1 MET 1 N 0.0029 0.0162 -0.0013 2 MET 1 CA 0.0024 0.0145 -0.0009 3 MET 1 C 0.0010 0.0153 0.0002 4 MET 1 O 0.0011 0.0170 0.0002 5 MET 1 CB 0.0037 0.0137 -0.0020 6 MET 1 CG 0.0035 0.0115 -0.0020 7 MET 1 SD 0.0052 0.0104 -0.0034 8 MET 1 CE 0.0046 0.0078 -0.0030 9 MET 1 H 0.0039 0.0158 -0.0021 10 MET 1 H2 0.0032 0.0174 -0.0015 11 MET 1 H3 0.0021 0.0167 -0.0006 12 GLU 2 N -0.0002 0.0140 0.0012 13 GLU 2 CA -0.0015 0.0147 0.0022 14 GLU 2 C -0.0009 0.0149 0.0018 15 GLU 2 O 0.0001 0.0138 0.0009 16 GLU 2 CB -0.0028 0.0132 0.0033 17 GLU 2 CG -0.0044 0.0140 0.0046 18 GLU 2 CD -0.0058 0.0127 0.0057 19 GLU 2 OE1 -0.0071 0.0132 0.0068 20 GLU 2 OE2 -0.0056 0.0113 0.0056 21 GLU 2 H -0.0002 0.0126 0.0011 22 GLN 3 N -0.0013 0.0160 0.0022 23 GLN 3 CA -0.0009 0.0164 0.0019 24 GLN 3 C -0.0022 0.0161 0.0029 25 GLN 3 O -0.0034 0.0168 0.0037 26 GLN 3 CB -0.0002 0.0182 0.0014 27 GLN 3 CG 0.0003 0.0186 0.0009 28 GLN 3 CD 0.0010 0.0204 0.0003 29 GLN 3 NE2 0.0008 0.0214 0.0005 30 GLN 3 OE1 0.0019 0.0210 -0.0003 31 GLN 3 H -0.0022 0.0166 0.0029 32 GLN 3 HE21 0.0000 0.0210 0.0011 33 GLN 3 HE22 0.0012 0.0226 0.0002 34 PHE 4 N -0.0019 0.0152 0.0027 35 PHE 4 CA -0.0031 0.0149 0.0036 36 PHE 4 C -0.0026 0.0155 0.0032 37 PHE 4 O -0.0015 0.0149 0.0024 38 PHE 4 CB -0.0034 0.0128 0.0038 39 PHE 4 CG -0.0037 0.0120 0.0041 40 PHE 4 CD1 -0.0051 0.0121 0.0051 41 PHE 4 CD2 -0.0026 0.0110 0.0033 42 PHE 4 CE1 -0.0054 0.0113 0.0054 43 PHE 4 CE2 -0.0029 0.0101 0.0036 44 PHE 4 CZ -0.0043 0.0103 0.0046 45 PHE 4 H -0.0009 0.0147 0.0020 46 ASP 5 N -0.0027 0.0167 0.0038 47 ASP 5 CA -0.0024 0.0173 0.0035 48 ASP 5 C -0.0030 0.0165 0.0041 49 ASP 5 O -0.0041 0.0164 0.0051 50 ASP 5 CB -0.0026 0.0191 0.0035 51 ASP 5 CG -0.0020 0.0200 0.0030 52 ASP 5 OD1 -0.0010 0.0197 0.0020 53 ASP 5 OD2 -0.0027 0.0209 0.0035 54 ASP 5 H -0.0034 0.0172 0.0044 55 PHE 6 N -0.0023 0.0160 0.0035 56 PHE 6 CA -0.0026 0.0151 0.0039 57 PHE 6 C -0.0021 0.0158 0.0033 58 PHE 6 O -0.0012 0.0167 0.0025 59 PHE 6 CB -0.0023 0.0133 0.0037 60 PHE 6 CG -0.0031 0.0125 0.0044 61 PHE 6 CD1 -0.0041 0.0119 0.0054 62 PHE 6 CD2 -0.0027 0.0124 0.0041 63 PHE 6 CE1 -0.0049 0.0112 0.0061 64 PHE 6 CE2 -0.0034 0.0117 0.0048 65 PHE 6 CZ -0.0045 0.0111 0.0058 66 PHE 6 H -0.0014 0.0161 0.0027 67 ASP 7 N -0.0026 0.0154 0.0043 68 ASP 7 CA -0.0021 0.0157 0.0038 69 ASP 7 C -0.0012 0.0144 0.0029 70 ASP 7 O -0.0002 0.0148 0.0020 71 ASP 7 CB -0.0031 0.0157 0.0048 72 ASP 7 CG -0.0039 0.0171 0.0056 73 ASP 7 OD1 -0.0034 0.0185 0.0052 74 ASP 7 OD2 -0.0049 0.0169 0.0066 75 ASP 7 H -0.0033 0.0147 0.0049 76 VAL 8 N -0.0015 0.0128 0.0031 77 VAL 8 CA -0.0008 0.0114 0.0024 78 VAL 8 C -0.0007 0.0104 0.0022 79 VAL 8 O -0.0016 0.0099 0.0031 80 VAL 8 CB -0.0014 0.0103 0.0029 81 VAL 8 CG1 -0.0005 0.0090 0.0020 82 VAL 8 CG2 -0.0017 0.0114 0.0032 83 VAL 8 H -0.0023 0.0126 0.0039 84 VAL 9 N 0.0004 0.0100 0.0011 85 VAL 9 CA 0.0007 0.0089 0.0008 86 VAL 9 C 0.0013 0.0074 0.0002 87 VAL 9 O 0.0021 0.0075 -0.0006 88 VAL 9 CB 0.0015 0.0097 0.0001 89 VAL 9 CG1 0.0017 0.0085 -0.0002 90 VAL 9 CG2 0.0009 0.0111 0.0007 91 VAL 9 H 0.0011 0.0105 0.0005 92 ILE 10 N 0.0008 0.0059 0.0006 93 ILE 10 CA 0.0012 0.0044 0.0002 94 ILE 10 C 0.0016 0.0034 -0.0003 95 ILE 10 O 0.0010 0.0031 0.0003 96 ILE 10 CB 0.0002 0.0035 0.0011 97 ILE 10 CG1 -0.0002 0.0045 0.0015 98 ILE 10 CG2 0.0007 0.0018 0.0006 99 ILE 10 CD1 -0.0013 0.0038 0.0025 100 ILE 10 H 0.0000 0.0059 0.0013 101 VAL 11 N 0.0025 0.0025 -0.0016 102 VAL 11 CA 0.0030 0.0017 -0.0021 103 VAL 11 C 0.0030 0.0001 -0.0022 104 VAL 11 O 0.0036 -0.0003 -0.0028 105 VAL 11 CB 0.0040 0.0023 -0.0032 106 VAL 11 CG1 0.0044 0.0015 -0.0036 107 VAL 11 CG2 0.0040 0.0039 -0.0031 108 VAL 11 H 0.0029 0.0028 -0.0020 109 GLY 12 N 0.0023 -0.0008 -0.0015 110 GLY 12 CA 0.0022 -0.0023 -0.0014 111 GLY 12 C 0.0011 -0.0027 -0.0004 112 GLY 12 O 0.0009 -0.0021 -0.0001 113 GLY 12 H 0.0019 -0.0003 -0.0011 114 GLY 13 N 0.0009 -0.0034 0.0001 115 GLY 13 CA -0.0001 -0.0038 0.0012 116 GLY 13 C -0.0004 -0.0052 0.0011 117 GLY 13 O -0.0011 -0.0060 0.0018 118 GLY 13 H 0.0012 -0.0037 -0.0003 119 GLY 14 N 0.0002 -0.0056 0.0003 120 GLY 14 CA 0.0000 -0.0068 0.0002 121 GLY 14 C -0.0006 -0.0066 0.0010 122 GLY 14 O -0.0009 -0.0055 0.0016 123 GLY 14 H 0.0008 -0.0049 -0.0002 124 PRO 15 N -0.0008 -0.0077 0.0011 125 PRO 15 CA -0.0013 -0.0077 0.0018 126 PRO 15 C -0.0011 -0.0064 0.0016 127 PRO 15 O -0.0017 -0.0058 0.0024 128 PRO 15 CB -0.0012 -0.0092 0.0015 129 PRO 15 CG -0.0003 -0.0097 0.0004 130 PRO 15 CD -0.0003 -0.0091 0.0005 131 ALA 16 N -0.0002 -0.0060 0.0005 132 ALA 16 CA 0.0002 -0.0047 0.0001 133 ALA 16 C -0.0002 -0.0032 0.0007 134 ALA 16 O -0.0006 -0.0023 0.0012 135 ALA 16 CB 0.0012 -0.0046 -0.0012 136 ALA 16 H 0.0003 -0.0065 -0.0001 137 GLY 17 N -0.0001 -0.0030 0.0006 138 GLY 17 CA -0.0004 -0.0016 0.0011 139 GLY 17 C -0.0016 -0.0015 0.0024 140 GLY 17 O -0.0019 -0.0003 0.0029 141 GLY 17 H 0.0001 -0.0039 0.0002 142 CYS 18 N -0.0022 -0.0028 0.0030 143 CYS 18 CA -0.0033 -0.0028 0.0042 144 CYS 18 C -0.0036 -0.0024 0.0047 145 CYS 18 O -0.0043 -0.0015 0.0055 146 CYS 18 CB -0.0037 -0.0044 0.0046 147 CYS 18 SG -0.0035 -0.0046 0.0043 148 CYS 18 H -0.0019 -0.0037 0.0025 149 THR 19 N -0.0033 -0.0030 0.0042 150 THR 19 CA -0.0036 -0.0026 0.0045 151 THR 19 C -0.0033 -0.0009 0.0044 152 THR 19 O -0.0040 -0.0001 0.0051 153 THR 19 CB -0.0030 -0.0037 0.0039 154 THR 19 CG2 -0.0034 -0.0033 0.0043 155 THR 19 OG1 -0.0033 -0.0052 0.0041 156 THR 19 H -0.0028 -0.0038 0.0036 157 THR 19 HG1 -0.0029 -0.0056 0.0036 158 CYS 20 N -0.0024 -0.0002 0.0034 159 CYS 20 CA -0.0021 0.0014 0.0031 160 CYS 20 C -0.0029 0.0025 0.0041 161 CYS 20 O -0.0032 0.0036 0.0046 162 CYS 20 CB -0.0010 0.0017 0.0019 163 CYS 20 SG -0.0006 0.0037 0.0015 164 CYS 20 H -0.0019 -0.0009 0.0028 165 ALA 21 N -0.0032 0.0021 0.0044 166 ALA 21 CA -0.0040 0.0029 0.0053 167 ALA 21 C -0.0051 0.0029 0.0065 168 ALA 21 O -0.0055 0.0041 0.0071 169 ALA 21 CB -0.0041 0.0022 0.0054 170 ALA 21 H -0.0029 0.0011 0.0040 171 LEU 22 N -0.0055 0.0015 0.0069 172 LEU 22 CA -0.0064 0.0012 0.0080 173 LEU 22 C -0.0065 0.0024 0.0081 174 LEU 22 O -0.0072 0.0033 0.0090 175 LEU 22 CB -0.0065 -0.0005 0.0080 176 LEU 22 CG -0.0074 -0.0010 0.0090 177 LEU 22 CD1 -0.0085 -0.0006 0.0102 178 LEU 22 CD2 -0.0074 -0.0027 0.0089 179 LEU 22 H -0.0051 0.0005 0.0064 180 TYR 23 N -0.0058 0.0025 0.0073 181 TYR 23 CA -0.0058 0.0035 0.0073 182 TYR 23 C -0.0056 0.0053 0.0072 183 TYR 23 O -0.0061 0.0064 0.0078 184 TYR 23 CB -0.0049 0.0029 0.0063 185 TYR 23 CG -0.0053 0.0015 0.0066 186 TYR 23 CD1 -0.0056 0.0018 0.0070 187 TYR 23 CD2 -0.0054 -0.0001 0.0066 188 TYR 23 CE1 -0.0060 0.0005 0.0073 189 TYR 23 CE2 -0.0058 -0.0014 0.0069 190 TYR 23 CZ -0.0061 -0.0011 0.0073 191 TYR 23 OH -0.0065 -0.0024 0.0077 192 TYR 23 H -0.0052 0.0017 0.0065 193 TYR 23 HH -0.0068 -0.0032 0.0079 194 THR 24 N -0.0049 0.0058 0.0065 195 THR 24 CA -0.0048 0.0075 0.0065 196 THR 24 C -0.0058 0.0081 0.0076 197 THR 24 O -0.0061 0.0095 0.0081 198 THR 24 CB -0.0037 0.0078 0.0054 199 THR 24 CG2 -0.0027 0.0076 0.0042 200 THR 24 OG1 -0.0037 0.0067 0.0053 201 THR 24 H -0.0046 0.0049 0.0061 202 THR 24 HG1 -0.0036 0.0057 0.0050 203 ALA 25 N -0.0062 0.0072 0.0082 204 ALA 25 CA -0.0072 0.0076 0.0093 205 ALA 25 C -0.0082 0.0078 0.0104 206 ALA 25 O -0.0087 0.0090 0.0111 207 ALA 25 CB -0.0075 0.0064 0.0095 208 ALA 25 H -0.0059 0.0061 0.0077 209 ARG 26 N -0.0083 0.0066 0.0104 210 ARG 26 CA -0.0091 0.0067 0.0113 211 ARG 26 C -0.0088 0.0083 0.0111 212 ARG 26 O -0.0096 0.0089 0.0120 213 ARG 26 CB -0.0091 0.0052 0.0111 214 ARG 26 CG -0.0099 0.0051 0.0120 215 ARG 26 CD -0.0098 0.0035 0.0118 216 ARG 26 NE -0.0105 0.0035 0.0125 217 ARG 26 CZ -0.0116 0.0029 0.0136 218 ARG 26 NH1 -0.0122 0.0022 0.0142 219 ARG 26 NH2 -0.0120 0.0029 0.0141 220 ARG 26 H -0.0079 0.0056 0.0098 221 ARG 26 HE -0.0101 0.0038 0.0121 222 ARG 26 HH11 -0.0118 0.0021 0.0138 223 ARG 26 HH12 -0.0129 0.0017 0.0150 224 ARG 26 HH21 -0.0115 0.0033 0.0136 225 ARG 26 HH22 -0.0128 0.0023 0.0149 226 SER 27 N -0.0081 0.0090 0.0099 227 SER 27 CA -0.0077 0.0107 0.0096 228 SER 27 C -0.0079 0.0122 0.0099 229 SER 27 O -0.0074 0.0136 0.0094 230 SER 27 CB -0.0064 0.0106 0.0083 231 SER 27 OG -0.0063 0.0093 0.0081 232 SER 27 H -0.0075 0.0084 0.0093 233 SER 27 HG -0.0063 0.0083 0.0080 234 GLU 28 N -0.0086 0.0120 0.0106 235 GLU 28 CA -0.0089 0.0133 0.0109 236 GLU 28 C -0.0078 0.0141 0.0099 237 GLU 28 O -0.0078 0.0155 0.0100 238 GLU 28 CB -0.0097 0.0147 0.0118 239 GLU 28 CG -0.0108 0.0140 0.0129 240 GLU 28 CD -0.0116 0.0154 0.0138 241 GLU 28 OE1 -0.0128 0.0151 0.0149 242 GLU 28 OE2 -0.0111 0.0167 0.0133 243 GLU 28 H -0.0090 0.0108 0.0109 244 LEU 29 N -0.0069 0.0131 0.0085 245 LEU 29 CA -0.0060 0.0135 0.0076 246 LEU 29 C -0.0062 0.0128 0.0078 247 LEU 29 O -0.0065 0.0114 0.0080 248 LEU 29 CB -0.0048 0.0129 0.0066 249 LEU 29 CG -0.0046 0.0137 0.0063 250 LEU 29 CD1 -0.0035 0.0129 0.0053 251 LEU 29 CD2 -0.0042 0.0155 0.0061 252 LEU 29 H -0.0070 0.0121 0.0085 253 LYS 30 N -0.0059 0.0137 0.0076 254 LYS 30 CA -0.0060 0.0132 0.0076 255 LYS 30 C -0.0050 0.0121 0.0067 256 LYS 30 O -0.0040 0.0126 0.0058 257 LYS 30 CB -0.0060 0.0146 0.0077 258 LYS 30 CG -0.0063 0.0141 0.0080 259 LYS 30 CD -0.0061 0.0155 0.0078 260 LYS 30 CE -0.0063 0.0149 0.0080 261 LYS 30 NZ -0.0059 0.0161 0.0077 262 LYS 30 H -0.0056 0.0149 0.0074 263 LYS 30 HZ1 -0.0060 0.0158 0.0078 264 LYS 30 HZ2 -0.0062 0.0172 0.0081 265 LYS 30 HZ3 -0.0050 0.0163 0.0069 266 THR 31 N -0.0049 0.0105 0.0069 267 THR 31 CA -0.0041 0.0092 0.0059 268 THR 31 C -0.0041 0.0083 0.0058 269 THR 31 O -0.0050 0.0079 0.0067 270 THR 31 CB -0.0043 0.0080 0.0060 271 THR 31 CG2 -0.0034 0.0067 0.0050 272 THR 31 OG1 -0.0041 0.0088 0.0059 273 THR 31 H -0.0057 0.0101 0.0076 274 THR 31 HG1 -0.0042 0.0080 0.0059 275 VAL 32 N -0.0031 0.0080 0.0048 276 VAL 32 CA -0.0029 0.0069 0.0045 277 VAL 32 C -0.0021 0.0055 0.0036 278 VAL 32 O -0.0012 0.0058 0.0028 279 VAL 32 CB -0.0024 0.0078 0.0042 280 VAL 32 CG1 -0.0012 0.0087 0.0031 281 VAL 32 CG2 -0.0024 0.0067 0.0040 282 VAL 32 H -0.0023 0.0084 0.0041 283 ILE 33 N -0.0021 0.0038 0.0035 284 ILE 33 CA -0.0014 0.0025 0.0027 285 ILE 33 C -0.0009 0.0023 0.0023 286 ILE 33 O -0.0016 0.0021 0.0029 287 ILE 33 CB -0.0020 0.0010 0.0031 288 ILE 33 CG1 -0.0024 0.0012 0.0035 289 ILE 33 CG2 -0.0012 -0.0003 0.0023 290 ILE 33 CD1 -0.0031 -0.0002 0.0040 291 ILE 33 H -0.0029 0.0036 0.0041 292 LEU 34 N 0.0002 0.0024 0.0013 293 LEU 34 CA 0.0008 0.0020 0.0008 294 LEU 34 C 0.0012 0.0004 0.0003 295 LEU 34 O 0.0020 0.0001 -0.0004 296 LEU 34 CB 0.0018 0.0031 0.0000 297 LEU 34 CG 0.0015 0.0047 0.0004 298 LEU 34 CD1 0.0026 0.0057 -0.0004 299 LEU 34 CD2 0.0006 0.0050 0.0012 300 LEU 34 H 0.0007 0.0026 0.0009 301 ASP 35 N 0.0016 -0.0016 0.0002 302 ASP 35 CA 0.0015 -0.0025 -0.0003 303 ASP 35 C 0.0019 -0.0029 -0.0008 304 ASP 35 O 0.0017 -0.0027 -0.0006 305 ASP 35 CB 0.0007 -0.0031 0.0002 306 ASP 35 CG 0.0005 -0.0041 -0.0002 307 ASP 35 OD1 0.0011 -0.0043 -0.0008 308 ASP 35 OD2 -0.0001 -0.0046 0.0001 309 ASP 35 H 0.0013 -0.0014 0.0005 310 LYS 36 N 0.0023 -0.0033 -0.0015 311 LYS 36 CA 0.0027 -0.0036 -0.0021 312 LYS 36 C 0.0022 -0.0044 -0.0020 313 LYS 36 O 0.0022 -0.0045 -0.0021 314 LYS 36 CB 0.0034 -0.0038 -0.0029 315 LYS 36 CG 0.0032 -0.0046 -0.0031 316 LYS 36 CD 0.0039 -0.0049 -0.0039 317 LYS 36 CE 0.0037 -0.0058 -0.0042 318 LYS 36 NZ 0.0043 -0.0062 -0.0050 319 LYS 36 H 0.0024 -0.0034 -0.0017 320 LYS 36 HZ1 0.0041 -0.0069 -0.0052 321 LYS 36 HZ2 0.0048 -0.0059 -0.0053 322 LYS 36 HZ3 0.0044 -0.0062 -0.0051 323 ASN 37 N 0.0037 -0.0042 -0.0016 324 ASN 37 CA 0.0031 -0.0052 -0.0019 325 ASN 37 C 0.0019 -0.0060 -0.0011 326 ASN 37 O 0.0016 -0.0066 -0.0015 327 ASN 37 CB 0.0033 -0.0058 -0.0034 328 ASN 37 CG 0.0028 -0.0065 -0.0037 329 ASN 37 ND2 0.0034 -0.0065 -0.0047 330 ASN 37 OD1 0.0019 -0.0072 -0.0031 331 ASN 37 H 0.0035 -0.0043 -0.0013 332 ASN 37 HD21 0.0042 -0.0059 -0.0052 333 ASN 37 HD22 0.0032 -0.0068 -0.0047 334 PRO 38 N 0.0013 -0.0062 -0.0002 335 PRO 38 CA 0.0002 -0.0069 0.0006 336 PRO 38 C -0.0004 -0.0082 -0.0002 337 PRO 38 O -0.0013 -0.0089 0.0002 338 PRO 38 CB -0.0002 -0.0067 0.0017 339 PRO 38 CG 0.0005 -0.0063 0.0011 340 PRO 38 CD 0.0015 -0.0056 0.0003 341 ALA 39 N 0.0020 -0.0077 -0.0010 342 ALA 39 CA 0.0020 -0.0082 -0.0013 343 ALA 39 C 0.0021 -0.0083 -0.0019 344 ALA 39 O 0.0021 -0.0087 -0.0022 345 ALA 39 CB 0.0020 -0.0082 -0.0013 346 ALA 39 H 0.0021 -0.0073 -0.0011 347 ALA 40 N 0.0022 -0.0079 -0.0021 348 ALA 40 CA 0.0024 -0.0080 -0.0026 349 ALA 40 C 0.0023 -0.0083 -0.0025 350 ALA 40 O 0.0022 -0.0082 -0.0021 351 ALA 40 CB 0.0026 -0.0075 -0.0029 352 ALA 40 H 0.0023 -0.0076 -0.0018 353 GLY 41 N 0.0029 -0.0087 -0.0031 354 GLY 41 CA 0.0029 -0.0091 -0.0032 355 GLY 41 C 0.0025 -0.0107 -0.0029 356 GLY 41 O 0.0022 -0.0114 -0.0025 357 GLY 41 H 0.0032 -0.0091 -0.0038 358 ALA 42 N 0.0027 -0.0112 -0.0033 359 ALA 42 CA 0.0025 -0.0127 -0.0034 360 ALA 42 C 0.0017 -0.0134 -0.0021 361 ALA 42 O 0.0015 -0.0146 -0.0020 362 ALA 42 CB 0.0028 -0.0129 -0.0042 363 ALA 42 H 0.0030 -0.0105 -0.0037 364 LEU 43 N 0.0008 -0.0133 -0.0014 365 LEU 43 CA -0.0001 -0.0138 -0.0002 366 LEU 43 C -0.0005 -0.0139 0.0004 367 LEU 43 O -0.0009 -0.0150 0.0008 368 LEU 43 CB -0.0004 -0.0128 0.0006 369 LEU 43 CG -0.0013 -0.0133 0.0019 370 LEU 43 CD1 -0.0016 -0.0149 0.0019 371 LEU 43 CD2 -0.0017 -0.0123 0.0027 372 LEU 43 H 0.0011 -0.0123 -0.0016 373 ALA 44 N -0.0002 -0.0129 0.0002 374 ALA 44 CA -0.0005 -0.0129 0.0007 375 ALA 44 C -0.0004 -0.0143 0.0002 376 ALA 44 O -0.0009 -0.0149 0.0009 377 ALA 44 CB -0.0001 -0.0115 0.0005 378 ALA 44 H 0.0002 -0.0120 -0.0002 379 ILE 45 N 0.0005 -0.0137 -0.0005 380 ILE 45 CA 0.0006 -0.0150 -0.0012 381 ILE 45 C 0.0002 -0.0168 -0.0010 382 ILE 45 O 0.0002 -0.0181 -0.0016 383 ILE 45 CB 0.0014 -0.0148 -0.0030 384 ILE 45 CG1 0.0018 -0.0150 -0.0040 385 ILE 45 CG2 0.0018 -0.0130 -0.0032 386 ILE 45 CD1 0.0026 -0.0151 -0.0058 387 ILE 45 H 0.0009 -0.0131 -0.0012 388 THR 46 N -0.0002 -0.0170 -0.0003 389 THR 46 CA -0.0006 -0.0186 -0.0000 390 THR 46 C -0.0013 -0.0194 0.0013 391 THR 46 O -0.0018 -0.0189 0.0026 392 THR 46 CB -0.0007 -0.0185 0.0003 393 THR 46 CG2 -0.0011 -0.0201 0.0007 394 THR 46 OG1 0.0000 -0.0180 -0.0011 395 THR 46 H -0.0003 -0.0160 0.0003 396 THR 46 HG1 0.0003 -0.0169 -0.0013 397 HIS 47 N -0.0021 -0.0208 -0.0002 398 HIS 47 CA -0.0027 -0.0216 0.0011 399 HIS 47 C -0.0033 -0.0225 0.0024 400 HIS 47 O -0.0039 -0.0226 0.0039 401 HIS 47 CB -0.0026 -0.0230 0.0002 402 HIS 47 CG -0.0020 -0.0222 -0.0010 403 HIS 47 CD2 -0.0015 -0.0226 -0.0027 404 HIS 47 ND1 -0.0020 -0.0210 -0.0005 405 HIS 47 CE1 -0.0015 -0.0206 -0.0019 406 HIS 47 NE2 -0.0011 -0.0216 -0.0032 407 HIS 47 H -0.0017 -0.0210 -0.0014 408 HIS 47 HD1 -0.0024 -0.0204 0.0007 409 LYS 48 N -0.0033 -0.0232 0.0020 410 LYS 48 CA -0.0038 -0.0242 0.0031 411 LYS 48 C -0.0036 -0.0240 0.0027 412 LYS 48 O -0.0032 -0.0245 0.0013 413 LYS 48 CB -0.0041 -0.0261 0.0030 414 LYS 48 CG -0.0047 -0.0272 0.0043 415 LYS 48 CD -0.0049 -0.0291 0.0042 416 LYS 48 CE -0.0054 -0.0303 0.0052 417 LYS 48 NZ -0.0058 -0.0321 0.0054 418 LYS 48 H -0.0028 -0.0230 0.0008 419 LYS 48 HZ1 -0.0061 -0.0327 0.0060 420 LYS 48 HZ2 -0.0061 -0.0320 0.0062 421 LYS 48 HZ3 -0.0055 -0.0327 0.0043 422 ILE 49 N -0.0039 -0.0228 0.0037 423 ILE 49 CA -0.0038 -0.0224 0.0036 424 ILE 49 C -0.0047 -0.0232 0.0050 425 ILE 49 O -0.0055 -0.0231 0.0063 426 ILE 49 CB -0.0035 -0.0204 0.0035 427 ILE 49 CG1 -0.0032 -0.0200 0.0031 428 ILE 49 CG2 -0.0042 -0.0192 0.0049 429 ILE 49 CD1 -0.0026 -0.0181 0.0026 430 ILE 49 H -0.0045 -0.0225 0.0047 431 ALA 50 N -0.0047 -0.0240 0.0047 432 ALA 50 CA -0.0055 -0.0249 0.0059 433 ALA 50 C -0.0054 -0.0245 0.0058 434 ALA 50 O -0.0060 -0.0250 0.0068 435 ALA 50 CB -0.0056 -0.0269 0.0057 436 ALA 50 H -0.0040 -0.0241 0.0036 437 ASN 51 N -0.0043 -0.0233 0.0046 438 ASN 51 CA -0.0039 -0.0229 0.0042 439 ASN 51 C -0.0039 -0.0211 0.0043 440 ASN 51 O -0.0034 -0.0205 0.0036 441 ASN 51 CB -0.0030 -0.0237 0.0028 442 ASN 51 CG -0.0023 -0.0231 0.0018 443 ASN 51 ND2 -0.0015 -0.0225 0.0007 444 ASN 51 OD1 -0.0024 -0.0233 0.0019 445 ASN 51 H -0.0038 -0.0230 0.0040 446 ASN 51 HD21 -0.0011 -0.0220 0.0001 447 ASN 51 HD22 -0.0014 -0.0221 0.0006 448 TYR 52 N -0.0043 -0.0201 0.0050 449 TYR 52 CA -0.0044 -0.0185 0.0053 450 TYR 52 C -0.0052 -0.0184 0.0064 451 TYR 52 O -0.0059 -0.0189 0.0075 452 TYR 52 CB -0.0046 -0.0175 0.0057 453 TYR 52 CG -0.0046 -0.0157 0.0058 454 TYR 52 CD1 -0.0054 -0.0150 0.0070 455 TYR 52 CD2 -0.0037 -0.0148 0.0046 456 TYR 52 CE1 -0.0053 -0.0134 0.0071 457 TYR 52 CE2 -0.0037 -0.0132 0.0047 458 TYR 52 CZ -0.0045 -0.0124 0.0059 459 TYR 52 OH -0.0044 -0.0109 0.0060 460 TYR 52 H -0.0048 -0.0207 0.0056 461 TYR 52 HH -0.0051 -0.0106 0.0070 462 PRO 53 N -0.0049 -0.0180 0.0062 463 PRO 53 CA -0.0056 -0.0181 0.0072 464 PRO 53 C -0.0065 -0.0170 0.0087 465 PRO 53 O -0.0064 -0.0156 0.0086 466 PRO 53 CB -0.0051 -0.0173 0.0065 467 PRO 53 CG -0.0040 -0.0175 0.0049 468 PRO 53 CD -0.0040 -0.0173 0.0049 469 GLY 54 N -0.0074 -0.0178 0.0099 470 GLY 54 CA -0.0083 -0.0170 0.0113 471 GLY 54 C -0.0088 -0.0173 0.0120 472 GLY 54 O -0.0096 -0.0169 0.0132 473 GLY 54 H -0.0074 -0.0190 0.0098 474 VAL 55 N -0.0083 -0.0181 0.0110 475 VAL 55 CA -0.0086 -0.0184 0.0115 476 VAL 55 C -0.0088 -0.0205 0.0115 477 VAL 55 O -0.0081 -0.0212 0.0102 478 VAL 55 CB -0.0079 -0.0174 0.0106 479 VAL 55 CG1 -0.0083 -0.0178 0.0111 480 VAL 55 CG2 -0.0079 -0.0154 0.0108 481 VAL 55 H -0.0076 -0.0184 0.0099 482 PRO 56 N -0.0096 -0.0214 0.0127 483 PRO 56 CA -0.0098 -0.0234 0.0127 484 PRO 56 C -0.0098 -0.0241 0.0126 485 PRO 56 O -0.0100 -0.0233 0.0131 486 PRO 56 CB -0.0108 -0.0238 0.0143 487 PRO 56 CG -0.0113 -0.0222 0.0153 488 PRO 56 CD -0.0105 -0.0206 0.0143 489 GLY 57 N -0.0097 -0.0255 0.0121 490 GLY 57 CA -0.0096 -0.0265 0.0119 491 GLY 57 C -0.0087 -0.0260 0.0105 492 GLY 57 O -0.0079 -0.0253 0.0094 493 GLY 57 H -0.0095 -0.0261 0.0118 494 GLU 58 N -0.0087 -0.0263 0.0105 495 GLU 58 CA -0.0078 -0.0261 0.0092 496 GLU 58 C -0.0080 -0.0248 0.0096 497 GLU 58 O -0.0088 -0.0250 0.0108 498 GLU 58 CB -0.0076 -0.0279 0.0086 499 GLU 58 CG -0.0076 -0.0294 0.0083 500 GLU 58 CD -0.0073 -0.0311 0.0076 501 GLU 58 OE1 -0.0067 -0.0320 0.0066 502 GLU 58 OE2 -0.0075 -0.0315 0.0079 503 GLU 58 H -0.0093 -0.0268 0.0114 504 MET 59 N -0.0068 -0.0231 0.0083 505 MET 59 CA -0.0068 -0.0219 0.0085 506 MET 59 C -0.0059 -0.0215 0.0071 507 MET 59 O -0.0053 -0.0219 0.0060 508 MET 59 CB -0.0071 -0.0204 0.0093 509 MET 59 CG -0.0065 -0.0194 0.0085 510 MET 59 SD -0.0070 -0.0179 0.0096 511 MET 59 CE -0.0075 -0.0170 0.0106 512 MET 59 H -0.0063 -0.0230 0.0074 513 SER 60 N -0.0058 -0.0207 0.0071 514 SER 60 CA -0.0050 -0.0200 0.0058 515 SER 60 C -0.0046 -0.0185 0.0055 516 SER 60 O -0.0051 -0.0176 0.0064 517 SER 60 CB -0.0050 -0.0198 0.0059 518 SER 60 OG -0.0056 -0.0187 0.0071 519 SER 60 H -0.0063 -0.0203 0.0080 520 SER 60 HG -0.0053 -0.0178 0.0067 521 GLY 61 N -0.0036 -0.0179 0.0041 522 GLY 61 CA -0.0032 -0.0166 0.0037 523 GLY 61 C -0.0033 -0.0152 0.0041 524 GLY 61 O -0.0034 -0.0141 0.0043 525 GLY 61 H -0.0033 -0.0185 0.0036 526 ASP 62 N -0.0034 -0.0153 0.0042 527 ASP 62 CA -0.0036 -0.0141 0.0047 528 ASP 62 C -0.0045 -0.0137 0.0059 529 ASP 62 O -0.0046 -0.0124 0.0062 530 ASP 62 CB -0.0036 -0.0144 0.0045 531 ASP 62 CG -0.0042 -0.0157 0.0052 532 ASP 62 OD1 -0.0044 -0.0167 0.0054 533 ASP 62 OD2 -0.0044 -0.0158 0.0054 534 ASP 62 H -0.0034 -0.0162 0.0041 535 HIS 63 N -0.0053 -0.0150 0.0069 536 HIS 63 CA -0.0062 -0.0147 0.0082 537 HIS 63 C -0.0062 -0.0141 0.0082 538 HIS 63 O -0.0066 -0.0130 0.0089 539 HIS 63 CB -0.0068 -0.0161 0.0089 540 HIS 63 CG -0.0077 -0.0158 0.0102 541 HIS 63 CD2 -0.0083 -0.0166 0.0110 542 HIS 63 ND1 -0.0082 -0.0146 0.0109 543 HIS 63 CE1 -0.0090 -0.0147 0.0121 544 HIS 63 NE2 -0.0091 -0.0159 0.0121 545 HIS 63 H -0.0052 -0.0161 0.0067 546 HIS 63 HD1 -0.0079 -0.0138 0.0107 547 LEU 64 N -0.0057 -0.0146 0.0075 548 LEU 64 CA -0.0056 -0.0139 0.0074 549 LEU 64 C -0.0052 -0.0123 0.0070 550 LEU 64 O -0.0054 -0.0113 0.0075 551 LEU 64 CB -0.0050 -0.0148 0.0065 552 LEU 64 CG -0.0048 -0.0142 0.0063 553 LEU 64 CD1 -0.0056 -0.0140 0.0075 554 LEU 64 CD2 -0.0042 -0.0151 0.0054 555 LEU 64 H -0.0054 -0.0155 0.0069 556 LEU 65 N -0.0045 -0.0123 0.0057 557 LEU 65 CA -0.0040 -0.0107 0.0053 558 LEU 65 C -0.0048 -0.0097 0.0063 559 LEU 65 O -0.0048 -0.0083 0.0064 560 LEU 65 CB -0.0031 -0.0109 0.0042 561 LEU 65 CG -0.0025 -0.0093 0.0036 562 LEU 65 CD1 -0.0022 -0.0085 0.0032 563 LEU 65 CD2 -0.0016 -0.0097 0.0025 564 LEU 65 H -0.0043 -0.0132 0.0054 565 GLU 66 N -0.0054 -0.0104 0.0070 566 GLU 66 CA -0.0062 -0.0096 0.0080 567 GLU 66 C -0.0070 -0.0090 0.0090 568 GLU 66 O -0.0071 -0.0076 0.0093 569 GLU 66 CB -0.0068 -0.0107 0.0086 570 GLU 66 CG -0.0076 -0.0100 0.0097 571 GLU 66 CD -0.0081 -0.0111 0.0101 572 GLU 66 OE1 -0.0082 -0.0106 0.0103 573 GLU 66 OE2 -0.0083 -0.0125 0.0102 574 GLU 66 H -0.0054 -0.0115 0.0068 575 VAL 67 N -0.0074 -0.0101 0.0095 576 VAL 67 CA -0.0079 -0.0097 0.0102 577 VAL 67 C -0.0075 -0.0084 0.0097 578 VAL 67 O -0.0079 -0.0074 0.0103 579 VAL 67 CB -0.0081 -0.0111 0.0104 580 VAL 67 CG1 -0.0086 -0.0107 0.0110 581 VAL 67 CG2 -0.0087 -0.0122 0.0111 582 VAL 67 H -0.0072 -0.0112 0.0092 583 MET 68 N -0.0066 -0.0085 0.0085 584 MET 68 CA -0.0061 -0.0073 0.0080 585 MET 68 C -0.0061 -0.0058 0.0080 586 MET 68 O -0.0061 -0.0046 0.0081 587 MET 68 CB -0.0051 -0.0077 0.0067 588 MET 68 CG -0.0050 -0.0089 0.0065 589 MET 68 SD -0.0038 -0.0094 0.0050 590 MET 68 CE -0.0040 -0.0107 0.0052 591 MET 68 H -0.0062 -0.0094 0.0081 592 ARG 69 N -0.0057 -0.0058 0.0076 593 ARG 69 CA -0.0056 -0.0044 0.0076 594 ARG 69 C -0.0067 -0.0037 0.0089 595 ARG 69 O -0.0067 -0.0022 0.0091 596 ARG 69 CB -0.0052 -0.0050 0.0071 597 ARG 69 CG -0.0049 -0.0036 0.0069 598 ARG 69 CD -0.0048 -0.0043 0.0067 599 ARG 69 NE -0.0039 -0.0055 0.0056 600 ARG 69 CZ -0.0041 -0.0070 0.0056 601 ARG 69 NH1 -0.0050 -0.0077 0.0066 602 ARG 69 NH2 -0.0032 -0.0079 0.0046 603 ARG 69 H -0.0057 -0.0069 0.0075 604 ARG 69 HE -0.0031 -0.0050 0.0048 605 ARG 69 HH11 -0.0051 -0.0089 0.0066 606 ARG 69 HH12 -0.0057 -0.0071 0.0074 607 ARG 69 HH21 -0.0034 -0.0091 0.0046 608 ARG 69 HH22 -0.0025 -0.0075 0.0038 609 ASP 70 N -0.0076 -0.0047 0.0098 610 ASP 70 CA -0.0087 -0.0041 0.0111 611 ASP 70 C -0.0091 -0.0033 0.0116 612 ASP 70 O -0.0094 -0.0019 0.0122 613 ASP 70 CB -0.0094 -0.0056 0.0118 614 ASP 70 CG -0.0092 -0.0062 0.0115 615 ASP 70 OD1 -0.0085 -0.0054 0.0108 616 ASP 70 OD2 -0.0098 -0.0074 0.0120 617 ASP 70 H -0.0075 -0.0059 0.0096 618 GLN 71 N -0.0091 -0.0042 0.0113 619 GLN 71 CA -0.0093 -0.0034 0.0115 620 GLN 71 C -0.0088 -0.0018 0.0110 621 GLN 71 O -0.0093 -0.0007 0.0115 622 GLN 71 CB -0.0088 -0.0043 0.0109 623 GLN 71 CG -0.0093 -0.0057 0.0116 624 GLN 71 CD -0.0088 -0.0065 0.0109 625 GLN 71 NE2 -0.0092 -0.0070 0.0115 626 GLN 71 OE1 -0.0079 -0.0067 0.0099 627 GLN 71 H -0.0088 -0.0052 0.0110 628 GLN 71 HE21 -0.0088 -0.0074 0.0110 629 GLN 71 HE22 -0.0099 -0.0069 0.0124 630 ALA 72 N -0.0079 -0.0016 0.0099 631 ALA 72 CA -0.0075 -0.0001 0.0093 632 ALA 72 C -0.0080 0.0010 0.0100 633 ALA 72 O -0.0081 0.0023 0.0101 634 ALA 72 CB -0.0064 -0.0003 0.0080 635 ALA 72 H -0.0076 -0.0025 0.0094 636 VAL 73 N -0.0083 0.0004 0.0102 637 VAL 73 CA -0.0089 0.0013 0.0109 638 VAL 73 C -0.0100 0.0018 0.0121 639 VAL 73 O -0.0103 0.0031 0.0125 640 VAL 73 CB -0.0090 0.0003 0.0109 641 VAL 73 CG1 -0.0097 0.0011 0.0117 642 VAL 73 CG2 -0.0079 0.0002 0.0097 643 VAL 73 H -0.0082 -0.0007 0.0100 644 GLU 74 N -0.0106 0.0007 0.0127 645 GLU 74 CA -0.0116 0.0010 0.0138 646 GLU 74 C -0.0115 0.0024 0.0138 647 GLU 74 O -0.0122 0.0034 0.0146 648 GLU 74 CB -0.0121 -0.0004 0.0142 649 GLU 74 CG -0.0126 -0.0017 0.0146 650 GLU 74 CD -0.0130 -0.0032 0.0149 651 GLU 74 OE1 -0.0135 -0.0042 0.0154 652 GLU 74 OE2 -0.0128 -0.0033 0.0148 653 GLU 74 H -0.0103 -0.0004 0.0123 654 PHE 75 N -0.0109 0.0025 0.0130 655 PHE 75 CA -0.0106 0.0038 0.0128 656 PHE 75 C -0.0102 0.0052 0.0124 657 PHE 75 O -0.0100 0.0064 0.0123 658 PHE 75 CB -0.0099 0.0033 0.0120 659 PHE 75 CG -0.0105 0.0025 0.0125 660 PHE 75 CD1 -0.0109 0.0034 0.0130 661 PHE 75 CD2 -0.0107 0.0009 0.0126 662 PHE 75 CE1 -0.0114 0.0027 0.0136 663 PHE 75 CE2 -0.0112 0.0002 0.0131 664 PHE 75 CZ -0.0116 0.0011 0.0136 665 PHE 75 H -0.0104 0.0016 0.0124 666 GLY 76 N -0.0101 0.0052 0.0123 667 GLY 76 CA -0.0098 0.0066 0.0121 668 GLY 76 C -0.0087 0.0067 0.0109 669 GLY 76 O -0.0083 0.0078 0.0106 670 GLY 76 H -0.0103 0.0043 0.0125 671 THR 77 N -0.0082 0.0053 0.0101 672 THR 77 CA -0.0070 0.0052 0.0089 673 THR 77 C -0.0071 0.0051 0.0089 674 THR 77 O -0.0077 0.0042 0.0095 675 THR 77 CB -0.0065 0.0037 0.0081 676 THR 77 CG2 -0.0053 0.0036 0.0069 677 THR 77 OG1 -0.0063 0.0039 0.0080 678 THR 77 H -0.0086 0.0044 0.0104 679 THR 77 HG1 -0.0071 0.0035 0.0088 680 VAL 78 N -0.0063 0.0061 0.0082 681 VAL 78 CA -0.0061 0.0059 0.0080 682 VAL 78 C -0.0053 0.0045 0.0070 683 VAL 78 O -0.0043 0.0047 0.0060 684 VAL 78 CB -0.0056 0.0075 0.0077 685 VAL 78 CG1 -0.0054 0.0073 0.0075 686 VAL 78 CG2 -0.0064 0.0088 0.0087 687 VAL 78 H -0.0057 0.0069 0.0078 688 TYR 79 N -0.0050 0.0032 0.0065 689 TYR 79 CA -0.0042 0.0020 0.0057 690 TYR 79 C -0.0039 0.0023 0.0054 691 TYR 79 O -0.0046 0.0025 0.0061 692 TYR 79 CB -0.0048 0.0004 0.0061 693 TYR 79 CG -0.0039 -0.0010 0.0053 694 TYR 79 CD1 -0.0041 -0.0018 0.0054 695 TYR 79 CD2 -0.0031 -0.0014 0.0045 696 TYR 79 CE1 -0.0033 -0.0031 0.0047 697 TYR 79 CE2 -0.0023 -0.0027 0.0038 698 TYR 79 CZ -0.0025 -0.0035 0.0039 699 TYR 79 OH -0.0018 -0.0048 0.0032 700 TYR 79 H -0.0059 0.0030 0.0072 701 TYR 79 HH -0.0012 -0.0050 0.0026 702 ARG 80 N -0.0027 0.0022 0.0043 703 ARG 80 CA -0.0023 0.0024 0.0039 704 ARG 80 C -0.0014 0.0011 0.0031 705 ARG 80 O -0.0005 0.0010 0.0023 706 ARG 80 CB -0.0017 0.0040 0.0035 707 ARG 80 CG -0.0025 0.0054 0.0043 708 ARG 80 CD -0.0034 0.0052 0.0050 709 ARG 80 NE -0.0042 0.0065 0.0058 710 ARG 80 CZ -0.0053 0.0064 0.0068 711 ARG 80 NH1 -0.0058 0.0052 0.0072 712 ARG 80 NH2 -0.0060 0.0076 0.0075 713 ARG 80 H -0.0022 0.0021 0.0038 714 ARG 80 HE -0.0039 0.0075 0.0056 715 ARG 80 HH11 -0.0053 0.0042 0.0067 716 ARG 80 HH12 -0.0066 0.0051 0.0080 717 ARG 80 HH21 -0.0068 0.0076 0.0083 718 ARG 80 HH22 -0.0057 0.0086 