 86 CA 0.0070 -0.0006 -0.0044 61 LYS 86 C 0.0067 -0.0002 -0.0055 62 LYS 86 O 0.0069 -0.0005 -0.0047 63 LYS 86 CB 0.0092 -0.0008 -0.0046 64 LYS 86 CG 0.0095 -0.0011 -0.0038 65 LYS 86 CD 0.0114 -0.0018 -0.0027 66 LYS 86 CE 0.0122 -0.0019 -0.0027 67 LYS 86 NZ 0.0136 -0.0015 -0.0044 68 HIS 87 N 0.0063 0.0006 -0.0073 69 HIS 87 CA 0.0058 0.0011 -0.0084 70 HIS 87 C 0.0041 0.0009 -0.0075 71 HIS 87 O 0.0043 0.0008 -0.0072 72 HIS 87 CB 0.0053 0.0019 -0.0104 73 HIS 87 CG 0.0069 0.0022 -0.0119 74 HIS 87 CD2 0.0076 0.0026 -0.0132 75 HIS 87 ND1 0.0081 0.0022 -0.0123 76 HIS 87 CE1 0.0094 0.0025 -0.0137 77 HIS 87 NE2 0.0092 0.0028 -0.0142 78 ALA 88 N 0.0025 0.0009 -0.0069 79 ALA 88 CA 0.0008 0.0008 -0.0060 80 ALA 88 C 0.0013 0.0000 -0.0041 81 ALA 88 O 0.0006 -0.0001 -0.0036 82 ALA 88 CB -0.0010 0.0010 -0.0058 83 ILE 89 N -0.0007 -0.0021 -0.0059 84 ILE 89 CA -0.0006 -0.0036 -0.0044 85 ILE 89 C -0.0004 -0.0042 -0.0040 86 ILE 89 O -0.0011 -0.0048 -0.0027 87 ILE 89 CB 0.0006 -0.0046 -0.0045 88 ILE 89 CG1 0.0000 -0.0041 -0.0045 89 ILE 89 CG2 0.0010 -0.0061 -0.0031 90 ILE 89 CD1 0.0014 -0.0045 -0.0052 91 GLN 90 N 0.0007 -0.0041 -0.0050 92 GLN 90 CA 0.0011 -0.0047 -0.0047 93 GLN 90 C -0.0004 -0.0038 -0.0044 94 GLN 90 O -0.0007 -0.0045 -0.0034 95 GLN 90 CB 0.0026 -0.0047 -0.0060 96 GLN 90 CG 0.0031 -0.0055 -0.0056 97 GLN 90 CD 0.0035 -0.0071 -0.0043 98 GLN 90 NE2 0.0043 -0.0078 -0.0042 99 GLN 90 OE1 0.0031 -0.0076 -0.0034 100 LYS 91 N -0.0011 -0.0024 -0.0052 101 LYS 91 CA -0.0025 -0.0016 -0.0049 102 LYS 91 C -0.0039 -0.0019 -0.0034 103 LYS 91 O -0.0047 -0.0020 -0.0025 104 LYS 91 CB -0.0031 0.0001 -0.0061 105 LYS 91 CG -0.0047 0.0011 -0.0058 106 LYS 91 CD -0.0048 0.0007 -0.0053 107 LYS 91 CE -0.0056 0.0020 -0.0060 108 LYS 91 NZ -0.0060 0.0017 -0.0053 109 ALA 92 N -0.0013 -0.0019 -0.0055 110 ALA 92 CA -0.0022 -0.0025 -0.0046 111 ALA 92 C -0.0027 -0.0045 -0.0040 112 ALA 92 O -0.0038 -0.0050 -0.0030 113 ALA 92 CB -0.0015 -0.0025 -0.0053 114 LYS 93 N -0.0018 -0.0056 -0.0047 115 LYS 93 CA -0.0021 -0.0074 -0.0042 116 LYS 93 C -0.0034 -0.0074 -0.0031 117 LYS 93 O -0.0043 -0.0084 -0.0021 118 LYS 93 CB -0.0008 -0.0085 -0.0052 119 LYS 93 CG -0.0001 -0.0098 -0.0057 120 LYS 93 CD -0.0011 -0.0108 -0.0047 121 LYS 93 CE -0.0023 -0.0116 -0.0036 122 LYS 93 NZ -0.0034 -0.0126 -0.0025 123 HIS 94 N -0.0033 -0.0062 -0.0033 124 HIS 94 CA -0.0045 -0.0059 -0.0022 125 HIS 94 C -0.0058 -0.0051 -0.0012 126 HIS 94 O -0.0070 -0.0053 -0.0001 127 HIS 94 CB -0.0041 -0.0048 -0.0027 128 HIS 94 CG -0.0029 -0.0056 -0.0037 129 HIS 94 CD2 -0.0017 -0.0048 -0.0048 130 HIS 94 ND1 -0.0027 -0.0074 -0.0037 131 HIS 94 CE1 -0.0015 -0.0077 -0.0047 132 HIS 94 NE2 -0.0009 -0.0062 -0.0054 133 MET 95 N -0.0074 -0.0037 -0.0026 134 MET 95 CA -0.0063 -0.0024 -0.0012 135 MET 95 C -0.0065 -0.0026 -0.0011 136 MET 95 O -0.0068 -0.0030 -0.0028 137 MET 95 CB -0.0048 -0.0006 -0.0021 138 MET 95 CG -0.0038 0.0007 -0.0004 139 MET 95 SD -0.0041 0.0003 0.0005 140 MET 95 CE -0.0040 0.0005 0.0035 141 PRO 96 N -0.0063 -0.0023 0.0009 142 PRO 96 CA -0.0064 -0.0024 0.0011 143 PRO 96 C -0.0049 -0.0007 0.0005 144 PRO 96 O -0.0038 0.0007 0.0004 145 PRO 96 CB -0.0067 -0.0028 0.0036 146 PRO 96 CG -0.0060 -0.0019 0.0047 147 PRO 96 CD -0.0061 -0.0021 0.0031 148 ASP 97 N -0.0050 -0.0007 0.0002 149 ASP 97 CA -0.0036 0.0009 -0.0002 150 ASP 97 C -0.0029 0.0019 0.0021 151 ASP 97 O -0.0035 0.0012 0.0037 152 ASP 97 CB -0.0040 0.0004 -0.0010 153 ASP 97 CG -0.0027 0.0020 -0.0014 154 ASP 97 OD1 -0.0015 0.0035 -0.0012 155 ASP 97 OD2 -0.0028 0.0018 -0.0020 156 PRO 98 N -0.0012 0.0033 -0.0016 157 PRO 98 CA -0.0001 0.0027 -0.0013 158 PRO 98 C 0.0013 0.0036 -0.0010 159 PRO 98 O 0.0024 0.0031 -0.0007 160 PRO 98 CB -0.0008 0.0025 -0.0014 161 PRO 98 CG -0.0021 0.0036 -0.0018 162 PRO 98 CD -0.0026 0.0036 -0.0019 163 TRP 99 N 0.0013 0.0050 -0.0010 164 TRP 99 CA 0.0026 0.0061 -0.0008 165 TRP 99 C 0.0032 0.0064 -0.0006 166 TRP 99 O 0.0040 0.0075 -0.0005 167 TRP 99 CB 0.0022 0.0076 -0.0009 168 TRP 99 CG 0.0021 0.0075 -0.0009 169 TRP 99 CD1 0.0023 0.0062 -0.0008 170 TRP 99 CD2 0.0017 0.0087 -0.0011 171 TRP 99 CE2 0.0017 0.0081 -0.0011 172 TRP 99 CE3 0.0013 0.0102 -0.0012 173 TRP 99 NE1 0.0021 0.0066 -0.0009 174 TRP 99 CZ2 0.0014 0.0089 -0.0012 175 TRP 99 CZ3 0.0009 0.0111 -0.0014 176 TRP 99 CH2 0.0010 0.0104 -0.0013 177 ALA 100 N 0.0028 0.0054 -0.0007 178 ALA 100 CA 0.0032 0.0057 -0.0006 179 ALA 100 C 0.0049 0.0058 -0.0002 180 ALA 100 O 0.0054 0.0068 -0.0001 181 ALA 100 CB 0.0026 0.0044 -0.0007 182 GLU 101 N 0.0054 0.0065 0.0000 183 GLU 101 CA 0.0061 0.0065 0.0003 184 GLU 101 C 0.0064 0.0072 0.0005 185 GLU 101 O 0.0070 0.0073 0.0008 186 GLU 101 CB 0.0064 0.0058 0.0003 187 GLU 101 CG 0.0063 0.0059 0.0003 188 GLU 101 CD 0.0057 0.0055 0.0000 189 GLU 101 OE1 0.0051 0.0057 -0.0002 190 GLU 101 OE2 0.0059 0.0050 -0.0000 191 PHE 102 N 0.0059 0.0076 0.0005 192 PHE 102 CA 0.0061 0.0083 0.0006 193 PHE 102 C 0.0061 0.0089 0.0007 194 PHE 102 O 0.0064 0.0095 0.0009 195 PHE 102 CB 0.0057 0.0086 0.0005 196 PHE 102 CG 0.0057 0.0080 0.0004 197 PHE 102 CD1 0.0063 0.0078 0.0006 198 PHE 102 CD2 0.0051 0.0077 0.0002 199 PHE 102 CE1 0.0063 0.0073 0.0005 200 PHE 102 CE2 0.0051 0.0072 0.0001 201 PHE 102 CZ 0.0057 0.0070 0.0003 202 HIS 103 N 0.0058 0.0088 0.0006 203 HIS 103 CA 0.0058 0.0092 0.0006 204 HIS 103 C 0.0056 0.0100 0.0007 205 HIS 103 O 0.0060 0.0105 0.0009 206 HIS 103 CB 0.0064 0.0091 0.0009 207 HIS 103 CG 0.0066 0.0083 0.0008 208 HIS 103 CD2 0.0070 0.0078 0.0009 209 HIS 103 ND1 0.0061 0.0081 0.0006 210 HIS 103 CE1 0.0064 0.0074 0.0006 211 HIS 103 NE2 0.0069 0.0072 0.0007 212 LEU 104 N 0.0052 0.0058 -0.0007 213 LEU 104 CA 0.0051 0.0045 -0.0001 214 LEU 104 C 0.0065 0.0020 0.0003 215 LEU 104 O 0.0060 0.0005 0.0013 216 LEU 104 CB 0.0060 0.0060 -0.0011 217 LEU 104 CG 0.0047 0.0085 -0.0016 218 LEU 104 CD1 0.0059 0.0098 -0.0028 219 LEU 104 CD2 0.0021 0.0086 -0.0005 220 GLU 105 N 0.0083 0.0016 -0.0003 221 GLU 105 CA 0.0097 -0.0008 0.0001 222 GLU 105 C 0.0083 -0.0027 0.0016 223 GLU 105 O 0.0091 -0.0049 0.0021 224 GLU 105 CB 0.0118 -0.0008 -0.0009 225 GLU 105 CG 0.0112 -0.0003 -0.0008 226 GLU 105 CD 0.0104 0.0023 -0.0016 227 GLU 105 OE1 0.0107 0.0038 -0.0024 228 GLU 105 OE2 0.0094 0.0028 -0.0013 229 ASP 106 N 0.0062 -0.0020 0.0022 230 ASP 106 CA 0.0047 -0.0037 0.0037 231 ASP 106 C 0.0032 -0.0044 0.0047 232 ASP 106 O 0.0020 -0.0061 0.0059 233 ASP 106 CB 0.0032 -0.0027 0.0040 234 ASP 106 CG 0.0045 -0.0027 0.0033 235 ASP 106 OD1 0.0064 -0.0041 0.0031 236 ASP 106 OD2 0.0037 -0.0012 0.0031 237 ILE 107 N 0.0022 -0.0064 0.0035 238 ILE 107 CA 0.0021 -0.0051 0.0041 239 ILE 107 C 0.0027 -0.0066 0.0024 240 ILE 107 O 0.0036 -0.0077 0.0003 241 ILE 107 CB 0.0029 -0.0020 0.0037 242 ILE 107 CG1 0.0023 -0.0006 0.0054 243 ILE 107 CG2 0.0030 -0.0006 0.0041 244 ILE 107 CD1 0.0031 0.0024 0.0049 245 ALA 108 N 0.0022 -0.0067 0.0034 246 ALA 108 CA 0.0026 -0.0080 0.0021 247 ALA 108 C 0.0041 -0.0064 -0.0002 248 ALA 108 O 0.0045 -0.0039 0.0000 249 ALA 108 CB 0.0017 -0.0081 0.0038 250 THR 109 N 0.0050 -0.0080 -0.0024 251 THR 109 CA 0.0064 -0.0067 -0.0047 252 THR 109 C 0.0066 -0.0055 -0.0046 253 THR 109 O 0.0059 -0.0067 -0.0037 254 THR 109 CB 0.0072 -0.0088 -0.0069 255 THR 109 CG2 0.0087 -0.0075 -0.0094 256 THR 109 OG1 0.0070 -0.0099 -0.0070 257 GLU 110 N 0.0054 -0.0005 -0.0095 258 GLU 110 CA 0.0058 -0.0003 -0.0097 259 GLU 110 C 0.0069 -0.0002 -0.0107 260 GLU 110 O 0.0075 0.0001 -0.0110 261 GLU 110 CB 0.0056 0.0009 -0.0090 262 GLU 110 CG 0.0046 0.0008 -0.0081 263 GLU 110 CD 0.0045 0.0020 -0.0074 264 GLU 110 OE1 0.0044 0.0028 -0.0069 265 GLU 110 OE2 0.0046 0.0021 -0.0075 266 ARG 111 N 0.0073 -0.0006 -0.0111 267 ARG 111 CA 0.0084 -0.0005 -0.0121 268 ARG 111 C 0.0089 0.0006 -0.0120 269 ARG 111 O 0.0085 0.0008 -0.0115 270 ARG 111 CB 0.0084 -0.0017 -0.0127 271 ARG 111 CG 0.0095 -0.0020 -0.0138 272 ARG 111 CD 0.0094 -0.0032 -0.0143 273 ARG 111 NE 0.0103 -0.0032 -0.0151 274 ARG 111 CZ 0.0104 -0.0042 -0.0157 275 ARG 111 NH1 0.0096 -0.0052 -0.0156 276 ARG 111 NH2 0.0113 -0.0041 -0.0164 277 ALA 112 N 0.0098 0.0013 -0.0124 278 ALA 112 CA 0.0104 0.0023 -0.0124 279 ALA 112 C 0.0116 0.0024 -0.0134 280 ALA 112 O 0.0120 0.0018 -0.0140 281 ALA 112 CB 0.0103 0.0035 -0.0117 282 THR 113 N 0.0060 -0.0014 -0.0122 283 THR 113 CA 0.0051 -0.0026 -0.0093 284 THR 113 C 0.0038 -0.0032 -0.0115 285 THR 113 O 0.0015 -0.0046 -0.0141 286 THR 113 CB 0.0027 -0.0050 -0.0067 287 THR 113 CG2 0.0017 -0.0064 -0.0039 288 THR 113 OG1 0.0041 -0.0044 -0.0045 289 ARG 114 N 0.0053 -0.0022 -0.0106 290 ARG 114 CA 0.0043 -0.0027 -0.0124 291 ARG 114 C 0.0022 -0.0049 -0.0097 292 ARG 114 O 0.0031 -0.0048 -0.0062 293 ARG 114 CB 0.0071 -0.0003 -0.0131 294 ARG 114 CG 0.0063 -0.0007 -0.0142 295 ARG 114 CD 0.0091 0.0018 -0.0152 296 ARG 114 NE 0.0116 0.0031 -0.0118 297 ARG 114 CZ 0.0141 0.0051 -0.0117 298 ARG 114 NH1 0.0146 0.0061 -0.0148 299 ARG 114 NH2 0.0162 0.0061 -0.0085 300 HIS 115 N -0.0006 -0.0068 -0.0115 301 HIS 115 CA -0.0029 -0.0089 -0.0097 302 HIS 115 C -0.0029 -0.0086 -0.0115 303 HIS 115 O -0.0035 -0.0084 -0.0151 304 HIS 115 CB -0.0062 -0.0115 -0.0104 305 HIS 115 CG -0.0064 -0.0118 -0.0092 306 HIS 115 CD2 -0.0060 -0.0111 -0.0112 307 HIS 115 ND1 -0.0071 -0.0131 -0.0055 308 HIS 115 CE1 -0.0071 -0.0132 -0.0052 309 HIS 115 NE2 -0.0064 -0.0119 -0.0086 310 ARG 116 N -0.0016 -0.0148 -0.0071 311 ARG 116 CA -0.0008 -0.0132 -0.0097 312 ARG 116 C -0.0029 -0.0147 -0.0083 313 ARG 116 O -0.0027 -0.0165 -0.0046 314 ARG 116 CB 0.0040 -0.0116 -0.0096 315 ARG 116 CG 0.0060 -0.0094 -0.0126 316 ARG 116 CD 0.0108 -0.0080 -0.0120 317 ARG 116 NE 0.0128 -0.0094 -0.0079 318 ARG 116 CZ 0.0167 -0.0089 -0.0062 319 ARG 116 NH1 0.0193 -0.0070 -0.0083 320 ARG 116 NH2 0.0181 -0.0103 -0.0025 321 TYR 117 N -0.0049 -0.0139 -0.0112 322 TYR 117 CA -0.0073 -0.0152 -0.0102 323 TYR 117 C -0.0048 -0.0140 -0.0109 324 TYR 117 O -0.0032 -0.0119 -0.0141 325 TYR 117 CB -0.0117 -0.0155 -0.0128 326 TYR 117 CG -0.0144 -0.0169 -0.0119 327 TYR 117 CD1 -0.0160 -0.0193 -0.0083 328 TYR 117 CD2 -0.0155 -0.0158 -0.0148 329 TYR 117 CE1 -0.0185 -0.0206 -0.0075 330 TYR 117 CE2 -0.0180 -0.0170 -0.0140 331 TYR 117 CZ -0.0194 -0.0194 -0.0104 332 TYR 117 OH -0.0219 -0.0207 -0.0096 333 ASN 118 N -0.0045 -0.0154 -0.0080 334 ASN 118 CA -0.0027 -0.0146 -0.0084 335 ASN 118 C -0.0065 -0.0156 -0.0089 336 ASN 118 O -0.0087 -0.0178 -0.0062 337 ASN 118 CB 0.0005 -0.0154 -0.0046 338 ASN 118 CG 0.0029 -0.0143 -0.0050 339 ASN 118 ND2 0.0070 -0.0137 -0.0034 340 ASN 118 OD1 0.0011 -0.0140 -0.0069 341 ALA 119 N -0.0052 -0.0271 -0.0106 342 ALA 119 CA -0.0134 -0.0178 -0.0145 343 ALA 119 C -0.0151 -0.0146 -0.0232 344 ALA 119 O -0.0223 -0.0066 -0.0248 345 ALA 119 CB -0.0145 -0.0157 -0.0201 346 VAL 120 N -0.0087 -0.0205 -0.0290 347 VAL 120 CA -0.0101 -0.0179 -0.0366 348 VAL 120 C -0.0127 -0.0162 -0.0290 349 VAL 120 O -0.0186 -0.0097 -0.0312 350 VAL 120 CB -0.0023 -0.0249 -0.0452 351 VAL 120 CG1 -0.0036 -0.0223 -0.0529 352 VAL 120 CG2 0.0000 -0.0262 -0.0530 353 THR 121 N -0.0084 -0.0222 -0.0199 354 THR 121 CA -0.0103 -0.0215 -0.0119 355 THR 121 C -0.0165 -0.0165 -0.0013 356 THR 121 O -0.0198 -0.0139 0.0049 357 THR 121 CB -0.0024 -0.0306 -0.0074 358 THR 121 CG2 0.0043 -0.0361 -0.0178 359 THR 121 OG1 0.0005 -0.0349 0.0007 360 GLY 122 N -0.0147 -0.0215 0.0006 361 GLY 122 CA -0.0211 -0.0236 0.0011 362 GLY 122 C -0.0193 -0.0252 0.0061 363 GLY 122 O -0.0244 -0.0280 0.0092 364 GLU 123 N -0.0122 -0.0235 0.0069 365 GLU 123 CA -0.0097 -0.0252 0.0124 366 GLU 123 C -0.0072 -0.0230 0.0089 367 GLU 123 O -0.0042 -0.0197 0.0033 368 GLU 123 CB -0.0031 -0.0256 0.0176 369 GLU 123 CG -0.0055 -0.0287 0.0231 370 GLU 123 CD 0.0008 -0.0296 0.0292 371 GLU 123 OE1 0.0074 -0.0270 0.0276 372 GLU 123 OE2 -0.0009 -0.0329 0.0355 373 TRP 124 N -0.0085 -0.0249 0.0125 374 TRP 124 CA -0.0058 -0.0232 0.0103 375 TRP 124 C 0.0014 -0.0232 0.0150 376 TRP 124 O 0.0023 -0.0258 0.0215 377 TRP 124 CB -0.0119 -0.0251 0.0107 378 TRP 124 CG -0.0186 -0.0246 0.0052 379 TRP 124 CD1 -0.0250 -0.0268 0.0060 380 TRP 124 CD2 -0.0196 -0.0218 -0.0019 381 TRP 124 CE2 -0.0268 -0.0224 -0.0052 382 TRP 124 CE3 -0.0152 -0.0188 -0.0059 383 TRP 124 NE1 -0.0299 -0.0255 -0.0002 384 TRP 124 CZ2 -0.0296 -0.0201 -0.0122 385 TRP 124 CZ3 -0.0180 -0.0165 -0.0129 386 TRP 124 CH2 -0.0252 -0.0172 -0.0159 387 LEU 125 N 0.0040 -0.0254 0.0104 388 LEU 125 CA 0.0083 -0.0220 0.0130 389 LEU 125 C 0.0082 -0.0197 0.0085 390 LEU 125 O 0.0078 -0.0173 0.0031 391 LEU 125 CB 0.0127 -0.0178 0.0143 392 LEU 125 CG 0.0174 -0.0136 0.0163 393 LEU 125 CD1 0.0179 -0.0158 0.0212 394 LEU 125 CD2 0.0214 -0.0103 0.0184 395 ASP 126 N 0.0085 -0.0205 0.0106 396 ASP 126 CA 0.0084 -0.0186 0.0069 397 ASP 126 C 0.0133 -0.0144 0.0090 398 ASP 126 O 0.0157 -0.0146 0.0146 399 ASP 126 CB 0.0047 -0.0229 0.0071 400 ASP 126 CG 0.0065 -0.0238 0.0125 401 ASP 126 OD1 0.0061 -0.0269 0.0175 402 ASP 126 OD2 0.0082 -0.0214 0.0118 403 ASP 127 N 0.0147 -0.0104 0.0046 404 ASP 127 CA 0.0191 -0.0062 0.0061 405 ASP 127 C 0.0188 -0.0038 0.0008 406 ASP 127 O 0.0153 -0.0051 -0.0039 407 ASP 127 CB 0.0232 -0.0024 0.0075 408 ASP 127 CG 0.0232 0.0006 0.0018 409 ASP 127 OD1 0.0193 -0.0014 -0.0024 410 ASP 127 OD2 0.0270 0.0050 0.0016 411 GLU 128 N 0.0162 -0.0001 -0.0110 412 GLU 128 CA 0.0150 -0.0005 -0.0101 413 GLU 128 C 0.0151 -0.0000 -0.0102 414 GLU 128 O 0.0160 -0.0002 -0.0109 415 GLU 128 CB 0.0148 -0.0023 -0.0099 416 GLU 128 CG 0.0146 -0.0029 -0.0097 417 GLU 128 CD 0.0134 -0.0022 -0.0088 418 GLU 128 OE1 0.0123 -0.0027 -0.0080 419 GLU 128 OE2 0.0135 -0.0012 -0.0089 420 VAL 129 N 0.0140 0.0006 -0.0094 421 VAL 129 CA 0.0138 0.0010 -0.0093 422 VAL 129 C 0.0126 0.0004 -0.0083 423 VAL 129 O 0.0117 0.0002 -0.0076 424 VAL 129 CB 0.0140 0.0028 -0.0094 425 VAL 129 CG1 0.0153 0.0033 -0.0105 426 VAL 129 CG2 0.0130 0.0037 -0.0087 427 LEU 130 N 0.0125 0.0003 -0.0082 428 LEU 130 CA 0.0113 -0.0002 -0.0073 429 LEU 130 C 0.0109 0.0012 -0.0070 430 LEU 130 O 0.0116 0.0019 -0.0076 431 LEU 130 CB 0.0116 -0.0016 -0.0075 432 LEU 130 CG 0.0121 -0.0031 -0.0079 433 LEU 130 CD1 0.0124 -0.0044 -0.0080 434 LEU 130 CD2 0.0112 -0.0036 -0.0072 435 ILE 131 N 0.0086 -0.0003 -0.0065 436 ILE 131 CA 0.0078 0.0017 -0.0064 437 ILE 131 C 0.0064 0.0010 -0.0049 438 ILE 131 O 0.0056 -0.0005 -0.0036 439 ILE 131 CB 0.0070 0.0039 -0.0064 440 ILE 131 CG1 0.0053 0.0036 -0.0047 441 ILE 131 CG2 0.0083 0.0044 -0.0079 442 ILE 131 CD1 0.0044 0.0056 -0.0046 443 LYS 132 N 0.0061 0.0022 -0.0050 444 LYS 132 CA 0.0046 0.0021 -0.0036 445 LYS 132 C 0.0035 0.0046 -0.0034 446 LYS 132 O 0.0041 0.0060 -0.0045 447 LYS 132 CB 0.0052 0.0011 -0.0038 448 LYS 132 CG 0.0059 -0.0015 -0.0035 449 LYS 132 CD 0.0067 -0.0024 -0.0040 450 LYS 132 CE 0.0075 -0.0050 -0.0038 451 LYS 132 NZ 0.0083 -0.0059 -0.0043 452 MET 133 N 0.0019 0.0051 -0.0021 453 MET 133 CA 0.0008 0.0074 -0.0019 454 MET 133 C -0.0009 0.0076 -0.0003 455 MET 133 O -0.0018 0.0061 0.0010 456 MET 133 CB 0.0004 0.0081 -0.0017 457 MET 133 CG -0.0001 0.0107 -0.0021 458 MET 133 SD -0.0017 0.0115 -0.0009 459 MET 133 CE -0.0001 0.0121 -0.0025 460 ALA 134 N -0.0044 0.0075 -0.0003 461 ALA 134 CA -0.0016 0.0059 0.0048 462 ALA 134 C -0.0015 0.0115 0.0099 463 ALA 134 O -0.0041 0.0170 0.0088 464 ALA 134 CB -0.0018 0.0038 0.0024 465 SER 135 N 0.0016 0.0101 0.0156 466 SER 135 CA 0.0020 0.0151 0.0209 467 SER 135 C 0.0013 0.0178 0.0218 468 SER 135 O 0.0007 0.0230 0.0250 469 SER 135 CB 0.0055 0.0126 0.0268 470 SER 135 OG 0.0080 0.0065 0.0271 471 GLN 136 N 0.0014 0.0144 0.0191 472 GLN 136 CA 0.0009 0.0166 0.0198 473 GLN 136 C -0.0020 0.0169 0.0135 474 GLN 136 O -0.0024 0.0128 0.0090 475 GLN 136 CB 0.0041 0.0122 0.0232 