0.0072 719 ARG 81 N 0.0017 -0.0014 0.0008 720 ARG 81 CA 0.0020 -0.0018 -0.0000 721 ARG 81 C 0.0027 -0.0012 -0.0005 722 ARG 81 O 0.0029 -0.0008 -0.0004 723 ARG 81 CB 0.0018 -0.0023 -0.0001 724 ARG 81 CG 0.0020 -0.0029 -0.0009 725 ARG 81 CD 0.0016 -0.0035 -0.0010 726 ARG 81 NE 0.0019 -0.0039 -0.0018 727 ARG 81 CZ 0.0017 -0.0045 -0.0022 728 ARG 81 NH1 0.0012 -0.0049 -0.0018 729 ARG 81 NH2 0.0020 -0.0047 -0.0029 730 ARG 81 H 0.0016 -0.0012 0.0011 731 ARG 81 HE 0.0022 -0.0037 -0.0022 732 ARG 81 HH11 0.0010 -0.0047 -0.0012 733 ARG 81 HH12 0.0011 -0.0054 -0.0021 734 ARG 81 HH21 0.0024 -0.0045 -0.0032 735 ARG 81 HH22 0.0019 -0.0053 -0.0031 736 ALA 82 N 0.0030 -0.0012 -0.0009 737 ALA 82 CA 0.0036 -0.0007 -0.0013 738 ALA 82 C 0.0038 -0.0010 -0.0020 739 ALA 82 O 0.0036 -0.0012 -0.0019 740 ALA 82 CB 0.0037 0.0001 -0.0008 741 ALA 82 H 0.0027 -0.0016 -0.0009 742 GLN 83 N 0.0018 -0.0021 -0.0022 743 GLN 83 CA 0.0031 -0.0023 -0.0030 744 GLN 83 C 0.0038 -0.0008 -0.0034 745 GLN 83 O 0.0041 -0.0000 -0.0035 746 GLN 83 CB 0.0038 -0.0034 -0.0035 747 GLN 83 CG 0.0052 -0.0037 -0.0044 748 GLN 83 CD 0.0054 -0.0045 -0.0045 749 GLN 83 NE2 0.0064 -0.0040 -0.0051 750 GLN 83 OE1 0.0046 -0.0054 -0.0041 751 GLN 83 H 0.0016 -0.0021 -0.0021 752 GLN 83 HE21 0.0070 -0.0032 -0.0054 753 GLN 83 HE22 0.0065 -0.0046 -0.0052 754 VAL 84 N 0.0042 -0.0003 -0.0036 755 VAL 84 CA 0.0051 0.0011 -0.0041 756 VAL 84 C 0.0065 0.0006 -0.0049 757 VAL 84 O 0.0070 -0.0005 -0.0053 758 VAL 84 CB 0.0050 0.0017 -0.0040 759 VAL 84 CG1 0.0059 0.0031 -0.0045 760 VAL 84 CG2 0.0036 0.0023 -0.0031 761 VAL 84 H 0.0040 -0.0009 -0.0035 762 TYR 85 N 0.0074 0.0018 -0.0060 763 TYR 85 CA 0.0090 0.0015 -0.0070 764 TYR 85 C 0.0101 0.0030 -0.0075 765 TYR 85 O 0.0115 0.0028 -0.0083 766 TYR 85 CB 0.0092 0.0010 -0.0072 767 TYR 85 CG 0.0088 0.0025 -0.0068 768 TYR 85 CD1 0.0075 0.0023 -0.0060 769 TYR 85 CD2 0.0099 0.0040 -0.0072 770 TYR 85 CE1 0.0071 0.0037 -0.0056 771 TYR 85 CE2 0.0095 0.0054 -0.0068 772 TYR 85 CZ 0.0081 0.0052 -0.0060 773 TYR 85 OH 0.0078 0.0065 -0.0056 774 TYR 85 H 0.0069 0.0028 -0.0055 775 TYR 85 HH 0.0068 0.0063 -0.0050 776 GLY 86 N 0.0096 0.0046 -0.0069 777 GLY 86 CA 0.0106 0.0061 -0.0073 778 GLY 86 C 0.0097 0.0075 -0.0066 779 GLY 86 O 0.0083 0.0076 -0.0057 780 GLY 86 H 0.0084 0.0047 -0.0062 781 LEU 87 N 0.0099 0.0084 -0.0079 782 LEU 87 CA 0.0095 0.0097 -0.0073 783 LEU 87 C 0.0103 0.0114 -0.0080 784 LEU 87 O 0.0115 0.0114 -0.0090 785 LEU 87 CB 0.0095 0.0090 -0.0074 786 LEU 87 CG 0.0088 0.0072 -0.0069 787 LEU 87 CD1 0.0090 0.0066 -0.0072 788 LEU 87 CD2 0.0073 0.0073 -0.0056 789 LEU 87 H 0.0109 0.0082 -0.0087 790 ASP 88 N 0.0097 0.0129 -0.0073 791 ASP 88 CA 0.0105 0.0145 -0.0078 792 ASP 88 C 0.0100 0.0151 -0.0073 793 ASP 88 O 0.0088 0.0156 -0.0063 794 ASP 88 CB 0.0103 0.0159 -0.0076 795 ASP 88 CG 0.0108 0.0178 -0.0078 796 ASP 88 OD1 0.0115 0.0180 -0.0085 797 ASP 88 OD2 0.0104 0.0189 -0.0074 798 ASP 88 H 0.0088 0.0128 -0.0065 799 LEU 89 N 0.0106 0.0149 -0.0085 800 LEU 89 CA 0.0103 0.0152 -0.0082 801 LEU 89 C 0.0109 0.0170 -0.0085 802 LEU 89 O 0.0107 0.0174 -0.0083 803 LEU 89 CB 0.0107 0.0137 -0.0087 804 LEU 89 CG 0.0102 0.0118 -0.0085 805 LEU 89 CD1 0.0105 0.0105 -0.0089 806 LEU 89 CD2 0.0087 0.0117 -0.0071 807 LEU 89 H 0.0115 0.0144 -0.0094 808 SER 90 N 0.0115 0.0180 -0.0090 809 SER 90 CA 0.0123 0.0197 -0.0095 810 SER 90 C 0.0115 0.0211 -0.0085 811 SER 90 O 0.0119 0.0222 -0.0088 812 SER 90 CB 0.0132 0.0203 -0.0102 813 SER 90 OG 0.0125 0.0208 -0.0095 814 SER 90 H 0.0116 0.0177 -0.0090 815 SER 90 HG 0.0122 0.0197 -0.0093 816 GLU 91 N 0.0105 0.0211 -0.0077 817 GLU 91 CA 0.0096 0.0224 -0.0069 818 GLU 91 C 0.0087 0.0218 -0.0060 819 GLU 91 O 0.0085 0.0202 -0.0059 820 GLU 91 CB 0.0089 0.0230 -0.0062 821 GLU 91 CG 0.0098 0.0241 -0.0070 822 GLU 91 CD 0.0103 0.0257 -0.0074 823 GLU 91 OE1 0.0113 0.0263 -0.0083 824 GLU 91 OE2 0.0097 0.0264 -0.0068 825 GLU 91 H 0.0102 0.0203 -0.0075 826 PRO 92 N 0.0080 0.0229 -0.0054 827 PRO 92 CA 0.0070 0.0223 -0.0045 828 PRO 92 C 0.0059 0.0213 -0.0035 829 PRO 92 O 0.0055 0.0200 -0.0032 830 PRO 92 CB 0.0065 0.0240 -0.0039 831 PRO 92 CG 0.0076 0.0253 -0.0049 832 PRO 92 CD 0.0082 0.0247 -0.0055 833 VAL 93 N 0.0056 0.0216 -0.0033 834 VAL 93 CA 0.0048 0.0206 -0.0026 835 VAL 93 C 0.0055 0.0193 -0.0034 836 VAL 93 O 0.0063 0.0198 -0.0041 837 VAL 93 CB 0.0040 0.0217 -0.0018 838 VAL 93 CG1 0.0032 0.0206 -0.0011 839 VAL 93 CG2 0.0032 0.0228 -0.0010 840 VAL 93 H 0.0061 0.0225 -0.0037 841 LYS 94 N 0.0053 0.0177 -0.0033 842 LYS 94 CA 0.0060 0.0164 -0.0041 843 LYS 94 C 0.0055 0.0160 -0.0036 844 LYS 94 O 0.0044 0.0161 -0.0026 845 LYS 94 CB 0.0059 0.0148 -0.0041 846 LYS 94 CG 0.0061 0.0151 -0.0043 847 LYS 94 CD 0.0074 0.0161 -0.0053 848 LYS 94 CE 0.0074 0.0167 -0.0054 849 LYS 94 NZ 0.0086 0.0177 -0.0063 850 LYS 94 H 0.0046 0.0174 -0.0027 851 LYS 94 HZ1 0.0087 0.0180 -0.0064 852 LYS 94 HZ2 0.0086 0.0188 -0.0062 853 LYS 94 HZ3 0.0093 0.0171 -0.0071 854 LYS 95 N 0.0063 0.0155 -0.0042 855 LYS 95 CA 0.0059 0.0148 -0.0039 856 LYS 95 C 0.0062 0.0129 -0.0043 857 LYS 95 O 0.0073 0.0123 -0.0052 858 LYS 95 CB 0.0065 0.0158 -0.0044 859 LYS 95 CG 0.0063 0.0178 -0.0041 860 LYS 95 CD 0.0072 0.0186 -0.0048 861 LYS 95 CE 0.0073 0.0206 -0.0048 862 LYS 95 NZ 0.0087 0.0212 -0.0059 863 LYS 95 H 0.0073 0.0155 -0.0050 864 LYS 95 HZ1 0.0088 0.0225 -0.0060 865 LYS 95 HZ2 0.0089 0.0210 -0.0061 866 LYS 95 HZ3 0.0093 0.0206 -0.0065 867 VAL 96 N 0.0052 0.0118 -0.0035 868 VAL 96 CA 0.0053 0.0100 -0.0036 869 VAL 96 C 0.0051 0.0096 -0.0035 870 VAL 96 O 0.0041 0.0102 -0.0026 871 VAL 96 CB 0.0042 0.0090 -0.0028 872 VAL 96 CG1 0.0044 0.0070 -0.0030 873 VAL 96 CG2 0.0044 0.0094 -0.0029 874 VAL 96 H 0.0044 0.0124 -0.0027 875 TYR 97 N 0.0062 0.0086 -0.0045 876 TYR 97 CA 0.0061 0.0081 -0.0044 877 TYR 97 C 0.0057 0.0061 -0.0041 878 TYR 97 O 0.0064 0.0049 -0.0045 879 TYR 97 CB 0.0077 0.0085 -0.0054 880 TYR 97 CG 0.0082 0.0104 -0.0058 881 TYR 97 CD1 0.0078 0.0116 -0.0055 882 TYR 97 CD2 0.0091 0.0109 -0.0064 883 TYR 97 CE1 0.0083 0.0134 -0.0059 884 TYR 97 CE2 0.0096 0.0127 -0.0068 885 TYR 97 CZ 0.0092 0.0139 -0.0065 886 TYR 97 OH 0.0097 0.0156 -0.0068 887 TYR 97 H 0.0071 0.0082 -0.0051 888 TYR 97 HH 0.0103 0.0158 -0.0073 889 THR 98 N 0.0045 0.0058 -0.0033 890 THR 98 CA 0.0039 0.0041 -0.0029 891 THR 98 C 0.0036 0.0040 -0.0027 892 THR 98 O 0.0036 0.0055 -0.0027 893 THR 98 CB 0.0024 0.0036 -0.0020 894 THR 98 CG2 0.0024 0.0042 -0.0019 895 THR 98 OG1 0.0011 0.0042 -0.0011 896 THR 98 H 0.0039 0.0069 -0.0029 897 THR 98 HG1 0.0006 0.0032 -0.0007 898 PRO 99 N 0.0030 0.0010 -0.0030 899 PRO 99 CA 0.0027 0.0010 -0.0028 900 PRO 99 C 0.0013 0.0021 -0.0017 901 PRO 99 O 0.0013 0.0029 -0.0016 902 PRO 99 CB 0.0025 -0.0010 -0.0028 903 PRO 99 CG 0.0035 -0.0020 -0.0036 904 PRO 99 CD 0.0032 -0.0009 -0.0033 905 GLU 100 N 0.0002 0.0021 -0.0009 906 GLU 100 CA -0.0012 0.0029 0.0002 907 GLU 100 C -0.0011 0.0050 0.0003 908 GLU 100 O -0.0020 0.0060 0.0010 909 GLU 100 CB -0.0024 0.0021 0.0010 910 GLU 100 CG -0.0027 -0.0000 0.0011 911 GLU 100 CD -0.0014 -0.0012 0.0001 912 GLU 100 OE1 -0.0013 -0.0027 -0.0001 913 GLU 100 OE2 -0.0006 -0.0005 -0.0005 914 GLU 100 H 0.0003 0.0013 -0.0010 915 GLY 101 N 0.0007 0.0074 -0.0000 916 GLY 101 CA 0.0008 0.0094 0.0000 917 GLY 101 C 0.0019 0.0099 -0.0008 918 GLY 101 O 0.0027 0.0087 -0.0014 919 GLY 101 H 0.0014 0.0065 -0.0006 920 ILE 102 N 0.0019 0.0117 -0.0007 921 ILE 102 CA 0.0026 0.0124 -0.0012 922 ILE 102 C 0.0014 0.0127 -0.0003 923 ILE 102 O 0.0004 0.0138 0.0005 924 ILE 102 CB 0.0035 0.0142 -0.0018 925 ILE 102 CG1 0.0046 0.0139 -0.0027 926 ILE 102 CG2 0.0043 0.0149 -0.0024 927 ILE 102 CD1 0.0055 0.0157 -0.0033 928 ILE 102 H 0.0012 0.0125 -0.0001 929 PHE 103 N 0.0020 0.0118 -0.0007 930 PHE 103 CA 0.0011 0.0121 0.0000 931 PHE 103 C 0.0019 0.0133 -0.0005 932 PHE 103 O 0.0030 0.0131 -0.0014 933 PHE 103 CB 0.0007 0.0104 0.0002 934 PHE 103 CG -0.0002 0.0093 0.0008 935 PHE 103 CD1 -0.0016 0.0092 0.0019 936 PHE 103 CD2 0.0004 0.0084 0.0004 937 PHE 103 CE1 -0.0024 0.0082 0.0025 938 PHE 103 CE2 -0.0005 0.0074 0.0009 939 PHE 103 CZ -0.0019 0.0073 0.0020 940 PHE 103 H 0.0028 0.0111 -0.0013 941 THR 104 N 0.0012 0.0146 0.0002 942 THR 104 CA 0.0017 0.0158 -0.0002 943 THR 104 C 0.0010 0.0156 0.0004 944 THR 104 O -0.0002 0.0153 0.0013 945 THR 104 CB 0.0018 0.0177 -0.0001 946 THR 104 CG2 0.0023 0.0179 -0.0005 947 THR 104 OG1 0.0006 0.0184 0.0009 948 THR 104 H 0.0002 0.0147 0.0009 949 THR 104 HG1 0.0002 0.0188 0.0012 950 GLY 105 N 0.0021 0.0159 -0.0003 951 GLY 105 CA 0.0016 0.0155 0.0001 952 GLY 105 C 0.0021 0.0166 -0.0003 953 GLY 105 O 0.0032 0.0169 -0.0013 954 GLY 105 H 0.0029 0.0162 -0.0011 955 ARG 106 N 0.0014 0.0171 0.0004 956 ARG 106 CA 0.0019 0.0179 0.0001 957 ARG 106 C 0.0024 0.0166 -0.0005 958 ARG 106 O 0.0031 0.0170 -0.0012 959 ARG 106 CB 0.0009 0.0187 0.0011 960 ARG 106 CG 0.0004 0.0201 0.0017 961 ARG 106 CD -0.0004 0.0211 0.0026 962 ARG 106 NE -0.0015 0.0202 0.0036 963 ARG 106 CZ -0.0021 0.0204 0.0042 964 ARG 106 NH1 -0.0017 0.0213 0.0039 965 ARG 106 NH2 -0.0031 0.0197 0.0051 966 ARG 106 H 0.0006 0.0168 0.0012 967 ARG 106 HE -0.0019 0.0196 0.0040 968 ARG 106 HH11 -0.0009 0.0219 0.0032 969 ARG 106 HH12 -0.0022 0.0213 0.0044 970 ARG 106 HH21 -0.0034 0.0191 0.0054 971 ARG 106 HH22 -0.0036 0.0197 0.0056 972 ALA 107 N 0.0019 0.0149 -0.0002 973 ALA 107 CA 0.0024 0.0135 -0.0008 974 ALA 107 C 0.0026 0.0122 -0.0011 975 ALA 107 O 0.0019 0.0119 -0.0004 976 ALA 107 CB 0.0016 0.0129 -0.0001 977 ALA 107 H 0.0012 0.0147 0.0004 978 LEU 108 N 0.0036 0.0113 -0.0021 979 LEU 108 CA 0.0038 0.0099 -0.0025 980 LEU 108 C 0.0039 0.0085 -0.0027 981 LEU 108 O 0.0045 0.0086 -0.0032 982 LEU 108 CB 0.0049 0.0104 -0.0035 983 LEU 108 CG 0.0054 0.0090 -0.0040 984 LEU 108 CD1 0.0045 0.0084 -0.0032 985 LEU 108 CD2 0.0065 0.0095 -0.0051 986 LEU 108 H 0.0041 0.0117 -0.0026 987 VAL 109 N 0.0033 0.0067 -0.0024 988 VAL 109 CA 0.0033 0.0052 -0.0026 989 VAL 109 C 0.0038 0.0041 -0.0032 990 VAL 109 O 0.0034 0.0038 -0.0028 991 VAL 109 CB 0.0022 0.0046 -0.0015 992 VAL 109 CG1 0.0023 0.0031 -0.0017 993 VAL 109 CG2 0.0017 0.0058 -0.0008 994 VAL 109 H 0.0028 0.0068 -0.0019 995 LEU 110 N 0.0046 0.0034 -0.0042 996 LEU 110 CA 0.0051 0.0022 -0.0049 997 LEU 110 C 0.0046 0.0006 -0.0046 998 LEU 110 O 0.0048 0.0002 -0.0048 999 LEU 110 CB 0.0063 0.0025 -0.0062 1000 LEU 110 CG 0.0068 0.0041 -0.0065 1001 LEU 110 CD1 0.0080 0.0042 -0.0078 1002 LEU 110 CD2 0.0067 0.0047 -0.0064 1003 LEU 110 H 0.0049 0.0037 -0.0045 1004 ALA 111 N 0.0038 -0.0008 -0.0039 1005 ALA 111 CA 0.0033 -0.0021 -0.0035 1006 ALA 111 C 0.0034 -0.0032 -0.0038 1007 ALA 111 O 0.0028 -0.0041 -0.0032 1008 ALA 111 CB 0.0023 -0.0018 -0.0024 1009 ALA 111 H 0.0037 -0.0004 -0.0038 1010 THR 112 N 0.0042 -0.0031 -0.0046 1011 THR 112 CA 0.0044 -0.0040 -0.0049 1012 THR 112 C 0.0046 -0.0054 -0.0053 1013 THR 112 O 0.0048 -0.0062 -0.0055 1014 THR 112 CB 0.0052 -0.0033 -0.0057 1015 THR 112 CG2 0.0049 -0.0021 -0.0052 1016 THR 112 OG1 0.0059 -0.0028 -0.0064 1017 THR 112 H 0.0047 -0.0024 -0.0050 1018 THR 112 HG1 0.0065 -0.0028 -0.0070 1019 GLY 113 N 0.0048 -0.0057 -0.0057 1020 GLY 113 CA 0.0051 -0.0069 -0.0059 1021 GLY 113 C 0.0056 -0.0072 -0.0069 1022 GLY 113 O 0.0058 -0.0065 -0.0076 1023 GLY 113 H 0.0047 -0.0053 -0.0057 1024 ALA 114 N 0.0058 -0.0082 -0.0069 1025 ALA 114 CA 0.0063 -0.0086 -0.0078 1026 ALA 114 C 0.0063 -0.0093 -0.0077 1027 ALA 114 O 0.0067 -0.0101 -0.0081 1028 ALA 114 CB 0.0067 -0.0092 -0.0084 1029 ALA 114 H 0.0056 -0.0087 -0.0064 1030 MET 115 N 0.0052 -0.0084 -0.0071 1031 MET 115 CA 0.0052 -0.0087 -0.0068 1032 MET 115 C 0.0050 -0.0083 -0.0070 1033 MET 115 O 0.0050 -0.0084 -0.0067 1034 MET 115 CB 0.0049 -0.0087 -0.0060 1035 MET 115 CG 0.0050 -0.0092 -0.0058 1036 MET 115 SD 0.0055 -0.0099 -0.0058 1037 MET 115 CE 0.0054 -0.0101 -0.0052 1038 MET 115 H 0.0049 -0.0081 -0.0070 1039 GLY 116 N 0.0050 -0.0079 -0.0075 1040 GLY 116 CA 0.0049 -0.0076 -0.0079 1041 GLY 116 C 0.0053 -0.0079 -0.0082 1042 GLY 116 O 0.0057 -0.0084 -0.0083 1043 GLY 116 H 0.0051 -0.0079 -0.0078 1044 ARG 117 N 0.0025 -0.0074 -0.0048 1045 ARG 117 CA 0.0014 -0.0062 -0.0023 1046 ARG 117 C -0.0014 -0.0080 -0.0015 1047 ARG 117 O -0.0029 -0.0099 -0.0024 1048 ARG 117 CB 0.0017 -0.0042 -0.0001 1049 ARG 117 CG 0.0005 -0.0050 0.0001 1050 ARG 117 CD 0.0008 -0.0029 0.0024 1051 ARG 117 NE -0.0010 -0.0021 0.0051 1052 ARG 117 CZ -0.0035 -0.0032 0.0063 1053 ARG 117 NH1 -0.0044 -0.0048 0.0053 1054 ARG 117 NH2 -0.0051 -0.0026 0.0086 1055 ARG 117 H 0.0013 -0.0089 -0.0053 1056 ARG 117 HE -0.0003 -0.0009 0.0059 1057 ARG 117 HH11 -0.0034 -0.0055 0.0034 1058 ARG 117 HH12 -0.0064 -0.0059 0.0060 1059 ARG 117 HH21 -0.0069 -0.0035 0.0094 1060 ARG 117 HH22 -0.0045 -0.0014 0.0094 1061 ILE 118 N -0.0023 -0.0073 0.0001 1062 ILE 118 CA -0.0051 -0.0086 0.0015 1063 ILE 118 C -0.0063 -0.0076 0.0039 1064 ILE 118 O -0.0051 -0.0054 0.0053 1065 ILE 118 CB -0.0054 -0.0082 0.0022 1066 ILE 118 CG1 -0.0042 -0.0093 -0.0004 1067 ILE 118 CG2 -0.0084 -0.0094 0.0038 1068 ILE 118 CD1 -0.0039 -0.0086 0.0002 1069 ILE 118 H -0.0010 -0.0057 0.0008 1070 ALA 119 N -0.0094 -0.0100 0.0088 1071 ALA 119 CA -0.0106 -0.0088 0.0103 1072 ALA 119 C -0.0121 -0.0065 0.0123 1073 ALA 119 O -0.0138 -0.0072 0.0133 1074 ALA 119 CB -0.0124 -0.0114 0.0106 1075 ALA 119 H -0.0099 -0.0123 0.0083 1076 SER 120 N -0.0113 -0.0037 0.0128 1077 SER 120 CA -0.0120 -0.0011 0.0144 1078 SER 120 C -0.0130 0.0008 0.0159 1079 SER 120 O -0.0140 0.0028 0.0175 1080 SER 120 CB -0.0099 0.0008 0.0135 1081 SER 120 OG -0.0078 0.0023 0.0125 1082 SER 120 H -0.0100 -0.0034 0.0119 1083 SER 120 HG -0.0084 0.0040 0.0136 1084 ILE 121 N -0.0140 0.0002 0.0155 1085 ILE 121 CA -0.0145 0.0013 0.0161 1086 ILE 121 C -0.0163 -0.0003 0.0177 1087 ILE 121 O -0.0163 -0.0027 0.0175 1088 ILE 121 CB -0.0128 0.0013 0.0144 1089 ILE 121 CG1 -0.0110 0.0029 0.0128 1090 ILE 121 CG2 -0.0133 0.0024 0.0151 1091 ILE 121 CD1 -0.0092 0.0026 0.0111 1092 ILE 121 H -0.0131 -0.0013 0.0145 1093 PRO 122 N -0.0178 0.0010 0.0194 1094 PRO 122 CA -0.0196 -0.0004 0.0209 1095 PRO 122 C -0.0191 -0.0022 0.0202 1096 PRO 122 O -0.0180 -0.0013 0.0193 1097 PRO 122 CB -0.0208 0.0018 0.0223 1098 PRO 122 CG -0.0203 0.0041 0.0220 1099 PRO 122 CD -0.0181 0.0038 0.0199 1100 GLY 123 N -0.0190 -0.0047 0.0206 1101 GLY 123 CA -0.0184 -0.0070 0.0199 1102 GLY 123 C -0.0166 -0.0086 0.0179 1103 GLY 123 O -0.0164 -0.0110 0.0175 1104 GLY 123 H -0.0199 -0.0052 0.0216 1105 GLU 124 N -0.0155 -0.0074 0.0167 1106 GLU 124 CA -0.0136 -0.0087 0.0147 1107 GLU 124 C -0.0139 -0.0116 0.0149 1108 GLU 124 O -0.0131 -0.0137 0.0138 1109 GLU 124 CB -0.0126 -0.0066 0.0136 1110 GLU 124 CG -0.0106 -0.0074 0.0114 1111 GLU 124 CD -0.0098 -0.0054 0.0106 1112 GLU 124 OE1 -0.0083 -0.0062 0.0090 1113 GLU 124 OE2 -0.0105 -0.0032 0.0115 1114 GLU 124 H -0.0157 -0.0054 0.0171 1115 ALA 125 N -0.0149 -0.0115 0.0166 1116 ALA 125 CA -0.0153 -0.0140 0.0171 1117 ALA 125 C -0.0163 -0.0160 0.0181 1118 ALA 125 O -0.0161 -0.0185 0.0179 1119 ALA 125 CB -0.0165 -0.0134 0.0184 1120 ALA 125 H -0.0156 -0.0097 0.0173 1121 GLU 126 N -0.0174 -0.0150 0.0193 1122 GLU 126 CA -0.0184 -0.0166 0.0205 1123 GLU 126 C -0.0172 -0.0182 0.0192 1124 GLU 126 O -0.0175 -0.0205 0.0196 1125 GLU 126 CB -0.0198 -0.0147 0.0220 1126 GLU 126 CG -0.0211 -0.0162 0.0234 1127 GLU 126 CD -0.0224 -0.0142 0.0249 1128 GLU 126 OE1 -0.0233 -0.0152 0.0260 1129 GLU 126 OE2 -0.0224 -0.0118 0.0249 1130 GLU 126 H -0.0174 -0.0129 0.0193 1131 TYR 127 N -0.0152 -0.0159 0.0184 1132 TYR 127 CA -0.0139 -0.0171 0.0170 1133 TYR 127 C -0.0121 -0.0181 0.0150 1134 TYR 127 O -0.0109 -0.0188 0.0136 1135 TYR 127 CB -0.0137 -0.0150 0.0167 1136 TYR 127 CG -0.0154 -0.0143 0.0186 1137 TYR 127 CD1 -0.0162 -0.0163 0.0195 1138 TYR 127 CD2 -0.0163 -0.0118 0.0195 1139 TYR 127 CE1 -0.0178 -0.0157 0.0213 1140 TYR 127 CE2 -0.0179 -0.0112 0.0213 1141 TYR 127 CZ -0.0187 -0.0132 0.0223 1142 TYR 127 OH -0.0204 -0.0128 0.0241 1143 TYR 127 H -0.0151 -0.0140 0.0182 1144 TYR 127 HH -0.0211 -0.0117 0.0249 1145 LEU 128 N -0.0120 -0.0183 0.0148 1146 LEU 128 CA -0.0104 -0.0195 0.0131 1147 LEU 128 C -0.0101 -0.0225 0.0128 1148 LEU 128 O -0.0114 -0.0241 0.0143 1149 LEU 128 CB -0.0106 -0.0193 0.0133 1150 LEU 128 CG -0.0088 -0.0202 0.0114 1151 LEU 128 CD1 -0.0072 -0.0184 0.0095 1152 LEU 128 CD2 -0.0092 -0.0200 0.0118 1153 LEU 128 H -0.0130 -0.0177 0.0160 1154 GLY 129 N -0.0083 -0.0229 0.0112 1155 GLY 129 CA -0.0079 -0.0255 0.0108 1156 GLY 129 C -0.0087 -0.0259 0.0117 1157 GLY 129 O -0.0085 -0.0281 0.0115 1158 GLY 129 H -0.0073 -0.0215 0.0101 1159 ARG 130 N -0.0096 -0.0239 0.0128 1160 ARG 130 CA -0.0105 -0.0238 0.0137 1161 ARG 130 C -0.0100 -0.0212 0.0131 1162 ARG 130 O -0.0112 -0.0199 0.0144 1163 ARG 130 CB -0.0125 -0.0243 0.0160 1164 ARG 130 CG -0.0129 -0.0270 0.0166 1165 ARG 130 CD -0.0149 -0.0275 0.0189 1166 ARG 130 NE -0.0160 -0.0255 0.0201 1167 ARG 130 CZ -0.0176 -0.0246 0.0219 1168 ARG 130 NH1 -0.0185 -0.0254 0.0229 1169 ARG 130 NH2 -0.0184 -0.0229 0.0227 1170 ARG 130 H -0.0098 -0.0223 0.0129 1171 ARG 130 HE -0.0154 -0.0248 0.0194 1172 ARG 130 HH11 -0.0179 -0.0265 0.0222 1173 ARG 130 HH12 -0.0196 -0.0245 0.0242 1174 ARG 130 HH21 -0.0195 -0.0220 0.0240 1175 ARG 130 HH22 -0.0176 -0.0220 0.0219 1176 GLY 131 N -0.0074 -0.0198 0.0113 1177 GLY 131 CA -0.0068 -0.0173 0.0104 1178 GLY 131 C -0.0061 -0.0155 0.0096 1179 GLY 131 O -0.0049 -0.0140 0.0082 1180 GLY 131 H -0.0065 -0.0210 0.0104 1181 VAL 132 N -0.0068 -0.0155 0.0103 1182 VAL 132 CA -0.0060 -0.0141 0.0094 1183 VAL 132 C -0.0047 -0.0158 0.0081 1184 VAL 132 O -0.0051 -0.0180 0.0087 1185 VAL 132 CB -0.0075 -0.0128 0.0109 1186 VAL 132 CG1 -0.0068 -0.0113 0.0100 1187 VAL 132 CG2 -0.0087 -0.0109 0.0121 1188 VAL 132 H -0.0078 -0.0167 0.0115 1189 SER 133 N -0.0020 -0.0130 0.0054 1190 SER 133 CA -0.0008 -0.0140 0.0042 1191 SER 133 C 0.0001 -0.0128 0.0035 1192 SER 133 O 0.0002 -0.0110 0.0036 1193 SER 133 CB 0.0000 -0.0148 0.0033 1194 SER 133 OG 0.0011 -0.0158 0.0022 1195 SER 133 H -0.0017 -0.0116 0.0053 1196 SER 133 HG 0.0010 -0.0171 0.0022 1197 TYR 134 N 0.0008 -0.0137 0.0027 1198 TYR 134 CA 0.0019 -0.0128 0.0017 1199 TYR 134 C 0.0033 -0.0136 0.0003 1200 TYR 134 O 0.0043 -0.0133 -0.0006 1201 TYR 134 CB 0.0015 -0.0130 0.0021 1202 TYR 134 CG 0.0000 -0.0124 0.0035 1203 TYR 134 CD1 -0.0004 -0.0107 0.0042 1204 TYR 134 CD2 -0.0008 -0.0135 0.0042 1205 TYR 134 CE1 -0.0018 -0.0102 0.0055 1206 TYR 134 CE2 -0.0021 -0.0129 0.0055 1207 TYR 134 CZ -0.0026 -0.0113 0.0062 1208 TYR 134 OH -0.0039 -0.0108 0.0075 1209 TYR 134 H 0.0007 -0.0151 0.0027 1210 TYR 134 HH -0.0044 -0.0117 0.0078 1211 CYS 135 N 0.0053 -0.0129 0.0009 1212 CYS 135 CA 0.0057 -0.0136 -0.0004 1213 CYS 135 C 0.0060 -0.0146 -0.0010 1214 CYS 135 O 0.0062 -0.0158 -0.0005 1215 CYS 135 CB 0.0058 -0.0146 -0.0000 1216 CYS 135 SG 0.0064 -0.0155 -0.0016 1217 CYS 135 H 0.0052 -0.0134 0.0016 1218 ALA 136 N 0.0062 -0.0139 -0.0021 1219 ALA 136 CA 0.0065 -0.0147 -0.0029 1220 ALA 136 C 0.0069 -0.0160 -0.0037 1221 ALA 136 O 0.0072 -0.0171 -0.0037 1222 ALA 136 CB 0.0065 -0.0136 -0.0039 1223 ALA 136 H 0.0061 -0.0130 -0.0026 1224 THR 137 N 0.0070 -0.0158 -0.0032 1225 THR 137 CA 0.0065 -0.0164 -0.0042 1226 THR 137 C 0.0068 -0.0170 -0.0035 1227 THR 137 O 0.0064 -0.0181 -0.0040 1228 THR 137 CB 0.0061 -0.0152 -0.0054 1229 THR 137 CG2 0.0056 -0.0149 -0.0064 1230 THR 137 OG1 0.0065 -0.0137 -0.0048 1231 THR 137 H 0.0072 -0.0146 -0.0033 1232 THR 137 HG1 0.0065 -0.0130 -0.0050 1233 CYS 138 N 0.0074 -0.0165 -0.0023 1234 CYS 138 CA 0.0078 -0.0170 -0.0014 1235 CYS 138 C 0.0081 -0.0185 -0.0005 1236 CYS 138 O 0.0079 -0.0197 -0.0005 1237 CYS 138 CB 0.0084 -0.0157 -0.0005 1238 CYS 138 SG 0.0082 -0.0138 -0.0013 1239 CYS 138 H 0.0077 -0.0155 -0.0019 1240 ASP 139 N 0.0065 -0.0208 0.0001 1241 ASP 139 CA 0.0061 -0.0211 0.0012 1242 ASP 139 C 0.0065 -0.0207 0.0001 1243 ASP 139 O 0.0063 -0.0212 0.0008 1244 ASP 139 CB 0.0049 -0.0199 0.0029 1245 ASP 139 CG 0.0043 -0.0206 0.0042 1246 ASP 139 OD1 0.0046 -0.0225 0.0046 1247 ASP 139 OD2 0.0036 -0.0193 0.0049 1248 ASP 139 H 0.0062 -0.0194 0.0001 1249 GLY 140 N 0.0071 -0.0196 -0.0016 1250 GLY 140 CA 0.0075 -0.0188 -0.0026 1251 GLY 140 C 0.0081 -0.0205 -0.0029 1252 GLY 140 O 0.0080 -0.0201 -0.0029 1253 GLY 140 H 0.0073 -0.0192 -0.0021 1254 ALA 141 N 0.0086 -0.0230 -0.0032 1255 ALA 141 CA 0.0094 -0.0249 -0.0035 1256 ALA 141 C 0.0084 -0.0256 -0.0016 1257 ALA 141 O 0.0088 -0.0264 -0.0020 1258 ALA 141 CB 0.0103 -0.0271 -0.0040 1259 ALA 141 H 0.0086 -0.0234 -0.0030 1260 PHE 142 N 0.0070 -0.0252 0.0003 1261 PHE 142 CA 0.0060 -0.0256 0.0022 1262 PHE 142 C 0.0055 -0.0238 0.0021 1263 PHE 142 O 0.0050 -0.0243 0.0031 1264 PHE 142 CB 0.0047 -0.0256 0.0042 1265 PHE 142 CG 0.0050 -0.0276 0.0046 1266 PHE 142 CD1 0.0055 -0.0301 0.0049 1267 PHE 142 CD2 0.0047 -0.0271 0.0048 1268 PHE 142 CE1 0.0058 -0.0320 0.0053 1269 PHE 142 CE2 0.0050 -0.0290 0.0052 1270 PHE 142 CZ 0.0056 -0.0314 0.0054 1271 PHE 142 H 0.0067 -0.0244 0.0005 1272 TYR 143 N 0.0055 -0.0218 0.0003 1273 TYR 143 CA 0.0051 -0.0196 0.0002 1274 TYR 143 C 0.0064 -0.0194 -0.0016 1275 TYR 143 O 0.0065 -0.0174 -0.0023 1276 TYR 143 CB 0.0044 -0.0174 0.0003 1277 TYR 143 CG 0.0029 -0.0176 0.0021 1278 TYR 143 CD1 0.0014 -0.0172 0.0039 1279 TYR 143 CD2 0.0031 -0.0184 0.0021 1280 TYR 143 CE1 0.0001 -0.0176 0.0056 1281 TYR 143 CE2 0.0018 -0.0187 0.0039 1282 TYR 143 CZ 0.0003 -0.0183 0.0056 1283 TYR 143 OH -0.0010 -0.0186 0.0073 1284 TYR 143 H 0.0060 -0.0216 -0.0004 1285 TYR 143 HH -0.0006 -0.0190 0.0070 1286 ARG 144 N 0.0075 -0.0214 -0.0023 1287 ARG 144 CA 0.0088 -0.0213 -0.0040 1288 ARG 144 C 0.0082 -0.0203 -0.0035 1289 ARG 144 O 0.0073 -0.0212 -0.0021 1290 ARG 144 CB 0.0099 -0.0239 -0.0045 1291 ARG 144 CG 0.0114 -0.0238 -0.0064 1292 ARG 144 CD 0.0126 -0.0262 -0.0071 1293 ARG 144 NE 0.0133 -0.0271 -0.0076 1294 ARG 144 CZ 0.0143 -0.0264 -0.0092 1295 ARG 144 NH1 0.0149 -0.0246 -0.0105 1296 ARG 144 NH2 0.0148 -0.0274 -0.0095 1297 ARG 144 H 0.0074 -0.0230 -0.0017 1298 ARG 144 HE 0.0128 -0.0284 -0.0066 1299 ARG 144 HH11 0.0156 -0.0238 -0.0116 1300 ARG 144 HH12 0.0145 -0.0237 -0.0103 1301 ARG 144 HH21 0.0156 -0.0267 -0.0107 1302 ARG 144 HH22 0.0143 -0.0287 -0.0084 1303 ASN 145 N 0.0088 -0.0186 -0.0048 1304 ASN 145 CA 0.0083 -0.0171 -0.0047 1305 ASN 145 C 0.0064 -0.0158 -0.0028 1306 ASN 145 O 0.0058 -0.0151 -0.0023 1307 ASN 145 CB 0.0089 -0.0188 -0.0049 1308 ASN 145 CG 0.0107 -0.0200 -0.0068 1309 ASN 145 ND2 0.0112 -0.0223 -0.0066 1310 ASN 145 OD1 0.0118 -0.0190 -0.0084 1311 ASN 145 H 0.0095 -0.0179 -0.0060 1312 ASN 145 HD21 0.0104 -0.0231 -0.0052 1313 ASN 145 HD22 0.0125 -0.0231 -0.0079 1314 ARG 146 N 0.0055 -0.0154 -0.0019 1315 ARG 146 CA 0.0038 -0.0140 -0.0001 1316 ARG 146 C 0.0036 -0.0115 -0.0008 1317 ARG 146 O 0.0047 -0.0110 -0.0024 1318 ARG 146 CB 0.0028 -0.0155 0.0016 1319 ARG 146 CG 0.0030 -0.0182 0.0023 1320 ARG 146 CD 0.0019 -0.0195 0.0042 1321 ARG 146 NE 0.0021 -0.0220 0.0049 1322 ARG 146 CZ 0.0009 -0.0232 0.0068 1323 ARG 146 NH1 -0.0004 -0.0224 0.0082 1324 ARG 146 NH2 0.0011 -0.0253 0.0073 1325 ARG 146 H 0.0061 -0.0160 -0.0024 1326 ARG 146 HE 0.0031 -0.0228 0.0039 1327 ARG 146 HH11 -0.0003 -0.0212 0.0077 1328 ARG 146 HH12 -0.0013 -0.0213 0.0089 1329 ARG 146 HH21 0.0001 -0.0261 0.0088 1330 ARG 146 HH22 0.0020 -0.0261 0.0064 1331 GLU 147 N 0.0019 -0.0098 0.0004 1332 GLU 147 CA 0.0015 -0.0074 0.0001 1333 GLU 147 C 0.0006 -0.0078 0.0012 1334 GLU 147 O -0.0005 -0.0090 0.0029 1335 GLU 147 CB 0.0004 -0.0053 0.0007 1336 GLU 147 CG 0.0013 -0.0049 -0.0004 1337 GLU 147 CD 0.0006 -0.0024 -0.0004 1338 GLU 147 OE1 0.0011 -0.0023 -0.0010 1339 GLU 147 OE2 -0.0003 -0.0006 0.0000 1340 GLU 147 H 0.0009 -0.0103 0.0016 1341 VAL 148 N 0.0013 -0.0069 0.0002 1342 VAL 148 CA 0.0006 -0.0071 0.0010 1343 VAL 148 C 0.0002 -0.0045 0.0006 1344 VAL 148 O 0.0010 -0.0029 -0.0007 1345 VAL 148 CB 0.0018 -0.0090 0.0002 1346 VAL 148 CG1 0.0022 -0.0116 0.0006 1347 VAL 148 CG2 0.0036 -0.0083 -0.0020 1348 VAL 148 H 0.0022 -0.0060 -0.0012 1349 VAL 149 N -0.0009 -0.0044 0.0017 1350 VAL 149 CA -0.0013 -0.0024 0.0015 1351 VAL 149 C -0.0006 -0.0031 0.0010 1352 VAL 149 O -0.0008 -0.0050 0.0018 1353 VAL 149 CB -0.0033 -0.0015 0.0033 1354 VAL 149 CG1 -0.0039 0.0003 0.0034 1355 VAL 149 CG2 -0.0039 -0.0004 0.0036 1356 VAL 149 H -0.0015 -0.0058 0.0027 1357 VAL 150 N 0.0002 -0.0016 -0.0002 1358 VAL 150 CA 0.0007 -0.0018 -0.0006 1359 VAL 150 C -0.0004 0.0004 -0.0002 1360 VAL 150 O -0.0003 0.0024 -0.0008 1361 VAL 150 CB 0.0026 -0.0020 -0.0025 1362 VAL 150 CG1 0.0030 -0.0022 -0.0029 1363 VAL 150 CG2 0.0036 -0.0042 -0.0029 1364 VAL 150 H 0.0003 -0.0001 -0.0007 1365 VAL 151 N -0.0012 -0.0003 0.0006 1366 VAL 151 CA -0.0022 0.0014 0.0010 1367 VAL 151 C -0.0017 0.0012 0.0006 1368 VAL 151 O -0.0018 -0.0003 0.0011 1369 VAL 151 CB -0.0041 0.0013 0.0026 1370 VAL 151 CG1 -0.0051 0.0032 0.0029 1371 VAL 151 CG2 -0.0046 0.0011 0.0031 1372 VAL 151 H -0.0012 -0.0018 0.0011 1373 GLY 152 N -0.0012 0.0029 -0.0004 1374 GLY 152 CA -0.0006 0.0029 -0.0010 1375 GLY 152 C 0.0005 0.0044 -0.0025 1376 GLY 152 O 0.0014 0.0047 -0.0033 1377 GLY 152 H -0.0011 0.0040 -0.0009 1378 LEU 153 N -0.0007 0.0046 -0.0027 1379 LEU 153 CA 0.0010 0.0062 -0.0043 1380 LEU 153 C 0.0021 0.0052 -0.0050 1381 LEU 153 O 0.0016 0.0062 -0.0048 1382 LEU 153 CB -0.0000 0.0091 -0.0042 1383 LEU 153 CG 0.0017 0.0110 -0.0058 1384 LEU 153 CD1 0.0033 0.0111 -0.0071 1385 LEU 153 CD2 0.0005 0.0138 -0.0055 1386 LEU 153 H -0.0015 0.0040 -0.0019 1387 ASN 154 N 0.0036 0.0032 -0.0057 1388 ASN 154 CA 0.0051 0.0019 -0.0066 1389 ASN 154 C 0.0070 0.0004 -0.0077 1390 ASN 154 O 0.0069 -0.0000 -0.0075 1391 ASN 154 CB 0.0038 0.0002 -0.0052 1392 ASN 154 CG 0.0026 -0.0017 -0.0039 1393 ASN 154 ND2 0.0006 -0.0017 -0.0024 1394 ASN 154 OD1 0.0035 -0.0032 -0.0043 1395 ASN 154 H 0.0039 0.0025 -0.0058 1396 ASN 154 HD21 -0.0002 -0.0004 -0.0021 1397 ASN 154 HD22 -0.0002 -0.0028 -0.0015 1398 PRO 155 N 0.0046 -0.0021 -0.0074 1399 PRO 155 CA 0.0053 -0.0029 -0.0080 1400 PRO 155 C 0.0053 -0.0039 -0.0075 1401 PRO 155 O 0.0058 -0.0044 -0.0078 1402 PRO 155 CB 0.0056 -0.0029 -0.0085 1403 PRO 155 CG 0.0052 -0.0018 -0.0085 1404 PRO 155 CD 0.0045 -0.0016 -0.0076 1405 GLU 156 N 0.0049 -0.0043 -0.0067 1406 GLU 156 