476 GLN 136 CG 0.0070 0.0127 0.0301 477 GLN 136 CD 0.0057 0.0194 0.0332 478 GLN 136 NE2 0.0070 0.0201 0.0367 479 GLN 136 OE1 0.0036 0.0239 0.0324 480 PRO 137 N -0.0089 0.0180 0.0039 481 PRO 137 CA -0.0082 0.0186 0.0043 482 PRO 137 C -0.0086 0.0190 0.0054 483 PRO 137 O -0.0091 0.0191 0.0061 484 PRO 137 CB -0.0071 0.0190 0.0042 485 PRO 137 CG -0.0075 0.0189 0.0043 486 PRO 137 CD -0.0085 0.0182 0.0039 487 PHE 138 N -0.0082 0.0192 0.0056 488 PHE 138 CA -0.0086 0.0196 0.0067 489 PHE 138 C -0.0076 0.0204 0.0073 490 PHE 138 O -0.0077 0.0208 0.0081 491 PHE 138 CB -0.0090 0.0194 0.0065 492 PHE 138 CG -0.0081 0.0196 0.0061 493 PHE 138 CD1 -0.0077 0.0191 0.0050 494 PHE 138 CD2 -0.0076 0.0201 0.0068 495 PHE 138 CE1 -0.0069 0.0193 0.0046 496 PHE 138 CE2 -0.0067 0.0203 0.0064 497 PHE 138 CZ -0.0064 0.0198 0.0053 498 GLY 139 N -0.0067 0.0205 0.0069 499 GLY 139 CA -0.0058 0.0212 0.0075 500 GLY 139 C -0.0048 0.0213 0.0068 501 GLY 139 O -0.0047 0.0208 0.0058 502 ARG 140 N 0.0034 -0.0080 0.0083 503 ARG 140 CA 0.0039 -0.0068 0.0079 504 ARG 140 C 0.0037 -0.0140 0.0093 505 ARG 140 O 0.0069 -0.0196 0.0093 506 ARG 140 CB 0.0107 -0.0029 0.0050 507 ARG 140 CG 0.0176 -0.0075 0.0037 508 ARG 140 CD 0.0238 -0.0037 0.0010 509 ARG 140 NE 0.0253 0.0030 -0.0007 510 ARG 140 CZ 0.0318 0.0047 -0.0030 511 ARG 140 NH1 0.0374 0.0002 -0.0040 512 ARG 140 NH2 0.0325 0.0109 -0.0044 513 GLY 141 N -0.0001 -0.0140 0.0105 514 GLY 141 CA -0.0000 -0.0202 0.0116 515 GLY 141 C 0.0058 -0.0198 0.0097 516 GLY 141 O 0.0115 -0.0171 0.0074 517 ALA 142 N 0.0044 -0.0226 0.0107 518 ALA 142 CA 0.0094 -0.0218 0.0090 519 ALA 142 C 0.0083 -0.0144 0.0079 520 ALA 142 O 0.0133 -0.0120 0.0059 521 ALA 142 CB 0.0086 -0.0279 0.0104 522 MET 143 N -0.0020 0.0042 0.0019 523 MET 143 CA -0.0026 0.0064 0.0020 524 MET 143 C -0.0026 0.0073 0.0020 525 MET 143 O -0.0022 0.0092 0.0022 526 MET 143 CB -0.0047 0.0067 0.0016 527 MET 143 CG -0.0048 0.0061 0.0015 528 MET 143 SD -0.0034 0.0079 0.0019 529 MET 143 CE -0.0049 0.0102 0.0017 530 ARG 144 N -0.0030 0.0062 0.0019 531 ARG 144 CA -0.0034 0.0071 0.0019 532 ARG 144 C -0.0023 0.0059 0.0020 533 ARG 144 O -0.0022 0.0040 0.0019 534 ARG 144 CB -0.0057 0.0072 0.0014 535 ARG 144 CG -0.0069 0.0086 0.0013 536 ARG 144 CD -0.0091 0.0087 0.0009 537 ARG 144 NE -0.0100 0.0067 0.0006 538 ARG 144 CZ -0.0119 0.0063 0.0002 539 ARG 144 NH1 -0.0131 0.0078 0.0001 540 ARG 144 NH2 -0.0126 0.0044 -0.0000 541 GLU 145 N -0.0016 0.0071 0.0022 542 GLU 145 CA -0.0007 0.0064 0.0023 543 GLU 145 C -0.0024 0.0064 0.0020 544 GLU 145 O -0.0038 0.0076 0.0018 545 GLU 145 CB 0.0010 0.0078 0.0027 546 GLU 145 CG 0.0031 0.0072 0.0031 547 GLU 145 CD 0.0046 0.0089 0.0034 548 GLU 145 OE1 0.0042 0.0102 0.0034 549 GLU 145 OE2 0.0062 0.0088 0.0037 550 CYS 146 N -0.0057 0.0162 0.0020 551 CYS 146 CA -0.0053 0.0156 0.0014 552 CYS 146 C -0.0048 0.0149 0.0019 553 CYS 146 O -0.0046 0.0146 0.0023 554 CYS 146 CB -0.0053 0.0155 0.0005 555 CYS 146 SG -0.0060 0.0164 -0.0001 556 PHE 147 N -0.0045 0.0145 0.0018 557 PHE 147 CA -0.0040 0.0138 0.0022 558 PHE 147 C -0.0036 0.0132 0.0014 559 PHE 147 O -0.0038 0.0134 0.0008 560 PHE 147 CB -0.0040 0.0139 0.0029 561 PHE 147 CG -0.0043 0.0144 0.0038 562 PHE 147 CD1 -0.0049 0.0152 0.0037 563 PHE 147 CD2 -0.0041 0.0141 0.0046 564 PHE 147 CE1 -0.0052 0.0157 0.0044 565 PHE 147 CE2 -0.0044 0.0146 0.0053 566 PHE 147 CZ -0.0049 0.0154 0.0053 567 ARG 148 N -0.0032 0.0125 0.0015 568 ARG 148 CA -0.0028 0.0119 0.0008 569 ARG 148 C -0.0026 0.0117 0.0012 570 ARG 148 O -0.0025 0.0116 0.0020 571 ARG 148 CB -0.0023 0.0112 0.0008 572 ARG 148 CG -0.0024 0.0114 0.0005 573 ARG 148 CD -0.0019 0.0106 0.0002 574 ARG 148 NE -0.0021 0.0108 -0.0003 575 ARG 148 CZ -0.0021 0.0109 0.0001 576 ARG 148 NH1 -0.0020 0.0109 0.0010 577 ARG 148 NH2 -0.0023 0.0111 -0.0004 578 THR 149 N 0.0019 0.0080 -0.0009 579 THR 149 CA 0.0023 0.0069 -0.0012 580 THR 149 C 0.0031 0.0063 -0.0019 581 THR 149 O 0.0036 0.0070 -0.0025 582 THR 149 CB 0.0025 0.0073 -0.0014 583 THR 149 CG2 0.0028 0.0061 -0.0016 584 THR 149 OG1 0.0017 0.0080 -0.0007 585 LYS 150 N 0.0032 0.0051 -0.0019 586 LYS 150 CA 0.0041 0.0044 -0.0027 587 LYS 150 C 0.0045 0.0038 -0.0031 588 LYS 150 O 0.0041 0.0031 -0.0026 589 LYS 150 CB 0.0039 0.0034 -0.0024 590 LYS 150 CG 0.0047 0.0029 -0.0032 591 LYS 150 CD 0.0045 0.0021 -0.0029 592 LYS 150 CE 0.0052 0.0023 -0.0036 593 LYS 150 NZ 0.0055 0.0035 -0.0042 594 LYS 151 N 0.0053 0.0041 -0.0040 595 LYS 151 CA 0.0059 0.0035 -0.0045 596 LYS 151 C 0.0064 0.0024 -0.0049 597 LYS 151 O 0.0068 0.0026 -0.0054 598 LYS 151 CB 0.0065 0.0044 -0.0053 599 LYS 151 CG 0.0069 0.0038 -0.0057 600 LYS 151 CD 0.0074 0.0048 -0.0063 601 LYS 151 CE 0.0081 0.0054 -0.0071 602 LYS 151 NZ 0.0088 0.0044 -0.0078 603 LEU 152 N 0.0073 -0.0043 -0.0000 604 LEU 152 CA 0.0063 -0.0051 -0.0005 605 LEU 152 C 0.0056 -0.0050 -0.0017 606 LEU 152 O 0.0057 -0.0042 -0.0026 607 LEU 152 CB 0.0064 -0.0050 -0.0005 608 LEU 152 CG 0.0072 -0.0050 0.0007 609 LEU 152 CD1 0.0071 -0.0050 0.0006 610 LEU 152 CD2 0.0070 -0.0061 0.0017 611 SER 153 N 0.0050 -0.0058 -0.0018 612 SER 153 CA 0.0040 -0.0061 -0.0028 613 SER 153 C 0.0033 -0.0073 -0.0025 614 SER 153 O 0.0035 -0.0076 -0.0018 615 SER 153 CB 0.0039 -0.0060 -0.0032 616 SER 153 OG 0.0042 -0.0064 -0.0021 617 ASN 154 N 0.0024 -0.0079 -0.0031 618 ASN 154 CA 0.0017 -0.0091 -0.0028 619 ASN 154 C 0.0015 -0.0093 -0.0028 620 ASN 154 O 0.0014 -0.0100 -0.0020 621 ASN 154 CB 0.0019 -0.0098 -0.0015 622 ASN 154 CG 0.0016 -0.0101 -0.0016 623 ASN 154 ND2 0.0006 -0.0110 -0.0021 624 ASN 154 OD1 0.0021 -0.0097 -0.0013 625 PHE 155 N 0.0043 -0.0206 0.0059 626 PHE 155 CA 0.0130 -0.0103 0.0083 627 PHE 155 C 0.0171 -0.0023 0.0127 628 PHE 155 O 0.0270 0.0045 0.0104 629 PHE 155 CB 0.0090 -0.0062 0.0162 630 PHE 155 CG 0.0098 -0.0105 0.0112 631 PHE 155 CD1 0.0193 -0.0053 0.0076 632 PHE 155 CD2 0.0009 -0.0196 0.0100 633 PHE 155 CE1 0.0200 -0.0092 0.0029 634 PHE 155 CE2 0.0016 -0.0236 0.0054 635 PHE 155 CZ 0.0112 -0.0184 0.0018 636 LEU 156 N 0.0098 -0.0030 0.0188 637 LEU 156 CA 0.0127 0.0045 0.0236 638 LEU 156 C 0.0169 0.0011 0.0164 639 LEU 156 O 0.0245 0.0078 0.0162 640 LEU 156 CB 0.0028 0.0058 0.0342 641 LEU 156 CG -0.0023 0.0095 0.0427 642 LEU 156 CD1 -0.0148 0.0027 0.0474 643 LEU 156 CD2 0.0010 0.0211 0.0515 644 HIS 157 N 0.0121 -0.0092 0.0104 645 HIS 157 CA 0.0150 -0.0132 0.0035 646 HIS 157 C 0.0172 -0.0222 -0.0076 647 HIS 157 O 0.0115 -0.0286 -0.0089 648 HIS 157 CB 0.0058 -0.0170 0.0082 649 HIS 157 CG 0.0045 -0.0081 0.0184 650 HIS 157 CD2 0.0108 -0.0006 0.0203 651 HIS 157 ND1 -0.0042 -0.0064 0.0283 652 HIS 157 CE1 -0.0032 0.0019 0.0358 653 HIS 157 NE2 0.0058 0.0056 0.0312 654 ALA 158 N 0.0049 -0.0132 0.0023 655 ALA 158 CA 0.0051 -0.0133 0.0024 656 ALA 158 C 0.0036 -0.0129 0.0007 657 ALA 158 O 0.0029 -0.0132 -0.0010 658 ALA 158 CB 0.0069 -0.0151 0.0023 659 GLN 159 N 0.0033 -0.0123 0.0012 660 GLN 159 CA 0.0020 -0.0119 -0.0003 661 GLN 159 C 0.0025 -0.0135 -0.0023 662 GLN 159 O 0.0038 -0.0147 -0.0021 663 GLN 159 CB 0.0018 -0.0112 0.0006 664 GLN 159 CG 0.0003 -0.0093 0.0014 665 GLN 159 CD -0.0000 -0.0087 0.0019 666 GLN 159 NE2 0.0012 -0.0088 0.0036 667 GLN 159 OE1 -0.0013 -0.0080 0.0009 668 GLN 160 N 0.0014 -0.0136 -0.0041 669 GLN 160 CA 0.0018 -0.0150 -0.0060 670 GLN 160 C 0.0014 -0.0149 -0.0064 671 GLN 160 O 0.0027 -0.0158 -0.0059 672 GLN 160 CB 0.0007 -0.0150 -0.0078 673 GLN 160 CG 0.0011 -0.0152 -0.0073 674 GLN 160 CD 0.0027 -0.0170 -0.0080 675 GLN 160 NE2 0.0033 -0.0173 -0.0072 676 GLN 160 OE1 0.0032 -0.0182 -0.0091 677 TRP 161 N -0.0026 -0.0054 -0.0065 678 TRP 161 CA -0.0025 -0.0043 -0.0051 679 TRP 161 C -0.0025 -0.0040 -0.0040 680 TRP 161 O -0.0022 -0.0034 -0.0046 681 TRP 161 CB -0.0018 -0.0028 -0.0056 682 TRP 161 CG -0.0017 -0.0017 -0.0042 683 TRP 161 CD1 -0.0021 -0.0020 -0.0027 684 TRP 161 CD2 -0.0011 -0.0001 -0.0040 685 TRP 161 CE2 -0.0012 0.0005 -0.0025 686 TRP 161 CE3 -0.0006 0.0009 -0.0051 687 TRP 161 NE1 -0.0017 -0.0007 -0.0017 688 TRP 161 CZ2 -0.0007 0.0020 -0.0020 689 TRP 161 CZ3 -0.0001 0.0025 -0.0046 690 TRP 161 CH2 -0.0002 0.0030 -0.0030 691 LYS 162 N -0.0030 -0.0044 -0.0025 692 LYS 162 CA -0.0031 -0.0044 -0.0015 693 LYS 162 C -0.0026 -0.0028 -0.0009 694 LYS 162 O -0.0027 -0.0027 -0.0001 695 LYS 162 CB -0.0037 -0.0054 0.0000 696 LYS 162 CG -0.0042 -0.0070 -0.0004 697 LYS 162 CD -0.0046 -0.0074 0.0009 698 LYS 162 CE -0.0051 -0.0089 0.0004 699 LYS 162 NZ -0.0057 -0.0099 0.0018 700 GLY 163 N -0.0021 -0.0016 -0.0013 701 GLY 163 CA -0.0017 -0.0000 -0.0007 702 GLY 163 C -0.0011 0.0010 -0.0020 703 GLY 163 O -0.0006 0.0024 -0.0017 704 ALA 164 N 0.0012 0.0021 -0.0039 705 ALA 164 CA 0.0012 0.0027 -0.0046 706 ALA 164 C 0.0014 0.0034 -0.0044 707 ALA 164 O 0.0014 0.0040 -0.0049 708 ALA 164 CB 0.0008 0.0024 -0.0053 709 SER 165 N 0.0015 0.0033 -0.0038 710 SER 165 CA 0.0017 0.0039 -0.0037 711 SER 165 C 0.0021 0.0043 -0.0029 712 SER 165 O 0.0023 0.0047 -0.0026 713 SER 165 CB 0.0016 0.0035 -0.0037 714 SER 165 OG 0.0013 0.0031 -0.0044 715 ASN 166 N 0.0022 0.0042 -0.0026 716 ASN 166 CA 0.0025 0.0046 -0.0019 717 ASN 166 C 0.0026 0.0055 -0.0021 718 ASN 166 O 0.0025 0.0056 -0.0026 719 ASN 166 CB 0.0025 0.0041 -0.0014 720 ASN 166 CG 0.0024 0.0033 -0.0011 721 ASN 166 ND2 0.0023 0.0027 -0.0010 722 ASN 166 OD1 0.0025 0.0032 -0.0009 723 TYR 167 N 0.0023 0.0096 -0.0050 724 TYR 167 CA 0.0018 0.0100 -0.0050 725 TYR 167 C 0.0005 0.0105 -0.0046 726 TYR 167 O 0.0001 0.0101 -0.0041 727 TYR 167 CB 0.0019 0.0092 -0.0045 728 TYR 167 CG 0.0031 0.0089 -0.0049 729 TYR 167 CD1 0.0039 0.0082 -0.0049 730 TYR 167 CD2 0.0033 0.0093 -0.0053 731 TYR 167 CE1 0.0050 0.0080 -0.0054 732 TYR 167 CE2 0.0043 0.0091 -0.0057 733 TYR 167 CZ 0.0052 0.0084 -0.0057 734 TYR 167 OH 0.0062 0.0081 -0.0061 735 VAL 168 N -0.0000 0.0112 -0.0048 736 VAL 168 CA -0.0012 0.0116 -0.0044 737 VAL 168 C -0.0016 0.0112 -0.0038 738 VAL 168 O -0.0013 0.0113 -0.0041 739 VAL 168 CB -0.0016 0.0128 -0.0050 740 VAL 168 CG1 -0.0028 0.0132 -0.0046 741 VAL 168 CG2 -0.0011 0.0132 -0.0055 742 ALA 169 N -0.0024 0.0108 -0.0031 743 ALA 169 CA -0.0030 0.0104 -0.0025 744 ALA 169 C -0.0042 0.0111 -0.0023 745 ALA 169 O -0.0047 0.0114 -0.0022 746 ALA 169 CB -0.0030 0.0093 -0.0017 747 LYS 170 N -0.0052 0.0082 -0.0013 748 LYS 170 CA -0.0050 0.0076 -0.0017 749 LYS 170 C -0.0049 0.0079 -0.0015 750 LYS 170 O -0.0055 0.0083 -0.0011 751 LYS 170 CB -0.0056 0.0068 -0.0016 752 LYS 170 CG -0.0055 0.0063 -0.0019 753 LYS 170 CD -0.0060 0.0054 -0.0020 754 LYS 170 CE -0.0065 0.0051 -0.0019 755 LYS 170 NZ -0.0066 0.0042 -0.0021 756 ARG 171 N -0.0043 0.0079 -0.0019 757 ARG 171 CA -0.0042 0.0082 -0.0018 758 ARG 171 C -0.0041 0.0075 -0.0022 759 ARG 171 O -0.0037 0.0069 -0.0026 760 ARG 171 CB -0.0035 0.0089 -0.0019 761 ARG 171 CG -0.0033 0.0093 -0.0019 762 ARG 171 CD -0.0029 0.0102 -0.0017 763 ARG 171 NE -0.0027 0.0106 -0.0016 764 ARG 171 CZ -0.0033 0.0108 -0.0013 765 ARG 171 NH1 -0.0041 0.0106 -0.0009 766 ARG 171 NH2 -0.0030 0.0111 -0.0013 767 TYR 172 N -0.0044 0.0075 -0.0020 768 TYR 172 CA -0.0043 0.0068 -0.0023 769 TYR 172 C -0.0034 0.0069 -0.0028 770 TYR 172 O -0.0030 0.0076 -0.0027 771 TYR 172 CB -0.0048 0.0068 -0.0020 772 TYR 172 CG -0.0056 0.0063 -0.0018 773 TYR 172 CD1 -0.0058 0.0055 -0.0021 774 TYR 172 CD2 -0.0063 0.0067 -0.0013 775 TYR 172 CE1 -0.0066 0.0050 -0.0019 776 TYR 172 CE2 -0.0070 0.0062 -0.0011 777 TYR 172 CZ -0.0072 0.0054 -0.0014 778 TYR 172 OH -0.0079 0.0049 -0.0012 779 ILE 173 N 0.0059 0.0081 0.0031 780 ILE 173 CA 0.0064 0.0077 0.0082 781 ILE 173 C 0.0057 0.0112 0.0113 782 ILE 173 O 0.0063 0.0100 0.0148 783 ILE 173 CB 0.0063 0.0082 0.0088 784 ILE 173 CG1 0.0072 0.0042 0.0062 785 ILE 173 CG2 0.0067 0.0084 0.0142 786 ILE 173 CD1 0.0068 0.0054 0.0049 787 GLU 174 N 0.0044 0.0157 0.0101 788 GLU 174 CA 0.0036 0.0193 0.0127 789 GLU 174 C 0.0032 0.0199 0.0101 790 GLU 174 O 0.0029 0.0198 0.0056 791 GLU 174 CB 0.0024 0.0239 0.0130 792 GLU 174 CG 0.0026 0.0234 0.0139 793 GLU 174 CD 0.0032 0.0227 0.0192 794 GLU 174 OE1 0.0025 0.0262 0.0221 795 GLU 174 OE2 0.0044 0.0188 0.0205 796 PRO 175 N 0.0033 0.0206 0.0128 797 PRO 175 CA 0.0030 0.0211 0.0106 798 PRO 175 C 0.0016 0.0249 0.0068 799 PRO 175 O 0.0006 0.0287 0.0075 800 PRO 175 CB 0.0030 0.0223 0.0149 801 PRO 175 CG 0.0039 0.0200 0.0191 802 PRO 175 CD 0.0038 0.0204 0.0182 803 VAL 176 N -0.0022 0.0118 0.0028 804 VAL 176 CA -0.0024 0.0131 0.0013 805 VAL 176 C -0.0031 0.0143 -0.0008 806 VAL 176 O -0.0037 0.0137 -0.0012 807 VAL 176 CB -0.0036 0.0117 0.0007 808 VAL 176 CG1 -0.0029 0.0106 0.0027 809 VAL 176 CG2 -0.0052 0.0100 -0.0003 810 ASP 177 N -0.0031 0.0160 -0.0021 811 ASP 177 CA -0.0039 0.0170 -0.0042 812 ASP 177 C -0.0057 0.0153 -0.0055 813 ASP 177 O -0.0063 0.0139 -0.0053 814 ASP 177 CB -0.0034 0.0191 -0.0053 815 ASP 177 CG -0.0045 0.0199 -0.0076 816 ASP 177 OD1 -0.0052 0.0202 -0.0089 817 ASP 177 OD2 -0.0046 0.0204 -0.0081 818 ARG 178 N -0.0065 0.0155 -0.0069 819 ARG 178 N -0.0065 0.0154 -0.0069 820 ARG 178 CA -0.0081 0.0138 -0.0080 821 ARG 178 CA -0.0082 0.0138 -0.0081 822 ARG 178 C -0.0092 0.0137 -0.0096 823 ARG 178 C -0.0091 0.0136 -0.0094 824 ARG 178 O -0.0105 0.0120 -0.0101 825 ARG 178 O -0.0102 0.0118 -0.0096 826 ARG 178 CB -0.0087 0.0141 -0.0092 827 ARG 178 CB -0.0088 0.0144 -0.0096 828 ARG 178 CG -0.0078 0.0140 -0.0077 829 ARG 178 CG -0.0077 0.0154 -0.0087 830 ARG 178 CD -0.0080 0.0151 -0.0089 831 ARG 178 CD -0.0086 0.0146 -0.0094 832 ARG 178 NE -0.0096 0.0136 -0.0101 833 ARG 178 NE -0.0083 0.0131 -0.0076 834 ARG 178 CZ -0.0107 0.0139 -0.0122 835 ARG 178 CZ -0.0093 0.0113 -0.0078 836 ARG 178 NH1 -0.0106 0.0156 -0.0133 837 ARG 178 NH1 -0.0108 0.0107 -0.0096 838 ARG 178 NH2 -0.0121 0.0125 -0.0131 839 ARG 178 NH2 -0.0089 0.0100 -0.0061 840 ASP 179 N -0.0145 0.0081 -0.0042 841 ASP 179 CA -0.0168 0.0071 -0.0040 842 ASP 179 C -0.0169 0.0044 -0.0044 843 ASP 179 O -0.0188 0.0034 -0.0043 844 ASP 179 CB -0.0181 0.0078 -0.0037 845 ASP 179 CG -0.0207 0.0080 -0.0033 846 ASP 179 OD1 -0.0220 0.0062 -0.0034 847 ASP 179 OD2 -0.0215 0.0100 -0.0028 848 VAL 180 N -0.0149 0.0033 -0.0049 849 VAL 180 CA -0.0149 0.0007 -0.0053 850 VAL 180 C -0.0156 0.0003 -0.0053 851 VAL 180 O -0.0169 -0.0014 -0.0054 852 VAL 180 CB -0.0125 -0.0003 -0.0058 853 VAL 180 CG1 -0.0123 -0.0027 -0.0063 854 VAL 180 CG2 -0.0122 -0.0003 -0.0059 855 TYR 181 N -0.0147 0.0017 -0.0052 856 TYR 181 CA -0.0153 0.0015 -0.0051 857 TYR 181 C -0.0180 0.0017 -0.0047 858 TYR 181 O -0.0191 0.0003 -0.0047 859 TYR 181 CB -0.0140 0.0034 -0.0050 860 TYR 181 CG -0.0114 0.0029 -0.0055 861 TYR 181 CD1 -0.0106 0.0016 -0.0058 862 TYR 181 CD2 -0.0097 0.0038 -0.0056 863 TYR 181 CE1 -0.0083 0.0012 -0.0063 864 TYR 181 CE2 -0.0074 0.0034 -0.0061 865 TYR 181 CZ -0.0067 0.0020 -0.0064 866 TYR 181 OH -0.0043 0.0016 -0.0068 867 PHE 182 N -0.0208 -0.0040 -0.0049 868 PHE 182 CA -0.0218 -0.0039 -0.0046 869 PHE 182 C -0.0217 -0.0049 -0.0037 870 PHE 182 O -0.0227 -0.0051 -0.0030 871 PHE 182 CB -0.0217 -0.0030 -0.0056 872 PHE 182 CG -0.0221 -0.0019 -0.0065 873 PHE 182 CD1 -0.0234 -0.0013 -0.0065 874 PHE 182 CD2 -0.0211 -0.0015 -0.0073 875 PHE 182 CE1 -0.0238 -0.0004 -0.0074 876 PHE 182 CE2 -0.0214 -0.0006 -0.0081 877 PHE 182 CZ -0.0228 -0.0000 -0.0082 878 GLU 183 N -0.0204 -0.0054 -0.0036 879 GLU 183 CA -0.0202 -0.0064 -0.0027 880 GLU 183 C -0.0206 -0.0072 -0.0017 881 GLU 183 O -0.0212 -0.0079 -0.0009 882 GLU 183 CB -0.0187 -0.0068 -0.0029 883 GLU 183 CG -0.0184 -0.0076 -0.0022 884 GLU 183 CD -0.0192 -0.0072 -0.0023 885 GLU 183 OE1 -0.0192 -0.0063 -0.0032 886 GLU 183 OE2 -0.0197 -0.0078 -0.0015 887 ASP 184 N -0.0205 -0.0072 -0.0018 888 ASP 184 CA -0.0210 -0.0080 -0.0009 889 ASP 184 C -0.0226 -0.0077 -0.0005 890 ASP 184 O -0.0231 -0.0084 0.0005 891 ASP 184 CB -0.0205 -0.0079 -0.0011 892 ASP 184 CG -0.0190 -0.0084 -0.0012 893 ASP 184 OD1 -0.0183 -0.0090 -0.0009 894 ASP 184 OD2 -0.0184 -0.0081 -0.0017 895 VAL 185 N -0.0185 -0.0090 -0.0016 896 VAL 185 CA -0.0194 -0.0088 -0.0014 897 VAL 185 C -0.0193 -0.0090 -0.0010 898 VAL 185 O -0.0198 -0.0092 -0.0002 899 VAL 185 CB -0.0200 -0.0083 -0.0023 900 VAL 185 CG1 -0.0209 -0.0080 -0.0021 901 VAL 185 CG2 -0.0204 -0.0080 -0.0025 902 ARG 186 N -0.0186 -0.0091 -0.0014 903 ARG 186 CA -0.0183 -0.0093 -0.0011 904 ARG 186 C -0.0181 -0.0098 -0.0000 905 ARG 186 O -0.0185 -0.0099 0.0006 906 ARG 186 CB -0.0174 -0.0093 -0.0017 907 ARG 186 CG -0.0176 -0.0088 -0.0027 908 ARG 186 CD -0.0168 -0.0089 -0.0032 909 ARG 186 NE -0.0168 -0.0085 -0.0042 910 ARG 186 CZ -0.0163 -0.0084 -0.0048 911 ARG 186 NH1 -0.0158 -0.0087 -0.0045 912 ARG 186 NH2 -0.0164 -0.0080 -0.0058 913 LEU 187 N -0.0175 -0.0101 0.0002 914 LEU 187 CA -0.0173 -0.0106 0.0012 915 LEU 187 C -0.0182 -0.0105 0.0019 916 LEU 187 O -0.0184 -0.0108 0.0026 917 LEU 187 CB -0.0166 -0.0108 0.0012 918 LEU 187 CG -0.0161 -0.0113 0.0021 919 LEU 187 CD1 -0.0154 -0.0114 0.0019 920 LEU 187 CD2 -0.0167 -0.0115 0.0030 921 GLN 188 N -0.0103 -0.0085 0.0006 922 GLN 188 CA -0.0105 -0.0076 0.0011 923 GLN 188 C -0.0100 -0.0075 0.0018 924 GLN 188 O -0.0098 -0.0070 0.0024 925 GLN 188 CB -0.0112 -0.0071 0.0005 926 GLN 188 CG -0.0114 -0.0062 0.0009 927 GLN 188 CD -0.0121 -0.0057 0.0004 928 GLN 188 NE2 -0.0124 -0.0049 0.0005 929 GLN 188 OE1 -0.0122 -0.0061 0.0000 930 MET 189 N -0.0098 -0.0080 0.0016 931 MET 189 CA -0.0094 -0.0079 0.0023 932 MET 189 C -0.0087 -0.0082 0.0029 933 MET 189 O -0.0084 -0.0079 0.0036 934 MET 189 CB -0.0094 -0.0083 0.0019 935 MET 189 CG -0.0101 -0.0080 0.0013 936 MET 189 SD -0.0105 -0.0069 0.0016 937 MET 189 CE -0.0109 -0.0064 0.0014 938 GLU 190 N -0.0085 -0.0089 0.0027 939 GLU 190 CA -0.0078 -0.0092 0.0034 940 GLU 190 C -0.0079 -0.0085 0.0038 941 GLU 190 O -0.0074 -0.0083 0.0046 942 GLU 190 CB -0.0076 -0.0101 0.0030 943 GLU 190 CG -0.0073 -0.0108 0.0028 944 GLU 190 CD -0.0067 -0.0110 0.0035 945 GLU 190 OE1 -0.0064 -0.0107 0.0041 946 GLU 190 OE2 -0.0065 -0.0115 0.0034 947 ALA 191 N -0.0073 -0.0060 0.0060 948 ALA 191 CA -0.0071 -0.0044 0.0051 949 ALA 191 C -0.0055 -0.0032 0.0055 950 ALA 191 O -0.0049 -0.0022 0.0053 951 ALA 191 CB -0.0084 -0.0039 0.0037 952 LYS 192 N -0.0049 -0.0033 0.0060 953 LYS 192 CA -0.0033 -0.0023 0.0065 954 LYS 192 C -0.0021 -0.0025 0.0076 955 LYS 192 O -0.0011 -0.0014 0.0076 956 LYS 192 CB -0.0030 -0.0025 0.0070 957 LYS 192 CG -0.0015 -0.0013 0.0073 958 LYS 192 CD -0.0013 -0.0016 0.0076 959 LYS 192 CE 0.0001 -0.0003 0.0079 960 LYS 192 NZ 0.0001 0.0013 0.0067 961 LEU 193 N -0.0023 -0.0041 0.0085 962 LEU 193 CA -0.0012 -0.0044 0.0096 963 LEU 193 C -0.0014 -0.0037 0.0090 964 LEU 193 O -0.0002 -0.0030 0.0094 965 LEU 193 CB -0.0016 -0.0062 0.0105 966 LEU 193 CG -0.0013 -0.0071 0.0114 967 LEU 193 CD1 -0.0016 -0.0089 0.0123 968 LEU 193 CD2 0.0004 -0.0063 0.0121 969 TRP 194 N 0.0018 0.0008 0.0090 970 TRP 194 CA 0.0016 0.0017 0.0083 971 TRP 194 C 0.0021 0.0018 0.0078 972 TRP 194 O 0.0023 0.0023 0.0070 973 TRP 194 CB 0.0007 0.0022 0.0086 974 TRP 194 CG 0.0003 0.0024 0.0088 975 TRP 194 CD1 -0.0002 0.0020 0.0095 976 TRP 194 CD2 0.0003 0.0029 0.0082 977 TRP 194 CE2 -0.0001 0.0028 0.0086 978 TRP 194 CE3 0.0007 0.0033 0.0074 979 TRP 194 NE1 -0.0004 0.0023 0.0094 980 TRP 194 CZ2 -0.0002 0.0033 0.0083 981 TRP 194 CZ3 0.0006 0.0037 0.0071 982 TRP 194 CH2 0.0002 0.0037 0.0075 983 GLY 195 N 0.0022 0.0014 0.0081 984 GLY 195 CA 0.0027 0.0014 0.0076 985 GLY 195 C 0.0036 0.0011 0.0071 986 GLY 195 O 0.0040 0.0015 0.0064 987 GLU 196 N 0.0039 0.0005 0.0074 988 GLU 196 CA 0.0048 0.0002 0.0070 989 GLU 196 C 0.0048 0.0008 0.0063 990 GLU 196 O 0.0054 0.0009 0.0056 991 GLU 196 CB 0.0050 -0.0006 0.0075 992 GLU 196 CG 0.0052 -0.0012 0.0080 993 GLU 196 CD 0.0053 -0.0019 0.0087 994 GLU 196 OE1 0.0053 -0.0020 0.0087 995 GLU 196 OE2 0.0052 -0.0025 0.0092 996 GLU 197 N 0.0059 0.0018 0.0106 997 GLU 197 CA 0.0050 0.0020 0.0098 998 GLU 197 C 0.0050 0.0013 0.0091 999 GLU 197 O 0.0044 0.0011 0.0082 1000 GLU 197 CB 0.0044 0.0030 0.0102 1001 GLU 197 CG 0.0035 0.0034 0.0095 1002 GLU 197 CD 0.0029 0.0035 0.0089 1003 GLU 197 OE1 0.0031 0.0035 0.0092 1004 GLU 197 OE2 0.0021 0.0036 0.0082 1005 TYR 198 N 0.0056 0.0010 0.0094 1006 TYR 198 CA 0.0057 0.0003 0.0088 1007 TYR 198 C 0.0059 -0.0006 0.0081 1008 TYR 198 O 0.0055 -0.0010 0.0073 1009 TYR 198 CB 0.0064 0.0001 0.0094 1010 TYR 198 CG 0.0066 -0.0007 0.0088 1011 TYR 198 CD1 0.0060 -0.0005 0.0083 1012 TYR 198 CD2 0.0074 -0.0016 0.0088 1013 TYR 198 CE1 0.0062 -0.0012 0.0077 1014 TYR 198 CE2 0.0075 -0.0023 0.0082 1015 TYR 198 CZ 0.0069 -0.0021 0.0077 1016 TYR 198 OH 0.0071 -0.0028 0.0072 1017 ASN 199 N 0.0065 -0.0009 0.0086 1018 ASN 199 CA 0.0068 -0.0017 0.0080 1019 ASN 199 C 0.0061 -0.0016 0.0072 1020 ASN 199 O 0.0060 -0.0023 0.0065 1021 ASN 199 CB 0.0076 -0.0020 0.0086 1022 ASN 199 CG 0.0084 -0.0022 0.0093 1023 ASN 199 ND2 0.0090 -0.0021 0.0101 1024 ASN 199 OD1 0.0085 -0.0025 0.0091 1025 ARG 200 N 0.0077 -0.0020 0.0084 1026 ARG 200 CA 0.0071 -0.0017 0.0063 1027 ARG 200 C 0.0062 -0.0011 0.0040 1028 ARG 200 O 0.0060 -0.0013 0.0020 1029 ARG 200 CB 0.0061 -0.0001 0.0072 1030 ARG 200 CG 0.0070 -0.0009 0.0086 1031 ARG 200 CD 0.0059 0.0008 0.0094 1032 ARG 200 NE 0.0067 0.0002 0.0115 1033 ARG 200 CZ 0.0065 0.0011 0.0139 1034 ARG 200 NH1 0.0055 0.0026 0.0145 1035 ARG 200 NH2 0.0074 0.0005 0.0157 1036 HIS 201 N 0.0057 -0.0004 0.0042 1037 HIS 201 CA 0.0049 0.0002 0.0021 1038 HIS 201 C 0.0059 -0.0016 0.0008 1039 HIS 201 O 0.0053 -0.0012 -0.0007 1040 HIS 201 CB 0.0036 0.0021 0.0029 1041 HIS 201 CG 0.0023 0.0040 0.0033 1042 HIS 201 CD2 0.0008 0.0057 0.0020 1043 HIS 201 ND1 0.0024 0.0044 0.0054 1044 HIS 201 CE1 0.0010 0.0063 0.0053 1045 HIS 201 NE2 0.0000 0.0070 0.0033 1046 LYS 202 N 0.0074 -0.0035 0.0014 1047 LYS 202 CA 0.0086 -0.0054 0.0002 1048 LYS 202 C 0.0085 -0.0052 0.0004 1049 LYS 202 O 0.0081 -0.0052 -0.0015 1050 LYS 202 CB 0.0084 -0.0058 -0.0025 1051 LYS 202 CG 0.0085 -0.0060 -0.0028 1052 LYS 202 CD 0.0091 -0.0075 -0.0050 1053 LYS 202 CE 0.0078 -0.0064 -0.0074 1054 LYS 202 NZ 0.0070 -0.0053 -0.0076 1055 PRO 203 N 0.0092 -0.0065 0.0059 1056 PRO 203 CA 0.0097 -0.0071 0.0054 1057 PRO 203 C 0.0108 -0.0081 0.0049 1058 PRO 203 O 0.0114 -0.0083 0.0051 1059 PRO 203 CB 0.0102 -0.0065 0.0065 1060 PRO 203 CG 0.0107 -0.0059 0.0074 1061 PRO 203 CD 0.0098 -0.0057 0.0071 1062 PRO 204 N 0.0110 -0.0089 0.0042 1063 PRO 204 CA 0.0121 -0.0099 0.0037 1064 PRO 204 C 0.0135 -0.0098 0.0046 1065 PRO 204 O 0.0143 -0.0104 0.0044 1066 PRO 204 CB 0.0121 -0.0105 0.0029 1067 PRO 204 CG 0.0113 -0.0097 0.0034 1068 PRO 204 CD 0.0103 -0.0088 0.0038 1069 LYS 205 N 0.0137 -0.0091 0.0055 1070 LYS 205 CA 0.0149 -0.0089 0.0065 1071 LYS 205 C 0.0145 -0.0078 0.0076 1072 LYS 205 O 0.0138 -0.0072 0.0078 1073 LYS 205 CB 0.0158 -0.0093 0.0066 1074 LYS 205 CG 0.0164 -0.0105 0.0056 1075 LYS 205 CD 0.0174 -0.0108 0.0058 1076 LYS 205 CE 0.0179 -0.0120 0.0047 1077 LYS 205 NZ 0.0188 -0.0124 0.0048 1078 GLN 206 N 0.0073 -0.0018 0.0096 1079 GLN 206 CA 0.0075 -0.0017 0.0089 1080 GLN 206 C 0.0076 -0.0016 0.0090 1081 GLN 206 O 0.0073 -0.0018 0.0095 1082 GLN 206 CB 0.0071 -0.0018 0.0083 1083 GLN 206 CG 0.0071 -0.0018 0.0081 1084 GLN 206 CD 0.0069 -0.0019 0.0074 1085 GLN 206 NE2 0.0068 -0.0019 0.0072 1086 GLN 206 OE1 0.0068 -0.0019 0.0069 1087 VAL 207 N 0.0080 -0.0014 0.0085 1088 VAL 207 CA 0.0081 -0.0014 0.0085 1089 VAL 207 C 0.0079 -0.0014 0.0078 1090 VAL 207 O 0.0078 -0.0015 0.0073 1091 VAL 207 CB 0.0088 -0.0011 0.0087 1092 VAL 207 CG1 0.0090 -0.0010 0.0094 1093 VAL 207 CG2 0.0092 -0.0008 0.0081 1094 ASP 208 N 0.0078 -0.0015 0.0078 1095 ASP 208 CA 0.0077 -0.0015 0.0071 1096 ASP 208 C 0.0079 -0.0014 0.0072 1097 ASP 208 O 0.0077 -0.0015 0.0077 1098 ASP 208 CB 0.0070 -0.0018 0.0070 1099 ASP 208 CG 0.0068 -0.0019 0.0062 1100 ASP 208 OD1 0.0072 -0.0016 0.0058 1101 ASP 208 OD2 0.0063 -0.0021 0.0060 1102 ILE 209 N 0.0006 -0.0016 0.0068 1103 ILE 209 CA 0.0008 -0.0019 0.0052 1104 ILE 209 C 0.0004 -0.0008 0.0044 1105 ILE 209 O 0.0002 -0.0004 0.0049 1106 ILE 209 CB 0.0014 -0.0033 0.0050 1107 ILE 209 CG1 0.0019 -0.0045 0.0054 1108 ILE 209 CG2 0.0016 -0.0034 0.0034 1109 ILE 209 CD1 0.0019 -0.0047 0.0071 1110 MET 210 N 0.0003 -0.0002 0.0032 1111 MET 210 CA -0.0001 0.0010 0.0025 1112 MET 210 C 0.0001 0.0006 0.0019 1113 MET 210 O 0.0006 -0.0005 0.0013 1114 MET 210 CB -0.0003 0.0016 0.0012 1115 MET 210 CG -0.0006 0.0022 0.0016 1116 MET 210 SD -0.0014 0.0039 0.0023 1117 MET 210 CE -0.0014 0.0037 0.0041 1118 GLN 211 N -0.0003 0.0015 0.0021 1119 GLN 211 CA -0.0002 0.0013 0.0014 1120 GLN 211 C -0.0001 0.0014 -0.0003 1121 GLN 211 O -0.0004 0.0023 -0.0009 1122 GLN 211 CB -0.0007 0.0024 0.0019 1123 GLN 211 CG -0.0006 0.0024 0.0011 1124 GLN 211 CD -0.0010 0.0032 0.0019 1125 GLN 211 NE2 -0.0016 0.0045 0.0017 1126 GLN 211 OE1 -0.0008 0.0026 0.0026 1127 MET 212 N -0.0054 0.0023 -0.0055 1128 MET 212 CA -0.0062 0.0019 -0.0068 1129 MET 212 C -0.0061 0.0009 -0.0067 1130 MET 212 O -0.0056 -0.0001 -0.0059 1131 MET 212 CB -0.0065 0.0012 -0.0075 1132 MET 212 CG -0.0073 0.0007 -0.0089 1133 MET 212 SD -0.0077 -0.0001 -0.0097 1134 MET 212 CE -0.0073 -0.0019 -0.0092 1135 CYS 213 N -0.0066 0.0011 -0.0076 1136 CYS 213 CA -0.0065 0.0001 -0.0077 1137 CYS 213 C -0.0073 -0.0003 -0.0090 1138 CYS 213 O -0.0078 0.0000 -0.0099 1139 CYS 213 CB -0.0062 0.0009 -0.0070 1140 CYS 213 SG -0.0068 0.0024 -0.0079 1141 ILE 214 N -0.0074 -0.0012 -0.0093 1142 ILE 214 CA -0.0081 -0.0016 -0.0105 1143 ILE 214 C -0.0083 -0.0009 -0.0108 1144 ILE 214 O -0.0078 -0.0009 -0.0100 1145 ILE 214 CB -0.0080 -0.0033 -0.0107 1146 ILE 214 CG1 -0.0080 -0.0039 -0.0107 1147 ILE 214 CG2 -0.0087 -0.0037 -0.0120 1148 ILE 214 CD1 -0.0076 -0.0054 -0.0102 1149 ILE 215 N -0.0027 0.0021 -0.0135 1150 ILE 215 CA -0.0023 0.0026 -0.0133 1151 ILE 215 C -0.0020 0.0028 -0.0131 1152 ILE 215 O -0.0019 0.0025 -0.0134 1153 ILE 215 CB -0.0017 0.0025 -0.0135 1154 ILE 215 CG1 -0.0013 0.0021 -0.0140 1155 ILE 215 CG2 -0.0019 0.0023 -0.0136 1156 ILE 215 CD1 -0.0006 0.0021 -0.0141 1157 GLU 216 N -0.0020 0.0033 -0.0127 1158 GLU 216 CA -0.0018 0.0036 -0.0125 1159 GLU 216 C -0.0012 0.0039 -0.0124 1160 GLU 216 O -0.0011 0.0042 -0.0121 1161 GLU 216 CB -0.0023 0.0039 -0.0121 1162 GLU 216 CG -0.0022 0.0042 -0.0118 1163 GLU 216 CD -0.0028 0.0044 -0.0115 1164 GLU 216 OE1 -0.0032 0.0045 -0.0113 1165 GLU 216 OE2 -0.0028 0.0045 -0.0114 1166 LEU 217 N -0.0006 0.0039 -0.0125 1167 LEU 217 CA 0.0000 0.0042 -0.0125 1168 LEU 217 C 0.0001 0.0047 -0.0120 1169 LEU 217 O 0.0003 0.0047 -0.0121 1170 LEU 217 CB 0.0006 0.0039 -0.0129 1171 LEU 217 CG 0.0008 0.0035 -0.0132 1172 LEU 217 CD1 0.0011 0.0038 -0.0131 1173 LEU 217 CD2 0.0002 0.0031 -0.0134 1174 LYS 218 N 0.0047 0.0060 -0.0117 1175 LYS 218 CA 0.0048 0.0056 -0.0120 1176 LYS 218 C 0.0042 0.0053 -0.0119 1177 LYS 218 O 0.0042 0.0053 -0.0119 1178 LYS 218 CB 0.0050 0.0052 -0.0126 1179 LYS 218 CG 0.0057 0.0055 -0.0129 1180 LYS 218 CD 0.0062 0.0057 -0.0132 1181 LYS 218 CE 0.0068 0.0060 -0.0134 1182 LYS 218 NZ 0.0070 0.0056 -0.0139 1183 ASP 219 N 0.0037 0.0051 -0.0117 1184 ASP 219 CA 0.0031 0.0047 -0.0115 1185 ASP 219 C 0.0029 0.0050 -0.0110 1186 ASP 219 O 0.0025 0.0048 -0.0110 1187 ASP 219 CB 0.0027 0.0044 -0.0115 1188 ASP 219 CG 0.0029 0.0039 -0.0121 1189 ASP 219 OD1 0.0032 0.0038 -0.0125 1190 ASP 219 OD2 0.0026 0.0037 -0.0121 1191 ARG 220 N 0.0030 0.0056 -0.0106 1192 ARG 220 CA 0.0027 0.0059 -0.0101 1193 ARG 220 C 0.0030 0.0061 -0.0102 1194 ARG 220 O 0.0035 0.0061 -0.0106 1195 ARG 220 CB 0.0028 0.0064 -0.0097 1196 ARG 220 CG 0.0025 0.0064 -0.0094 1197 ARG 220 CD 0.0026 0.0069 -0.0090 1198 ARG 220 NE 0.0023 0.0069 -0.0088 1199 ARG 220 CZ 0.0024 0.0073 -0.0084 1200 ARG 220 NH1 0.0026 0.0079 -0.0082 1201 ARG 220 NH2 0.0022 0.0073 -0.0083 1202 PRO 221 N 0.0096 0.0127 -0.0089 1203 PRO 221 CA 0.0094 0.0140 -0.0084 1204 PRO 221 C 0.0077 0.0130 -0.0093 1205 PRO 221 O 0.0079 0.0109 -0.0102 1206 PRO 221 CB 0.0120 0.0139 -0.0078 1207 PRO 221 CG 0.0136 0.0133 -0.0076 1208 PRO 221 CD 0.0122 0.0119 -0.0086 1209 GLY 222 N 0.0060 0.0144 -0.0092 1210 GLY 222 CA 0.0043 0.0137 -0.0100 1211 GLY 222 C 0.0018 0.0135 -0.0107 1212 GLY 222 O 0.0001 0.0133 -0.0113 1213 LYS 223 N 0.0015 0.0136 -0.0107 1214 LYS 223 CA -0.0006 0.0130 -0.0116 1215 LYS 223 C -0.0015 0.0108 -0.0128 1216 LYS 223 O -0.0035 0.0108 -0.0133 1217 LYS 223 CB -0.0027 0.0149 -0.0113 1218 LYS 223 CG -0.0021 0.0172 -0.0101 1219 LYS 223 CD -0.0043 0.0190 -0.0099 1220 LYS 223 CE -0.0054 0.0191 -0.0102 1221 LYS 223 NZ -0.0079 0.0202 -0.0104 1222 PRO 224 N -0.0023 0.0082 -0.0101 1223 PRO 224 CA -0.0024 0.0073 -0.0100 1224 PRO 224 C -0.0032 0.0070 -0.0096 1225 PRO 224 O -0.0036 0.0074 -0.0095 1226 PRO 224 CB -0.0018 0.0070 -0.0102 1227 PRO 224 CG -0.0017 0.0078 -0.0103 1228 PRO 224 CD -0.0018 0.0085 -0.0103 1229 LEU 225 N -0.0034 0.0063 -0.0095 1230 LEU 225 CA -0.0042 0.0059 -0.0091 1231 LEU 225 C -0.0040 0.0052 -0.0091 1232 LEU 225 O -0.0034 0.0047 -0.0093 1233 LEU 225 CB -0.0045 0.0056 -0.0089 1234 LEU 225 CG -0.0047 0.0062 -0.0089 1235 LEU 225 CD1 -0.0050 0.0058 -0.0087 1236 LEU 225 CD2 -0.0053 0.0069 -0.0087 1237 PHE 226 N -0.0046 0.0050 -0.0088 1238 PHE 226 CA -0.0046 0.0043 -0.0088 1239 PHE 226 C -0.0054 0.0039 -0.0084 1240 PHE 226 O -0.0060 0.0044 -0.0082 1241 PHE 226 CB -0.0045 0.0046 -0.0089 1242 PHE 226 CG -0.0036 0.0049 -0.0092 1243 PHE 226 CD1 -0.0034 0.0057 -0.0094 1244 PHE 226 CD2 -0.0031 0.0043 -0.0095 1245 PHE 226 CE1 -0.0027 0.0059 -0.0098 1246 PHE 226 CE2 -0.0023 0.0046 -0.0098 1247 PHE 226 CZ -0.0021 0.0054 -0.0100 1248 HIS 227 N -0.0065 0.0034 -0.0071 1249 HIS 227 CA -0.0064 0.0035 -0.0065 1250 HIS 227 C -0.0055 0.0047 -0.0067 1251 HIS 227 O -0.0050 0.0053 -0.0077 1252 HIS 227 CB -0.0070 0.0027 -0.0072 1253 HIS 227 CG -0.0079 0.0014 -0.0068 1254 HIS 227 CD2 -0.0082 0.0009 -0.0055 1255 HIS 227 ND1 -0.0085 0.0006 -0.0078 1256 HIS 227 CE1 -0.0092 -0.0004 -0.0072 1257 HIS 227 NE2 -0.0091 -0.0003 -0.0058 1258 LEU 228 N -0.0051 0.0051 -0.0056 1259 LEU 228 CA -0.0043 0.0063 -0.0057 1260 LEU 228 C -0.0042 0.0064 -0.0053 1261 LEU 228 O -0.0046 0.0059 -0.0042 1262 LEU 228 CB -0.0037 0.0071 -0.0046 1263 LEU 228 CG -0.0028 0.0084 -0.0049 1264 LEU 228 CD1 -0.0025 0.0087 -0.0061 1265 LEU 228 CD2 -0.0022 0.0091 -0.0036 1266 GLU 229 N -0.0038 0.0070 -0.0063 1267 GLU 229 CA -0.0037 0.0071 -0.0061 1268 GLU 229 C -0.0028 0.0084 -0.0065 1269 GLU 229 O -0.0024 0.0089 -0.0074 1270 GLU 229 CB -0.0043 0.0063 -0.0070 1271 GLU 229 CG -0.0052 0.0051 -0.0070 1272 GLU 229 CD -0.0058 0.0043 -0.0082 1273 GLU 229 OE1 -0.0056 0.0046 -0.0085 1274 GLU 229 OE2 -0.0063 0.0036 -0.0087 1275 HIS 230 N 0.0039 0.0081 -0.0052 1276 HIS 230 CA 0.0033 0.0086 -0.0049 1277 HIS 230 C 0.0032 0.0088 -0.0046 1278 HIS 230 O 0.0037 0.0086 -0.0042 1279 HIS 230 CB 0.0033 0.0088 -0.0044 1280 HIS 230 CG 0.0027 0.0093 -0.0043 1281 HIS 230 CD2 0.0024 0.0095 -0.0045 1282 HIS 230 ND1 0.0022 0.0097 -0.0041 1283 HIS 230 CE1 0.0017 0.0101 -0.0041 1284 HIS 230 NE2 0.0018 0.0099 -0.0043 1285 TYR 231 N 0.0026 0.0092 -0.0047 1286 TYR 231 CA 0.0024 0.0094 -0.0044 1287 TYR 231 C 0.0025 0.0097 -0.0036 1288 TYR 231 O 0.0023 0.0100 -0.0033 1289 TYR 231 CB 0.0017 0.0098 -0.0048 1290 TYR 231 CG 0.0015 0.0101 -0.0044 1291 TYR 231 CD1 0.0018 0.0099 -0.0044 1292 TYR 231 CD2 0.0010 0.0106 -0.0041 1293 TYR 231 CE1 0.0015 0.0102 -0.0041 1294 TYR 231 CE2 0.0008 0.0109 -0.0037 1295 TYR 231 CZ 0.0010 0.0107 -0.0038 1296 TYR 231 OH 0.0008 0.0110 -0.0034 1297 ILE 232 N 0.0028 0.0097 -0.0032 1298 ILE 232 CA 0.0028 0.0100 -0.0024 1299 ILE 232 C 0.0025 0.0103 -0.0022 1300 ILE 232 O 0.0027 0.0101 -0.0024 1301 ILE 232 CB 0.0035 0.0097 -0.0020 1302 ILE 232 CG1 0.0039 0.0093 -0.0023 1303 ILE 232 CG2 0.0036 0.0100 -0.0012 1304 ILE 232 CD1 0.0038 0.0094 -0.0020 1305 GLU 233 N 0.0062 0.0047 -0.0029 1306 GLU 233 CA 0.0040 0.0076 -0.0027 1307 GLU 233 C 0.0058 0.0101 -0.0011 1308 GLU 233 O 0.0086 0.0104 0.0001 1309 GLU 233 CB 0.0022 0.0090 -0.0028 1310 GLU 233 CG 0.0040 0.0113 -0.0013 1311 GLU 233 CD 0.0023 0.0122 -0.0017 1312 GLU 233 OE1 -0.0007 0.0122 -0.0028 1313 GLU 233 OE2 0.0039 0.0128 -0.0008 1314 GLY 234 N 0.0041 0.0119 -0.0011 1315 GLY 234 CA 0.0056 0.0141 0.0003 1316 GLY 234 C 0.0046 0.0136 -0.0003 1317 GLY 234 O 0.0032 0.0113 -0.0016 1318 LYS 235 N 0.0054 0.0159 0.0008 1319 LYS 235 CA 0.0045 0.0159 0.0005 1320 LYS 235 C 0.0064 0.0132 0.0003 1321 LYS 235 O 0.0094 0.0129 0.0013 1322 LYS 235 CB 0.0049 0.0192 0.0018 1323 LYS 235 CG 0.0036 0.0195 0.0015 1324 LYS 235 CD 0.0024 0.0230 0.0022 1325 LYS 235 CE 0.0049 0.0248 0.0038 1326 LYS 235 NZ 0.0048 0.0248 0.0038 1327 TYR 236 N 0.0136 0.0045 0.0003 1328 TYR 236 CA 0.0127 0.0024 0.0013 1329 TYR 236 C 0.0116 0.0012 0.0002 1330 TYR 236 O 0.0110 0.0015 -0.0018 1331 TYR 236 CB 0.0121 0.0016 0.0009 1332 TYR 236 CG 0.0112 -0.0006 0.0020 1333 TYR 236 CD1 0.0098 -0.0021 0.0010 1334 TYR 236 CD2 0.0118 -0.0010 0.0041 1335 TYR 236 CE1 0.0090 -0.0041 0.0020 1336 TYR 236 CE2 0.0109 -0.0030 0.0052 1337 TYR 236 CZ 0.0096 -0.0045 0.0041 1338 TYR 236 OH 0.0088 -0.0064 0.0051 1339 ILE 237 N 0.0113 -0.0000 0.0015 1340 ILE 237 CA 0.0104 -0.0011 0.0008 1341 ILE 237 C 0.0095 -0.0032 0.0019 1342 ILE 237 O 0.0100 -0.0037 0.0039 1343 ILE 237 CB 0.0111 -0.0002 0.0012 1344 ILE 237 CG1 0.0122 0.0021 0.0005 1345 ILE 237 CG2 0.0101 -0.0011 0.0001 1346 ILE 237 CD1 0.0118 0.0028 -0.0018 1347 LYS 238 N 0.0082 -0.0046 0.0007 1348 LYS 238 CA 0.0072 -0.0067 0.0016 1349 LYS 238 C 0.0071 -0.0070 0.0017 1350 LYS 238 O 0.0066 -0.0068 0.0001 1351 LYS 238 CB 0.0059 -0.0080 0.0002 1352 LYS 238 CG 0.0060 -0.0074 -0.0006 1353 LYS 238 CD 0.0047 -0.0091 -0.0012 1354 LYS 238 CE 0.0049 -0.0089 -0.0010 1355 LYS 238 NZ 0.0037 -0.0107 -0.0013 1356 TYR 239 N 0.0048 -0.0056 0.0050 1357 TYR 239 CA 0.0037 -0.0063 0.0043 1358 TYR 239 C 0.0014 -0.0077 0.0042 1359 TYR 239 O 0.0004 -0.0084 0.0024 1360 TYR 239 CB 0.0042 -0.0058 0.0061 1361 TYR 239 CG 0.0065 -0.0044 0.0061 1362 TYR 239 CD1 0.0076 -0.0040 0.0041 1363 TYR 239 CD2 0.0077 -0.0036 0.0081 1364 TYR 239 CE1 0.0097 -0.0027 0.0042 1365 TYR 239 CE2 0.0098 -0.0023 0.0082 1366 TYR 239 CZ 0.0108 -0.0018 0.0062 1367 TYR 239 OH 0.0129 -0.0006 0.0063 1368 ASN 240 N 0.0004 -0.0082 0.0060 1369 ASN 240 CA -0.0018 -0.0095 0.0058 1370 ASN 240 C -0.0020 -0.0095 0.0072 1371 ASN 240 O -0.0006 -0.0086 0.0085 1372 ASN 240 CB -0.0034 -0.0104 0.0068 1373 ASN 240 CG -0.0031 -0.0100 0.0095 1374 ASN 240 ND2 -0.0032 -0.0100 0.0101 1375 ASN 240 OD1 -0.0030 -0.0098 0.0111 1376 SER 241 N -0.0037 -0.0106 0.0067 1377 SER 241 CA -0.0042 -0.0108 0.0079 1378 SER 241 C -0.0060 -0.0117 0.0098 1379 SER 241 O -0.0068 -0.0122 0.0101 1380 SER 241 CB -0.0047 -0.0113 0.0060 1381 SER 241 OG -0.0067 -0.0126 0.0052 1382 ASN 242 N -0.0058 -0.0078 0.0106 1383 ASN 242 CA -0.0077 -0.0066 0.0112 1384 ASN 242 C -0.0099 -0.0052 0.0110 1385 ASN 242 O -0.0116 -0.0041 0.0116 1386 ASN 242 CB -0.0075 -0.0067 0.0139 1387 ASN 242 CG -0.0085 -0.0060 0.0160 1388 ASN 242 ND2 -0.0098 -0.0052 0.0177 1389 ASN 242 OD1 -0.0082 -0.0063 0.0162 1390 SER 243 N -0.0098 -0.0052 0.0100 1391 SER 243 CA -0.0117 -0.0040 0.0100 1392 SER 243 C -0.0122 -0.0037 0.0073 1393 SER 243 O -0.0135 -0.0028 0.0071 1394 SER 243 CB -0.0115 -0.0041 0.0120 1395 SER 243 OG -0.0100 -0.0051 0.0111 1396 GLY 244 N -0.0111 -0.0044 0.0052 1397 GLY 244 CA -0.0115 -0.0042 0.0026 1398 GLY 244 C -0.0097 -0.0053 0.0012 1399 GLY 244 O -0.0098 -0.0053 -0.0012 1400 PHE 245 N -0.0093 -0.0211 -0.0012 1401 PHE 245 CA -0.0072 -0.0193 -0.0037 1402 PHE 245 C -0.0061 -0.0179 -0.0019 1403 PHE 245 O -0.0058 -0.0170 0.0014 1404 PHE 245 CB -0.0050 -0.0172 -0.0046 1405 PHE 245 CG -0.0023 -0.0146 -0.0053 1406 PHE 245 CD1 -0.0013 -0.0142 -0.0088 1407 PHE 245 CD2 -0.0007 -0.0125 -0.0025 1408 PHE 245 CE1 0.0011 -0.0118 -0.0095 1409 PHE 245 CE2 0.0018 -0.0101 -0.0032 1410 PHE 245 CZ 0.0027 -0.0097 -0.0067 1411 VAL 246 N -0.0055 -0.0177 -0.0041 1412 VAL 246 CA -0.0041 -0.0160 -0.0031 1413 VAL 246 C -0.0022 -0.0147 -0.0065 1414 VAL 246 O -0.0028 -0.0159 -0.0096 1415 VAL 246 CB -0.0059 -0.0177 -0.0017 1416 VAL 246 CG1 -0.0079 -0.0201 -0.0044 1417 VAL 246 CG2 -0.0044 -0.0160 -0.0011 1418 ARG 247 N 0.0002 -0.0122 -0.0058 1419 ARG 247 CA 0.0023 -0.0105 -0.0088 1420 ARG 247 C 0.0014 -0.0119 -0.0119 1421 ARG 247 O 0.0007 -0.0126 -0.0112 1422 ARG 247 CB 0.0046 -0.0079 -0.0073 1423 ARG 247 CG 0.0064 -0.0058 -0.0057 1424 ARG 247 CD 0.0086 -0.0041 -0.0086 1425 ARG 247 NE 0.0109 -0.0017 -0.0087 1426 ARG 247 CZ 0.0133 0.0004 -0.0104 1427 ARG 247 NH1 0.0137 0.0005 -0.0121 1428 ARG 247 NH2 0.0152 0.0024 -0.0103 1429 ASP 248 N 0.0032 -0.0192 -0.0328 1430 ASP 248 CA 0.0028 -0.0203 -0.0348 1431 ASP 248 C 0.0028 -0.0119 -0.0351 1432 ASP 248 O 0.0018 -0.0101 -0.0409 1433 ASP 248 CB 0.0011 -0.0251 -0.0431 1434 ASP 248 CG 0.0010 -0.0329 -0.0435 1435 ASP 248 OD1 0.0021 -0.0374 -0.0371 1436 ASP 248 OD2 -0.0003 -0.0346 -0.0502 1437 ASP 249 N 0.0041 -0.0066 -0.0288 1438 ASP 249 CA 0.0043 0.0015 -0.0281 1439 ASP 249 C 0.0061 0.0042 -0.0190 1440 ASP 249 O 0.0071 -0.0011 -0.0135 1441 ASP 249 CB 0.0034 0.0083 -0.0334 1442 ASP 249 CG 0.0036 0.0081 -0.0325 1443 ASP 249 OD1 0.0048 0.0119 -0.0265 1444 ASP 249 OD2 0.0025 0.0040 -0.0378 1445 ASN 250 N 0.0065 0.0124 -0.0173 1446 ASN 250 CA 0.0082 0.0155 -0.0088 1447 ASN 250 C 0.0090 0.0114 -0.0043 1448 ASN 250 O 0.0088 0.0143 -0.0051 1449 ASN 250 CB 0.0084 0.0251 -0.0085 1450 ASN 250 CG 0.0082 0.0295 -0.0096 1451 ASN 250 ND2 0.0084 0.0379 -0.0094 1452 ASN 250 OD1 0.0080 0.0253 -0.0107 1453 ILE 251 N 0.0118 -0.0032 0.0021 1454 ILE 251 CA 0.0118 -0.0042 0.0034 1455 ILE 251 C 0.0121 -0.0029 0.0053 1456 ILE 251 O 0.0123 -0.0018 0.0061 1457 ILE 251 CB 0.0116 -0.0064 0.0040 1458 ILE 251 CG1 0.0113 -0.0079 0.0023 1459 ILE 251 CG2 0.0117 -0.0071 0.0061 1460 ILE 251 CD1 0.0111 -0.0101 0.0027 1461 ARG 252 N 0.0122 -0.0029 0.0060 1462 ARG 252 CA 0.0125 -0.0020 0.0080 1463 ARG 252 C 0.0124 -0.0038 0.0095 1464 ARG 252 O 0.0122 -0.0054 0.0090 1465 ARG 252 CB 0.0126 -0.0007 0.0077 1466 ARG 252 CG 0.0127 0.0014 0.0066 1467 ARG 252 CD 0.0129 0.0030 0.0070 1468 ARG 252 NE 0.0132 0.0034 0.0092 1469 ARG 252 CZ 0.0132 0.0030 0.0103 1470 ARG 252 NH1 0.0131 0.0022 0.0094 1471 ARG 252 NH2 0.0135 0.0034 0.0123 1472 LEU 253 N 0.0126 -0.0035 0.0115 1473 LEU 253 CA 0.0126 -0.0051 0.0130 1474 LEU 253 C 0.0127 -0.0054 0.0139 1475 LEU 253 O 0.0125 -0.0071 0.0145 1476 LEU 253 CB 0.0128 -0.0048 0.0148 1477 LEU 253 CG 0.0128 -0.0043 0.0143 1478 LEU 253 CD1 0.0130 -0.0045 0.0162 1479 LEU 253 CD2 0.0125 -0.0058 0.0126 1480 THR 254 N 0.0089 -0.0047 0.0086 1481 THR 254 CA 0.0090 -0.0047 0.0101 1482 THR 254 C 0.0082 -0.0048 0.0110 1483 THR 254 O 0.0075 -0.0050 0.0119 1484 THR 254 CB 0.0104 -0.0042 0.0105 1485 THR 254 CG2 0.0106 -0.0041 0.0121 1486 THR 254 OG1 0.0110 -0.0041 0.0100 1487 PRO 255 N 0.0084 -0.0048 0.0107 1488 PRO 255 CA 0.0076 -0.0050 0.0116 1489 PRO 255 C 0.0061 -0.0054 0.0116 1490 PRO 255 O 0.0054 -0.0056 0.0126 1491 PRO 255 CB 0.0080 -0.0049 0.0111 1492 PRO 255 CG 0.0093 -0.0046 0.0103 1493 PRO 255 CD 0.0092 -0.0046 0.0097 1494 GLN 256 N 0.0056 -0.0056 0.0103 1495 GLN 256 CA 0.0042 -0.0060 0.0102 1496 GLN 256 C 0.0037 -0.0061 0.0108 1497 GLN 256 O 0.0027 -0.0064 0.0115 1498 GLN 256 CB 0.0038 -0.0061 0.0086 1499 GLN 256 CG 0.0046 -0.0060 0.0078 1500 GLN 256 CD 0.0044 -0.0060 0.0084 1501 GLN 256 NE2 0.0055 -0.0057 0.0083 1502 GLN 256 OE1 0.0034 -0.0062 0.0091 1503 ALA 257 N 0.0027 -0.0013 0.0072 1504 ALA 257 CA 0.0026 -0.0013 0.0069 1505 ALA 257 C 0.0026 -0.0013 0.0074 1506 ALA 257 O 0.0024 -0.0012 0.0074 1507 ALA 257 CB 0.0030 -0.0015 0.0064 1508 PHE 258 N 0.0029 -0.0016 0.0078 1509 PHE 258 CA 0.0030 -0.0016 0.0083 1510 PHE 258 C 0.0025 -0.0014 0.0086 1511 PHE 258 O 0.0023 -0.0013 0.0088 1512 PHE 258 CB 0.0034 -0.0020 0.0086 1513 PHE 258 CG 0.0034 -0.0020 0.0092 1514 PHE 258 CD1 0.0035 -0.0021 0.0092 1515 PHE 258 CD2 0.0034 -0.0021 0.0097 1516 PHE 258 CE1 0.0035 -0.0021 0.0097 1517 PHE 258 CE2 0.0034 -0.0021 0.0102 1518 PHE 258 CZ 0.0035 -0.0021 0.0102 1519 SER 259 N 0.0023 -0.0013 0.0088 1520 SER 259 CA 0.0018 -0.0010 0.0092 1521 SER 259 C 0.0014 -0.0007 0.0088 1522 SER 259 O 0.0012 -0.0005 0.0091 1523 SER 259 CB 0.0017 -0.0009 0.0093 1524 SER 259 OG 0.0020 -0.0012 0.0097 1525 HIS 260 N -0.0008 0.0031 0.0039 1526 HIS 260 CA -0.0012 0.0031 0.0038 1527 HIS 260 C -0.0015 0.0032 0.0039 1528 HIS 260 O -0.0018 0.0034 0.0039 1529 HIS 260 CB -0.0012 0.0027 0.0035 1530 HIS 260 CG -0.0016 0.0026 0.0034 1531 HIS 260 CD2 -0.0019 0.0028 0.0035 1532 HIS 260 ND1 -0.0018 0.0023 0.0032 1533 HIS 260 CE1 -0.0021 0.0023 0.0031 1534 HIS 260 NE2 -0.0022 0.0026 0.0033 1535 PHE 261 N -0.0014 0.0032 0.0039 1536 PHE 261 CA -0.0017 0.0034 0.0040 1537 PHE 261 C -0.0018 0.0038 0.0042 1538 PHE 261 O -0.0021 0.0040 0.0043 1539 PHE 261 CB -0.0016 0.0033 0.0039 1540 PHE 261 CG -0.0018 0.0036 0.0040 1541 PHE 261 CD1 -0.0022 0.0035 0.0039 1542 PHE 261 CD2 -0.0016 0.0039 0.0043 1543 PHE 261 CE1 -0.0024 0.0037 0.0040 1544 PHE 261 CE2 -0.0019 0.0041 0.0044 1545 PHE 261 CZ -0.0022 0.0040 0.0043 1546 THR 262 N -0.0014 0.0039 0.0044 1547 THR 262 CA -0.0014 0.0043 0.0046 1548 THR 262 C -0.0017 0.0044 0.0046 1549 THR 262 O -0.0019 0.0047 0.0048 1550 THR 262 CB -0.0010 0.0045 0.0048 1551 THR 262 CG2 -0.0008 0.0044 0.0048 1552 THR 262 OG1 -0.0008 0.0043 0.0047 1553 PHE 263 N -0.0011 0.0089 -0.0010 1554 PHE 263 CA -0.0012 0.0085 -0.0010 1555 PHE 263 C -0.0028 0.0083 -0.0006 1556 PHE 263 O -0.0033 0.0090 -0.0004 1557 PHE 263 CB -0.0003 0.0071 -0.0013 1558 PHE 263 CG -0.0004 0.0067 -0.0013 1559 PHE 263 CD1 0.0004 0.0076 -0.0014 1560 PHE 263 CD2 -0.0012 0.0054 -0.0012 1561 PHE 263 CE1 0.0003 0.0072 -0.0015 1562 PHE 263 CE2 -0.0012 0.0051 -0.0012 1563 PHE 263 CZ -0.0005 0.0060 -0.0013 1564 GLU 264 N -0.0037 0.0075 -0.0004 1565 GLU 264 CA -0.0052 0.0072 -0.0000 1566 GLU 264 C -0.0061 0.0086 0.0003 1567 GLU 264 O -0.0069 0.0090 0.0005 1568 GLU 264 CB -0.0059 0.0059 0.0001 1569 GLU 264 CG -0.0052 0.0044 -0.0002 1570 GLU 264 CD -0.0063 0.0031 0.0000 1571 GLU 264 OE1 -0.0076 0.0034 0.0004 1572 GLU 264 OE2 -0.0059 0.0019 -0.0002 1573 ARG 265 N -0.0061 0.0094 0.0003 1574 ARG 265 CA -0.0071 0.0106 0.0007 1575 ARG 265 C -0.0068 0.0120 0.0007 1576 ARG 265 O -0.0079 0.0128 0.0010 1577 ARG 265 CB -0.0069 0.0111 0.0007 1578 ARG 265 CG -0.0078 0.0124 0.0010 1579 ARG 265 CD -0.0094 0.0118 0.0014 1580 ARG 265 NE -0.0104 0.0131 0.0017 1581 ARG 265 CZ -0.0108 0.0141 0.0019 1582 ARG 265 NH1 -0.0103 0.0141 0.0017 1583 ARG 265 NH2 -0.0116 0.0152 0.0022 1584 SER 266 N -0.0043 0.0134 -0.0048 1585 SER 266 CA -0.0036 0.0151 -0.0055 1586 SER 266 C -0.0035 0.0145 -0.0054 1587 SER 266 O -0.0028 0.0157 -0.0059 1588 SER 266 CB -0.0014 0.0158 -0.0063 1589 SER 266 OG 0.0003 0.0142 -0.0064 1590 GLY 267 N -0.0041 0.0125 -0.0047 1591 GLY 267 CA -0.0039 0.0117 -0.0046 1592 GLY 267 C -0.0016 0.0112 -0.0051 1593 GLY 267 O -0.0010 0.0116 -0.0054 1594 HIS 268 N -0.0002 0.0104 -0.0054 1595 HIS 268 CA 0.0021 0.0098 -0.0059 1596 HIS 268 C 0.0034 0.0118 -0.0068 1597 HIS 268 O 0.0053 0.0116 -0.0073 1598 HIS 268 CB 0.0025 0.0082 -0.0056 1599 HIS 268 CG 0.0015 0.0061 -0.0048 1600 HIS 268 CD2 0.0003 0.0054 -0.0042 1601 HIS 268 ND1 0.0016 0.0044 -0.0044 1602 HIS 268 CE1 0.0005 0.0027 -0.0037 1603 HIS 268 NE2 -0.0003 0.0033 -0.0036 1604 GLN 269 N -0.0008 0.0141 -0.0089 1605 GLN 269 CA -0.0007 0.0143 -0.0081 1606 GLN 269 C -0.0013 0.0121 -0.0052 1607 GLN 269 O -0.0011 0.0126 -0.0036 1608 GLN 269 CB -0.0010 0.0136 -0.0112 1609 GLN 269 CG -0.0003 0.0163 -0.0138 1610 GLN 269 CD -0.0005 0.0158 -0.0166 1611 GLN 269 NE2 -0.0001 0.0170 -0.0161 1612 GLN 269 OE1 -0.0009 0.0143 -0.0191 1613 LEU 270 N -0.0020 0.0096 -0.0046 1614 LEU 270 CA -0.0025 0.0075 -0.0018 1615 LEU 270 C -0.0030 0.0058 -0.0007 1616 LEU 270 O -0.0030 0.0059 -0.0024 1617 LEU 270 CB -0.0032 0.0050 -0.0026 1618 LEU 270 CG -0.0040 0.0027 -0.0055 1619 LEU 270 CD1 -0.0048 -0.0003 -0.0043 1620 LEU 270 CD2 -0.0043 0.0018 -0.0071 1621 ILE 271 N -0.0033 0.0042 0.0022 1622 ILE 271 CA -0.0039 0.0021 0.0034 1623 ILE 271 C -0.0047 -0.0006 0.0053 1624 ILE 271 O -0.0045 -0.0001 0.0071 1625 ILE 271 CB -0.0034 0.0040 0.0056 1626 ILE 271 CG1 -0.0039 0.0018 0.0063 1627 ILE 271 CG2 -0.0029 0.0052 0.0087 1628 ILE 271 CD1 -0.0034 0.0035 0.0081 1629 VAL 272 N -0.0057 -0.0045 0.0073 1630 VAL 272 CA -0.0053 -0.0054 0.0080 1631 VAL 272 C -0.0052 -0.0055 0.0081 1632 VAL 272 O -0.0050 -0.0057 0.0073 1633 VAL 272 CB -0.0048 -0.0062 0.0075 1634 VAL 272 CG1 -0.0043 -0.0071 0.0082 1635 VAL 272 CG2 -0.0048 -0.0061 0.0074 1636 VAL 273 N -0.0053 -0.0054 0.0091 1637 VAL 273 CA -0.0052 -0.0055 0.0093 1638 VAL 273 C -0.0049 -0.0062 0.0102 1639 VAL 273 O -0.0047 -0.0067 0.0105 1640 VAL 273 CB -0.0058 -0.0046 0.0095 1641 VAL 273 CG1 -0.0061 -0.0039 0.0085 1642 VAL 273 CG2 -0.0061 -0.0041 0.0104 1643 ASP 274 N -0.0050 -0.0062 0.0107 1644 ASP 274 CA -0.0046 -0.0069 0.0116 1645 ASP 274 C -0.0041 -0.0079 0.0112 1646 ASP 274 O -0.0038 -0.0086 0.0117 1647 ASP 274 CB -0.0048 -0.0068 0.0126 1648 ASP 274 CG -0.0047 -0.0070 0.0136 1649 ASP 274 OD1 -0.0047 -0.0071 0.0136 1650 ASP 274 OD2 -0.0047 -0.0071 0.0145 1651 ILE 275 N -0.0012 -0.0079 0.0097 1652 ILE 275 CA 0.0009 -0.0069 0.0099 1653 ILE 275 C 0.0018 -0.0060 0.0085 1654 ILE 275 O 0.0012 -0.0057 0.0066 1655 ILE 275 CB 0.0013 -0.0066 0.0094 1656 ILE 275 CG1 0.0002 -0.0076 0.0107 1657 ILE 275 CG2 0.0034 -0.0057 0.0097 1658 ILE 275 CD1 0.0007 -0.0081 0.0129 1659 GLN 276 N 0.0034 -0.0056 0.0093 1660 GLN 276 CA 0.0042 -0.0048 0.0081 1661 GLN 276 C 0.0062 -0.0042 0.0092 1662 GLN 276 O 0.0066 -0.0046 0.0110 1663 GLN 276 CB 0.0029 -0.0053 0.0079 1664 GLN 276 CG 0.0026 -0.0062 0.0099 1665 GLN 276 CD 0.0010 -0.0069 0.0097 1666 GLN 276 NE2 -0.0004 -0.0079 0.0108 1667 GLN 276 OE1 0.0010 -0.0065 0.0085 1668 GLY 277 N 0.0074 -0.0032 0.0080 1669 GLY 277 CA 0.0093 -0.0026 0.0089 1670 GLY 277 C 0.0108 -0.0014 0.0074 1671 GLY 277 O 0.0103 -0.0010 0.0056 1672 VAL 278 N 0.0118 0.0008 0.0060 1673 VAL 278 CA 0.0116 0.0015 0.0063 1674 VAL 278 C 0.0113 0.0014 0.0075 1675 VAL 278 O 0.0110 0.0017 0.0082 1676 VAL 278 CB 0.0116 0.0028 0.0059 1677 VAL 278 CG1 0.0115 0.0035 0.0061 1678 VAL 278 CG2 0.0120 0.0029 0.0047 1679 GLY 279 N 0.0112 0.0011 0.0078 1680 GLY 279 CA 0.0109 0.0008 0.0090 1681 GLY 279 C 0.0108 -0.0000 0.0094 1682 GLY 279 O 0.0111 -0.0010 0.0090 1683 ASP 280 N 0.0105 0.0002 0.0104 1684 ASP 280 CA 0.0105 -0.0005 0.0108 1685 ASP 280 C 0.0104 0.0001 0.0107 1686 ASP 280 O 0.0103 -0.0001 0.0113 1687 ASP 280 CB 0.0101 -0.0008 0.0120 1688 ASP 280 CG 0.0102 -0.0017 0.0122 1689 ASP 280 OD1 0.0104 -0.0026 0.0117 1690 ASP 280 OD2 0.0100 -0.0015 0.0128 1691 LEU 281 N 0.0051 0.0003 0.0103 1692 LEU 281 CA 0.0049 -0.0004 0.0099 1693 LEU 281 C 0.0046 -0.0011 0.0092 1694 LEU 281 O 0.0039 -0.0008 0.0087 1695 LEU 281 CB 0.0044 0.0002 0.0096 1696 LEU 281 CG 0.0048 0.0009 0.0102 1697 LEU 281 CD1 0.0043 0.0011 0.0098 1698 LEU 281 CD2 0.0056 0.0004 0.0108 1699 TYR 282 N 0.0050 -0.0019 0.0094 1700 TYR 282 CA 0.0047 -0.0026 0.0088 1701 TYR 282 C 0.0044 -0.0033 0.0082 1702 TYR 282 O 0.0046 -0.0036 0.0084 1703 TYR 282 CB 0.0053 -0.0032 0.0092 1704 TYR 282 CG 0.0057 -0.0025 0.0098 1705 TYR 282 CD1 0.0053 -0.0016 0.0098 1706 TYR 282 CD2 0.0065 -0.0028 0.0105 1707 TYR 282 CE1 0.0057 -0.0010 0.0103 1708 TYR 282 CE2 0.0068 -0.0022 0.0110 1709 TYR 282 CZ 0.0064 -0.0014 0.0110 1710 TYR 282 OH 0.0068 -0.0008 0.0115 1711 THR 283 N 0.0039 -0.0037 0.0076 1712 THR 283 CA 0.0035 -0.0045 0.0070 1713 THR 283 C 0.0033 -0.0051 0.0066 1714 THR 283 O 0.0033 -0.0048 0.0066 1715 THR 283 CB 0.0028 -0.0040 0.0065 1716 THR 283 CG2 0.0022 -0.0034 0.0061 1717 THR 283 OG1 0.0026 -0.0048 0.0059 1718 ASP 284 N -0.0037 -0.0082 0.0111 1719 ASP 284 CA -0.0047 -0.0085 0.0111 1720 ASP 284 C -0.0053 -0.0085 0.0106 1721 ASP 284 O -0.0059 -0.0085 0.0100 1722 ASP 284 CB -0.0049 -0.0084 0.0106 1723 ASP 284 CG -0.0058 -0.0087 0.0107 1724 ASP 284 OD1 -0.0062 -0.0090 0.0114 1725 ASP 284 OD2 -0.0061 -0.0086 0.0102 1726 PRO 285 N -0.0053 -0.0086 0.0109 1727 PRO 285 CA -0.0060 -0.0087 0.0106 1728 PRO 285 C -0.0069 -0.0091 0.0110 1729 PRO 285 O -0.0069 -0.0093 0.0117 1730 PRO 285 CB -0.0055 -0.0086 0.0109 1731 PRO 285 CG -0.0046 -0.0086 0.0114 1732 PRO 285 CD -0.0047 -0.0087 0.0117 1733 GLN 286 N -0.0076 -0.0091 0.0106 1734 GLN 286 CA -0.0084 -0.0095 0.0110 1735 GLN 286 C -0.0087 -0.0096 0.0112 1736 GLN 286 O -0.0085 -0.0094 0.0106 1737 GLN 286 CB -0.0092 -0.0095 0.0104 1738 GLN 286 CG -0.0101 -0.0099 0.0108 1739 GLN 286 CD -0.0101 -0.0102 0.0117 1740 GLN 286 NE2 -0.0099 -0.0101 0.0117 1741 GLN 286 OE1 -0.0102 -0.0104 0.0124 1742 ILE 287 N -0.0086 -0.0062 0.0069 1743 ILE 287 CA -0.0086 -0.0048 0.0050 1744 ILE 287 C -0.0081 -0.0025 0.0058 1745 ILE 287 O -0.0078 -0.0017 0.0068 1746 ILE 287 CB -0.0090 -0.0050 0.0031 1747 ILE 287 CG1 -0.0095 -0.0074 0.0024 1748 ILE 287 CG2 -0.0090 -0.0035 0.0013 1749 ILE 287 CD1 -0.0098 -0.0078 0.0007 1750 HIS 288 N -0.0080 -0.0014 0.0053 1751 HIS 288 CA -0.0076 0.0009 0.0056 1752 HIS 288 C -0.0077 0.0021 0.0035 1753 HIS 288 O -0.0081 0.0015 0.0019 1754 HIS 288 CB -0.0073 0.0015 0.0066 1755 HIS 288 CG -0.0071 0.0006 0.0088 1756 HIS 288 CD2 -0.0072 -0.0006 0.0096 1757 HIS 288 ND1 -0.0068 0.0007 0.0105 1758 HIS 288 CE1 -0.0067 -0.0003 0.0122 1759 HIS 288 NE2 -0.0069 -0.0011 0.0117 1760 THR 289 N -0.0075 0.0037 0.0034 1761 THR 289 CA -0.0076 0.0048 0.0013 1762 THR 289 C -0.0072 0.0072 0.0015 1763 THR 289 O -0.0068 0.0081 0.0032 1764 THR 289 CB -0.0078 0.0045 0.0006 1765 THR 289 CG2 -0.0082 0.0022 0.0006 1766 THR 289 OG1 -0.0073 0.0057 0.0020 1767 GLU 290 N -0.0008 0.0135 -0.0052 1768 GLU 290 CA 0.0008 0.0181 -0.0055 1769 GLU 290 C 0.0004 0.0190 -0.0037 1770 GLU 290 O 0.0006 0.0224 -0.0013 1771 GLU 290 CB 0.0029 0.0189 -0.0103 1772 GLU 290 CG 0.0046 0.0223 -0.0117 1773 GLU 290 CD 0.0067 0.0232 -0.0163 1774 GLU 290 OE1 0.0067 0.0200 -0.0191 1775 GLU 290 OE2 0.0083 0.0271 -0.0173 1776 THR 291 N -0.0002 0.0159 -0.0048 1777 THR 291 CA -0.0005 0.0166 -0.0033 1778 THR 291 C -0.0026 0.0157 0.0014 1779 THR 291 O -0.0028 0.0180 0.0038 1780 THR 291 CB -0.0004 0.0136 -0.0063 1781 THR 291 CG2 0.0014 0.0135 -0.0110 1782 THR 291 OG1 -0.0023 0.0092 -0.0051 1783 GLY 292 N -0.0043 0.0124 0.0028 1784 GLY 292 CA -0.0063 0.0113 0.0072 1785 GLY 292 C -0.0077 0.0082 0.0080 1786 GLY 292 O -0.0094 0.0073 0.0117 1787 THR 293 N -0.0073 0.0059 0.0050 1788 THR 293 CA -0.0074 0.0056 0.0052 1789 THR 293 C -0.0086 0.0026 0.0049 1790 THR 293 O -0.0088 0.0018 0.0063 1791 THR 293 CB -0.0068 0.0076 0.0029 1792 THR 293 CG2 -0.0074 0.0067 -0.0003 1793 THR 293 OG1 -0.0067 0.0077 0.0036 1794 ASP 294 N -0.0094 0.0009 0.0030 1795 ASP 294 CA -0.0105 -0.0019 0.0026 1796 ASP 294 C -0.0111 -0.0039 0.0049 1797 ASP 294 O -0.0106 -0.0031 0.0067 1798 ASP 294 CB -0.0111 -0.0029 -0.0006 1799 ASP 294 CG -0.0108 -0.0018 -0.0019 1800 ASP 294 OD1 -0.0100 -0.0001 -0.0004 1801 ASP 294 OD2 -0.0113 -0.0026 -0.0044 1802 PHE 295 N -0.0122 -0.0066 0.0048 1803 PHE 295 CA -0.0129 -0.0089 0.0066 1804 PHE 295 C -0.0125 -0.0086 0.0100 1805 PHE 295 O -0.0128 -0.0095 0.0117 1806 PHE 295 CB -0.0131 -0.0091 0.0057 1807 PHE 295 CG -0.0136 -0.0097 0.0024 1808 PHE 295 CD1 -0.0145 -0.0117 0.0010 1809 PHE 295 CD2 -0.0132 -0.0083 0.0008 1810 PHE 295 CE1 -0.0149 -0.0123 -0.0020 1811 PHE 295 CE2 -0.0136 -0.0089 -0.0023 1812 PHE 295 CZ -0.0145 -0.0109 -0.0036 1813 GLY 296 N -0.0118 -0.0114 0.0048 1814 GLY 296 CA -0.0106 -0.0117 0.0158 1815 GLY 296 C -0.0097 -0.0045 0.0205 1816 GLY 296 O -0.0100 0.0016 0.0155 1817 ASP 297 N -0.0087 -0.0054 0.0306 1818 ASP 297 CA -0.0077 0.0011 0.0365 1819 ASP 297 C -0.0080 -0.0012 0.0344 1820 ASP 297 O -0.0075 0.0050 0.0372 1821 ASP 297 CB -0.0065 -0.0001 0.0478 1822 ASP 297 CG -0.0061 0.0033 0.0507 1823 ASP 297 OD1 -0.0064 0.0092 0.0448 1824 ASP 297 OD2 -0.0053 0.0001 0.0588 1825 GLY 298 N -0.0090 -0.0099 0.0298 1826 GLY 298 CA -0.0094 -0.0122 0.0271 1827 GLY 298 C -0.0100 -0.0061 0.0182 1828 GLY 298 O -0.0103 -0.0062 0.0164 1829 ASN 299 N -0.0084 -0.0000 0.0137 1830 ASN 299 CA -0.0081 0.0015 0.0119 1831 ASN 299 C -0.0081 0.0037 0.0129 1832 ASN 299 O -0.0081 0.0048 0.0138 1833 ASN 299 CB -0.0079 0.0017 0.0105 1834 ASN 299 CG -0.0077 0.0025 0.0083 1835 ASN 299 ND2 -0.0076 0.0022 0.0068 1836 ASN 299 OD1 -0.0076 0.0033 0.0079 1837 LEU 300 N -0.0080 0.0042 0.0127 1838 LEU 300 CA -0.0080 0.0063 0.0135 1839 LEU 300 C -0.0077 0.0079 0.0116 1840 LEU 300 O -0.0077 0.0097 0.0119 1841 LEU 300 CB -0.0081 0.0061 0.0146 1842 LEU 300 CG -0.0084 0.0049 0.0167 1843 LEU 300 CD1 -0.0085 0.0052 0.0179 1844 LEU 300 CD2 -0.0085 0.0058 0.0181 1845 GLY 301 N -0.0076 0.0074 0.0098 1846 GLY 301 CA -0.0073 0.0089 0.0080 1847 GLY 301 C -0.0072 0.0094 0.0072 1848 GLY 301 O -0.0073 0.0080 0.0072 1849 VAL 302 N -0.0037 0.0036 -0.0034 1850 VAL 302 CA -0.0030 0.0055 -0.0038 1851 VAL 302 C -0.0041 0.0066 -0.0012 1852 VAL 302 O -0.0039 0.0076 -0.0012 1853 VAL 302 CB -0.0016 0.0082 -0.0053 1854 VAL 302 CG1 -0.0004 0.0071 -0.0081 1855 VAL 302 CG2 -0.0020 0.0099 -0.0037 1856 ARG 303 N -0.0053 0.0064 0.0011 1857 ARG 303 CA -0.0065 0.0070 0.0037 1858 ARG 303 C -0.0072 0.0048 0.0039 1859 ARG 303 O -0.0075 0.0056 0.0050 1860 ARG 303 CB -0.0078 0.0069 0.0060 1861 ARG 303 CG -0.0073 0.0094 0.0062 1862 ARG 303 CD -0.0085 0.0090 0.0083 1863 ARG 303 NE -0.0087 0.0064 0.0076 1864 ARG 303 CZ -0.0100 0.0042 0.0091 1865 ARG 303 NH1 -0.0112 0.0041 0.0114 1866 ARG 303 NH2 -0.0101 0.0020 0.0083 1867 GLY 304 N -0.0073 0.0020 0.0028 1868 GLY 304 CA -0.0078 -0.0001 0.0029 1869 GLY 304 C -0.0067 0.0005 0.0011 1870 GLY 304 O -0.0072 0.0001 0.0018 1871 MET 305 N -0.0067 0.0035 -0.0008 1872 MET 305 CA -0.0066 0.0035 -0.0015 1873 MET 305 C -0.0067 0.0040 -0.0012 1874 MET 305 O -0.0066 0.0038 -0.0014 1875 MET 305 CB -0.0065 0.0038 -0.0023 1876 MET 305 CG -0.0065 0.0035 -0.0024 1877 MET 305 SD -0.0064 0.0040 -0.0032 1878 MET 305 CE -0.0064 0.0033 -0.0036 1879 ALA 306 N -0.0067 0.0047 -0.0008 1880 ALA 306 CA -0.0067 0.0052 -0.0005 1881 ALA 306 C -0.0068 0.0047 0.0001 1882 ALA 306 O -0.0068 0.0048 0.0001 1883 ALA 306 CB -0.0068 0.0060 -0.0000 1884 LEU 307 N -0.0069 0.0042 0.0007 1885 LEU 307 CA -0.0070 0.0037 0.0012 1886 LEU 307 C -0.0070 0.0031 0.0007 1887 LEU 307 O -0.0070 0.0029 0.0010 1888 LEU 307 CB -0.0071 0.0033 0.0018 1889 LEU 307 CG -0.0072 0.0038 0.0025 1890 LEU 307 CD1 -0.0073 0.0033 0.0029 1891 LEU 307 CD2 -0.0073 0.0041 0.0030 1892 PHE 308 N -0.0059 0.0007 0.0039 1893 PHE 308 CA -0.0056 0.0004 0.0035 1894 PHE 308 C -0.0055 0.0009 0.0030 1895 PHE 308 O -0.0054 0.0008 0.0029 1896 PHE 308 CB -0.0053 0.0000 0.0033 1897 PHE 308 CG -0.0049 -0.0002 0.0028 1898 PHE 308 CD1 -0.0048 -0.0007 0.0029 1899 PHE 308 CD2 -0.0048 0.0001 0.0022 1900 PHE 308 CE1 -0.0044 -0.0009 0.0024 1901 PHE 308 CE2 -0.0045 -0.0002 0.0018 1902 PHE 308 CZ -0.0043 -0.0006 0.0018 1903 PHE 309 N -0.0056 0.0013 0.0028 1904 PHE 309 CA -0.0055 0.0017 0.0023 1905 PHE 309 C -0.0058 0.0021 0.0024 1906 PHE 309 O -0.0057 0.0023 0.0020 1907 PHE 309 CB -0.0055 0.0020 0.0020 1908 PHE 309 CG -0.0052 0.0016 0.0016 1909 PHE 309 CD1 -0.0049 0.0014 0.0012 1910 PHE 309 CD2 -0.0052 0.0015 0.0018 1911 PHE 309 CE1 -0.0046 0.0011 0.0009 1912 PHE 309 CE2 -0.0049 0.0011 0.0015 1913 PHE 309 CZ -0.0046 0.0009 0.0010 1914 TYR 310 N -0.0061 0.0022 0.0029 1915 TYR 310 CA -0.0063 0.0025 0.0031 1916 TYR 310 C -0.0061 0.0023 0.0029 1917 TYR 310 O -0.0062 0.0026 0.0027 1918 TYR 310 CB -0.0066 0.0026 0.0037 1919 TYR 310 CG -0.0069 0.0030 0.0039 1920 TYR 310 CD1 -0.0071 0.0036 0.0037 1921 TYR 310 CD2 -0.0069 0.0027 0.0042 1922 TYR 310 CE1 -0.0073 0.0039 0.0039 1923 TYR 310 CE2 -0.0071 0.0030 0.0044 1924 TYR 310 CZ -0.0073 0.0036 0.0042 1925 TYR 310 OH -0.0075 0.0040 0.0043 1926 SER 311 N -0.0040 -0.0038 -0.0006 1927 SER 311 CA -0.0039 -0.0025 -0.0010 1928 SER 311 C -0.0033 -0.0017 0.0000 1929 SER 311 O -0.0032 -0.0007 -0.0002 1930 SER 311 CB -0.0041 -0.0020 -0.0018 1931 SER 311 OG -0.0046 -0.0028 -0.0027 1932 HIS 312 N -0.0030 -0.0022 0.0011 1933 HIS 312 CA -0.0024 -0.0014 0.0020 1934 HIS 312 C -0.0022 -0.0011 0.0025 1935 HIS 312 O -0.0023 -0.0020 0.0027 1936 HIS 312 CB -0.0021 -0.0020 0.0031 1937 HIS 312 CG -0.0015 -0.0012 0.0041 1938 HIS 312 CD2 -0.0011 -0.0015 0.0052 1939 HIS 312 ND1 -0.0013 -0.0001 0.0041 1940 HIS 312 CE1 -0.0008 0.0003 0.0051 1941 HIS 312 NE2 -0.0007 -0.0005 0.0058 1942 ALA 313 N -0.0019 0.0000 0.0026 1943 ALA 313 CA -0.0016 0.0004 0.0031 1944 ALA 313 C -0.0010 0.0010 0.0042 1945 ALA 313 O -0.0008 0.0019 0.0042 1946 ALA 313 CB -0.0017 0.0014 0.0023 1947 CYS 314 N 0.0004 0.0018 0.0088 1948 CYS 314 CA 0.0019 0.0011 0.0082 1949 CYS 314 C 0.0024 0.0018 0.0079 1950 CYS 314 O 0.0022 0.0034 0.0078 1951 CYS 314 CB 0.0031 0.0015 0.0076 1952 CYS 314 SG 0.0033 0.0000 0.0077 1953 ASN 315 N 0.0031 0.0007 0.0077 1954 ASN 315 CA 0.0035 0.0012 0.0075 1955 ASN 315 C 0.0053 0.0010 0.0067 1956 ASN 315 O 0.0062 0.0007 0.0064 1957 ASN 315 CB 0.0027 0.0001 0.0079 1958 ASN 315 CG 0.0029 -0.0018 0.0081 1959 ASN 315 ND2 0.0016 -0.0026 0.0087 1960 ASN 315 OD1 0.0042 -0.0025 0.0076 1961 ARG 316 N 0.0059 0.0011 0.0065 1962 ARG 316 CA 0.0076 0.0010 0.0057 1963 ARG 316 C 0.0083 -0.0007 0.0056 1964 ARG 316 O 0.0097 -0.0009 0.0050 1965 ARG 316 CB 0.0080 0.0015 0.0055 1966 ARG 316 CG 0.0073 0.0004 0.0059 1967 ARG 316 CD 0.0076 0.0011 0.0057 1968 ARG 316 NE 0.0069 0.0027 0.0059 1969 ARG 316 CZ 0.0058 0.0031 0.0063 1970 ARG 316 NH1 0.0054 0.0019 0.0066 1971 ARG 316 NH2 0.0052 0.0046 0.0064 1972 ILE 317 N 0.0059 -0.0032 0.0032 1973 ILE 317 CA 0.0060 -0.0031 0.0039 1974 ILE 317 C 0.0046 -0.0012 0.0042 1975 ILE 317 O 0.0041 -0.0008 0.0035 1976 ILE 317 CB 0.0071 -0.0039 0.0060 1977 ILE 317 CG1 0.0085 -0.0058 0.0057 1978 ILE 317 CG2 0.0073 -0.0039 0.0066 1979 ILE 317 CD1 0.0098 -0.0068 0.0076 1980 CYS 318 N 0.0039 0.0000 0.0052 1981 CYS 318 CA 0.0025 0.0019 0.0054 1982 CYS 318 C 0.0015 0.0024 0.0032 1983 CYS 318 O 0.0007 0.0033 0.0028 1984 CYS 318 CB 0.0019 0.0031 0.0065 1985 CYS 318 SG 0.0028 0.0029 0.0093 1986 GLU 319 N 0.0015 0.0018 0.0016 1987 GLU 319 CA 0.0007 0.0022 -0.0006 1988 GLU 319 C 0.0011 0.0013 -0.0017 1989 GLU 319 O 0.0001 0.0021 -0.0027 1990 GLU 319 CB 0.0007 0.0016 -0.0019 1991 GLU 319 CG -0.0002 0.0029 -0.0016 1992 GLU 319 CD 0.0005 0.0021 -0.0016 1993 GLU 319 OE1 0.0011 0.0008 -0.0030 1994 GLU 319 OE2 0.0004 0.0027 -0.0002 1995 SER 320 N 0.0004 -0.0002 -0.0043 1996 SER 320 CA 0.0007 -0.0010 -0.0051 1997 SER 320 C 0.0001 0.0002 -0.0041 1998 SER 320 O -0.0004 0.0001 -0.0051 1999 SER 320 CB 0.0026 -0.0028 -0.0049 2000 SER 320 OG 0.0036 -0.0026 -0.0027 2001 MET 321 N 0.0000 0.0013 -0.0021 2002 MET 321 CA -0.0007 0.0026 -0.0010 2003 MET 321 C -0.0026 0.0043 -0.0013 2004 MET 321 O -0.0033 0.0056 -0.0003 2005 MET 321 CB 0.0004 0.0028 0.0014 2006 MET 321 CG 0.0021 0.0014 0.0019 2007 MET 321 SD 0.0034 0.0016 0.0047 2008 MET 321 CE 0.0054 -0.0006 0.0045 2009 GLY 322 N -0.0034 0.0045 -0.0026 2010 GLY 322 CA -0.0052 0.0061 -0.0031 2011 GLY 322 C -0.0057 0.0075 -0.0013 2012 GLY 322 O -0.0071 0.0091 -0.0010 2013 LEU 323 N -0.0048 0.0040 0.0020 2014 LEU 323 CA -0.0047 0.0042 0.0022 2015 LEU 323 C -0.0049 0.0037 0.0018 2016 LEU 323 O -0.0047 0.0033 0.0013 2017 LEU 323 CB -0.0038 0.0044 0.0023 2018 LEU 323 CG -0.0035 0.0048 0.0026 2019 LEU 323 CD1 -0.0027 0.0050 0.0028 2020 LEU 323 CD2 -0.0040 0.0053 0.0031 2021 ALA 324 N -0.0054 0.0039 0.0019 2022 ALA 324 CA -0.0057 0.0035 0.0016 2023 ALA 324 C -0.0051 0.0034 0.0015 2024 ALA 324 O -0.0047 0.0038 0.0018 2025 ALA 324 CB -0.0064 0.0037 0.0018 2026 PRO 325 N -0.0050 0.0029 0.0010 2027 PRO 325 CA -0.0044 0.0028 0.0009 2028 PRO 325 C -0.0047 0.0030 0.0011 2029 PRO 325 O -0.0053 0.0030 0.0011 2030 PRO 325 CB -0.0043 0.0022 0.0003 2031 PRO 325 CG -0.0051 0.0020 0.0002 2032 PRO 325 CD -0.0054 0.0024 0.0006 2033 PHE 326 N -0.0054 0.0028 0.0019 2034 PHE 326 CA -0.0047 0.0027 0.0015 2035 PHE 326 C -0.0040 0.0030 0.0024 2036 PHE 326 O -0.0045 0.0033 0.0033 2037 PHE 326 CB -0.0053 0.0025 0.0009 2038 PHE 326 CG -0.0046 0.0024 0.0004 2039 PHE 326 CD1 -0.0043 0.0021 -0.0007 2040 PHE 326 CD2 -0.0043 0.0025 0.0009 2041 PHE 326 CE1 -0.0036 0.0019 -0.0012 2042 PHE 326 CE2 -0.0037 0.0024 0.0003 2043 PHE 326 CZ -0.0033 0.0021 -0.0007 2044 ASP 327 N -0.0030 0.0031 0.0023 2045 ASP 327 CA -0.0023 0.0034 0.0031 2046 ASP 327 C -0.0025 0.0034 0.0034 2047 ASP 327 O -0.0022 0.0032 0.0028 2048 ASP 327 CB -0.0011 0.0033 0.0029 2049 ASP 327 CG -0.0008 0.0033 0.0027 2050 ASP 327 OD1 -0.0010 0.0030 0.0018 2051 ASP 327 OD2 -0.0004 0.0035 0.0034 2052 LEU 328 N -0.0032 0.0036 0.0042 2053 LEU 328 CA -0.0034 0.0037 0.0045 2054 LEU 328 C -0.0027 0.0040 0.0054 2055 LEU 328 O -0.0023 0.0043 0.0060 2056 LEU 328 CB -0.0046 0.0038 0.0049 2057 LEU 328 CG -0.0055 0.0034 0.0040 2058 LEU 328 CD1 -0.0066 0.0035 0.0045 2059 LEU 328 CD2 -0.0053 0.0032 0.0032 2060 SER 329 N -0.0015 0.0059 0.0030 2061 SER 329 CA -0.0024 0.0077 0.0026 2062 SER 329 C -0.0017 0.0063 0.0015 2063 SER 329 O -0.0006 0.0041 0.0016 2064 SER 329 CB -0.0031 0.0090 0.0053 2065 SER 329 OG -0.0024 0.0076 0.0069 2066 PRO 330 N -0.0024 0.0076 0.0005 2067 PRO 330 CA -0.0017 0.0064 -0.0003 2068 PRO 330 C -0.0010 0.0049 0.0020 2069 PRO 330 O 0.0001 0.0028 0.0015 2070 PRO 330 CB -0.0028 0.0085 -0.0013 2071 PRO 330 CG -0.0038 0.0104 -0.0022 2072 PRO 330 CD -0.0037 0.0102 -0.0003 2073 ARG 331 N -0.0016 0.0060 0.0044 2074 ARG 331 CA -0.0009 0.0047 0.0067 2075 ARG 331 C 0.0002 0.0025 0.0075 2076 ARG 331 O 0.0012 0.0005 0.0079 2077 ARG 331 CB -0.0018 0.0064 0.0091 2078 ARG 331 CG -0.0028 0.0083 0.0087 2079 ARG 331 CD -0.0035 0.0096 0.0114 2080 ARG 331 NE -0.0026 0.0079 0.0137 2081 ARG 331 CZ -0.0030 0.0086 0.0163 2082 ARG 331 NH1 -0.0042 0.0109 0.0170 2083 ARG 331 NH2 -0.0022 0.0069 0.0183 2084 GLU 332 N -0.0021 -0.0026 0.0003 2085 GLU 332 CA -0.0003 -0.0007 0.0019 2086 GLU 332 C -0.0004 -0.0019 0.0008 2087 GLU 332 O 0.0022 -0.0017 0.0011 2088 GLU 332 CB -0.0021 0.0020 0.0042 2089 GLU 332 CG -0.0017 0.0036 0.0056 2090 GLU 332 CD -0.0046 0.0058 0.0074 2091 GLU 332 OE1 -0.0071 0.0058 0.0074 2092 GLU 332 OE2 -0.0042 0.0074 0.0088 2093 ARG 333 N -0.0033 -0.0032 -0.0003 2094 ARG 333 CA -0.0036 -0.0045 -0.0014 2095 ARG 333 C -0.0007 -0.0067 -0.0032 2096 ARG 333 O 0.0011 -0.0068 -0.0033 2097 ARG 333 CB -0.0073 -0.0057 -0.0024 2098 ARG 333 CG -0.0082 -0.0065 -0.0032 2099 ARG 333 CD -0.0099 -0.0042 -0.0012 2100 ARG 333 NE -0.0074 -0.0031 -0.0002 2101 ARG 333 CZ -0.0078 -0.0007 0.0019 2102 ARG 333 NH1 -0.0105 0.0009 0.0032 2103 ARG 333 NH2 -0.0053 0.0002 0.0026 2104 ASP 334 N -0.0003 -0.0084 -0.0047 2105 ASP 334 CA 0.0024 -0.0106 -0.0065 2106 ASP 334 C 0.0062 -0.0094 -0.0055 2107 ASP 334 O 0.0085 -0.0104 -0.0063 2108 ASP 334 CB 0.0019 -0.0125 -0.0082 2109 ASP 334 CG -0.0014 -0.0142 -0.0096 2110 ASP 334 OD1 -0.0022 -0.0152 -0.0105 2111 ASP 334 OD2 -0.0033 -0.0145 -0.0099 2112 ALA 335 N -0.0053 -0.0084 -0.0108 2113 ALA 335 CA -0.0025 -0.0067 -0.0107 2114 ALA 335 C 0.0003 -0.0045 -0.0081 2115 ALA 335 O 0.0034 -0.0028 -0.0090 2116 ALA 335 CB -0.0041 -0.0074 -0.0093 2117 VAL 336 N -0.0008 -0.0044 -0.0048 2118 VAL 336 CA 0.0017 -0.0024 -0.0021 2119 VAL 336 C 0.0040 -0.0015 -0.0039 2120 VAL 336 O 0.0072 0.0005 -0.0035 2121 VAL 336 CB -0.0002 -0.0027 0.0020 2122 VAL 336 CG1 0.0019 -0.0010 0.0043 2123 VAL 336 CG2 -0.0011 -0.0027 0.0046 2124 ASN 337 N 0.0024 -0.0028 -0.0061 2125 ASN 337 CA 0.0045 -0.0020 -0.0082 2126 ASN 337 C 0.0069 -0.0013 -0.0117 2127 ASN 337 O 0.0097 0.0000 -0.0129 2128 ASN 337 CB 0.0021 -0.0037 -0.0095 2129 ASN 337 CG 0.0000 -0.0042 -0.0060 2130 ASN 337 ND2 -0.0030 -0.0062 -0.0068 2131 ASN 337 OD1 0.0011 -0.0029 -0.0027 2132 GLN 338 N 0.0170 0.0029 -0.0212 2133 GLN 338 CA 0.0147 0.0083 -0.0292 2134 GLN 338 C 0.0168 0.0107 -0.0289 2135 GLN 338 O 0.0172 0.0171 -0.0343 2136 GLN 338 CB 0.0065 0.0041 -0.0353 2137 GLN 338 CG 0.0036 0.0098 -0.0442 2138 GLN 338 CD -0.0041 0.0051 -0.0493 2139 GLN 338 NE2 -0.0060 0.0095 -0.0558 2140 GLN 338 OE1 -0.0083 -0.0023 -0.0474 2141 ASN 339 N 0.0181 0.0058 -0.0226 2142 ASN 339 CA 0.0195 0.0070 -0.0220 2143 ASN 339 C 0.0132 0.0066 -0.0294 2144 ASN 339 O 0.0075 -0.0002 -0.0299 2145 ASN 339 CB 0.0265 0.0153 -0.0212 2146 ASN 339 CG 0.0332 0.0151 -0.0127 2147 ASN 339 ND2 0.0389 0.0195 -0.0100 2148 ASN 339 OD1 0.0334 0.0109 -0.0086 2149 GLN 344 N -0.0141 0.0237 0.0272 2150 GLN 344 CA -0.0191 0.0237 0.0237 2151 GLN 344 C -0.0011 0.0198 0.0259 2152 GLN 344 O 0.0151 0.0161 0.0276 2153 GLN 344 CB -0.0294 0.0191 0.0040 2154 GLN 344 CG -0.0164 0.0098 -0.0117 2155 GLN 344 CD -0.0273 0.0055 -0.0309 2156 GLN 344 NE2 -0.0167 -0.0028 -0.0455 2157 GLN 344 OE1 -0.0449 0.0095 -0.0328 2158 SER 345 N -0.0042 0.0205 0.0257 2159 SER 345 CA 0.0117 0.0170 0.0276 2160 SER 345 C 0.0035 0.0176 0.0234 2161 SER 345 O -0.0141 0.0218 0.0221 2162 SER 345 CB 0.0226 0.0214 0.0471 2163 SER 345 OG 0.0108 0.0297 0.0609 2164 ALA 346 N 0.0165 0.0133 0.0212 2165 ALA 346 CA 0.0114 0.0141 0.0197 2166 ALA 346 C 0.0091 0.0221 0.0394 2167 ALA 346 O 0.0230 0.0222 0.0495 2168 ALA 346 CB 0.0267 0.0065 0.0102 2169 LYS 347 N 0.0119 0.0057 0.0378 2170 LYS 347 CA 0.0127 -0.0018 0.0362 2171 LYS 347 C 0.0197 -0.0057 0.0336 2172 LYS 347 O 0.0228 -0.0031 0.0331 2173 LYS 347 CB 0.0130 -0.0009 0.0363 2174 LYS 347 CG 0.0059 0.0025 0.0389 2175 LYS 347 CD 0.0050 0.0015 0.0390 2176 LYS 347 CE 0.0091 0.0079 0.0390 2177 ILE 349 N 0.0248 -0.0212 0.0037 2178 ILE 349 CA 0.0220 -0.0222 0.0006 2179 ILE 349 C 0.0194 -0.0199 -0.0001 2180 ILE 349 O 0.0201 -0.0192 0.0010 2181 ILE 349 CB 0.0229 -0.0262 -0.0011 2182 ILE 349 CG1 0.0244 -0.0284 -0.0012 2183 ILE 349 CG2 0.0201 -0.0271 -0.0041 2184 ILE 349 CD1 0.0268 -0.0321 -0.0016 2185 LEU 350 N 0.0164 -0.0188 -0.0020 2186 LEU 350 CA 0.0137 -0.0167 -0.0029 2187 LEU 350 C 0.0130 -0.0189 -0.0049 2188 LEU 350 O 0.0143 -0.0222 -0.0059 2189 LEU 350 CB 0.0107 -0.0151 -0.0045 2190 LEU 350 CG 0.0108 -0.0126 -0.0027 2191 LEU 350 CD1 0.0077 -0.0112 -0.0045 2192 LEU 350 CD2 0.0117 -0.0096 0.0000 2193 ARG 351 N 0.0110 -0.0171 -0.0054 2194 ARG 351 CA 0.0103 -0.0189 -0.0072 2195 ARG 351 C 0.0067 -0.0179 -0.0097 2196 ARG 351 O 0.0056 -0.0200 -0.0119 2197 ARG 351 CB 0.0118 -0.0179 -0.0053 2198 ARG 351 CG 0.0153 -0.0184 -0.0026 2199 ARG 351 CD 0.0170 -0.0189 -0.0015 2200 ARG 351 NE 0.0153 -0.0160 -0.0011 2201 ARG 351 CZ 0.0165 -0.0136 0.0015 2202 ARG 351 NH1 0.0194 -0.0136 0.0039 2203 ARG 351 NH2 0.0148 -0.0111 0.0017 2204 GLY 352 N 0.0086 -0.0169 -0.0128 2205 GLY 352 CA 0.0061 -0.0157 -0.0151 2206 GLY 352 C 0.0050 -0.0136 -0.0144 2207 GLY 352 O 0.0028 -0.0122 -0.0161 2208 THR 353 N 0.0065 -0.0134 -0.0120 2209 THR 353 CA 0.0056 -0.0115 -0.0112 2210 THR 353 C 0.0047 -0.0084 -0.0091 2211 THR 353 O 0.0038 -0.0065 -0.0085 2212 THR 353 CB 0.0077 -0.0129 -0.0097 2213 THR 353 CG2 0.0084 -0.0158 -0.0118 2214 THR 353 OG1 0.0098 -0.0133 -0.0071 2215 GLU 354 N 0.0050 -0.0078 -0.0082 2216 GLU 354 CA 0.0045 -0.0050 -0.0059 2217 GLU 354 C 0.0018 -0.0025 -0.0070 2218 GLU 354 O 0.0001 -0.0026 -0.0096 2219 GLU 354 CB 0.0051 -0.0051 -0.0050 2220 GLU 354 CG 0.0079 -0.0071 -0.0032 2221 GLU 354 CD 0.0088 -0.0102 -0.0052 2222 GLU 354 OE1 0.0078 -0.0106 -0.0070 2223 GLU 354 OE2 0.0106 -0.0123 -0.0049 2224 GLU 355 N 0.0020 -0.0018 -0.0103 2225 GLU 355 CA -0.0009 0.0003 -0.0103 2226 GLU 355 C -0.0031 0.0025 -0.0089 2227 GLU 355 O -0.0021 0.0026 -0.0070 2228 GLU 355 CB -0.0004 0.0009 -0.0081 2229 GLU 355 CG 0.0022 -0.0012 -0.0089 2230 GLU 355 CD 0.0013 -0.0007 -0.0090 2231 GLU 355 OE1 0.0004 -0.0013 -0.0119 2232 GLU 355 OE2 0.0015 0.0004 -0.0061 2233 LYS 356 N -0.0060 0.0042 -0.0099 2234 LYS 356 CA -0.0084 0.0063 -0.0090 2235 LYS 356 C -0.0085 0.0080 -0.0052 2236 LYS 356 O -0.0085 0.0084 -0.0041 2237 LYS 356 CB -0.0116 0.0075 -0.0114 2238 LYS 356 CG -0.0141 0.0095 -0.0109 2239 LYS 356 CD -0.0173 0.0110 -0.0129 2240 LYS 356 CE -0.0186 0.0127 -0.0111 2241 LYS 356 NZ -0.0217 0.0141 -0.0131 2242 CYS 357 N -0.0087 0.0090 -0.0033 2243 CYS 357 CA -0.0090 0.0107 0.0003 2244 CYS 357 C -0.0120 0.0129 0.0005 2245 CYS 357 O -0.0145 0.0142 -0.0007 2246 CYS 357 CB -0.0090 0.0114 0.0019 2247 CYS 357 SG -0.0094 0.0136 0.0064 2248 GLY 358 N -0.0123 0.0140 -0.0000 2249 GLY 358 CA -0.0169 0.0164 0.0016 2250 GLY 358 C -0.0176 0.0156 -0.0021 2251 GLY 358 O -0.0187 0.0145 -0.0076 2252 LEU 496 N -0.0190 0.0208 -0.0004 2253 LEU 496 CA -0.0155 0.0219 -0.0036 2254 LEU 496 C -0.0135 0.0185 -0.0033 2255 LEU 496 O -0.0099 0.0165 -0.0050 2256 LEU 496 CB -0.0168 0.0267 -0.0051 2257 LEU 496 CG -0.0140 0.0298 -0.0087 2258 LEU 496 CD1 -0.0138 0.0307 -0.0093 2259 LEU 496 CD2 -0.0155 0.0343 -0.0098 2260 PRO 497 N -0.0157 0.0177 -0.0013 2261 PRO 497 CA -0.0138 0.0146 -0.0012 2262 PRO 497 C -0.0119 0.0099 -0.0002 2263 PRO 497 O -0.0136 0.0082 0.0019 2264 PRO 497 CB -0.0173 0.0148 0.0014 2265 PRO 497 CG -0.0210 0.0163 0.0033 2266 PRO 497 CD -0.0201 0.0197 0.0010 2267 ARG 498 N -0.0084 0.0077 -0.0017 2268 ARG 498 CA -0.0061 0.0032 -0.0011 2269 ARG 498 C -0.0049 0.0002 -0.0005 2270 ARG 498 O -0.0036 0.0017 -0.0022 2271 ARG 498 CB -0.0022 0.0033 -0.0041 2272 ARG 498 CG -0.0026 0.0033 -0.0038 2273 ARG 498 CD 0.0009 0.0047 -0.0071 2274 ARG 498 NE -0.0001 0.0070 -0.0075 2275 ARG 498 CZ 0.0026 0.0080 -0.0100 2276 ARG 498 NH1 0.0065 0.0070 -0.0124 2277 ARG 498 NH2 0.0013 0.0102 -0.0101 2278 ALA 499 N -0.0037 -0.0004 -0.0046 2279 ALA 499 CA -0.0037 -0.0008 -0.0038 2280 ALA 499 C -0.0026 -0.0011 -0.0043 2281 ALA 499 O -0.0017 -0.0013 -0.0051 2282 ALA 499 CB -0.0036 -0.0015 -0.0024 2283 SER 500 N -0.0027 -0.0012 -0.0039 2284 SER 500 CA -0.0018 -0.0015 -0.0044 2285 SER 500 C -0.0008 -0.0024 -0.0036 2286 SER 500 O -0.0000 -0.0027 -0.0039 2287 SER 500 CB -0.0025 -0.0011 -0.0045 2288 SER 500 OG -0.0035 -0.0003 -0.0050 2289 ALA 501 N -0.0008 -0.0029 -0.0026 2290 ALA 501 CA 0.0001 -0.0037 -0.0017 2291 ALA 501 C 0.0012 -0.0041 -0.0021 2292 ALA 501 O 0.0010 -0.0039 -0.0025 2293 ALA 501 CB -0.0006 -0.0040 -0.0003 2294 VAL 502 N 0.0046 -0.0072 -0.0031 2295 VAL 502 CA 0.0076 -0.0055 -0.0045 2296 VAL 502 C 0.0088 -0.0048 -0.0058 2297 VAL 502 O 0.0104 -0.0038 -0.0084 2298 VAL 502 CB 0.0098 -0.0045 -0.0018 2299 VAL 502 CG1 0.0100 -0.0046 0.0015 2300 VAL 502 CG2 0.0130 -0.0027 -0.0033 2301 ALA 503 N 0.0081 -0.0053 -0.0041 2302 ALA 503 CA 0.0092 -0.0046 -0.0053 2303 ALA 503 C 0.0079 -0.0051 -0.0088 2304 ALA 503 O 0.0096 -0.0041 -0.0111 2305 ALA 503 CB 0.0084 -0.0052 -0.0026 2306 LEU 504 N 0.0049 -0.0067 -0.0094 2307 LEU 504 CA 0.0036 -0.0073 -0.0128 2308 LEU 504 C 0.0047 -0.0065 -0.0155 2309 LEU 504 O 0.0050 -0.0061 -0.0185 2310 LEU 504 CB 0.0001 -0.0091 -0.0125 2311 LEU 504 CG -0.0013 -0.0100 -0.0100 2312 LEU 504 CD1 -0.0043 -0.0117 -0.0086 2313 LEU 504 CD2 -0.0016 -0.0101 -0.0116 2314 GLU 505 N 0.0096 -0.0130 -0.0169 2315 GLU 505 CA 0.0096 -0.0107 -0.0154 2316 GLU 505 C 0.0084 -0.0075 -0.0162 2317 GLU 505 O 0.0078 -0.0056 -0.0164 2318 GLU 505 CB 0.0109 -0.0109 -0.0121 2319 GLU 505 CG 0.0111 -0.0085 -0.0103 2320 GLU 505 CD 0.0114 -0.0095 -0.0100 2321 GLU 505 OE1 0.0115 -0.0119 -0.0114 2322 GLU 505 OE2 0.0116 -0.0078 -0.0085 2323 VAL 506 N 0.0080 -0.0069 -0.0167 2324 VAL 506 CA 0.0068 -0.0040 -0.0178 2325 VAL 506 C 0.0055 -0.0038 -0.0208 2326 VAL 506 O 0.0046 -0.0014 -0.0214 2327 VAL 506 CB 0.0066 -0.0037 -0.0180 2328 VAL 506 CG1 0.0052 -0.0009 -0.0195 2329 VAL 506 CG2 0.0078 -0.0034 -0.0149 2330 GLN 507 N 0.0054 -0.0063 -0.0226 2331 GLN 507 CA 0.0043 -0.0064 -0.0254 2332 GLN 507 C 0.0043 -0.0058 -0.0250 2333 GLN 507 O 0.0032 -0.0041 -0.0266 2334 GLN 507 CB 0.0044 -0.0094 -0.0272 2335 GLN 507 CG 0.0034 -0.0093 -0.0295 2336 GLN 507 CD 0.0040 -0.0123 -0.0301 2337 GLN 507 NE2 0.0051 -0.0133 -0.0280 2338 GLN 507 OE1 0.0034 -0.0138 -0.0325 2339 ARG 508 N 0.0079 -0.0146 -0.0218 2340 ARG 508 CA 0.0087 -0.0121 -0.0179 2341 ARG 508 C 0.0056 -0.0092 -0.0152 2342 ARG 508 O 0.0036 -0.0071 -0.0131 2343 ARG 508 CB 0.0137 -0.0124 -0.0159 2344 ARG 508 CG 0.0149 -0.0100 -0.0120 2345 ARG 508 CD 0.0198 -0.0101 -0.0099 2346 ARG 508 NE 0.0204 -0.0091 -0.0082 2347 ARG 508 CZ 0.0193 -0.0064 -0.0048 2348 ARG 508 NH1 0.0172 -0.0042 -0.0026 2349 ARG 508 NH2 0.0202 -0.0058 -0.0035 2350 LEU 509 N 0.0053 -0.0091 -0.0151 2351 LEU 509 CA 0.0024 -0.0064 -0.0126 2352 LEU 509 C -0.0027 -0.0058 -0.0141 2353 LEU 509 O -0.0053 -0.0033 -0.0117 2354 LEU 509 CB 0.0034 -0.0066 -0.0124 2355 LEU 509 CG 0.0083 -0.0069 -0.0106 2356 LEU 509 CD1 0.0093 -0.0080 -0.0117 2357 LEU 509 CD2 0.0091 -0.0041 -0.0061 2358 ASN 510 N -0.0041 -0.0081 -0.0180 2359 ASN 510 CA -0.0089 -0.0076 -0.0196 2360 ASN 510 C -0.0101 -0.0064 -0.0185 2361 ASN 510 O -0.0138 -0.0045 -0.0174 2362 ASN 510 CB -0.0098 -0.0105 -0.0242 2363 ASN 510 CG -0.0098 -0.0114 -0.0255 2364 ASN 510 ND2 -0.0096 -0.0141 -0.0293 2365 ASN 510 OD1 -0.0100 -0.0097 -0.0231 2366 ALA 511 N -0.0148 -0.0195 -0.0465 2367 ALA 511 CA -0.0164 -0.0121 -0.0319 2368 ALA 511 C -0.0181 -0.0039 -0.0155 2369 ALA 511 O -0.0289 -0.0017 -0.0028 2370 ALA 511 CB -0.0006 -0.0062 -0.0340 2371 LEU 512 N -0.0076 0.0007 -0.0157 2372 LEU 512 CA -0.0087 0.0083 -0.0011 2373 LEU 512 C -0.0273 0.0029 0.0043 2374 LEU 512 O -0.0352 -0.0063 -0.0061 2375 LEU 512 CB 0.0045 0.0119 -0.0052 2376 LEU 512 CG 0.0037 0.0185 0.0075 2377 LEU 512 CD1 0.0059 0.0290 0.0247 2378 LEU 512 CD2 0.0174 0.0211 0.0009 2379 ASP 513 N -0.0343 0.0088 0.0207 2380 ASP 513 CA -0.0518 0.0047 0.0275 2381 ASP 513 C -0.0513 0.0048 0.0272 2382 ASP 513 O -0.0486 0.0128 0.0396 2383 ASP 513 CB -0.0587 0.0115 0.0454 2384 ASP 513 CG -0.0771 0.0073 0.0527 2385 ASP 513 OD1 -0.0874 -0.0028 0.0429 2386 ASP 513 OD2 -0.0812 0.0140 0.0683 2387 LEU 514 N 0.0490 -0.0396 -0.0597 2388 LEU 514 CA 0.0270 -0.0376 -0.0413 2389 LEU 514 C 0.0332 -0.0280 -0.0455 2390 LEU 514 O 0.0490 -0.0068 -0.0565 2391 LEU 514 CB 0.0104 -0.0139 -0.0253 2392 LEU 514 CG -0.0020 -0.0219 -0.0158 2393 LEU 514 CD1 -0.0117 0.0075 -0.0049 2394 LEU 514 CD2 -0.0224 -0.0473 -0.0013 2395 GLU 515 N 0.0207 -0.0436 -0.0367 2396 GLU 515 CA 0.0215 -0.0332 -0.0363 2397 GLU 515 C 0.0019 -0.0097 -0.0178 2398 GLU 515 O -0.0146 -0.0144 -0.0046 2399 GLU 515 CB 0.0183 -0.0612 -0.0364 2400 GLU 515 CG 0.0236 -0.0532 -0.0399 2401 GLU 515 CD 0.0047 -0.0683 -0.0257 2402 GLU 515 OE1 -0.0167 -0.0726 -0.0084 2403 GLU 515 OE2 0.0112 -0.0756 -0.0319 2404 LYS 516 N 0.0040 0.0160 -0.0172 2405 LYS 516 CA -0.0150 0.0385 0.0007 2406 LYS 516 C -0.0397 0.0214 0.0196 2407 LYS 516 O -0.0585 0.0298 0.0359 2408 LYS 516 CB -0.0156 0.0589 0.0032 2409 LYS 516 CG 0.0069 0.0812 -0.0133 2410 LYS 516 CD 0.0018 0.1087 -0.0065 2411 LYS 516 CE -0.0036 0.0982 -0.0030 2412 LYS 516 NZ 0.0180 0.0860 -0.0221 2413 LYS 517 N -0.0198 -0.0229 0.0145 2414 LYS 517 CA -0.0181 -0.0257 0.0194 2415 LYS 517 C -0.0169 -0.0217 0.0115 2416 LYS 517 O -0.0121 -0.0178 0.0029 2417 LYS 517 CB -0.0073 -0.0304 0.0259 2418 LYS 517 CG -0.0083 -0.0351 0.0351 2419 LYS 517 CD -0.0194 -0.0372 0.0417 2420 LYS 517 CE -0.0199 -0.0397 0.0466 2421 LYS 517 NZ -0.0310 -0.0417 0.0528 2422 ILE 518 N -0.0214 -0.0228 0.0146 2423 ILE 518 CA -0.0208 -0.0197 0.0084 2424 ILE 518 C -0.0175 -0.0237 0.0153 2425 ILE 518 O -0.0178 -0.0286 0.0248 2426 ILE 518 CB -0.0323 -0.0156 0.0031 2427 ILE 518 CG1 -0.0426 -0.0185 0.0110 2428 ILE 518 CG2 -0.0341 -0.0109 -0.0054 2429 ILE 518 CD1 -0.0456 -0.0205 0.0156 2430 GLY 519 N -0.0146 -0.0215 0.0105 2431 GLY 519 CA -0.0102 -0.0250 0.0162 2432 GLY 519 C 0.0023 -0.0278 0.0189 2433 GLY 519 O 0.0058 -0.0321 0.0263 2434 LYS 520 N 0.0038 -0.0196 0.0037 2435 LYS 520 CA 0.0065 -0.0162 0.0072 2436 LYS 520 C 0.0082 -0.0113 0.0053 2437 LYS 520 O 0.0106 -0.0083 0.0082 2438 LYS 520 CB 0.0072 -0.0179 0.0123 2439 LYS 520 CG 0.0056 -0.0228 0.0146 2440 LYS 520 CD 0.0060 -0.0228 0.0158 2441 LYS 520 CE 0.0048 -0.0273 0.0189 2442 LYS 520 NZ 0.0022 -0.0307 0.0158 2443 SER 521 N 0.0072 -0.0104 0.0006 2444 SER 521 CA 0.0087 -0.0060 -0.0015 2445 SER 521 C 0.0085 -0.0036 -0.0056 2446 SER 521 O 0.0064 -0.0055 -0.0094 2447 SER 521 CB 0.0077 -0.0066 -0.0036 2448 SER 521 OG 0.0092 -0.0022 -0.0056 2449 ILE 522 N 0.0107 0.0005 -0.0048 2450 ILE 522 CA 0.0108 0.0033 -0.0088 2451 ILE 522 C 0.0105 0.0053 -0.0129 2452 ILE 522 O 0.0092 0.0055 -0.0174 2453 ILE 522 CB 0.0134 0.0072 -0.0067 2454 ILE 522 CG1 0.0135 0.0051 -0.0031 2455 ILE 522 CG2 0.0137 0.0106 -0.0108 2456 ILE 522 CD1 0.0161 0.0085 0.0003 2457 LEU 523 N 0.0070 -0.0023 -0.0117 2458 LEU 523 CA 0.0068 -0.0021 -0.0103 2459 LEU 523 C 0.0080 -0.0024 -0.0102 2460 LEU 523 O 0.0077 -0.0022 -0.0097 2461 LEU 523 CB 0.0068 -0.0019 -0.0090 2462 LEU 523 CG 0.0064 -0.0016 -0.0075 2463 LEU 523 CD1 0.0049 -0.0012 -0.0076 2464 LEU 523 CD2 0.0067 -0.0016 -0.0063 2465 GLY 524 N 0.0093 -0.0028 -0.0105 2466 GLY 524 CA 0.0104 -0.0031 -0.0104 2467 GLY 524 C 0.0102 -0.0032 -0.0115 2468 GLY 524 O 0.0105 -0.0032 -0.0111 2469 LYS 525 N 0.0096 -0.0032 -0.0128 2470 LYS 525 CA 0.0093 -0.0032 -0.0139 2471 LYS 525 C 0.0081 -0.0028 -0.0133 2472 LYS 525 O 0.0080 -0.0028 -0.0136 2473 LYS 525 CB 0.0088 -0.0032 -0.0154 2474 LYS 525 CG 0.0099 -0.0036 -0.0161 2475 LYS 525 CD 0.0094 -0.0036 -0.0176 2476 LYS 525 CE 0.0106 -0.0041 -0.0185 2477 LYS 525 NZ 0.0114 -0.0042 -0.0178 2478 VAL 526 N 0.0029 0.0010 -0.0094 2479 VAL 526 CA 0.0015 0.0025 -0.0093 2480 VAL 526 C 0.0021 0.0021 -0.0086 2481 VAL 526 O 0.0014 0.0025 -0.0095 2482 VAL 526 CB 0.0006 0.0040 -0.0079 2483 VAL 526 CG1 -0.0008 0.0055 -0.0076 2484 VAL 526 CG2 -0.0001 0.0044 -0.0088 2485 HIS 527 N 0.0034 0.0014 -0.0069 2486 HIS 527 CA 0.0040 0.0009 -0.0062 2487 HIS 527 C 0.0046 -0.0003 -0.0080 2488 HIS 527 O 0.0044 -0.0002 -0.0083 2489 HIS 527 CB 0.0054 0.0003 -0.0041 2490 HIS 527 CG 0.0048 0.0016 -0.0021 2491 HIS 527 CD2 0.0046 0.0022 -0.0008 2492 HIS 527 ND1 0.0043 0.0025 -0.0010 2493 HIS 527 CE1 0.0039 0.0036 0.0007 2494 HIS 527 NE2 0.0041 0.0034 0.0009 2495 LEU 528 N 0.0053 -0.0015 -0.0093 2496 LEU 528 CA 0.0058 -0.0027 -0.0111 2497 LEU 528 C 0.0044 -0.0019 -0.0128 2498 LEU 528 O 0.0045 -0.0023 -0.0137 2499 LEU 528 CB 0.0068 -0.0041 -0.0120 2500 LEU 528 CG 0.0076 -0.0056 -0.0137 2501 LEU 528 CD1 0.0087 -0.0064 -0.0128 2502 LEU 528 CD2 0.0086 -0.0068 -0.0145 2503 ALA 529 N -0.0000 0.0007 -0.0071 2504 ALA 529 CA -0.0017 0.0007 -0.0075 2505 ALA 529 C -0.0025 0.0015 -0.0059 2506 ALA 