CA 0.0049 -0.0053 -0.0061 1407 GLU 156 C 0.0048 -0.0054 -0.0059 1408 GLU 156 O 0.0052 -0.0061 -0.0060 1409 GLU 156 CB 0.0044 -0.0056 -0.0052 1410 GLU 156 CG 0.0044 -0.0066 -0.0046 1411 GLU 156 CD 0.0038 -0.0069 -0.0037 1412 GLU 156 OE1 0.0038 -0.0078 -0.0032 1413 GLU 156 OE2 0.0034 -0.0062 -0.0035 1414 GLU 156 H 0.0046 -0.0039 -0.0064 1415 ALA 157 N 0.0043 -0.0035 -0.0059 1416 ALA 157 CA 0.0038 -0.0031 -0.0056 1417 ALA 157 C 0.0051 -0.0029 -0.0070 1418 ALA 157 O 0.0052 -0.0036 -0.0069 1419 ALA 157 CB 0.0025 -0.0012 -0.0049 1420 ALA 157 H 0.0038 -0.0025 -0.0058 1421 VAL 158 N 0.0060 -0.0019 -0.0085 1422 VAL 158 CA 0.0073 -0.0016 -0.0100 1423 VAL 158 C 0.0085 -0.0036 -0.0104 1424 VAL 158 O 0.0090 -0.0041 -0.0107 1425 VAL 158 CB 0.0081 -0.0000 -0.0113 1426 VAL 158 CG1 0.0095 0.0001 -0.0130 1427 VAL 158 CG2 0.0070 0.0021 -0.0110 1428 VAL 158 H 0.0059 -0.0014 -0.0085 1429 GLU 159 N 0.0064 -0.0056 -0.0098 1430 GLU 159 CA 0.0074 -0.0067 -0.0098 1431 GLU 159 C 0.0078 -0.0077 -0.0089 1432 GLU 159 O 0.0088 -0.0084 -0.0093 1433 GLU 159 CB 0.0074 -0.0070 -0.0093 1434 GLU 159 CG 0.0073 -0.0062 -0.0104 1435 GLU 159 CD 0.0072 -0.0064 -0.0098 1436 GLU 159 OE1 0.0077 -0.0066 -0.0105 1437 GLU 159 OE2 0.0066 -0.0066 -0.0086 1438 GLU 159 H 0.0058 -0.0052 -0.0094 1439 GLU 160 N 0.0071 -0.0076 -0.0078 1440 GLU 160 CA 0.0073 -0.0085 -0.0069 1441 GLU 160 C 0.0076 -0.0083 -0.0075 1442 GLU 160 O 0.0083 -0.0092 -0.0073 1443 GLU 160 CB 0.0064 -0.0084 -0.0055 1444 GLU 160 CG 0.0063 -0.0087 -0.0048 1445 GLU 160 CD 0.0072 -0.0100 -0.0042 1446 GLU 160 OE1 0.0080 -0.0105 -0.0048 1447 GLU 160 OE2 0.0071 -0.0105 -0.0032 1448 GLU 160 H 0.0063 -0.0070 -0.0075 1449 ALA 161 N 0.0071 -0.0062 -0.0079 1450 ALA 161 CA 0.0072 -0.0052 -0.0083 1451 ALA 161 C 0.0091 -0.0059 -0.0100 1452 ALA 161 O 0.0094 -0.0067 -0.0099 1453 ALA 161 CB 0.0064 -0.0024 -0.0087 1454 ALA 161 H 0.0069 -0.0050 -0.0081 1455 GLN 162 N 0.0106 -0.0059 -0.0115 1456 GLN 162 CA 0.0125 -0.0067 -0.0131 1457 GLN 162 C 0.0131 -0.0094 -0.0126 1458 GLN 162 O 0.0144 -0.0102 -0.0135 1459 GLN 162 CB 0.0137 -0.0059 -0.0146 1460 GLN 162 CG 0.0157 -0.0060 -0.0165 1461 GLN 162 CD 0.0158 -0.0041 -0.0174 1462 GLN 162 NE2 0.0174 -0.0040 -0.0191 1463 GLN 162 OE1 0.0144 -0.0026 -0.0166 1464 GLN 162 H 0.0103 -0.0052 -0.0115 1465 GLN 162 HE21 0.0186 -0.0046 -0.0200 1466 GLN 162 HE22 0.0173 -0.0025 -0.0196 1467 VAL 163 N 0.0108 -0.0101 -0.0110 1468 VAL 163 CA 0.0112 -0.0123 -0.0102 1469 VAL 163 C 0.0108 -0.0127 -0.0095 1470 VAL 163 O 0.0117 -0.0141 -0.0098 1471 VAL 163 CB 0.0106 -0.0131 -0.0089 1472 VAL 163 CG1 0.0109 -0.0153 -0.0079 1473 VAL 163 CG2 0.0112 -0.0131 -0.0098 1474 VAL 163 H 0.0100 -0.0094 -0.0104 1475 LEU 164 N 0.0096 -0.0115 -0.0085 1476 LEU 164 CA 0.0091 -0.0118 -0.0077 1477 LEU 164 C 0.0099 -0.0114 -0.0090 1478 LEU 164 O 0.0100 -0.0124 -0.0086 1479 LEU 164 CB 0.0076 -0.0105 -0.0064 1480 LEU 164 CG 0.0067 -0.0111 -0.0048 1481 LEU 164 CD1 0.0052 -0.0095 -0.0038 1482 LEU 164 CD2 0.0066 -0.0130 -0.0035 1483 LEU 164 H 0.0090 -0.0104 -0.0083 1484 THR 165 N 0.0111 -0.0096 -0.0106 1485 THR 165 CA 0.0120 -0.0091 -0.0119 1486 THR 165 C 0.0133 -0.0112 -0.0127 1487 THR 165 O 0.0137 -0.0112 -0.0132 1488 THR 165 CB 0.0128 -0.0071 -0.0136 1489 THR 165 CG2 0.0116 -0.0048 -0.0131 1490 THR 165 OG1 0.0139 -0.0078 -0.0147 1491 THR 165 H 0.0111 -0.0088 -0.0109 1492 THR 165 HG1 0.0142 -0.0064 -0.0156 1493 LYS 166 N 0.0138 -0.0130 -0.0126 1494 LYS 166 CA 0.0150 -0.0153 -0.0132 1495 LYS 166 C 0.0143 -0.0168 -0.0117 1496 LYS 166 O 0.0151 -0.0185 -0.0121 1497 LYS 166 CB 0.0157 -0.0167 -0.0135 1498 LYS 166 CG 0.0165 -0.0154 -0.0150 1499 LYS 166 CD 0.0170 -0.0168 -0.0151 1500 LYS 166 CE 0.0177 -0.0153 -0.0165 1501 LYS 166 NZ 0.0180 -0.0163 -0.0166 1502 LYS 166 H 0.0134 -0.0129 -0.0122 1503 LYS 166 HZ1 0.0185 -0.0152 -0.0175 1504 LYS 166 HZ2 0.0170 -0.0165 -0.0153 1505 LYS 166 HZ3 0.0189 -0.0179 -0.0170 1506 PHE 167 N 0.0123 -0.0162 -0.0103 1507 PHE 167 CA 0.0114 -0.0176 -0.0086 1508 PHE 167 C 0.0104 -0.0162 -0.0077 1509 PHE 167 O 0.0104 -0.0169 -0.0075 1510 PHE 167 CB 0.0106 -0.0187 -0.0071 1511 PHE 167 CG 0.0116 -0.0201 -0.0079 1512 PHE 167 CD1 0.0126 -0.0223 -0.0084 1513 PHE 167 CD2 0.0116 -0.0191 -0.0083 1514 PHE 167 CE1 0.0135 -0.0237 -0.0091 1515 PHE 167 CE2 0.0125 -0.0204 -0.0090 1516 PHE 167 CZ 0.0135 -0.0227 -0.0094 1517 PHE 167 H 0.0117 -0.0146 -0.0101 1518 ALA 168 N 0.0094 -0.0142 -0.0071 1519 ALA 168 CA 0.0082 -0.0127 -0.0060 1520 ALA 168 C 0.0088 -0.0115 -0.0073 1521 ALA 168 O 0.0099 -0.0108 -0.0091 1522 ALA 168 CB 0.0071 -0.0109 -0.0052 1523 ALA 168 H 0.0095 -0.0136 -0.0074 1524 SER 169 N 0.0081 -0.0110 -0.0064 1525 SER 169 CA 0.0084 -0.0093 -0.0073 1526 SER 169 C 0.0078 -0.0066 -0.0075 1527 SER 169 O 0.0086 -0.0050 -0.0089 1528 SER 169 CB 0.0075 -0.0097 -0.0061 1529 SER 169 OG 0.0057 -0.0094 -0.0041 1530 SER 169 H 0.0069 -0.0115 -0.0049 1531 SER 169 HG 0.0051 -0.0096 -0.0034 1532 THR 170 N 0.0065 -0.0059 -0.0062 1533 THR 170 CA 0.0059 -0.0034 -0.0063 1534 THR 170 C 0.0052 -0.0036 -0.0054 1535 THR 170 O 0.0042 -0.0049 -0.0038 1536 THR 170 CB 0.0046 -0.0017 -0.0054 1537 THR 170 CG2 0.0041 0.0010 -0.0057 1538 THR 170 OG1 0.0054 -0.0014 -0.0064 1539 THR 170 H 0.0058 -0.0072 -0.0050 1540 THR 170 HG1 0.0064 -0.0027 -0.0071 1541 VAL 171 N 0.0056 -0.0022 -0.0063 1542 VAL 171 CA 0.0050 -0.0019 -0.0057 1543 VAL 171 C 0.0040 0.0007 -0.0054 1544 VAL 171 O 0.0048 0.0025 -0.0067 1545 VAL 171 CB 0.0065 -0.0026 -0.0071 1546 VAL 171 CG1 0.0058 -0.0024 -0.0064 1547 VAL 171 CG2 0.0075 -0.0053 -0.0075 1548 VAL 171 H 0.0065 -0.0012 -0.0075 1549 HIS 172 N 0.0022 0.0011 -0.0036 1550 HIS 172 CA 0.0011 0.0035 -0.0030 1551 HIS 172 C 0.0009 0.0039 -0.0030 1552 HIS 172 O -0.0000 0.0028 -0.0017 1553 HIS 172 CB -0.0008 0.0035 -0.0011 1554 HIS 172 CG -0.0007 0.0035 -0.0011 1555 HIS 172 CD2 -0.0001 0.0016 -0.0012 1556 HIS 172 ND1 -0.0013 0.0056 -0.0011 1557 HIS 172 CE1 -0.0010 0.0049 -0.0012 1558 HIS 172 NE2 -0.0003 0.0025 -0.0013 1559 HIS 172 H 0.0017 -0.0004 -0.0026 1560 HIS 172 HD1 -0.0022 0.0071 -0.0006 1561 TRP 173 N 0.0020 0.0050 -0.0044 1562 TRP 173 CA 0.0018 0.0054 -0.0044 1563 TRP 173 C 0.0001 0.0076 -0.0037 1564 TRP 173 O 0.0002 0.0097 -0.0046 1565 TRP 173 CB 0.0035 0.0057 -0.0064 1566 TRP 173 CG 0.0036 0.0059 -0.0065 1567 TRP 173 CD1 0.0026 0.0050 -0.0051 1568 TRP 173 CD2 0.0046 0.0072 -0.0081 1569 TRP 173 CE2 0.0042 0.0069 -0.0075 1570 TRP 173 CE3 0.0059 0.0085 -0.0099 1571 TRP 173 NE1 0.0029 0.0056 -0.0057 1572 TRP 173 CZ2 0.0050 0.0079 -0.0087 1573 TRP 173 CZ3 0.0066 0.0095 -0.0111 1574 TRP 173 CH2 0.0062 0.0092 -0.0106 1575 TRP 173 H 0.0027 0.0059 -0.0055 1576 TRP 173 HE1 0.0023 0.0053 -0.0048 1577 ILE 174 N -0.0013 0.0072 -0.0020 1578 ILE 174 CA -0.0030 0.0090 -0.0010 1579 ILE 174 C -0.0030 0.0096 -0.0013 1580 ILE 174 O -0.0030 0.0082 -0.0007 1581 ILE 174 CB -0.0047 0.0081 0.0011 1582 ILE 174 CG1 -0.0048 0.0074 0.0015 1583 ILE 174 CG2 -0.0065 0.0101 0.0021 1584 ILE 174 CD1 -0.0063 0.0063 0.0035 1585 ILE 174 H -0.0012 0.0054 -0.0013 1586 THR 175 N -0.0030 0.0123 -0.0021 1587 THR 175 CA -0.0028 0.0133 -0.0027 1588 THR 175 C -0.0046 0.0157 -0.0017 1589 THR 175 O -0.0052 0.0176 -0.0017 1590 THR 175 CB -0.0007 0.0142 -0.0049 1591 THR 175 CG2 0.0012 0.0118 -0.0060 1592 THR 175 OG1 -0.0005 0.0164 -0.0058 1593 THR 175 H -0.0030 0.0137 -0.0025 1594 THR 175 HG1 -0.0003 0.0179 -0.0065 1595 PRO 176 N -0.0055 0.0157 -0.0008 1596 PRO 176 CA -0.0073 0.0179 0.0002 1597 PRO 176 C -0.0066 0.0207 -0.0013 1598 PRO 176 O -0.0080 0.0228 -0.0007 1599 PRO 176 CB -0.0082 0.0168 0.0014 1600 PRO 176 CG -0.0063 0.0148 0.0002 1601 PRO 176 CD -0.0050 0.0136 -0.0006 1602 LYS 177 N -0.0052 0.0205 -0.0029 1603 LYS 177 CA -0.0044 0.0228 -0.0046 1604 LYS 177 C -0.0024 0.0226 -0.0064 1605 LYS 177 O -0.0016 0.0206 -0.0063 1606 LYS 177 CB -0.0041 0.0230 -0.0050 1607 LYS 177 CG -0.0061 0.0234 -0.0032 1608 LYS 177 CD -0.0056 0.0236 -0.0038 1609 LYS 177 CE -0.0075 0.0239 -0.0022 1610 LYS 177 NZ -0.0069 0.0239 -0.0027 1611 LYS 177 H -0.0041 0.0188 -0.0032 1612 LYS 177 HZ1 -0.0082 0.0241 -0.0016 1613 LYS 177 HZ2 -0.0059 0.0222 -0.0030 1614 LYS 177 HZ3 -0.0063 0.0254 -0.0040 1615 ASP 178 N -0.0016 0.0246 -0.0080 1616 ASP 178 CA 0.0005 0.0246 -0.0100 1617 ASP 178 C 0.0022 0.0224 -0.0106 1618 ASP 178 O 0.0022 0.0223 -0.0106 1619 ASP 178 CB 0.0008 0.0274 -0.0114 1620 ASP 178 CG 0.0028 0.0279 -0.0134 1621 ASP 178 OD1 0.0044 0.0260 -0.0141 1622 ASP 178 OD2 0.0026 0.0302 -0.0143 1623 ASP 178 H -0.0023 0.0261 -0.0080 1624 PRO 179 N 0.0033 0.0204 -0.0112 1625 PRO 179 CA 0.0048 0.0183 -0.0119 1626 PRO 179 C 0.0067 0.0190 -0.0138 1627 PRO 179 O 0.0078 0.0175 -0.0143 1628 PRO 179 CB 0.0054 0.0164 -0.0118 1629 PRO 179 CG 0.0050 0.0183 -0.0121 1630 PRO 179 CD 0.0032 0.0203 -0.0111 1631 HIS 180 N 0.0071 0.0214 -0.0148 1632 HIS 180 CA 0.0088 0.0224 -0.0166 1633 HIS 180 C 0.0086 0.0225 -0.0165 1634 HIS 180 O 0.0101 0.0229 -0.0179 1635 HIS 180 CB 0.0090 0.0250 -0.0176 1636 HIS 180 CG 0.0096 0.0248 -0.0181 1637 HIS 180 CD2 0.0085 0.0258 -0.0174 1638 HIS 180 ND1 0.0115 0.0234 -0.0193 1639 HIS 180 CE1 0.0115 0.0237 -0.0194 1640 HIS 180 NE2 0.0097 0.0252 -0.0183 1641 HIS 180 H 0.0061 0.0227 -0.0144 1642 HIS 180 HD1 0.0126 0.0224 -0.0200 1643 THR 181 N 0.0066 0.0220 -0.0146 1644 THR 181 CA 0.0065 0.0218 -0.0144 1645 THR 181 C 0.0077 0.0190 -0.0149 1646 THR 181 O 0.0077 0.0186 -0.0148 1647 THR 181 CB 0.0041 0.0221 -0.0124 1648 THR 181 CG2 0.0027 0.0249 -0.0118 1649 THR 181 OG1 0.0031 0.0198 -0.0109 1650 THR 181 H 0.0053 0.0217 -0.0134 1651 THR 181 HG1 0.0040 0.0181 -0.0113 1652 LEU 182 N 0.0086 0.0169 -0.0152 1653 LEU 182 CA 0.0098 0.0142 -0.0157 1654 LEU 182 C 0.0122 0.0143 -0.0179 1655 LEU 182 O 0.0135 0.0122 -0.0185 1656 LEU 182 CB 0.0093 0.0118 -0.0147 1657 LEU 182 CG 0.0070 0.0111 -0.0124 1658 LEU 182 CD1 0.0068 0.0087 -0.0117 1659 LEU 182 CD2 0.0063 0.0102 -0.0116 1660 LEU 182 H 0.0084 0.0173 -0.0152 1661 ASP 183 N 0.0134 0.0163 -0.0188 1662 ASP 183 CA 0.0164 0.0167 -0.0206 1663 ASP 183 C 0.0177 0.0155 -0.0214 1664 ASP 183 O 0.0195 0.0136 -0.0227 1665 ASP 183 CB 0.0176 0.0154 -0.0214 1666 ASP 183 CG 0.0168 0.0172 -0.0208 1667 ASP 183 OD1 0.0163 0.0200 -0.0204 1668 ASP 183 OD2 0.0167 0.0157 -0.0208 1669 ASP 183 H 0.0124 0.0179 -0.0181 1670 GLY 184 N 0.0165 0.0164 -0.0207 1671 GLY 184 CA 0.0176 0.0155 -0.0214 1672 GLY 184 C 0.0168 0.0122 -0.0211 1673 GLY 184 O 0.0172 0.0116 -0.0214 1674 GLY 184 H 0.0150 0.0178 -0.0197 1675 HIS 185 N 0.0156 0.0108 -0.0204 1676 HIS 185 CA 0.0155 0.0081 -0.0197 1677 HIS 185 C 0.0145 0.0077 -0.0187 1678 HIS 185 O 0.0149 0.0057 -0.0186 1679 HIS 185 CB 0.0143 0.0070 -0.0184 1680 HIS 185 CG 0.0154 0.0066 -0.0192 1681 HIS 185 CD2 0.0163 0.0044 -0.0195 1682 HIS 185 ND1 0.0156 0.0084 -0.0199 1683 HIS 185 CE1 0.0167 0.0073 -0.0205 1684 HIS 185 NE2 0.0171 0.0048 -0.0203 1685 HIS 185 H 0.0150 0.0116 -0.0201 1686 HIS 185 HD1 0.0151 0.0103 -0.0199 1687 ALA 186 N 0.0133 0.0097 -0.0181 1688 ALA 186 CA 0.0122 0.0096 -0.0172 1689 ALA 186 C 0.0134 0.0103 -0.0184 1690 ALA 186 O 0.0128 0.0100 -0.0177 1691 ALA 186 CB 0.0103 0.0114 -0.0159 1692 ALA 186 H 0.0131 0.0113 -0.0183 1693 ASP 187 N 0.0156 0.0113 -0.0205 1694 ASP 187 CA 0.0166 0.0125 -0.0216 1695 ASP 187 C 0.0172 0.0105 -0.0218 1696 ASP 187 O 0.0169 0.0112 -0.0216 1697 ASP 187 CB 0.0184 0.0138 -0.0235 1698 ASP 187 CG 0.0178 0.0163 -0.0235 1699 ASP 187 OD1 0.0160 0.0172 -0.0220 1700 ASP 187 OD2 0.0192 0.0173 -0.0250 1701 ASP 187 H 0.0162 0.0115 -0.0210 1702 GLU 188 N 0.0180 0.0081 -0.0220 1703 GLU 188 CA 0.0186 0.0060 -0.0222 1704 GLU 188 C 0.0168 0.0052 -0.0203 1705 GLU 188 O 0.0168 0.0049 -0.0203 1706 GLU 188 CB 0.0198 0.0036 -0.0227 1707 GLU 188 CG 0.0207 0.0015 -0.0232 1708 GLU 188 CD 0.0218 -0.0011 -0.0236 1709 GLU 188 OE1 0.0218 -0.0031 -0.0232 1710 GLU 188 OE2 0.0225 -0.0010 -0.0242 1711 GLU 188 H 0.0183 0.0077 -0.0222 1712 LEU 189 N 0.0151 0.0050 -0.0188 1713 LEU 189 CA 0.0133 0.0043 -0.0170 1714 LEU 189 C 0.0124 0.0065 -0.0167 1715 LEU 189 O 0.0119 0.0060 -0.0161 1716 LEU 189 CB 0.0118 0.0038 -0.0155 1717 LEU 189 CG 0.0100 0.0030 -0.0135 1718 LEU 189 CD1 0.0104 0.0002 -0.0131 1719 LEU 189 CD2 0.0084 0.0030 -0.0120 1720 LEU 189 H 0.0150 0.0054 -0.0189 1721 LEU 190 N 0.0123 0.0090 -0.0173 1722 LEU 190 CA 0.0115 0.0113 -0.0172 1723 LEU 190 C 0.0128 0.0116 -0.0185 1724 LEU 190 O 0.0120 0.0125 -0.0181 1725 LEU 190 CB 0.0113 0.0138 -0.0177 1726 LEU 190 CG 0.0097 0.0141 -0.0162 1727 LEU 190 CD1 0.0098 0.0164 -0.0170 1728 LEU 190 CD2 0.0076 0.0145 -0.0144 1729 LEU 190 H 0.0128 0.0093 -0.0179 1730 ALA 191 N 0.0150 0.0104 -0.0203 1731 ALA 191 CA 0.0163 0.0102 -0.0216 1732 ALA 191 C 0.0162 0.0079 -0.0209 1733 ALA 191 O 0.0170 0.0078 -0.0217 1734 ALA 191 CB 0.0182 0.0102 -0.0236 1735 ALA 191 H 0.0155 0.0099 -0.0207 1736 HIS 192 N 0.0154 0.0061 -0.0196 1737 HIS 192 CA 0.0154 0.0037 -0.0190 1738 HIS 192 C 0.0142 0.0042 -0.0178 1739 HIS 192 O 0.0125 0.0051 -0.0163 1740 HIS 192 CB 0.0150 0.0017 -0.0180 1741 HIS 192 CG 0.0154 -0.0009 -0.0177 1742 HIS 192 CD2 0.0169 -0.0028 -0.0188 1743 HIS 192 ND1 0.0144 -0.0018 -0.0164 1744 HIS 192 CE1 0.0153 -0.0041 -0.0168 1745 HIS 192 NE2 0.0168 -0.0047 -0.0182 1746 HIS 192 H 0.0148 0.0063 -0.0190 1747 HIS 192 HD1 0.0131 -0.0010 -0.0153 1748 PRO 193 N 0.0151 0.0032 -0.0186 1749 PRO 193 CA 0.0141 0.0038 -0.0176 1750 PRO 193 C 0.0124 0.0027 -0.0155 1751 PRO 193 O 0.0112 0.0037 -0.0144 1752 PRO 193 CB 0.0154 0.0029 -0.0188 1753 PRO 193 CG 0.0167 0.0008 -0.0197 1754 PRO 193 CD 0.0169 0.0018 -0.0201 1755 SER 194 N 0.0124 0.0006 -0.0149 1756 SER 194 CA 0.0108 -0.0005 -0.0129 1757 SER 194 C 0.0094 0.0008 -0.0117 1758 SER 194 O 0.0080 0.0001 -0.0100 1759 SER 194 CB 0.0112 -0.0033 -0.0126 1760 SER 194 OG 0.0126 -0.0046 -0.0138 1761 SER 194 H 0.0135 -0.0003 -0.0159 1762 SER 194 HG 0.0125 -0.0063 -0.0132 1763 VAL 195 N 0.0097 0.0028 -0.0125 1764 VAL 195 CA 0.0084 0.0040 -0.0115 1765 VAL 195 C 0.0073 0.0063 -0.0111 1766 VAL 195 O 0.0080 0.0079 -0.0123 1767 VAL 195 CB 0.0093 0.0044 -0.0126 1768 VAL 195 CG1 0.0079 0.0058 -0.0115 1769 VAL 195 CG2 0.0101 0.0020 -0.0127 1770 VAL 195 H 0.0108 0.0035 -0.0139 1771 LYS 196 N 0.0056 0.0067 -0.0093 1772 LYS 196 CA 0.0044 0.0089 -0.0087 1773 LYS 196 C 0.0035 0.0099 -0.0079 1774 LYS 196 O 0.0025 0.0088 -0.0065 1775 LYS 196 CB 0.0032 0.0085 -0.0072 1776 LYS 196 CG 0.0040 0.0079 -0.0079 1777 LYS 196 CD 0.0027 0.0075 -0.0063 1778 LYS 196 CE 0.0035 0.0063 -0.0068 1779 LYS 196 NZ 0.0024 0.0050 -0.0051 1780 LYS 196 H 0.0052 0.0053 -0.0084 1781 LYS 196 HZ1 0.0030 0.0039 -0.0055 1782 LYS 196 HZ2 0.0020 0.0038 -0.0043 1783 LYS 196 HZ3 0.0013 0.0061 -0.0043 1784 LEU 197 N 0.0040 0.0125 -0.0091 1785 LEU 197 CA 0.0030 0.0137 -0.0085 1786 LEU 197 C 0.0009 0.0152 -0.0068 1787 LEU 197 O 0.0006 0.0168 -0.0070 1788 LEU 197 CB 0.0041 0.0156 -0.0103 1789 LEU 197 CG 0.0032 0.0171 -0.0098 1790 LEU 197 CD1 0.0031 0.0153 -0.0091 1791 LEU 197 CD2 0.0043 0.0191 -0.0117 1792 LEU 197 H 0.0049 0.0134 -0.0103 1793 TRP 198 N -0.0004 0.0147 -0.0053 1794 TRP 198 CA -0.0024 0.0162 -0.0037 1795 TRP 198 C -0.0028 0.0174 -0.0038 1796 TRP 198 O -0.0036 0.0165 -0.0026 1797 TRP 198 CB -0.0038 0.0144 -0.0017 1798 TRP 198 CG -0.0035 0.0132 -0.0016 1799 TRP 198 CD1 -0.0020 0.0112 -0.0025 1800 TRP 198 CD2 -0.0047 0.0138 -0.0005 1801 TRP 198 CE2 -0.0038 0.0122 -0.0009 1802 TRP 198 CE3 -0.0064 0.0156 0.0007 1803 TRP 198 NE1 -0.0021 0.0107 -0.0022 1804 TRP 198 CZ2 -0.0046 0.0123 -0.0001 1805 TRP 198 CZ3 -0.0073 0.0157 0.0015 1806 TRP 198 CH2 -0.0064 0.0141 0.0011 1807 TRP 198 H -0.0000 0.0133 -0.0052 1808 TRP 198 HE1 -0.0010 0.0096 -0.0029 1809 GLU 199 N -0.0021 0.0198 -0.0054 1810 GLU 199 CA -0.0025 0.0212 -0.0057 1811 GLU 199 C -0.0046 0.0228 -0.0040 1812 GLU 199 O -0.0058 0.0234 -0.0030 1813 GLU 199 CB -0.0011 0.0230 -0.0079 1814 GLU 199 CG -0.0013 0.0252 -0.0085 1815 GLU 199 CD -0.0007 0.0276 -0.0103 1816 GLU 199 OE1 -0.0002 0.0291 -0.0113 1817 GLU 199 OE2 -0.0009 0.0283 -0.0103 1818 GLU 199 H -0.0014 0.0205 -0.0065 1819 LYS 200 N -0.0052 0.0234 -0.0037 1820 LYS 200 CA -0.0072 0.0249 -0.0022 1821 LYS 200 C -0.0089 0.0236 0.0001 1822 LYS 200 O -0.0106 0.0247 0.0015 1823 LYS 200 CB -0.0076 0.0279 -0.0030 1824 LYS 200 CG -0.0063 0.0292 -0.0050 1825 LYS 200 CD -0.0065 0.0321 -0.0060 1826 LYS 200 CE -0.0050 0.0333 -0.0081 1827 LYS 200 NZ -0.0031 0.0332 -0.0100 1828 LYS 200 H -0.0042 0.0227 -0.0045 1829 LYS 200 HZ1 -0.0024 0.0312 -0.0099 1830 LYS 200 HZ2 -0.0021 0.0337 -0.0113 1831 LYS 200 HZ3 -0.0034 0.0341 -0.0101 1832 THR 201 N -0.0082 0.0211 0.0004 1833 THR 201 CA -0.0094 0.0199 0.0023 1834 THR 201 C -0.0101 0.0180 0.0040 1835 THR 201 O -0.0091 0.0168 0.0035 1836 THR 201 CB -0.0082 0.0187 0.0017 1837 THR 201 CG2 -0.0092 0.0172 0.0035 1838 THR 201 OG1 -0.0078 0.0206 0.0003 1839 THR 201 H -0.0067 0.0202 -0.0007 1840 THR 201 HG1 -0.0070 0.0214 -0.0010 1841 ARG 202 N -0.0118 0.0177 0.0060 1842 ARG 202 CA -0.0125 0.0157 0.0078 1843 ARG 202 C -0.0126 0.0136 0.0089 1844 ARG 202 O -0.0134 0.0142 0.0094 1845 ARG 202 CB -0.0146 0.0170 0.0093 1846 ARG 202 CG -0.0145 0.0189 0.0083 1847 ARG 202 CD -0.0166 0.0199 0.0100 1848 ARG 202 NE -0.0165 0.0217 0.0091 1849 ARG 202 CZ -0.0179 0.0225 0.0101 1850 ARG 202 NH1 -0.0195 0.0218 0.0122 1851 ARG 202 NH2 -0.0177 0.0241 0.0091 1852 ARG 202 H -0.0126 0.0187 0.0063 1853 ARG 202 HE -0.0154 0.0223 0.0075 1854 ARG 202 HH11 -0.0206 0.0225 0.0130 1855 ARG 202 HH12 -0.0197 0.0206 0.0130 1856 ARG 202 HH21 -0.0165 0.0246 0.0075 1857 ARG 202 HH22 -0.0188 0.0247 0.0099 1858 LEU 203 N -0.0111 0.0114 0.0087 1859 LEU 203 CA -0.0117 0.0092 0.0102 1860 LEU 203 C -0.0138 0.0095 0.0124 1861 LEU 203 O -0.0143 0.0094 0.0129 1862 LEU 203 CB -0.0104 0.0066 0.0096 1863 LEU 203 CG -0.0109 0.0041 0.0111 1864 LEU 203 CD1 -0.0109 0.0040 0.0112 1865 LEU 203 CD2 -0.0095 0.0016 0.0105 1866 LEU 203 H -0.0104 0.0111 0.0080 1867 ILE 204 N -0.0151 0.0098 0.0137 1868 ILE 204 CA -0.0171 0.0103 0.0158 1869 ILE 204 C -0.0177 0.0077 0.0174 1870 ILE 204 O -0.0190 0.0073 0.0189 1871 ILE 204 CB -0.0182 0.0123 0.0162 1872 ILE 204 CG1 -0.0177 0.0150 0.0147 1873 ILE 204 CG2 -0.0203 0.0128 0.0184 1874 ILE 204 CD1 -0.0181 0.0163 0.0146 1875 ILE 204 H -0.0146 0.0098 0.0131 1876 ARG 205 N -0.0164 0.0070 0.0167 1877 ARG 205 CA -0.0172 0.0045 0.0179 1878 ARG 205 C -0.0158 0.0024 0.0168 1879 ARG 205 O -0.0149 0.0032 0.0156 1880 ARG 205 CB -0.0190 0.0051 0.0199 1881 ARG 205 CG -0.0200 0.0025 0.0214 1882 ARG 205 CD -0.0219 0.0033 0.0233 1883 ARG 205 NE -0.0231 0.0049 0.0245 1884 ARG 205 CZ -0.0249 0.0054 0.0264 1885 ARG 205 NH1 -0.0258 0.0047 0.0275 1886 ARG 205 NH2 -0.0259 0.0068 0.0273 1887 ARG 205 H -0.0154 0.0075 0.0156 1888 ARG 205 HE -0.0226 0.0057 0.0237 1889 ARG 205 HH11 -0.0271 0.0052 0.0289 1890 ARG 205 HH12 -0.0250 0.0037 0.0267 1891 ARG 205 HH21 -0.0253 0.0075 0.0265 1892 ARG 205 HH22 -0.0273 0.0073 0.0287 1893 ILE 206 N -0.0159 -0.0001 0.0172 1894 ILE 206 CA -0.0150 -0.0024 0.0166 1895 ILE 206 C -0.0165 -0.0037 0.0185 1896 ILE 206 O -0.0179 -0.0042 0.0201 1897 ILE 206 CB -0.0139 -0.0044 0.0157 1898 ILE 206 CG1 -0.0124 -0.0030 0.0138 1899 ILE 206 CG2 -0.0130 -0.0069 0.0151 1900 ILE 206 CD1 -0.0115 -0.0046 0.0131 1901 ILE 206 H -0.0167 -0.0006 0.0182 1902 LYS 207 N -0.0164 -0.0040 0.0183 1903 LYS 207 CA -0.0176 -0.0051 0.0199 1904 LYS 207 C -0.0168 -0.0078 0.0194 1905 LYS 207 O -0.0152 -0.0082 0.0177 1906 LYS 207 CB -0.0181 -0.0033 0.0202 1907 LYS 207 CG -0.0193 -0.0007 0.0210 1908 LYS 207 CD -0.0197 0.0008 0.0212 1909 LYS 207 CE -0.0210 0.0033 0.0222 1910 LYS 207 NZ -0.0212 0.0051 0.0222 1911 LYS 207 H -0.0152 -0.0037 0.0170 1912 LYS 207 HZ1 -0.0201 0.0051 0.0209 1913 LYS 207 HZ2 -0.0221 0.0046 0.0232 1914 LYS 207 HZ3 -0.0216 0.0069 0.0223 1915 GLY 208 N -0.0179 -0.0095 0.0210 1916 GLY 208 CA -0.0173 -0.0121 0.0207 1917 GLY 208 C -0.0188 -0.0134 0.0227 1918 GLY 208 O -0.0203 -0.0123 0.0242 1919 GLY 208 H -0.0192 -0.0091 0.0224 1920 GLU 209 N -0.0188 -0.0158 0.0228 1921 GLU 209 CA -0.0202 -0.0181 0.0248 1922 GLU 209 C -0.0198 -0.0209 0.0245 1923 GLU 209 O -0.0186 -0.0209 0.0229 1924 GLU 209 CB -0.0201 -0.0190 0.0247 1925 GLU 209 CG -0.0206 -0.0162 0.0252 1926 GLU 209 CD -0.0205 -0.0171 0.0252 1927 GLU 209 OE1 -0.0210 -0.0150 0.0256 1928 GLU 209 OE2 -0.0201 -0.0199 0.0248 1929 GLU 209 H -0.0175 -0.0166 0.0210 1930 GLU 210 N -0.0207 -0.0235 0.0260 1931 GLU 210 CA -0.0204 -0.0264 0.0258 1932 GLU 210 C -0.0184 -0.0277 0.0232 1933 GLU 210 O -0.0176 -0.0288 0.0223 1934 GLU 210 CB -0.0218 -0.0288 0.0278 1935 GLU 210 CG -0.0218 -0.0317 0.0281 1936 GLU 210 CD -0.0233 -0.0339 0.0303 1937 GLU 210 OE1 -0.0236 -0.0361 0.0309 1938 GLU 210 OE2 -0.0242 -0.0334 0.0315 1939 GLU 210 H -0.0217 -0.0235 0.0273 1940 ALA 211 N -0.0174 -0.0268 0.0223 1941 ALA 211 CA -0.0154 -0.0278 0.0199 1942 ALA 211 C -0.0140 -0.0260 0.0180 1943 ALA 211 O -0.0123 -0.0270 0.0161 1944 ALA 211 CB -0.0151 -0.0278 0.0195 1945 ALA 211 H -0.0181 -0.0258 0.0231 1946 GLY 212 N -0.0145 -0.0233 0.0186 1947 GLY 212 CA -0.0132 -0.0213 0.0170 1948 GLY 212 C -0.0133 -0.0181 0.0169 1949 GLY 212 O -0.0146 -0.0171 0.0185 1950 GLY 212 H -0.0158 -0.0226 0.0202 1951 VAL 213 N -0.0117 -0.0165 0.0156 1952 VAL 213 CA -0.0117 -0.0135 0.0151 1953 VAL 213 C -0.0114 -0.0130 0.0147 1954 VAL 213 O -0.0102 -0.0144 0.0136 1955 VAL 213 CB -0.0103 -0.0123 0.0133 1956 VAL 213 CG1 -0.0102 -0.0093 0.0127 1957 VAL 213 CG2 -0.0107 -0.0126 0.0139 1958 VAL 213 H -0.0108 -0.0174 0.0147 1959 THR 214 N -0.0124 -0.0108 0.0155 1960 THR 214 CA -0.0122 -0.0099 0.0151 1961 THR 214 C -0.0118 -0.0069 0.0142 1962 THR 214 O -0.0110 -0.0061 0.0132 1963 THR 214 CB -0.0140 -0.0102 0.0171 1964 THR 214 CG2 -0.0143 -0.0132 0.0180 1965 THR 214 OG1 -0.0156 -0.0088 0.0187 1966 THR 214 H -0.0134 -0.0098 0.0164 1967 THR 214 HG1 -0.0166 -0.0093 0.0199 1968 ALA 215 N -0.0124 -0.0056 0.0146 1969 ALA 215 CA -0.0122 -0.0029 0.0138 1970 ALA 215 C -0.0125 -0.0019 0.0138 1971 ALA 215 O -0.0132 -0.0030 0.0149 1972 ALA 215 CB -0.0136 -0.0013 0.0149 1973 ALA 215 H -0.0130 -0.0064 0.0154 1974 VAL 216 N -0.0121 0.0005 0.0128 1975 VAL 216 CA -0.0126 0.0020 0.0130 1976 VAL 216 C -0.0135 0.0047 0.0134 1977 VAL 216 O -0.0131 0.0057 0.0127 1978 VAL 216 CB -0.0109 0.0021 0.0112 1979 VAL 216 CG1 -0.0101 -0.0006 0.0109 1980 VAL 216 CG2 -0.0094 0.0033 0.0093 1981 VAL 216 H -0.0115 0.0013 0.0120 1982 GLU 217 N -0.0149 0.0057 0.0145 1983 GLU 217 CA -0.0157 0.0085 0.0145 1984 GLU 217 C -0.0148 0.0100 0.0130 1985 GLU 217 O -0.0148 0.0095 0.0132 1986 GLU 217 CB -0.0178 0.0091 0.0167 1987 GLU 217 CG -0.0188 0.0080 0.0183 1988 GLU 217 CD -0.0209 0.0087 0.0205 1989 GLU 217 OE1 -0.0218 0.0083 0.0217 1990 GLU 217 OE2 -0.0215 0.0093 0.0210 1991 GLU 217 H -0.0151 0.0048 0.0151 1992 VAL 218 N -0.0141 0.0119 0.0115 1993 VAL 218 CA -0.0133 0.0137 0.0100 1994 VAL 218 C -0.0144 0.0165 0.0103 1995 VAL 218 O -0.0153 0.0172 0.0111 1996 VAL 218 CB -0.0113 0.0133 0.0078 1997 VAL 218 CG1 -0.0102 0.0104 0.0075 1998 VAL 218 CG2 -0.0109 0.0142 0.0070 1999 VAL 218 H -0.0142 0.0122 0.0115 2000 ARG 219 N -0.0148 0.0183 0.0098 2001 ARG 219 CA -0.0160 0.0212 0.0097 2002 ARG 219 C -0.0150 0.0229 0.0077 2003 ARG 219 O -0.0145 0.0224 0.0075 2004 ARG 219 CB -0.0181 0.0216 0.0119 2005 ARG 219 CG -0.0196 0.0245 0.0120 2006 ARG 219 CD -0.0217 0.0249 0.0142 2007 ARG 219 NE -0.0226 0.0232 0.0162 2008 ARG 219 CZ -0.0242 0.0227 0.0182 2009 ARG 219 NH1 -0.0252 0.0237 0.0188 2010 ARG 219 NH2 -0.0249 0.0211 0.0198 2011 ARG 219 H -0.0142 0.0175 0.0094 2012 ARG 219 HE -0.0221 0.0227 0.0159 2013 ARG 219 HH11 -0.0248 0.0252 0.0176 2014 ARG 219 HH12 -0.0265 0.0235 0.0204 2015 ARG 219 HH21 -0.0262 0.0207 0.0214 2016 ARG 219 HH22 -0.0242 0.0203 0.0194 2017 HIS 220 N -0.0147 0.0249 0.0064 2018 HIS 220 CA -0.0140 0.0269 0.0046 2019 HIS 220 C -0.0157 0.0291 0.0054 2020 HIS 220 O -0.0175 0.0297 0.0071 2021 HIS 220 CB -0.0129 0.0281 0.0028 2022 HIS 220 CG -0.0116 0.0295 0.0006 2023 HIS 220 CD2 -0.0096 0.0283 -0.0011 2024 HIS 220 ND1 -0.0122 0.0322 -0.0001 2025 HIS 220 CE1 -0.0106 0.0327 -0.0021 2026 HIS 220 NE2 -0.0090 0.0304 -0.0028 2027 HIS 220 H -0.0151 0.0252 0.0067 2028 HIS 220 HD1 -0.0135 0.0336 0.0007 2029 PRO 221 N -0.0153 0.0304 0.0045 2030 PRO 221 CA -0.0170 0.0326 0.0052 2031 PRO 221 C -0.0182 0.0353 0.0051 2032 PRO 221 O -0.0170 0.0364 0.0034 2033 PRO 221 CB -0.0158 0.0335 0.0035 2034 PRO 221 CG -0.0139 0.0306 0.0029 2035 PRO 221 CD -0.0133 0.0294 0.0028 2036 GLY 222 N -0.0204 0.0364 0.0069 2037 GLY 222 CA -0.0218 0.0389 0.0072 2038 GLY 222 C -0.0225 0.0380 0.0083 2039 GLY 222 O -0.0242 0.0397 0.0092 2040 GLY 222 H -0.0212 0.0352 0.0083 2041 GLU 223 N -0.0209 0.0354 0.0085 2042 GLU 223 CA -0.0216 0.0343 0.0098 2043 GLU 223 C -0.0234 0.0332 0.0123 2044 GLU 223 O -0.0234 0.0319 0.0129 2045 GLU 223 CB -0.0198 0.0320 0.0089 2046 GLU 223 CG -0.0182 0.0332 0.0065 2047 GLU 223 CD -0.0164 0.0310 0.0055 2048 GLU 223 OE1 -0.0153 0.0319 0.0038 2049 GLU 223 OE2 -0.0161 0.0285 0.0063 2050 GLU 223 H -0.0197 0.0342 0.0078 2051 SER 224 N -0.0249 0.0338 0.0138 2052 SER 224 CA -0.0266 0.0326 0.0162 2053 SER 224 C -0.0259 0.0297 0.0169 2054 SER 224 O -0.0265 0.0279 0.0184 2055 SER 224 CB -0.0284 0.0344 0.0175 2056 SER 224 OG -0.0279 0.0347 0.0168 2057 SER 224 H -0.0249 0.0349 0.0132 2058 SER 224 HG -0.0279 0.0331 0.0176 2059 ASP 225 N -0.0245 0.0292 0.0158 2060 ASP 225 CA -0.0240 0.0267 0.0164 2061 ASP 225 C -0.0219 0.0247 0.0151 2062 ASP 225 O -0.0204 0.0255 0.0132 2063 ASP 225 CB -0.0241 0.0275 0.0161 2064 ASP 225 CG -0.0262 0.0294 0.0175 2065 ASP 225 OD1 -0.0278 0.0299 0.0188 2066 ASP 225 OD2 -0.0263 0.0303 0.0172 2067 ASP 225 H -0.0240 0.0308 0.0146 2068 SER 226 N -0.0218 0.0219 0.0161 2069 SER 226 CA -0.0198 0.0198 0.0150 2070 SER 226 C -0.0186 0.0189 0.0142 2071 SER 226 O -0.0197 0.0186 0.0154 2072 SER 226 CB -0.0201 0.0172 0.0165 2073 SER 226 OG -0.0218 0.0164 0.0186 2074 SER 226 H -0.0230 0.0213 0.0176 2075 SER 226 HG -0.0214 0.0158 0.0184 2076 GLN 227 N -0.0168 0.0182 0.0124 2077 GLN 227 CA -0.0158 0.0169 0.0116 2078 GLN 227 C -0.0153 0.0139 0.0121 2079 GLN 227 O -0.0148 0.0129 0.0118 2080 GLN 227 CB -0.0141 0.0180 0.0092 2081 GLN 227 CG -0.0129 0.0166 0.0083 