529 O -0.0033 0.0016 -0.0059 2507 ALA 529 CB -0.0031 0.0005 -0.0084 2508 MET 530 N -0.0023 0.0021 -0.0045 2509 MET 530 CA -0.0029 0.0029 -0.0029 2510 MET 530 C -0.0019 0.0030 -0.0024 2511 MET 530 O -0.0027 0.0034 -0.0019 2512 MET 530 CB -0.0025 0.0035 -0.0015 2513 MET 530 CG -0.0037 0.0043 -0.0001 2514 MET 530 SD -0.0056 0.0045 -0.0002 2515 MET 530 CE -0.0047 0.0049 0.0011 2516 VAL 531 N -0.0001 0.0027 -0.0026 2517 VAL 531 CA 0.0010 0.0027 -0.0022 2518 VAL 531 C 0.0002 0.0024 -0.0032 2519 VAL 531 O -0.0001 0.0027 -0.0025 2520 VAL 531 CB 0.0030 0.0023 -0.0026 2521 VAL 531 CG1 0.0041 0.0022 -0.0025 2522 VAL 531 CG2 0.0039 0.0027 -0.0015 2523 ARG 532 N -0.0013 0.0013 -0.0025 2524 ARG 532 CA -0.0023 0.0007 -0.0037 2525 ARG 532 C -0.0039 0.0017 -0.0038 2526 ARG 532 O -0.0048 0.0016 -0.0044 2527 ARG 532 CB -0.0021 -0.0005 -0.0047 2528 ARG 532 CG -0.0005 -0.0015 -0.0046 2529 ARG 532 CD -0.0004 -0.0028 -0.0058 2530 ARG 532 NE 0.0010 -0.0038 -0.0058 2531 ARG 532 CZ 0.0020 -0.0046 -0.0060 2532 ARG 532 NH1 0.0016 -0.0045 -0.0062 2533 ARG 532 NH2 0.0033 -0.0054 -0.0059 2534 TYR 533 N -0.0044 0.0026 -0.0033 2535 TYR 533 CA -0.0059 0.0035 -0.0033 2536 TYR 533 C -0.0060 0.0045 -0.0026 2537 TYR 533 O -0.0072 0.0049 -0.0029 2538 TYR 533 CB -0.0062 0.0043 -0.0029 2539 TYR 533 CG -0.0069 0.0036 -0.0039 2540 TYR 533 CD1 -0.0080 0.0031 -0.0050 2541 TYR 533 CD2 -0.0065 0.0036 -0.0036 2542 TYR 533 CE1 -0.0086 0.0025 -0.0059 2543 TYR 533 CE2 -0.0071 0.0030 -0.0046 2544 TYR 533 CZ -0.0082 0.0025 -0.0057 2545 TYR 533 OH -0.0088 0.0019 -0.0066 2546 HIS 534 N -0.0049 0.0048 -0.0015 2547 HIS 534 CA -0.0049 0.0056 -0.0008 2548 HIS 534 C -0.0051 0.0050 -0.0015 2549 HIS 534 O -0.0062 0.0055 -0.0017 2550 HIS 534 CB -0.0034 0.0059 0.0004 2551 HIS 534 CG -0.0035 0.0071 0.0014 2552 HIS 534 CD2 -0.0026 0.0073 0.0022 2553 HIS 534 ND1 -0.0046 0.0083 0.0019 2554 HIS 534 CE1 -0.0043 0.0092 0.0029 2555 HIS 534 NE2 -0.0031 0.0086 0.0030 2556 GLU 535 N -0.0015 0.0053 -0.0023 2557 GLU 535 CA -0.0012 0.0054 -0.0023 2558 GLU 535 C -0.0021 0.0051 -0.0026 2559 GLU 535 O -0.0022 0.0052 -0.0023 2560 GLU 535 CB -0.0003 0.0052 -0.0030 2561 GLU 535 CG -0.0000 0.0051 -0.0032 2562 GLU 535 CD 0.0011 0.0052 -0.0035 2563 GLU 535 OE1 0.0016 0.0049 -0.0041 2564 GLU 535 OE2 0.0016 0.0054 -0.0031 2565 GLY 536 N -0.0028 0.0047 -0.0031 2566 GLY 536 CA -0.0036 0.0044 -0.0034 2567 GLY 536 C -0.0046 0.0046 -0.0027 2568 GLY 536 O -0.0053 0.0043 -0.0030 2569 GLY 537 N -0.0046 0.0050 -0.0020 2570 GLY 537 CA -0.0055 0.0052 -0.0013 2571 GLY 537 C -0.0063 0.0049 -0.0015 2572 GLY 537 O -0.0072 0.0050 -0.0011 2573 ARG 538 N -0.0073 0.0027 -0.0009 2574 ARG 538 CA -0.0064 0.0032 -0.0006 2575 ARG 538 C -0.0060 0.0029 -0.0014 2576 ARG 538 O -0.0050 0.0032 -0.0016 2577 ARG 538 CB -0.0067 0.0037 0.0006 2578 ARG 538 CG -0.0059 0.0042 0.0010 2579 ARG 538 CD -0.0046 0.0047 0.0010 2580 ARG 538 NE -0.0038 0.0053 0.0015 2581 ARG 538 CZ -0.0037 0.0059 0.0026 2582 ARG 538 NH1 -0.0043 0.0060 0.0032 2583 ARG 538 NH2 -0.0029 0.0064 0.0030 2584 PHE 539 N -0.0068 0.0023 -0.0019 2585 PHE 539 CA -0.0066 0.0020 -0.0027 2586 PHE 539 C -0.0064 0.0014 -0.0039 2587 PHE 539 O -0.0065 0.0009 -0.0047 2588 PHE 539 CB -0.0076 0.0017 -0.0025 2589 PHE 539 CG -0.0078 0.0022 -0.0013 2590 PHE 539 CD1 -0.0069 0.0028 -0.0008 2591 PHE 539 CD2 -0.0090 0.0021 -0.0007 2592 PHE 539 CE1 -0.0071 0.0033 0.0003 2593 PHE 539 CE2 -0.0092 0.0026 0.0004 2594 PHE 539 CZ -0.0083 0.0032 0.0009 2595 CYS 540 N -0.0061 0.0013 -0.0042 2596 CYS 540 CA -0.0060 0.0008 -0.0053 2597 CYS 540 C -0.0047 0.0010 -0.0058 2598 CYS 540 O -0.0040 0.0016 -0.0052 2599 CYS 540 CB -0.0067 0.0005 -0.0053 2600 CYS 540 SG -0.0070 -0.0003 -0.0066 2601 GLU 541 N 0.0183 -0.0178 -0.0294 2602 GLU 541 CA 0.0105 -0.0189 -0.0257 2603 GLU 541 C 0.0114 -0.0173 -0.0230 2604 GLU 541 O 0.0181 -0.0145 -0.0224 2605 GLU 541 CB 0.0064 -0.0173 -0.0192 2606 GLU 541 CG 0.0114 -0.0129 -0.0137 2607 GLU 541 CD 0.0062 -0.0113 -0.0063 2608 GLU 541 OE1 -0.0007 -0.0142 -0.0070 2609 GLU 541 OE2 0.0092 -0.0072 -0.0001 2610 LYS 542 N 0.0045 -0.0191 -0.0214 2611 LYS 542 CA 0.0045 -0.0188 -0.0209 2612 LYS 542 C 0.0092 -0.0141 -0.0147 2613 LYS 542 O 0.0119 -0.0135 -0.0154 2614 LYS 542 CB -0.0042 -0.0214 -0.0195 2615 LYS 542 CG -0.0088 -0.0264 -0.0263 2616 LYS 542 CD -0.0164 -0.0288 -0.0256 2617 LYS 542 CE -0.0224 -0.0277 -0.0184 2618 LYS 542 NZ -0.0256 -0.0291 -0.0188 2619 GLY 543 N 0.0102 -0.0109 -0.0087 2620 GLY 543 CA 0.0140 -0.0065 -0.0023 2621 GLY 543 C 0.0221 -0.0030 -0.0012 2622 GLY 543 O 0.0243 0.0010 0.0053 2623 GLU 544 N 0.0196 0.0021 -0.0077 2624 GLU 544 CA 0.0167 0.0007 -0.0076 2625 GLU 544 C 0.0152 0.0021 -0.0067 2626 GLU 544 O 0.0164 0.0043 -0.0061 2627 GLU 544 CB 0.0146 0.0008 -0.0072 2628 GLU 544 CG 0.0147 -0.0018 -0.0082 2629 GLU 544 CD 0.0179 -0.0022 -0.0091 2630 GLU 544 OE1 0.0192 -0.0004 -0.0086 2631 GLU 544 OE2 0.0189 -0.0044 -0.0102 2632 GLU 545 N 0.0127 0.0008 -0.0068 2633 GLU 545 CA 0.0108 0.0019 -0.0059 2634 GLU 545 C 0.0081 0.0032 -0.0049 2635 GLU 545 O 0.0069 0.0019 -0.0051 2636 GLU 545 CB 0.0097 -0.0005 -0.0067 2637 GLU 545 CG 0.0079 0.0005 -0.0059 2638 GLU 545 CD 0.0099 0.0022 -0.0056 2639 GLU 545 OE1 0.0127 0.0021 -0.0062 2640 GLU 545 OE2 0.0086 0.0038 -0.0047 2641 TRP 546 N 0.0073 0.0056 -0.0037 2642 TRP 546 CA 0.0051 0.0072 -0.0026 2643 TRP 546 C 0.0020 0.0056 -0.0026 2644 TRP 546 O 0.0012 0.0041 -0.0031 2645 TRP 546 CB 0.0051 0.0101 -0.0014 2646 TRP 546 CG 0.0040 0.0102 -0.0011 2647 TRP 546 CD1 0.0055 0.0097 -0.0016 2648 TRP 546 CD2 0.0011 0.0110 -0.0002 2649 TRP 546 CE2 0.0010 0.0108 -0.0003 2650 TRP 546 CE3 -0.0015 0.0117 0.0006 2651 TRP 546 NE1 0.0038 0.0100 -0.0012 2652 TRP 546 CZ2 -0.0015 0.0114 0.0005 2653 TRP 546 CZ3 -0.0040 0.0122 0.0013 2654 TRP 546 CH2 -0.0040 0.0121 0.0013 2655 ASP 547 N -0.0041 0.0112 0.0060 2656 ASP 547 CA -0.0024 0.0116 0.0083 2657 ASP 547 C 0.0006 0.0103 0.0072 2658 ASP 547 O 0.0007 0.0097 0.0058 2659 ASP 547 CB -0.0043 0.0125 0.0091 2660 ASP 547 CG -0.0028 0.0131 0.0117 2661 ASP 547 OD1 -0.0002 0.0128 0.0128 2662 ASP 547 OD2 -0.0042 0.0138 0.0126 2663 GLN 548 N 0.0030 0.0099 0.0079 2664 GLN 548 CA 0.0059 0.0087 0.0071 2665 GLN 548 C 0.0073 0.0090 0.0088 2666 GLN 548 O 0.0089 0.0081 0.0077 2667 GLN 548 CB 0.0081 0.0082 0.0075 2668 GLN 548 CG 0.0067 0.0081 0.0063 2669 GLN 548 CD 0.0090 0.0075 0.0062 2670 GLN 548 NE2 0.0082 0.0070 0.0046 2671 GLN 548 OE1 0.0115 0.0073 0.0077 2672 GLU 549 N 0.0067 0.0103 0.0116 2673 GLU 549 CA 0.0081 0.0106 0.0135 2674 GLU 549 C 0.0072 0.0104 0.0123 2675 GLU 549 O 0.0091 0.0097 0.0119 2676 GLU 549 CB 0.0072 0.0121 0.0166 2677 GLU 549 CG 0.0074 0.0125 0.0178 2678 GLU 549 CD 0.0044 0.0131 0.0171 2679 GLU 549 OE1 0.0022 0.0143 0.0184 2680 GLU 549 OE2 0.0044 0.0124 0.0153 2681 SER 550 N 0.0025 0.0129 0.0131 2682 SER 550 CA 0.0014 0.0123 0.0114 2683 SER 550 C 0.0025 0.0105 0.0080 2684 SER 550 O 0.0033 0.0098 0.0067 2685 SER 550 CB -0.0025 0.0128 0.0114 2686 SER 550 OG -0.0036 0.0144 0.0146 2687 ALA 551 N 0.0027 0.0098 0.0066 2688 ALA 551 CA 0.0040 0.0082 0.0034 2689 ALA 551 C 0.0077 0.0077 0.0034 2690 ALA 551 O 0.0086 0.0066 0.0013 2691 ALA 551 CB 0.0037 0.0077 0.0023 2692 VAL 552 N 0.0099 0.0085 0.0057 2693 VAL 552 CA 0.0135 0.0081 0.0058 2694 VAL 552 C 0.0137 0.0085 0.0066 2695 VAL 552 O 0.0159 0.0077 0.0055 2696 VAL 552 CB 0.0157 0.0090 0.0082 2697 VAL 552 CG1 0.0191 0.0090 0.0092 2698 VAL 552 CG2 0.0163 0.0082 0.0068 2699 PHE 553 N 0.0109 0.0075 0.0072 2700 PHE 553 CA 0.0107 0.0077 0.0076 2701 PHE 553 C 0.0102 0.0065 0.0049 2702 PHE 553 O 0.0119 0.0060 0.0042 2703 PHE 553 CB 0.0082 0.0088 0.0096 2704 PHE 553 CG 0.0073 0.0090 0.0099 2705 PHE 553 CD1 0.0051 0.0083 0.0082 2706 PHE 553 CD2 0.0087 0.0099 0.0119 2707 PHE 553 CE1 0.0043 0.0085 0.0085 2708 PHE 553 CE2 0.0079 0.0101 0.0122 2709 PHE 553 CZ 0.0057 0.0094 0.0105 2710 HIS 554 N 0.0080 0.0058 0.0033 2711 HIS 554 CA 0.0073 0.0046 0.0007 2712 HIS 554 C 0.0097 0.0035 -0.0015 2713 HIS 554 O 0.0103 0.0026 -0.0032 2714 HIS 554 CB 0.0041 0.0043 -0.0004 2715 HIS 554 CG 0.0016 0.0052 0.0011 2716 HIS 554 CD2 -0.0005 0.0061 0.0028 2717 HIS 554 ND1 0.0011 0.0052 0.0011 2718 HIS 554 CE1 -0.0012 0.0060 0.0027 2719 HIS 554 NE2 -0.0023 0.0066 0.0037 2720 LEU 555 N 0.0112 0.0035 -0.0013 2721 LEU 555 CA 0.0137 0.0025 -0.0031 2722 LEU 555 C 0.0164 0.0026 -0.0024 2723 LEU 555 O 0.0179 0.0017 -0.0043 2724 LEU 555 CB 0.0147 0.0025 -0.0029 2725 LEU 555 CG 0.0168 0.0014 -0.0051 2726 LEU 555 CD1 0.0152 0.0001 -0.0079 2727 LEU 555 CD2 0.0181 0.0017 -0.0043 2728 GLU 556 N 0.0190 0.0024 0.0023 2729 GLU 556 CA 0.0221 0.0029 0.0029 2730 GLU 556 C 0.0211 0.0019 0.0010 2731 GLU 556 O 0.0237 0.0011 -0.0008 2732 GLU 556 CB 0.0226 0.0049 0.0070 2733 GLU 556 CG 0.0259 0.0060 0.0087 2734 GLU 556 CD 0.0246 0.0077 0.0125 2735 GLU 556 OE1 0.0226 0.0086 0.0145 2736 GLU 556 OE2 0.0256 0.0083 0.0135 2737 HIS 557 N 0.0174 0.0019 0.0015 2738 HIS 557 CA 0.0163 0.0010 -0.0003 2739 HIS 557 C 0.0166 -0.0010 -0.0044 2740 HIS 557 O 0.0180 -0.0019 -0.0062 2741 HIS 557 CB 0.0120 0.0013 0.0009 2742 HIS 557 CG 0.0118 0.0030 0.0045 2743 HIS 557 CD2 0.0092 0.0043 0.0073 2744 HIS 557 ND1 0.0146 0.0037 0.0055 2745 HIS 557 CE1 0.0137 0.0053 0.0087 2746 HIS 557 NE2 0.0104 0.0056 0.0099 2747 ALA 558 N 0.0155 -0.0019 -0.0059 2748 ALA 558 CA 0.0159 -0.0038 -0.0098 2749 ALA 558 C 0.0203 -0.0041 -0.0111 2750 ALA 558 O 0.0213 -0.0054 -0.0139 2751 ALA 558 CB 0.0139 -0.0044 -0.0110 2752 ALA 559 N 0.0187 -0.0052 -0.0079 2753 ALA 559 CA 0.0231 -0.0063 -0.0086 2754 ALA 559 C 0.0252 -0.0061 -0.0074 2755 ALA 559 O 0.0277 -0.0075 -0.0094 2756 ALA 559 CB 0.0254 -0.0057 -0.0067 2757 ASN 560 N 0.0241 -0.0042 -0.0043 2758 ASN 560 CA 0.0259 -0.0039 -0.0031 2759 ASN 560 C 0.0242 -0.0049 -0.0055 2760 ASN 560 O 0.0259 -0.0051 -0.0053 2761 ASN 560 CB 0.0251 -0.0017 0.0010 2762 ASN 560 CG 0.0272 -0.0007 0.0036 2763 ASN 560 ND2 0.0255 0.0013 0.0068 2764 ASN 560 OD1 0.0302 -0.0016 0.0027 2765 LEU 561 N 0.0209 -0.0056 -0.0079 2766 LEU 561 CA 0.0194 -0.0068 -0.0106 2767 LEU 561 C 0.0208 -0.0090 -0.0145 2768 LEU 561 O 0.0192 -0.0102 -0.0172 2769 LEU 561 CB 0.0147 -0.0061 -0.0107 2770 LEU 561 CG 0.0131 -0.0040 -0.0072 2771 LEU 561 CD1 0.0084 -0.0034 -0.0075 2772 LEU 561 CD2 0.0150 -0.0038 -0.0063 2773 GLY 562 N 0.0132 -0.0272 -0.0076 2774 GLY 562 CA 0.0124 -0.0293 -0.0063 2775 GLY 562 C 0.0127 -0.0291 -0.0094 2776 GLY 562 O 0.0124 -0.0298 -0.0079 2777 GLU 563 N 0.0133 -0.0280 -0.0135 2778 GLU 563 CA 0.0136 -0.0280 -0.0167 2779 GLU 563 C 0.0122 -0.0325 -0.0185 2780 GLU 563 O 0.0118 -0.0341 -0.0209 2781 GLU 563 CB 0.0149 -0.0250 -0.0204 2782 GLU 563 CG 0.0163 -0.0205 -0.0194 2783 GLU 563 CD 0.0163 -0.0200 -0.0171 2784 GLU 563 OE1 0.0162 -0.0207 -0.0194 2785 GLU 563 OE2 0.0164 -0.0189 -0.0132 2786 SER 81 N 0.0026 -0.0297 0.0087 2787 SER 81 CA 0.0047 -0.0300 0.0041 2788 SER 81 C 0.0008 -0.0261 -0.0003 2789 SER 81 O 0.0019 -0.0254 -0.0060 2790 SER 81 CB 0.0100 -0.0327 0.0006 2791 SER 81 OG 0.0142 -0.0364 0.0036 2792 GLU 82 N -0.0040 -0.0236 0.0025 2793 GLU 82 CA -0.0081 -0.0198 -0.0012 2794 GLU 82 C -0.0113 -0.0184 0.0018 2795 GLU 82 O -0.0159 -0.0150 0.0008 2796 GLU 82 CB -0.0117 -0.0171 -0.0022 2797 GLU 82 CG -0.0142 -0.0169 0.0037 2798 GLU 82 CD -0.0166 -0.0149 0.0024 2799 GLU 82 OE1 -0.0181 -0.0151 0.0068 2800 GLU 82 OE2 -0.0170 -0.0132 -0.0031 2801 GLU 83 N -0.0090 -0.0209 0.0054 2802 GLU 83 CA -0.0117 -0.0198 0.0081 2803 GLU 83 C -0.0127 -0.0178 0.0032 2804 GLU 83 O -0.0164 -0.0156 0.0043 2805 GLU 83 CB -0.0085 -0.0232 0.0127 2806 GLU 83 CG -0.0031 -0.0261 0.0099 2807 GLU 83 CD -0.0028 -0.0262 0.0094 2808 GLU 83 OE1 -0.0064 -0.0245 0.0124 2809 GLU 83 OE2 0.0010 -0.0279 0.0060 2810 GLU 84 N -0.0088 -0.0157 0.0031 2811 GLU 84 CA -0.0090 -0.0154 0.0017 2812 GLU 84 C -0.0105 -0.0134 0.0003 2813 GLU 84 O -0.0113 -0.0123 0.0003 2814 GLU 84 CB -0.0076 -0.0171 -0.0002 2815 GLU 84 CG -0.0060 -0.0192 0.0009 2816 GLU 84 CD -0.0054 -0.0199 0.0002 2817 GLU 84 OE1 -0.0064 -0.0186 0.0001 2818 GLU 84 OE2 -0.0040 -0.0217 -0.0002 2819 ILE 85 N -0.0110 -0.0128 -0.0008 2820 ILE 85 CA -0.0124 -0.0109 -0.0023 2821 ILE 85 C -0.0139 -0.0091 -0.0006 2822 ILE 85 O -0.0150 -0.0075 -0.0011 2823 ILE 85 CB -0.0123 -0.0109 -0.0041 2824 ILE 85 CG1 -0.0108 -0.0128 -0.0056 2825 ILE 85 CG2 -0.0137 -0.0090 -0.0059 2826 ILE 85 CD1 -0.0108 -0.0127 -0.0082 2827 ARG 86 N -0.0138 -0.0092 0.0016 2828 ARG 86 CA -0.0151 -0.0076 0.0035 2829 ARG 86 C -0.0155 -0.0072 0.0044 2830 ARG 86 O -0.0168 -0.0054 0.0044 2831 ARG 86 CB -0.0148 -0.0081 0.0058 2832 ARG 86 CG -0.0146 -0.0083 0.0052 2833 ARG 86 CD -0.0154 -0.0074 0.0073 2834 ARG 86 NE -0.0148 -0.0081 0.0073 2835 ARG 86 CZ -0.0134 -0.0100 0.0079 2836 ARG 86 NH1 -0.0123 -0.0114 0.0086 2837 ARG 86 NH2 -0.0130 -0.0105 0.0078 2838 GLU 87 N -0.0081 -0.0065 -0.0000 2839 GLU 87 CA -0.0072 -0.0069 0.0010 2840 GLU 87 C -0.0073 -0.0078 0.0015 2841 GLU 87 O -0.0064 -0.0078 0.0022 2842 GLU 87 CB -0.0072 -0.0076 0.0014 2843 GLU 87 CG -0.0062 -0.0079 0.0025 2844 GLU 87 CD -0.0052 -0.0069 0.0027 2845 GLU 87 OE1 -0.0052 -0.0059 0.0020 2846 GLU 87 OE2 -0.0043 -0.0071 0.0035 2847 ALA 88 N -0.0083 -0.0084 0.0011 2848 ALA 88 CA -0.0083 -0.0091 0.0015 2849 ALA 88 C -0.0079 -0.0083 0.0013 2850 ALA 88 O -0.0076 -0.0087 0.0019 2851 ALA 88 CB -0.0095 -0.0099 0.0011 2852 PHE 89 N -0.0081 -0.0073 0.0005 2853 PHE 89 CA -0.0076 -0.0065 0.0004 2854 PHE 89 C -0.0064 -0.0062 0.0012 2855 PHE 89 O -0.0060 -0.0060 0.0014 2856 PHE 89 CB -0.0079 -0.0053 -0.0006 2857 PHE 89 CG -0.0076 -0.0045 -0.0009 2858 PHE 89 CD1 -0.0068 -0.0035 -0.0008 2859 PHE 89 CD2 -0.0083 -0.0048 -0.0013 2860 PHE 89 CE1 -0.0065 -0.0027 -0.0011 2861 PHE 89 CE2 -0.0080 -0.0040 -0.0016 2862 PHE 89 CZ -0.0072 -0.0030 -0.0015 2863 ARG 90 N -0.0035 -0.0020 -0.0006 2864 ARG 90 CA -0.0030 -0.0018 -0.0002 2865 ARG 90 C -0.0029 -0.0020 0.0007 2866 ARG 90 O -0.0023 -0.0017 0.0010 2867 ARG 90 CB -0.0031 -0.0018 -0.0004 2868 ARG 90 CG -0.0030 -0.0015 -0.0012 2869 ARG 90 CD -0.0032 -0.0016 -0.0015 2870 ARG 90 NE -0.0029 -0.0015 -0.0011 2871 ARG 90 CZ -0.0031 -0.0016 -0.0010 2872 ARG 90 NH1 -0.0037 -0.0019 -0.0014 2873 ARG 90 NH2 -0.0027 -0.0015 -0.0006 2874 VAL 91 N -0.0033 -0.0024 0.0010 2875 VAL 91 CA -0.0032 -0.0025 0.0018 2876 VAL 91 C -0.0027 -0.0023 0.0020 2877 VAL 91 O -0.0024 -0.0023 0.0027 2878 VAL 91 CB -0.0039 -0.0030 0.0022 2879 VAL 91 CG1 -0.0044 -0.0033 0.0019 2880 VAL 91 CG2 -0.0042 -0.0032 0.0020 2881 PHE 92 N -0.0027 -0.0021 0.0015 2882 PHE 92 CA -0.0022 -0.0019 0.0016 2883 PHE 92 C -0.0016 -0.0014 0.0013 2884 PHE 92 O -0.0010 -0.0011 0.0016 2885 PHE 92 CB -0.0026 -0.0020 0.0012 2886 PHE 92 CG -0.0032 -0.0025 0.0016 2887 PHE 92 CD1 -0.0032 -0.0027 0.0023 2888 PHE 92 CD2 -0.0039 -0.0027 0.0011 2889 PHE 92 CE1 -0.0038 -0.0031 0.0026 2890 PHE 92 CE2 -0.0044 -0.0032 0.0014 2891 PHE 92 CZ -0.0044 -0.0034 0.0021 2892 ASP 93 N -0.0000 0.0056 0.0032 2893 ASP 93 CA 0.0003 0.0055 0.0030 2894 ASP 93 C 0.0009 0.0055 0.0026 2895 ASP 93 O 0.0011 0.0059 0.0022 2896 ASP 93 CB -0.0000 0.0061 0.0030 2897 ASP 93 CG 0.0003 0.0061 0.0028 2898 ASP 93 OD1 0.0006 0.0056 0.0028 2899 ASP 93 OD2 0.0002 0.0066 0.0026 2900 LYS 94 N 0.0012 0.0049 0.0027 2901 LYS 94 CA 0.0018 0.0048 0.0023 2902 LYS 94 C 0.0022 0.0050 0.0019 2903 LYS 94 O 0.0025 0.0053 0.0015 2904 LYS 94 CB 0.0020 0.0041 0.0024 2905 LYS 94 CG 0.0019 0.0039 0.0026 2906 LYS 94 CD 0.0019 0.0044 0.0024 2907 LYS 94 CE 0.0024 0.0047 0.0019 2908 LYS 94 NZ 0.0023 0.0054 0.0016 2909 ASP 95 N 0.0022 0.0048 0.0020 2910 ASP 95 CA 0.0025 0.0050 0.0016 2911 ASP 95 C 0.0023 0.0057 0.0015 2912 ASP 95 O 0.0026 