2082 GLN 227 CD -0.0113 0.0178 0.0060 2083 GLN 227 NE2 -0.0100 0.0164 0.0049 2084 GLN 227 OE1 -0.0111 0.0199 0.0051 2085 GLN 227 H -0.0161 0.0185 0.0115 2086 GLN 227 HE21 -0.0089 0.0172 0.0034 2087 GLN 227 HE22 -0.0101 0.0146 0.0057 2088 GLU 228 N -0.0155 0.0124 0.0127 2089 GLU 228 CA -0.0148 0.0095 0.0129 2090 GLU 228 C -0.0128 0.0087 0.0108 2091 GLU 228 O -0.0122 0.0098 0.0097 2092 GLU 228 CB -0.0159 0.0082 0.0147 2093 GLU 228 CG -0.0155 0.0051 0.0152 2094 GLU 228 CD -0.0169 0.0039 0.0173 2095 GLU 228 OE1 -0.0166 0.0027 0.0173 2096 GLU 228 OE2 -0.0184 0.0043 0.0189 2097 GLU 228 H -0.0159 0.0132 0.0129 2098 LEU 229 N -0.0116 0.0069 0.0101 2099 LEU 229 CA -0.0097 0.0058 0.0083 2100 LEU 229 C -0.0094 0.0028 0.0089 2101 LEU 229 O -0.0099 0.0015 0.0098 2102 LEU 229 CB -0.0085 0.0066 0.0069 2103 LEU 229 CG -0.0065 0.0052 0.0051 2104 LEU 229 CD1 -0.0055 0.0058 0.0038 2105 LEU 229 CD2 -0.0055 0.0059 0.0038 2106 LEU 229 H -0.0122 0.0061 0.0110 2107 LEU 230 N -0.0087 0.0018 0.0084 2108 LEU 230 CA -0.0083 -0.0011 0.0087 2109 LEU 230 C -0.0066 -0.0024 0.0073 2110 LEU 230 O -0.0052 -0.0015 0.0055 2111 LEU 230 CB -0.0079 -0.0017 0.0085 2112 LEU 230 CG -0.0096 -0.0005 0.0099 2113 LEU 230 CD1 -0.0090 -0.0013 0.0095 2114 LEU 230 CD2 -0.0113 -0.0016 0.0121 2115 LEU 230 H -0.0083 0.0030 0.0076 2116 ALA 231 N -0.0066 -0.0040 0.0078 2117 ALA 231 CA -0.0052 -0.0055 0.0067 2118 ALA 231 C -0.0057 -0.0080 0.0081 2119 ALA 231 O -0.0073 -0.0081 0.0098 2120 ALA 231 CB -0.0050 -0.0040 0.0061 2121 ALA 231 H -0.0078 -0.0046 0.0092 2122 GLU 232 N -0.0044 -0.0101 0.0073 2123 GLU 232 CA -0.0047 -0.0127 0.0084 2124 GLU 232 C -0.0044 -0.0135 0.0083 2125 GLU 232 O -0.0050 -0.0152 0.0095 2126 GLU 232 CB -0.0035 -0.0147 0.0077 2127 GLU 232 CG -0.0040 -0.0142 0.0082 2128 GLU 232 CD -0.0028 -0.0162 0.0074 2129 GLU 232 OE1 -0.0029 -0.0185 0.0083 2130 GLU 232 OE2 -0.0015 -0.0155 0.0058 2131 GLU 232 H -0.0031 -0.0099 0.0058 2132 GLY 233 N -0.0032 -0.0119 0.0064 2133 GLY 233 CA -0.0027 -0.0123 0.0059 2134 GLY 233 C -0.0028 -0.0099 0.0056 2135 GLY 233 O -0.0024 -0.0080 0.0049 2136 GLY 233 H -0.0028 -0.0105 0.0057 2137 VAL 234 N -0.0033 -0.0099 0.0062 2138 VAL 234 CA -0.0034 -0.0078 0.0059 2139 VAL 234 C -0.0025 -0.0087 0.0051 2140 VAL 234 O -0.0031 -0.0102 0.0060 2141 VAL 234 CB -0.0052 -0.0067 0.0078 2142 VAL 234 CG1 -0.0052 -0.0044 0.0075 2143 VAL 234 CG2 -0.0061 -0.0059 0.0087 2144 VAL 234 H -0.0036 -0.0116 0.0068 2145 PHE 235 N -0.0008 -0.0075 0.0028 2146 PHE 235 CA 0.0001 -0.0080 0.0020 2147 PHE 235 C -0.0002 -0.0063 0.0020 2148 PHE 235 O 0.0000 -0.0045 0.0014 2149 PHE 235 CB 0.0019 -0.0085 0.0004 2150 PHE 235 CG 0.0023 -0.0104 0.0004 2151 PHE 235 CD1 0.0028 -0.0124 0.0003 2152 PHE 235 CD2 0.0020 -0.0103 0.0006 2153 PHE 235 CE1 0.0032 -0.0142 0.0003 2154 PHE 235 CE2 0.0024 -0.0121 0.0006 2155 PHE 235 CZ 0.0029 -0.0141 0.0005 2156 PHE 235 H -0.0004 -0.0064 0.0022 2157 VAL 236 N -0.0008 -0.0068 0.0028 2158 VAL 236 CA -0.0014 -0.0052 0.0030 2159 VAL 236 C -0.0005 -0.0054 0.0021 2160 VAL 236 O -0.0006 -0.0068 0.0025 2161 VAL 236 CB -0.0032 -0.0053 0.0048 2162 VAL 236 CG1 -0.0038 -0.0034 0.0050 2163 VAL 236 CG2 -0.0042 -0.0052 0.0057 2164 VAL 236 H -0.0010 -0.0083 0.0032 2165 TYR 237 N -0.0002 -0.0044 0.0005 2166 TYR 237 CA 0.0010 -0.0044 -0.0004 2167 TYR 237 C 0.0006 -0.0028 -0.0001 2168 TYR 237 O 0.0017 -0.0016 -0.0009 2169 TYR 237 CB 0.0027 -0.0043 -0.0016 2170 TYR 237 CG 0.0030 -0.0060 -0.0018 2171 TYR 237 CD1 0.0033 -0.0079 -0.0020 2172 TYR 237 CD2 0.0030 -0.0056 -0.0018 2173 TYR 237 CE1 0.0036 -0.0095 -0.0022 2174 TYR 237 CE2 0.0032 -0.0072 -0.0019 2175 TYR 237 CZ 0.0035 -0.0091 -0.0021 2176 TYR 237 OH 0.0037 -0.0106 -0.0022 2177 TYR 237 H -0.0002 -0.0032 0.0005 2178 TYR 237 HH 0.0045 -0.0115 -0.0028 2179 LEU 238 N -0.0009 -0.0027 0.0010 2180 LEU 238 CA -0.0014 -0.0014 0.0013 2181 LEU 238 C -0.0012 -0.0025 0.0012 2182 LEU 238 O -0.0016 -0.0042 0.0015 2183 LEU 238 CB -0.0032 -0.0007 0.0026 2184 LEU 238 CG -0.0034 0.0006 0.0027 2185 LEU 238 CD1 -0.0052 0.0010 0.0041 2186 LEU 238 CD2 -0.0026 0.0026 0.0021 2187 LEU 238 H -0.0016 -0.0037 0.0015 2188 GLN 239 N 0.0019 -0.0064 -0.0007 2189 GLN 239 CA 0.0028 -0.0059 -0.0022 2190 GLN 239 C 0.0038 -0.0055 -0.0019 2191 GLN 239 O 0.0042 -0.0054 -0.0005 2192 GLN 239 CB 0.0036 -0.0055 -0.0027 2193 GLN 239 CG 0.0025 -0.0059 -0.0032 2194 GLN 239 CD 0.0034 -0.0055 -0.0036 2195 GLN 239 NE2 0.0026 -0.0058 -0.0041 2196 GLN 239 OE1 0.0047 -0.0049 -0.0035 2197 GLN 239 H 0.0024 -0.0063 0.0002 2198 GLN 239 HE21 0.0032 -0.0056 -0.0044 2199 GLN 239 HE22 0.0015 -0.0064 -0.0043 2200 GLY 240 N 0.0043 -0.0051 -0.0032 2201 GLY 240 CA 0.0054 -0.0046 -0.0032 2202 GLY 240 C 0.0063 -0.0041 -0.0048 2203 GLY 240 O 0.0065 -0.0039 -0.0055 2204 GLY 240 H 0.0039 -0.0052 -0.0043 2205 SER 241 N 0.0083 -0.0096 -0.0067 2206 SER 241 CA 0.0088 -0.0093 -0.0074 2207 SER 241 C 0.0086 -0.0086 -0.0085 2208 SER 241 O 0.0093 -0.0085 -0.0093 2209 SER 241 CB 0.0100 -0.0099 -0.0074 2210 SER 241 OG 0.0106 -0.0100 -0.0076 2211 SER 241 H 0.0085 -0.0095 -0.0068 2212 SER 241 HG 0.0113 -0.0104 -0.0074 2213 LYS 242 N 0.0078 -0.0082 -0.0086 2214 LYS 242 CA 0.0075 -0.0075 -0.0096 2215 LYS 242 C 0.0065 -0.0070 -0.0098 2216 LYS 242 O 0.0057 -0.0071 -0.0091 2217 LYS 242 CB 0.0074 -0.0075 -0.0096 2218 LYS 242 CG 0.0084 -0.0079 -0.0096 2219 LYS 242 CD 0.0093 -0.0078 -0.0106 2220 LYS 242 CE 0.0103 -0.0082 -0.0106 2221 LYS 242 NZ 0.0111 -0.0080 -0.0116 2222 LYS 242 H 0.0072 -0.0083 -0.0080 2223 LYS 242 HZ1 0.0114 -0.0081 -0.0116 2224 LYS 242 HZ2 0.0118 -0.0082 -0.0117 2225 LYS 242 HZ3 0.0108 -0.0075 -0.0122 2226 PRO 243 N 0.0075 -0.0077 -0.0101 2227 PRO 243 CA 0.0070 -0.0068 -0.0097 2228 PRO 243 C 0.0069 -0.0063 -0.0097 2229 PRO 243 O 0.0074 -0.0062 -0.0103 2230 PRO 243 CB 0.0073 -0.0060 -0.0102 2231 PRO 243 CG 0.0077 -0.0068 -0.0105 2232 PRO 243 CD 0.0081 -0.0077 -0.0107 2233 ILE 244 N 0.0062 -0.0059 -0.0090 2234 ILE 244 CA 0.0060 -0.0053 -0.0089 2235 ILE 244 C 0.0060 -0.0041 -0.0091 2236 ILE 244 O 0.0055 -0.0036 -0.0086 2237 ILE 244 CB 0.0053 -0.0055 -0.0080 2238 ILE 244 CG1 0.0053 -0.0068 -0.0078 2239 ILE 244 CG2 0.0050 -0.0049 -0.0079 2240 ILE 244 CD1 0.0045 -0.0071 -0.0070 2241 ILE 244 H 0.0058 -0.0060 -0.0085 2242 THR 245 N 0.0072 -0.0038 -0.0098 2243 THR 245 CA 0.0077 -0.0015 -0.0101 2244 THR 245 C 0.0087 -0.0009 -0.0107 2245 THR 245 O 0.0094 0.0010 -0.0111 2246 THR 245 CB 0.0089 -0.0010 -0.0108 2247 THR 245 CG2 0.0079 -0.0012 -0.0102 2248 THR 245 OG1 0.0105 -0.0023 -0.0117 2249 THR 245 H 0.0082 -0.0049 -0.0104 2250 THR 245 HG1 0.0112 -0.0020 -0.0121 2251 ASP 246 N 0.0088 -0.0023 -0.0108 2252 ASP 246 CA 0.0097 -0.0019 -0.0113 2253 ASP 246 C 0.0089 0.0001 -0.0108 2254 ASP 246 O 0.0100 0.0014 -0.0114 2255 ASP 246 CB 0.0095 -0.0040 -0.0111 2256 ASP 246 CG 0.0075 -0.0048 -0.0100 2257 ASP 246 OD1 0.0066 -0.0053 -0.0095 2258 ASP 246 OD2 0.0068 -0.0050 -0.0096 2259 ASP 246 H 0.0080 -0.0036 -0.0103 2260 PHE 247 N 0.0100 0.0004 -0.0097 2261 PHE 247 CA 0.0095 0.0019 -0.0091 2262 PHE 247 C 0.0098 0.0033 -0.0092 2263 PHE 247 O 0.0096 0.0047 -0.0090 2264 PHE 247 CB 0.0081 0.0016 -0.0078 2265 PHE 247 CG 0.0075 0.0012 -0.0073 2266 PHE 247 CD1 0.0075 -0.0004 -0.0073 2267 PHE 247 CD2 0.0069 0.0024 -0.0066 2268 PHE 247 CE1 0.0069 -0.0007 -0.0068 2269 PHE 247 CE2 0.0063 0.0021 -0.0061 2270 PHE 247 CZ 0.0063 0.0006 -0.0062 2271 PHE 247 H 0.0095 -0.0006 -0.0093 2272 VAL 248 N 0.0102 0.0029 -0.0097 2273 VAL 248 CA 0.0105 0.0041 -0.0098 2274 VAL 248 C 0.0117 0.0050 -0.0109 2275 VAL 248 O 0.0119 0.0063 -0.0111 2276 VAL 248 CB 0.0104 0.0033 -0.0098 2277 VAL 248 CG1 0.0106 0.0046 -0.0099 2278 VAL 248 CG2 0.0092 0.0025 -0.0087 2279 VAL 248 H 0.0104 0.0017 -0.0099 2280 ALA 249 N 0.0124 0.0048 -0.0118 2281 ALA 249 CA 0.0135 0.0056 -0.0130 2282 ALA 249 C 0.0144 0.0063 -0.0138 2283 ALA 249 O 0.0149 0.0077 -0.0144 2284 ALA 249 CB 0.0131 0.0068 -0.0127 2285 ALA 249 H 0.0121 0.0037 -0.0115 2286 GLY 250 N 0.0145 0.0054 -0.0139 2287 GLY 250 CA 0.0153 0.0059 -0.0148 2288 GLY 250 C 0.0149 0.0076 -0.0144 2289 GLY 250 O 0.0157 0.0083 -0.0152 2290 GLY 250 H 0.0140 0.0043 -0.0134 2291 GLN 251 N 0.0141 0.0081 -0.0135 2292 GLN 251 CA 0.0138 0.0095 -0.0129 2293 GLN 251 C 0.0133 0.0094 -0.0125 2294 GLN 251 O 0.0132 0.0105 -0.0123 2295 GLN 251 CB 0.0129 0.0102 -0.0120 2296 GLN 251 CG 0.0134 0.0107 -0.0124 2297 GLN 251 CD 0.0124 0.0113 -0.0114 2298 GLN 251 NE2 0.0120 0.0104 -0.0111 2299 GLN 251 OE1 0.0121 0.0126 -0.0110 2300 GLN 251 H 0.0137 0.0076 -0.0131 2301 GLN 251 HE21 0.0122 0.0093 -0.0115 2302 GLN 251 HE22 0.0115 0.0108 -0.0106 2303 VAL 252 N 0.0131 0.0079 -0.0125 2304 VAL 252 CA 0.0128 0.0076 -0.0122 2305 VAL 252 C 0.0136 0.0066 -0.0131 2306 VAL 252 O 0.0142 0.0058 -0.0138 2307 VAL 252 CB 0.0115 0.0069 -0.0112 2308 VAL 252 CG1 0.0107 0.0078 -0.0103 2309 VAL 252 CG2 0.0114 0.0052 -0.0113 2310 VAL 252 H 0.0133 0.0070 -0.0128 2311 GLU 253 N 0.0130 0.0068 -0.0134 2312 GLU 253 CA 0.0136 0.0057 -0.0143 2313 GLU 253 C 0.0132 0.0040 -0.0141 2314 GLU 253 O 0.0122 0.0035 -0.0131 2315 GLU 253 CB 0.0136 0.0061 -0.0143 2316 GLU 253 CG 0.0144 0.0051 -0.0154 2317 GLU 253 CD 0.0145 0.0056 -0.0155 2318 GLU 253 OE1 0.0150 0.0048 -0.0162 2319 GLU 253 OE2 0.0143 0.0069 -0.0150 2320 GLU 253 H 0.0126 0.0075 -0.0128 2321 MET 254 N 0.0139 0.0031 -0.0151 2322 MET 254 CA 0.0136 0.0014 -0.0151 2323 MET 254 C 0.0141 0.0005 -0.0158 2324 MET 254 O 0.0149 0.0008 -0.0168 2325 MET 254 CB 0.0141 0.0010 -0.0157 2326 MET 254 CG 0.0137 0.0020 -0.0151 2327 MET 254 SD 0.0123 0.0018 -0.0135 2328 MET 254 CE 0.0121 -0.0002 -0.0135 2329 MET 254 H 0.0146 0.0035 -0.0159 2330 LYS 255 N 0.0128 -0.0010 -0.0159 2331 LYS 255 CA 0.0131 -0.0022 -0.0165 2332 LYS 255 C 0.0137 -0.0029 -0.0176 2333 LYS 255 O 0.0137 -0.0028 -0.0176 2334 LYS 255 CB 0.0124 -0.0033 -0.0156 2335 LYS 255 CG 0.0118 -0.0028 -0.0145 2336 LYS 255 CD 0.0112 -0.0041 -0.0138 2337 LYS 255 CE 0.0107 -0.0047 -0.0130 2338 LYS 255 NZ 0.0105 -0.0063 -0.0129 2339 LYS 255 H 0.0123 -0.0011 -0.0150 2340 LYS 255 HZ1 0.0109 -0.0069 -0.0137 2341 LYS 255 HZ2 0.0100 -0.0066 -0.0122 2342 LYS 255 HZ3 0.0103 -0.0066 -0.0127 2343 PRO 256 N 0.0142 -0.0037 -0.0186 2344 PRO 256 CA 0.0147 -0.0044 -0.0196 2345 PRO 256 C 0.0144 -0.0056 -0.0192 2346 PRO 256 O 0.0147 -0.0060 -0.0199 2347 PRO 256 CB 0.0151 -0.0052 -0.0204 2348 PRO 256 CG 0.0151 -0.0042 -0.0202 2349 PRO 256 CD 0.0143 -0.0037 -0.0188 2350 ASP 257 N 0.0133 -0.0066 -0.0178 2351 ASP 257 CA 0.0129 -0.0076 -0.0170 2352 ASP 257 C 0.0124 -0.0069 -0.0162 2353 ASP 257 O 0.0121 -0.0077 -0.0156 2354 ASP 257 CB 0.0126 -0.0086 -0.0162 2355 ASP 257 CG 0.0119 -0.0078 -0.0153 2356 ASP 257 OD1 0.0116 -0.0066 -0.0150 2357 ASP 257 OD2 0.0117 -0.0083 -0.0149 2358 ASP 257 H 0.0130 -0.0062 -0.0174 2359 GLY 258 N 0.0122 -0.0055 -0.0163 2360 GLY 258 CA 0.0117 -0.0047 -0.0156 2361 GLY 258 C 0.0108 -0.0043 -0.0144 2362 GLY 258 O 0.0103 -0.0036 -0.0137 2363 GLY 258 H 0.0125 -0.0049 -0.0168 2364 GLY 259 N 0.0112 -0.0047 -0.0141 2365 GLY 259 CA 0.0103 -0.0042 -0.0129 2366 GLY 259 C 0.0105 -0.0025 -0.0128 2367 GLY 259 O 0.0112 -0.0019 -0.0136 2368 GLY 259 H 0.0115 -0.0052 -0.0146 2369 VAL 260 N 0.0098 -0.0018 -0.0117 2370 VAL 260 CA 0.0097 -0.0003 -0.0114 2371 VAL 260 C 0.0097 -0.0003 -0.0114 2372 VAL 260 O 0.0092 -0.0012 -0.0109 2373 VAL 260 CB 0.0089 0.0004 -0.0103 2374 VAL 260 CG1 0.0089 0.0020 -0.0099 2375 VAL 260 CG2 0.0091 0.0006 -0.0104 2376 VAL 260 H 0.0092 -0.0023 -0.0111 2377 TRP 261 N 0.0109 0.0012 -0.0121 2378 TRP 261 CA 0.0109 0.0016 -0.0120 2379 TRP 261 C 0.0101 0.0025 -0.0110 2380 TRP 261 O 0.0099 0.0035 -0.0106 2381 TRP 261 CB 0.0119 0.0023 -0.0131 2382 TRP 261 CG 0.0120 0.0027 -0.0131 2383 TRP 261 CD1 0.0123 0.0019 -0.0136 2384 TRP 261 CD2 0.0117 0.0041 -0.0126 2385 TRP 261 CE2 0.0118 0.0040 -0.0128 2386 TRP 261 CE3 0.0112 0.0054 -0.0120 2387 TRP 261 NE1 0.0122 0.0026 -0.0134 2388 TRP 261 CZ2 0.0115 0.0051 -0.0124 2389 TRP 261 CZ3 0.0110 0.0065 -0.0115 2390 TRP 261 CH2 0.0111 0.0063 -0.0117 2391 TRP 261 H 0.0113 0.0019 -0.0124 2392 TRP 261 HE1 0.0124 0.0023 -0.0137 2393 VAL 262 N 0.0096 0.0021 -0.0104 2394 VAL 262 CA 0.0087 0.0030 -0.0094 2395 VAL 262 C 0.0088 0.0030 -0.0094 2396 VAL 262 O 0.0091 0.0020 -0.0099 2397 VAL 262 CB 0.0077 0.0024 -0.0083 2398 VAL 262 CG1 0.0076 0.0025 -0.0082 2399 VAL 262 CG2 0.0074 0.0007 -0.0082 2400 VAL 262 H 0.0098 0.0013 -0.0108 2401 ASP 263 N 0.0087 0.0042 -0.0089 2402 ASP 263 CA 0.0085 0.0044 -0.0087 2403 ASP 263 C 0.0075 0.0034 -0.0076 2404 ASP 263 O 0.0070 0.0025 -0.0071 2405 ASP 263 CB 0.0085 0.0061 -0.0085 2406 ASP 263 CG 0.0075 0.0070 -0.0074 2407 ASP 263 OD1 0.0067 0.0062 -0.0066 2408 ASP 263 OD2 0.0075 0.0085 -0.0073 2409 ASP 263 H 0.0084 0.0050 -0.0085 2410 GLU 264 N 0.0073 0.0036 -0.0073 2411 GLU 264 CA 0.0063 0.0028 -0.0064 2412 GLU 264 C 0.0052 0.0033 -0.0051 2413 GLU 264 O 0.0044 0.0025 -0.0043 2414 GLU 264 CB 0.0064 0.0031 -0.0064 2415 GLU 264 CG 0.0063 0.0049 -0.0063 2416 GLU 264 CD 0.0067 0.0053 -0.0066 2417 GLU 264 OE1 0.0063 0.0065 -0.0061 2418 GLU 264 OE2 0.0073 0.0044 -0.0073 2419 GLU 264 H 