0.0059 0.0011 2913 ASP 95 CB 0.0026 0.0045 0.0018 2914 ASP 95 CG 0.0021 0.0046 0.0021 2915 ASP 95 OD1 0.0016 0.0049 0.0023 2916 ASP 95 OD2 0.0022 0.0043 0.0022 2917 GLY 96 N 0.0040 0.0058 0.0036 2918 GLY 96 CA 0.0037 0.0071 0.0036 2919 GLY 96 C 0.0030 0.0077 0.0038 2920 GLY 96 O 0.0031 0.0088 0.0037 2921 ASN 97 N 0.0023 0.0069 0.0041 2922 ASN 97 CA 0.0016 0.0073 0.0043 2923 ASN 97 C 0.0004 0.0078 0.0047 2924 ASN 97 O -0.0003 0.0080 0.0050 2925 ASN 97 CB 0.0016 0.0063 0.0044 2926 ASN 97 CG 0.0006 0.0053 0.0048 2927 ASN 97 ND2 0.0000 0.0050 0.0050 2928 ASN 97 OD1 0.0004 0.0050 0.0049 2929 GLY 98 N 0.0001 0.0078 0.0048 2930 GLY 98 CA -0.0011 0.0083 0.0052 2931 GLY 98 C -0.0020 0.0073 0.0056 2932 GLY 98 O -0.0031 0.0076 0.0059 2933 TYR 99 N -0.0012 0.0059 0.0051 2934 TYR 99 CA -0.0019 0.0051 0.0050 2935 TYR 99 C -0.0014 0.0039 0.0054 2936 TYR 99 O -0.0004 0.0038 0.0058 2937 TYR 99 CB -0.0022 0.0056 0.0048 2938 TYR 99 CG -0.0027 0.0067 0.0044 2939 TYR 99 CD1 -0.0021 0.0078 0.0044 2940 TYR 99 CD2 -0.0039 0.0067 0.0039 2941 TYR 99 CE1 -0.0027 0.0089 0.0040 2942 TYR 99 CE2 -0.0044 0.0078 0.0035 2943 TYR 99 CZ -0.0038 0.0088 0.0035 2944 TYR 99 OH -0.0044 0.0099 0.0031 2945 ILE 100 N -0.0021 0.0029 0.0054 2946 ILE 100 CA -0.0018 0.0017 0.0057 2947 ILE 100 C -0.0021 0.0014 0.0057 2948 ILE 100 O -0.0031 0.0014 0.0053 2949 ILE 100 CB -0.0024 0.0008 0.0057 2950 ILE 100 CG1 -0.0021 0.0013 0.0057 2951 ILE 100 CG2 -0.0019 -0.0004 0.0061 2952 ILE 100 CD1 -0.0029 0.0006 0.0055 2953 SER 101 N -0.0013 0.0011 0.0060 2954 SER 101 CA -0.0014 0.0007 0.0061 2955 SER 101 C -0.0015 -0.0007 0.0063 2956 SER 101 O -0.0010 -0.0012 0.0066 2957 SER 101 CB -0.0005 0.0013 0.0063 2958 SER 101 OG 0.0006 0.0009 0.0068 2959 ALA 102 N 0.0008 0.0001 0.0066 2960 ALA 102 CA 0.0007 -0.0003 0.0072 2961 ALA 102 C 0.0012 -0.0005 0.0071 2962 ALA 102 O 0.0010 -0.0006 0.0074 2963 ALA 102 CB 0.0007 -0.0007 0.0076 2964 ALA 103 N 0.0018 -0.0005 0.0068 2965 ALA 103 CA 0.0023 -0.0007 0.0068 2966 ALA 103 C 0.0022 -0.0003 0.0064 2967 ALA 103 O 0.0022 -0.0005 0.0065 2968 ALA 103 CB 0.0030 -0.0008 0.0065 2969 GLU 104 N 0.0019 0.0001 0.0060 2970 GLU 104 CA 0.0017 0.0005 0.0057 2971 GLU 104 C 0.0011 0.0005 0.0060 2972 GLU 104 O 0.0011 0.0005 0.0060 2973 GLU 104 CB 0.0016 0.0011 0.0051 2974 GLU 104 CG 0.0022 0.0012 0.0046 2975 GLU 104 CD 0.0020 0.0017 0.0042 2976 GLU 104 OE1 0.0016 0.0018 0.0043 2977 GLU 104 OE2 0.0024 0.0019 0.0037 2978 LEU 105 N 0.0018 0.0021 0.0043 2979 LEU 105 CA 0.0024 0.0022 0.0040 2980 LEU 105 C 0.0023 0.0022 0.0033 2981 LEU 105 O 0.0028 0.0024 0.0030 2982 LEU 105 CB 0.0024 0.0022 0.0042 2983 LEU 105 CG 0.0029 0.0024 0.0039 2984 LEU 105 CD1 0.0035 0.0026 0.0042 2985 LEU 105 CD2 0.0028 0.0024 0.0040 2986 ARG 106 N 0.0018 0.0021 0.0030 2987 ARG 106 CA 0.0017 0.0020 0.0023 2988 ARG 106 C 0.0019 0.0021 0.0021 2989 ARG 106 O 0.0022 0.0022 0.0017 2990 ARG 106 CB 0.0011 0.0019 0.0021 2991 ARG 106 CG 0.0009 0.0018 0.0015 2992 ARG 106 CD 0.0012 0.0019 0.0010 2993 ARG 106 NE 0.0018 0.0021 0.0008 2994 ARG 106 CZ 0.0022 0.0022 0.0004 2995 ARG 106 NH1 0.0021 0.0021 0.0003 2996 ARG 106 NH2 0.0027 0.0023 0.0002 2997 HIS 107 N 0.0017 0.0020 0.0025 2998 HIS 107 CA 0.0018 0.0021 0.0023 2999 HIS 107 C 0.0025 0.0023 0.0024 3000 HIS 107 O 0.0027 0.0023 0.0020 3001 HIS 107 CB 0.0015 0.0020 0.0028 3002 HIS 107 CG 0.0017 0.0020 0.0027 3003 HIS 107 CD2 0.0021 0.0021 0.0031 3004 HIS 107 ND1 0.0015 0.0020 0.0023 3005 HIS 107 CE1 0.0017 0.0020 0.0023 3006 HIS 107 NE2 0.0021 0.0022 0.0028 3007 VAL 108 N -0.0007 0.0036 0.0007 3008 VAL 108 CA -0.0001 0.0033 0.0008 3009 VAL 108 C 0.0004 0.0042 0.0002 3010 VAL 108 O 0.0003 0.0044 0.0000 3011 VAL 108 CB 0.0007 0.0025 0.0013 3012 VAL 108 CG1 0.0014 0.0024 0.0013 3013 VAL 108 CG2 0.0001 0.0017 0.0020 3014 MET 109 N 0.0010 0.0046 -0.0002 3015 MET 109 CA 0.0016 0.0054 -0.0008 3016 MET 109 C 0.0008 0.0061 -0.0013 3017 MET 109 O 0.0012 0.0067 -0.0017 3018 MET 109 CB 0.0024 0.0057 -0.0012 3019 MET 109 CG 0.0032 0.0050 -0.0007 3020 MET 109 SD 0.0036 0.0041 -0.0002 3021 MET 109 CE 0.0051 0.0043 -0.0005 3022 THR 110 N -0.0002 0.0062 -0.0012 3023 THR 110 CA -0.0010 0.0069 -0.0016 3024 THR 110 C -0.0015 0.0066 -0.0013 3025 THR 110 O -0.0017 0.0071 -0.0016 3026 THR 110 CB -0.0019 0.0072 -0.0017 3027 THR 110 CG2 -0.0026 0.0080 -0.0022 3028 THR 110 OG1 -0.0014 0.0074 -0.0019 3029 ASN 111 N -0.0010 0.0100 -0.0026 3030 ASN 111 CA -0.0024 0.0091 -0.0021 3031 ASN 111 C -0.0025 0.0088 -0.0021 3032 ASN 111 O -0.0037 0.0090 -0.0015 3033 ASN 111 CB -0.0025 0.0075 -0.0022 3034 ASN 111 CG -0.0041 0.0066 -0.0017 3035 ASN 111 ND2 -0.0046 0.0058 -0.0016 3036 ASN 111 OD1 -0.0047 0.0065 -0.0015 3037 LEU 112 N -0.0013 0.0082 -0.0027 3038 LEU 112 CA -0.0014 0.0076 -0.0027 3039 LEU 112 C -0.0009 0.0089 -0.0027 3040 LEU 112 O -0.0006 0.0086 -0.0029 3041 LEU 112 CB -0.0003 0.0062 -0.0034 3042 LEU 112 CG -0.0006 0.0047 -0.0034 3043 LEU 112 CD1 -0.0001 0.0032 -0.0039 3044 LEU 112 CD2 -0.0023 0.0045 -0.0027 3045 GLY 113 N -0.0009 0.0105 -0.0026 3046 GLY 113 CA -0.0006 0.0118 -0.0025 3047 GLY 113 C 0.0009 0.0119 -0.0031 3048 GLY 113 O 0.0011 0.0126 -0.0031 3049 GLU 114 N -0.0003 0.0099 -0.0077 3050 GLU 114 CA 0.0021 0.0106 -0.0062 3051 GLU 114 C 0.0025 0.0113 -0.0062 3052 GLU 114 O 0.0012 0.0101 -0.0067 3053 GLU 114 CB 0.0034 0.0084 -0.0045 3054 GLU 114 CG 0.0032 0.0077 -0.0044 3055 GLU 114 CD 0.0053 0.0088 -0.0032 3056 GLU 114 OE1 0.0072 0.0081 -0.0016 3057 GLU 114 OE2 0.0053 0.0105 -0.0038 3058 LYS 115 N 0.0043 0.0132 -0.0055 3059 LYS 115 CA 0.0047 0.0144 -0.0057 3060 LYS 115 C 0.0065 0.0132 -0.0039 3061 LYS 115 O 0.0084 0.0146 -0.0030 3062 LYS 115 CB 0.0054 0.0174 -0.0063 3063 LYS 115 CG 0.0056 0.0186 -0.0065 3064 LYS 115 CD 0.0033 0.0190 -0.0084 3065 LYS 115 CE 0.0033 0.0192 -0.0084 3066 LEU 116 N 0.0059 0.0107 -0.0034 3067 LEU 116 CA 0.0073 0.0093 -0.0019 3068 LEU 116 C 0.0060 0.0083 -0.0025 3069 LEU 116 O 0.0039 0.0076 -0.0038 3070 LEU 116 CB 0.0081 0.0070 -0.0005 3071 LEU 116 CG 0.0092 0.0076 0.0001 3072 LEU 116 CD1 0.0084 0.0053 0.0003 3073 LEU 116 CD2 0.0118 0.0083 0.0017 3074 THR 117 N 0.0052 -0.0019 0.0034 3075 THR 117 CA 0.0073 -0.0038 0.0037 3076 THR 117 C 0.0083 -0.0036 0.0021 3077 THR 117 O 0.0072 -0.0021 0.0011 3078 THR 117 CB 0.0068 -0.0052 0.0063 3079 THR 117 CG2 0.0055 -0.0051 0.0079 3080 THR 117 OG1 0.0057 -0.0046 0.0069 3081 ASP 118 N 0.0103 -0.0052 0.0019 3082 ASP 118 CA 0.0113 -0.0051 0.0005 3083 ASP 118 C 0.0102 -0.0049 0.0017 3084 ASP 118 O 0.0101 -0.0041 0.0005 3085 ASP 118 CB 0.0138 -0.0069 0.0001 3086 ASP 118 CG 0.0143 -0.0088 0.0024 3087 ASP 118 OD1 0.0127 -0.0088 0.0044 3088 ASP 118 OD2 0.0162 -0.0103 0.0023 3089 GLU 119 N 0.0092 -0.0057 0.0041 3090 GLU 119 CA 0.0079 -0.0054 0.0053 3091 GLU 119 C 0.0058 -0.0033 0.0048 3092 GLU 119 O 0.0051 -0.0025 0.0045 3093 GLU 119 CB 0.0074 -0.0068 0.0080 3094 GLU 119 CG 0.0062 -0.0067 0.0095 3095 GLU 119 CD 0.0072 -0.0070 0.0085 3096 GLU 119 OE1 0.0092 -0.0079 0.0074 3097 GLU 119 OE2 0.0060 -0.0063 0.0090 3098 GLU 120 N 0.0046 0.0004 0.0059 3099 GLU 120 CA 0.0037 0.0018 0.0057 3100 GLU 120 C 0.0039 0.0023 0.0043 3101 GLU 120 O 0.0033 0.0031 0.0042 3102 GLU 120 CB 0.0031 0.0027 0.0056 3103 GLU 120 CG 0.0023 0.0031 0.0070 3104 GLU 120 CD 0.0020 0.0035 0.0070 3105 GLU 120 OE1 0.0027 0.0026 0.0068 3106 GLU 120 OE2 0.0011 0.0046 0.0072 3107 VAL 121 N 0.0048 0.0017 0.0031 3108 VAL 121 CA 0.0051 0.0020 0.0016 3109 VAL 121 C 0.0053 0.0015 0.0020 3110 VAL 121 O 0.0050 0.0022 0.0015 3111 VAL 121 CB 0.0059 0.0015 0.0003 3112 VAL 121 CG1 0.0065 0.0015 -0.0010 3113 VAL 121 CG2 0.0056 0.0023 -0.0002 3114 ASP 122 N 0.0060 0.0002 0.0027 3115 ASP 122 CA 0.0062 -0.0003 0.0032 3116 ASP 122 C 0.0052 0.0005 0.0042 3117 ASP 122 O 0.0051 0.0006 0.0041 3118 ASP 122 CB 0.0069 -0.0018 0.0041 3119 ASP 122 CG 0.0080 -0.0027 0.0030 3120 ASP 122 OD1 0.0082 -0.0023 0.0016 3121 ASP 122 OD2 0.0087 -0.0040 0.0036 3122 GLU 123 N -0.0005 0.0004 0.0011 3123 GLU 123 CA -0.0007 0.0008 0.0017 3124 GLU 123 C -0.0003 0.0015 0.0020 3125 GLU 123 O -0.0005 0.0019 0.0027 3126 GLU 123 CB -0.0007 0.0006 0.0015 3127 GLU 123 CG -0.0012 -0.0001 0.0015 3128 GLU 123 CD -0.0018 -0.0003 0.0022 3129 GLU 123 OE1 -0.0023 -0.0008 0.0022 3130 GLU 123 OE2 -0.0019 0.0001 0.0027 3131 MET 124 N 0.0003 0.0018 0.0016 3132 MET 124 CA 0.0006 0.0026 0.0018 3133 MET 124 C 0.0003 0.0026 0.0023 3134 MET 124 O 0.0003 0.0031 0.0029 3135 MET 124 CB 0.0013 0.0028 0.0012 3136 MET 124 CG 0.0017 0.0029 0.0008 3137 MET 124 SD 0.0024 0.0029 -0.0000 3138 MET 124 CE 0.0028 0.0038 0.0003 3139 ILE 125 N 0.0001 0.0022 0.0021 3140 ILE 125 CA -0.0002 0.0022 0.0025 3141 ILE 125 C -0.0007 0.0022 0.0032 3142 ILE 125 O -0.0008 0.0026 0.0037 3143 ILE 125 CB -0.0003 0.0016 0.0021 3144 ILE 125 CG1 0.0003 0.0018 0.0014 3145 ILE 125 CG2 -0.0007 0.0016 0.0026 3146 ILE 125 CD1 0.0006 0.0023 0.0016 3147 ARG 126 N -0.0027 0.0030 0.0020 3148 ARG 126 CA -0.0030 0.0031 0.0017 3149 ARG 126 C -0.0030 0.0029 0.0015 3150 ARG 126 O -0.0031 0.0030 0.0013 3151 ARG 126 CB -0.0032 0.0032 0.0014 3152 ARG 126 CG -0.0034 0.0036 0.0013 3153 ARG 126 CD -0.0035 0.0036 0.0011 3154 ARG 126 NE -0.0034 0.0034 0.0012 3155 ARG 126 CZ -0.0034 0.0032 0.0009 3156 ARG 126 NH1 -0.0036 0.0032 0.0005 3157 ARG 126 NH2 -0.0033 0.0031 0.0010 3158 GLU 127 N -0.0028 0.0025 0.0015 3159 GLU 127 CA -0.0027 0.0022 0.0013 3160 GLU 127 C -0.0027 0.0023 0.0016 3161 GLU 127 O -0.0027 0.0023 0.0014 3162 GLU 127 CB -0.0026 0.0018 0.0013 3163 GLU 127 CG -0.0026 0.0015 0.0010 3164 GLU 127 CD -0.0024 0.0010 0.0010 3165 GLU 127 OE1 -0.0021 0.0009 0.0013 3166 GLU 127 OE2 -0.0025 0.0008 0.0006 3167 ALA 128 N -0.0025 0.0023 0.0020 3168 ALA 128 CA -0.0024 0.0024 0.0022 3169 ALA 128 C -0.0026 0.0029 0.0023 3170 ALA 128 O -0.0026 0.0030 0.0024 3171 ALA 128 CB -0.0021 0.0023 0.0026 3172 ASP 129 N -0.0052 0.0025 0.0043 3173 ASP 129 CA -0.0054 0.0029 0.0044 3174 ASP 129 C -0.0055 0.0030 0.0039 3175 ASP 129 O -0.0057 0.0032 0.0036 3176 ASP 129 CB -0.0055 0.0033 0.0045 3177 ASP 129 CG -0.0057 0.0038 0.0045 3178 ASP 129 OD1 -0.0057 0.0039 0.0046 3179 ASP 129 OD2 -0.0059 0.0041 0.0044 3180 ILE 130 N -0.0055 0.0029 0.0039 3181 ILE 130 CA -0.0056 0.0029 0.0035 3182 ILE 130 C -0.0058 0.0035 0.0034 3183 ILE 130 O -0.0060 0.0036 0.0030 3184 ILE 130 CB -0.0055 0.0026 0.0035 3185 ILE 130 CG1 -0.0053 0.0021 0.0034 3186 ILE 130 CG2 -0.0056 0.0027 0.0031 3187 ILE 130 CD1 -0.0054 0.0020 0.0028 3188 ASP 131 N -0.0058 0.0037 0.0039 3189 ASP 131 CA -0.0060 0.0042 0.0039 3190 ASP 131 C -0.0062 0.0045 0.0036 3191 ASP 131 O -0.0063 0.0048 0.0034 3192 ASP 131 CB -0.0059 0.0044 0.0044 3193 ASP 131 CG -0.0058 0.0042 0.0047 3194 ASP 131 OD1 -0.0058 0.0044 0.0050 3195 ASP 131 OD2 -0.0056 0.0037 0.0047 3196 GLY 132 N -0.0091 0.0049 0.0046 3197 GLY 132 CA -0.0093 0.0046 0.0044 3198 GLY 132 C -0.0088 0.0052 0.0048 3199 GLY 132 O -0.0090 0.0051 0.0046 3200 ASP 133 N -0.0080 0.0058 0.0052 3201 ASP 133 CA -0.0074 0.0064 0.0056 3202 ASP 133 C -0.0065 0.0056 0.0059 3203 ASP 133 O -0.0059 0.0060 0.0062 3204 ASP 133 CB -0.0070 0.0074 0.0060 3205 ASP 133 CG -0.0062 0.0072 0.0063 3206 ASP 133 OD1 -0.0059 0.0062 0.0062 3207 ASP 133 OD2 -0.0058 0.0080 0.0067 3208 GLY 134 N -0.0064 0.0046 0.0057 3209 GLY 134 CA -0.0056 0.0038 0.0058 3210 GLY 134 C -0.0045 0.0037 0.0062 3211 GLY 134 O -0.0038 0.0030 0.0064 3212 GLN 135 N -0.0034 0.0040 0.0057 3213 GLN 135 CA -0.0038 0.0035 0.0061 3214 GLN 135 C -0.0047 0.0028 0.0053 3215 GLN 135 O -0.0050 0.0029 0.0044 3216 GLN 135 CB -0.0032 0.0041 0.0060 3217 GLN 135 CG -0.0022 0.0048 0.0066 3218 GLN 135 CD -0.0016 0.0054 0.0066 3219 GLN 135 NE2 -0.0014 0.0059 0.0056 3220 GLN 135 OE1 -0.0014 0.0053 0.0075 3221 VAL 136 N -0.0052 0.0022 0.0058 3222 VAL 136 CA -0.0062 0.0015 0.0052 3223 VAL 136 C -0.0062 0.0017 0.0047 3224 VAL 136 O -0.0060 0.0016 0.0054 3225 VAL 136 CB -0.0068 0.0006 0.0060 3226 VAL 136 CG1 -0.0078 -0.0001 0.0054 3227 VAL 136 CG2 -0.0069 0.0004 0.0064 3228 ASN 137 N -0.0064 0.0019 0.0035 3229 ASN 137 CA -0.0064 0.0020 0.0030 3230 ASN 137 C -0.0074 0.0011 0.0030 3231 ASN 137 O -0.0080 0.0004 0.0033 3232 ASN 137 CB -0.0062 0.0027 0.0018 3233 ASN 137 CG -0.0068 0.0024 0.0009 3234 ASN 137 ND2 -0.0064 0.0030 0.0002 3235 ASN 137 OD1 -0.0076 0.0016 0.0009 3236 TYR 138 N -0.0097 -0.0027 0.0022 3237 TYR 138 CA -0.0108 -0.0033 0.0021 3238 TYR 138 C -0.0107 -0.0036 0.0015 3239 TYR 138 O -0.0114 -0.0038 0.0018 3240 TYR 138 CB -0.0114 -0.0040 0.0015 3241 TYR 138 CG -0.0125 -0.0047 0.0014 3242 TYR 138 CD1 -0.0134 -0.0045 0.0023 3243 TYR 138 CD2 -0.0126 -0.0054 0.0004 3244 TYR 138 CE1 -0.0144 -0.0052 0.0022 3245 TYR 138 CE2 -0.0136 -0.0060 0.0003 3246 TYR 138 CZ -0.0145 -0.0059 0.0012 3247 TYR 138 OH -0.0155 -0.0065 0.0011 3248 GLU 139 N -0.0098 -0.0037 0.0007 3249 GLU 139 CA -0.0096 -0.0039 0.0002 3250 GLU 139 C -0.0095 -0.0034 0.0009 3251 GLU 139 O -0.0100 -0.0037 0.0009 3252 GLU 139 CB -0.0085 -0.0040 -0.0007 3253 GLU 139 CG -0.0083 -0.0043 -0.0013 3254 GLU 139 CD -0.0071 -0.0039 -0.0017 3255 GLU 139 OE1 -0.0064 -0.0034 -0.0015 3256 GLU 139 OE2 -0.0068 -0.0040 -0.0022 3257 GLU 140 N -0.0089 -0.0026 0.0015 3258 GLU 140 CA -0.0087 -0.0020 0.0023 3259 GLU 140 C -0.0098 -0.0021 0.0031 3260 GLU 140 O -0.0101 -0.0020 0.0034 3261 GLU 140 CB -0.0078 -0.0012 0.0028 3262 GLU 140 CG -0.0067 -0.0010 0.0021 3263 GLU 140 CD -0.0059 -0.0003 0.0026 3264 GLU 140 OE1 -0.0061 -0.0002 0.0029 3265 GLU 140 OE2 -0.0051 0.0003 0.0027 3266 PHE 141 N -0.0074 -0.0052 0.0017 3267 PHE 141 CA -0.0078 -0.0049 0.0018 3268 PHE 141 C -0.0080 -0.0049 0.0017 3269 PHE 141 O -0.0081 -0.0046 0.0019 3270 PHE 141 CB -0.0081 -0.0051 0.0015 3271 PHE 141 CG -0.0086 -0.0048 0.0016 3272 PHE 141 CD1 -0.0086 -0.0044 0.0018 3273 PHE 141 CD2 -0.0089 -0.0048 0.0014 3274 PHE 141 CE1 -0.0090 -0.0042 0.0018 3275 PHE 141 CE2 -0.0093 -0.0045 0.0014 3276 PHE 141 CZ -0.0094 -0.0042 0.0016 3277 VAL 142 N -0.0080 -0.0052 0.0015 3278 VAL 142 CA -0.0081 -0.0052 0.0014 3279 VAL 142 C -0.0079 -0.0050 0.0017 3280 VAL 142 O -0.0080 -0.0048 0.0018 3281 VAL 142 CB -0.0081 -0.0056 0.0011 3282 VAL 142 CG1 -0.0081 -0.0056 0.0011 3283 VAL 142 CG2 -0.0085 -0.0057 0.0008 3284 GLN 143 N -0.0074 -0.0051 0.0018 3285 GLN 143 CA -0.0072 -0.0050 0.0021 3286 GLN 143 C -0.0072 -0.0045 0.0024 3287 GLN 143 O -0.0073 -0.0043 0.0025 3288 GLN 143 CB -0.0067 -0.0051 0.0022 3289 GLN 143 CG -0.0065 -0.0055 0.0019 3290 GLN 143 CD -0.0065 -0.0055 0.0019 3291 GLN 143 NE2 -0.0066 -0.0059 0.0016 3292 GLN 143 OE1 -0.0065 -0.0053 0.0021 3293 MET 144 N -0.0048 -0.0031 0.0021 3294 MET 144 CA -0.0048 -0.0032 0.0020 3295 MET 144 C -0.0047 -0.0030 0.0020 3296 MET 144 O -0.0048 -0.0030 0.0020 3297 MET 144 CB -0.0047 -0.0034 0.0019 3298 MET 144 CG -0.0047 -0.0035 0.0019 3299 MET 144 SD -0.0045 -0.0034 0.0017 3300 MET 144 CE -0.0044 -0.0035 0.0015 3301 MET 145 N -0.0046 -0.0029 0.0018 3302 MET 145 CA -0.0045 -0.0027 0.0018 3303 MET 145 C -0.0046 -0.0025 0.0019 3304 MET 145 O -0.0046 -0.0024 0.0019 3305 MET 145 CB -0.0044 -0.0026 0.0016 3306 MET 145 CG -0.0043 -0.0028 0.0015 3307 MET 145 SD -0.0042 -0.0029 0.0014 3308 MET 145 CE -0.0040 -0.0028 0.0012 3309 THR 146 N -0.0047 -0.0024 0.0020 3310 THR 146 CA -0.0048 -0.0022 0.0021 3311 THR 146 C -0.0049 -0.0023 0.0023 3312 THR 146 O -0.0049 -0.0021 0.0023 3313 THR 146 CB -0.0048 -0.0021 0.0022 3314 THR 146 CG2 -0.0047 -0.0020 0.0020 3315 THR 146 OG1 -0.0049 -0.0022 0.0023 3316 ALA 147 N -0.0071 0.0031 0.0081 3317 ALA 147 CA -0.0071 0.0038 0.0126 3318 ALA 147 C -0.0081 0.0076 0.0132 3319 ALA 147 O -0.0086 0.0088 0.0102 3320 ALA 147 CB -0.0058 -0.0001 0.0144