0.0077 0.0043 -0.0078 2420 MET 265 N 0.0053 0.0047 -0.0050 2421 MET 265 CA 0.0044 0.0053 -0.0039 2422 MET 265 C 0.0044 0.0049 -0.0040 2423 MET 265 O 0.0037 0.0055 -0.0032 2424 MET 265 CB 0.0044 0.0072 -0.0038 2425 MET 265 CG 0.0043 0.0076 -0.0037 2426 MET 265 SD 0.0040 0.0098 -0.0032 2427 MET 265 CE 0.0055 0.0106 -0.0046 2428 MET 265 H 0.0061 0.0052 -0.0058 2429 MET 266 N 0.0051 0.0038 -0.0048 2430 MET 266 CA 0.0053 0.0033 -0.0051 2431 MET 266 C 0.0058 0.0047 -0.0055 2432 MET 266 O 0.0058 0.0045 -0.0056 2433 MET 266 CB 0.0042 0.0024 -0.0040 2434 MET 266 CG 0.0038 0.0009 -0.0037 2435 MET 266 SD 0.0047 -0.0007 -0.0049 2436 MET 266 CE 0.0043 -0.0017 -0.0045 2437 MET 266 H 0.0056 0.0034 -0.0055 2438 GLN 267 N 0.0061 0.0060 -0.0057 2439 GLN 267 CA 0.0066 0.0074 -0.0061 2440 GLN 267 C 0.0078 0.0070 -0.0074 2441 GLN 267 O 0.0084 0.0065 -0.0081 2442 GLN 267 CB 0.0065 0.0090 -0.0058 2443 GLN 267 CG 0.0068 0.0104 -0.0060 2444 GLN 267 CD 0.0066 0.0120 -0.0056 2445 GLN 267 NE2 0.0063 0.0120 -0.0052 2446 GLN 267 OE1 0.0066 0.0133 -0.0055 2447 GLN 267 H 0.0062 0.0061 -0.0057 2448 GLN 267 HE21 0.0062 0.0131 -0.0050 2449 GLN 267 HE22 0.0063 0.0110 -0.0054 2450 THR 268 N 0.0082 0.0073 -0.0077 2451 THR 268 CA 0.0093 0.0072 -0.0090 2452 THR 268 C 0.0101 0.0086 -0.0096 2453 THR 268 O 0.0097 0.0097 -0.0092 2454 THR 268 CB 0.0094 0.0071 -0.0091 2455 THR 268 CG2 0.0086 0.0059 -0.0083 2456 THR 268 OG1 0.0092 0.0087 -0.0087 2457 THR 268 H 0.0077 0.0078 -0.0071 2458 THR 268 HG1 0.0085 0.0089 -0.0079 2459 SER 269 N 0.0109 0.0086 -0.0106 2460 SER 269 CA 0.0117 0.0100 -0.0113 2461 SER 269 C 0.0116 0.0115 -0.0108 2462 SER 269 O 0.0121 0.0127 -0.0111 2463 SER 269 CB 0.0128 0.0096 -0.0125 2464 SER 269 OG 0.0129 0.0094 -0.0126 2465 SER 269 H 0.0112 0.0078 -0.0111 2466 SER 269 HG 0.0132 0.0104 -0.0128 2467 VAL 270 N 0.0109 0.0115 -0.0100 2468 VAL 270 CA 0.0106 0.0129 -0.0095 2469 VAL 270 C 0.0096 0.0133 -0.0082 2470 VAL 270 O 0.0088 0.0124 -0.0075 2471 VAL 270 CB 0.0107 0.0127 -0.0095 2472 VAL 270 CG1 0.0104 0.0142 -0.0090 2473 VAL 270 CG2 0.0117 0.0124 -0.0108 2474 VAL 270 H 0.0105 0.0105 -0.0097 2475 PRO 271 N 0.0096 0.0150 -0.0080 2476 PRO 271 CA 0.0086 0.0155 -0.0069 2477 PRO 271 C 0.0077 0.0155 -0.0060 2478 PRO 271 O 0.0080 0.0160 -0.0061 2479 PRO 271 CB 0.0089 0.0172 -0.0069 2480 PRO 271 CG 0.0100 0.0172 -0.0082 2481 PRO 271 CD 0.0105 0.0161 -0.0089 2482 GLY 272 N 0.0067 0.0148 -0.0050 2483 GLY 272 CA 0.0058 0.0146 -0.0041 2484 GLY 272 C 0.0058 0.0131 -0.0043 2485 GLY 272 O 0.0052 0.0129 -0.0037 2486 GLY 272 H 0.0066 0.0143 -0.0050 2487 VAL 273 N 0.0065 0.0119 -0.0052 2488 VAL 273 CA 0.0066 0.0104 -0.0055 2489 VAL 273 C 0.0065 0.0090 -0.0056 2490 VAL 273 O 0.0072 0.0090 -0.0063 2491 VAL 273 CB 0.0076 0.0104 -0.0066 2492 VAL 273 CG1 0.0077 0.0089 -0.0067 2493 VAL 273 CG2 0.0078 0.0119 -0.0065 2494 VAL 273 H 0.0070 0.0121 -0.0058 2495 TRP 274 N 0.0057 0.0078 -0.0049 2496 TRP 274 CA 0.0055 0.0063 -0.0048 2497 TRP 274 C 0.0058 0.0048 -0.0053 2498 TRP 274 O 0.0057 0.0048 -0.0052 2499 TRP 274 CB 0.0043 0.0062 -0.0036 2500 TRP 274 CG 0.0040 0.0074 -0.0032 2501 TRP 274 CD1 0.0039 0.0070 -0.0031 2502 TRP 274 CD2 0.0038 0.0090 -0.0028 2503 TRP 274 CE2 0.0037 0.0097 -0.0026 2504 TRP 274 CE3 0.0038 0.0101 -0.0026 2505 TRP 274 NE1 0.0037 0.0084 -0.0028 2506 TRP 274 CZ2 0.0035 0.0113 -0.0022 2507 TRP 274 CZ3 0.0035 0.0117 -0.0022 2508 TRP 274 CH2 0.0034 0.0123 -0.0020 2509 TRP 274 H 0.0052 0.0079 -0.0043 2510 TRP 274 HE1 0.0037 0.0084 -0.0027 2511 GLY 275 N 0.0058 0.0034 -0.0057 2512 GLY 275 CA 0.0059 0.0019 -0.0061 2513 GLY 275 C 0.0053 0.0005 -0.0056 2514 GLY 275 O 0.0054 0.0003 -0.0057 2515 GLY 275 H 0.0058 0.0034 -0.0057 2516 ILE 276 N 0.0047 -0.0004 -0.0049 2517 ILE 276 CA 0.0039 -0.0016 -0.0042 2518 ILE 276 C 0.0039 -0.0032 -0.0043 2519 ILE 276 O 0.0041 -0.0033 -0.0045 2520 ILE 276 CB 0.0029 -0.0011 -0.0029 2521 ILE 276 CG1 0.0024 -0.0006 -0.0024 2522 ILE 276 CG2 0.0028 0.0003 -0.0027 2523 ILE 276 CD1 0.0013 -0.0002 -0.0010 2524 ILE 276 H 0.0046 -0.0003 -0.0049 2525 GLY 277 N 0.0037 -0.0045 -0.0042 2526 GLY 277 CA 0.0036 -0.0059 -0.0042 2527 GLY 277 C 0.0046 -0.0064 -0.0054 2528 GLY 277 O 0.0053 -0.0059 -0.0063 2529 GLY 277 H 0.0036 -0.0044 -0.0042 2530 ASP 278 N 0.0046 -0.0074 -0.0054 2531 ASP 278 CA 0.0054 -0.0082 -0.0065 2532 ASP 278 C 0.0062 -0.0072 -0.0074 2533 ASP 278 O 0.0070 -0.0076 -0.0085 2534 ASP 278 CB 0.0052 -0.0094 -0.0062 2535 ASP 278 CG 0.0046 -0.0106 -0.0054 2536 ASP 278 OD1 0.0047 -0.0109 -0.0055 2537 ASP 278 OD2 0.0041 -0.0112 -0.0048 2538 ASP 278 H 0.0040 -0.0078 -0.0047 2539 ILE 279 N 0.0059 -0.0060 -0.0072 2540 ILE 279 CA 0.0066 -0.0050 -0.0081 2541 ILE 279 C 0.0074 -0.0046 -0.0089 2542 ILE 279 O 0.0082 -0.0043 -0.0099 2543 ILE 279 CB 0.0061 -0.0036 -0.0075 2544 ILE 279 CG1 0.0068 -0.0028 -0.0083 2545 ILE 279 CG2 0.0058 -0.0025 -0.0072 2546 ILE 279 CD1 0.0064 -0.0013 -0.0079 2547 ILE 279 H 0.0052 -0.0057 -0.0064 2548 ARG 280 N 0.0071 -0.0048 -0.0086 2549 ARG 280 CA 0.0077 -0.0047 -0.0093 2550 ARG 280 C 0.0085 -0.0060 -0.0101 2551 ARG 280 O 0.0091 -0.0060 -0.0109 2552 ARG 280 CB 0.0071 -0.0046 -0.0086 2553 ARG 280 CG 0.0065 -0.0032 -0.0079 2554 ARG 280 CD 0.0057 -0.0034 -0.0071 2555 ARG 280 NE 0.0062 -0.0035 -0.0076 2556 ARG 280 CZ 0.0060 -0.0043 -0.0073 2557 ARG 280 NH1 0.0052 -0.0052 -0.0065 2558 ARG 280 NH2 0.0064 -0.0042 -0.0078 2559 ARG 280 H 0.0064 -0.0051 -0.0078 2560 ARG 280 HE 0.0067 -0.0027 -0.0082 2561 ARG 280 HH11 0.0049 -0.0055 -0.0061 2562 ARG 280 HH12 0.0048 -0.0052 -0.0060 2563 ARG 280 HH21 0.0069 -0.0034 -0.0084 2564 ARG 280 HH22 0.0062 -0.0048 -0.0076 2565 ASN 281 N 0.0082 -0.0069 -0.0101 2566 ASN 281 CA 0.0088 -0.0083 -0.0107 2567 ASN 281 C 0.0090 -0.0092 -0.0109 2568 ASN 281 O 0.0097 -0.0098 -0.0118 2569 ASN 281 CB 0.0096 -0.0080 -0.0119 2570 ASN 281 CG 0.0100 -0.0093 -0.0123 2571 ASN 281 ND2 0.0108 -0.0093 -0.0134 2572 ASN 281 OD1 0.0096 -0.0104 -0.0117 2573 ASN 281 H 0.0077 -0.0068 -0.0094 2574 ASN 281 HD21 0.0112 -0.0084 -0.0140 2575 ASN 281 HD22 0.0111 -0.0102 -0.0137 2576 THR 282 N 0.0083 -0.0091 -0.0101 2577 THR 282 CA 0.0084 -0.0101 -0.0101 2578 THR 282 C 0.0084 -0.0117 -0.0100 2579 THR 282 O 0.0082 -0.0120 -0.0096 2580 THR 282 CB 0.0077 -0.0097 -0.0092 2581 THR 282 CG2 0.0077 -0.0081 -0.0092 2582 THR 282 OG1 0.0069 -0.0101 -0.0080 2583 THR 282 H 0.0078 -0.0086 -0.0093 2584 THR 282 HG1 0.0065 -0.0096 -0.0075 2585 PRO 283 N 0.0088 -0.0127 -0.0104 2586 PRO 283 CA 0.0087 -0.0143 -0.0101 2587 PRO 283 C 0.0076 -0.0148 -0.0088 2588 PRO 283 O 0.0074 -0.0161 -0.0085 2589 PRO 283 CB 0.0093 -0.0151 -0.0108 2590 PRO 283 CG 0.0100 -0.0138 -0.0117 2591 PRO 283 CD 0.0094 -0.0123 -0.0111 2592 PHE 284 N 0.0069 -0.0139 -0.0081 2593 PHE 284 CA 0.0058 -0.0142 -0.0068 2594 PHE 284 C 0.0051 -0.0139 -0.0060 2595 PHE 284 O 0.0044 -0.0129 -0.0052 2596 PHE 284 CB 0.0055 -0.0134 -0.0065 2597 PHE 284 CG 0.0063 -0.0135 -0.0074 2598 PHE 284 CD1 0.0065 -0.0150 -0.0076 2599 PHE 284 CD2 0.0068 -0.0122 -0.0081 2600 PHE 284 CE1 0.0072 -0.0151 -0.0084 2601 PHE 284 CE2 0.0075 -0.0123 -0.0089 2602 PHE 284 CZ 0.0077 -0.0138 -0.0091 2603 PHE 284 H 0.0071 -0.0128 -0.0084 2604 LYS 285 N 0.0052 -0.0143 -0.0061 2605 LYS 285 CA 0.0048 -0.0141 -0.0056 2606 LYS 285 C 0.0037 -0.0149 -0.0045 2607 LYS 285 O 0.0036 -0.0162 -0.0045 2608 LYS 285 CB 0.0055 -0.0144 -0.0064 2609 LYS 285 CG 0.0066 -0.0136 -0.0074 2610 LYS 285 CD 0.0072 -0.0140 -0.0082 2611 LYS 285 CE 0.0081 -0.0129 -0.0091 2612 LYS 285 NZ 0.0089 -0.0130 -0.0099 2613 LYS 285 H 0.0058 -0.0151 -0.0068 2614 LYS 285 HZ1 0.0091 -0.0140 -0.0102 2615 LYS 285 HZ2 0.0095 -0.0122 -0.0105 2616 LYS 285 HZ3 0.0086 -0.0126 -0.0095 2617 GLN 286 N 0.0029 -0.0141 -0.0036 2618 GLN 286 CA 0.0019 -0.0147 -0.0025 2619 GLN 286 C 0.0011 -0.0135 -0.0016 2620 GLN 286 O 0.0014 -0.0122 -0.0017 2621 GLN 286 CB 0.0018 -0.0151 -0.0025 2622 GLN 286 CG 0.0024 -0.0164 -0.0032 2623 GLN 286 CD 0.0019 -0.0179 -0.0029 2624 GLN 286 NE2 0.0024 -0.0190 -0.0036 2625 GLN 286 OE1 0.0009 -0.0180 -0.0019 2626 GLN 286 H 0.0031 -0.0131 -0.0037 2627 GLN 286 HE21 0.0020 -0.0200 -0.0032 2628 GLN 286 HE22 0.0032 -0.0190 -0.0044 2629 ALA 287 N 0.0004 -0.0141 -0.0008 2630 ALA 287 CA -0.0003 -0.0130 0.0002 2631 ALA 287 C -0.0006 -0.0121 0.0008 2632 ALA 287 O -0.0007 -0.0107 0.0009 2633 ALA 287 CB -0.0010 -0.0138 0.0012 2634 ALA 287 H 0.0003 -0.0152 -0.0007 2635 VAL 288 N -0.0008 -0.0129 0.0010 2636 VAL 288 CA -0.0012 -0.0122 0.0015 2637 VAL 288 C -0.0004 -0.0112 0.0006 2638 VAL 288 O -0.0006 -0.0100 0.0010 2639 VAL 288 CB -0.0016 -0.0135 0.0020 2640 VAL 288 CG1 -0.0009 -0.0145 0.0009 2641 VAL 288 CG2 -0.0021 -0.0128 0.0027 2642 VAL 288 H -0.0008 -0.0141 0.0008 2643 VAL 289 N 0.0005 -0.0115 -0.0006 2644 VAL 289 CA 0.0013 -0.0105 -0.0016 2645 VAL 289 C 0.0014 -0.0091 -0.0016 2646 VAL 289 O 0.0015 -0.0078 -0.0016 2647 VAL 289 CB 0.0023 -0.0114 -0.0028 2648 VAL 289 CG1 0.0031 -0.0103 -0.0037 2649 VAL 289 CG2 0.0022 -0.0127 -0.0027 2650 VAL 289 H 0.0007 -0.0125 -0.0009 2651 ALA 290 N 0.0013 -0.0093 -0.0015 2652 ALA 290 CA 0.0013 -0.0081 -0.0015 2653 ALA 290 C 0.0004 -0.0071 -0.0004 2654 ALA 290 O 0.0006 -0.0057 -0.0005 2655 ALA 290 CB 0.0013 -0.0088 -0.0015 2656 ALA 290 H 0.0013 -0.0104 -0.0015 2657 ALA 291 N -0.0005 -0.0077 0.0007 2658 ALA 291 CA -0.0014 -0.0068 0.0018 2659 ALA 291 C -0.0012 -0.0059 0.0016 2660 ALA 291 O -0.0014 -0.0045 0.0020 2661 ALA 291 CB -0.0023 -0.0080 0.0028 2662 ALA 291 H -0.0006 -0.0089 0.0007 2663 GLY 292 N -0.0008 -0.0066 0.0011 2664 GLY 292 CA -0.0006 -0.0058 0.0008 2665 GLY 292 C 0.0002 -0.0044 0.0001 2666 GLY 292 O -0.0001 -0.0032 0.0004 2667 GLY 292 H -0.0007 -0.0078 0.0009 2668 ASP 293 N 0.0009 -0.0046 -0.0009 2669 ASP 293 CA 0.0016 -0.0032 -0.0016 2670 ASP 293 C 0.0011 -0.0019 -0.0008 2671 ASP 293 O 0.0012 -0.0005 -0.0009 2672 ASP 293 CB 0.0024 -0.0037 -0.0026 2673 ASP 293 CG 0.0033 -0.0047 -0.0037 2674 ASP 293 OD1 0.0033 -0.0049 -0.0038 2675 ASP 293 OD2 0.0039 -0.0052 -0.0045 2676 ASP 293 H 0.0011 -0.0056 -0.0011 2677 GLY 294 N 0.0004 -0.0023 -0.0000 2678 GLY 294 CA -0.0002 -0.0012 0.0008 2679 GLY 294 C -0.0009 -0.0003 0.0016 2680 GLY 294 O -0.0010 0.0011 0.0018 2681 GLY 294 H 0.0002 -0.0035 0.0000 2682 CYS 295 N -0.0015 -0.0009 0.0022 2683 CYS 295 CA -0.0021 -0.0002 0.0030 2684 CYS 295 C -0.0014 0.0010 0.0023 2685 CYS 295 O -0.0017 0.0024 0.0028 2686 CYS 295 CB -0.0027 -0.0015 0.0035 2687 CYS 295 SG -0.0036 -0.0006 0.0046 2688 CYS 295 H -0.0014 -0.0021 0.0019 2689 ILE 296 N -0.0005 0.0006 0.0012 2690 ILE 296 CA 0.0002 0.0016 0.0005 2691 ILE 296 C 0.0006 0.0031 0.0002 2692 ILE 296 O 0.0006 0.0045 0.0004 2693 ILE 296 CB 0.0012 0.0007 -0.0007 2694 ILE 296 CG1 0.0008 -0.0006 -0.0004 2695 ILE 296 CG2 0.0021 0.0018 -0.0016 2696 ILE 296 CD1 0.0017 -0.0018 -0.0015 2697 ILE 296 H -0.0003 -0.0006 0.0009 2698 ALA 297 N 0.0009 0.0029 -0.0002 2699 ALA 297 CA 0.0012 0.0043 -0.0005 2700 ALA 297 C 0.0003 0.0054 0.0007 2701 ALA 297 O 0.0005 0.0069 0.0006 2702 ALA 297 CB 0.0017 0.0036 -0.0010 2703 ALA 297 H 0.0009 0.0018 -0.0004 2704 ALA 298 N -0.0007 0.0047 0.0017 2705 ALA 298 CA -0.0016 0.0057 0.0028 2706 ALA 298 C -0.0018 0.0068 0.0032 2707 ALA 298 O -0.0020 0.0082 0.0035 2708 ALA 298 CB -0.0026 0.0046 0.0038 2709 ALA 298 H -0.0008 0.0035 0.0017 2710 MET 299 N -0.0018 0.0062 0.0031 2711 MET 299 CA -0.0020 0.0072 0.0034 2712 MET 299 C -0.0010 0.0085 0.0024 2713 MET 299 O -0.0012 0.0098 0.0027 2714 MET 299 CB -0.0020 0.0060 0.0033 2715 MET 299 CG -0.0030 0.0048 0.0044 2716 MET 299 SD -0.0031 0.0036 0.0044 2717 MET 299 CE -0.0042 0.0047 0.0056 2718 MET 299 H -0.0017 0.0050 0.0029 2719 ALA 300 N -0.0000 0.0081 0.0013 2720 ALA 300 CA 0.0009 0.0093 0.0003 2721 ALA 300 C 0.0008 0.0106 0.0005 2722 ALA 300 O 0.0011 0.0121 0.0004 2723 ALA 300 CB 0.0020 0.0083 -0.0009 2724 ALA 300 H 0.0001 0.0069 0.0011 2725 ILE 301 N 0.0005 0.0103 0.0009 2726 ILE 301 CA 0.0003 0.0114 0.0012 2727 ILE 301 C -0.0007 0.0126 0.0023 2728 ILE 301 O -0.0005 0.0141 0.0023 2729 ILE 301 CB -0.0000 0.0104 0.0015 2730 ILE 301 CG1 0.0011 0.0097 0.0003 2731 ILE 301 CG2 -0.0005 0.0116 0.0021 2732 ILE 301 CD1 0.0008 0.0082 0.0005 2733 ILE 301 H 0.0003 0.0091 0.0010 2734 ASP 302 N -0.0017 0.0120 0.0033 2735 ASP 302 CA -0.0026 0.0130 0.0043 2736 ASP 302 C -0.0021 0.0143 0.0039 2737 ASP 302 O -0.0023 0.0158 0.0042 2738 ASP 302 CB -0.0036 0.0120 0.0053 2739 ASP 302 CG -0.0045 0.0131 0.0063 2740 ASP 302 OD1 -0.0047 0.0130 0.0066 2741 ASP 302 OD2 -0.0050 0.0141 0.0069 2742 ASP 302 H -0.0018 0.0107 0.0033 2743 ARG 303 N -0.0014 0.0139 0.0031 2744 ARG 303 CA -0.0009 0.0150 0.0027 2745 ARG 303 C -0.0001 0.0163 0.0020 2746 ARG 303 O -0.0001 0.0177 0.0021 2747 ARG 303 CB -0.0003 0.0140 0.0020 2748 ARG 303 CG 0.0002 0.0150 0.0016 2749 ARG 303 CD 0.0010 0.0141 0.0007 2750 ARG 303 NE 0.0015 0.0151 0.0003 2751 ARG 303 CZ 0.0024 0.0148 -0.0007 2752 ARG 303 NH1 0.0029 0.0135 -0.0013 2753 ARG 303 NH2 0.0028 0.0158 -0.0010 2754 ARG 303 H -0.0014 0.0127 0.0029 2755 ARG 303 HE 0.0011 0.0162 0.0007 2756 ARG 303 HH11 0.0036 0.0133 -0.0021 2757 ARG 303 HH12 0.0027 0.0127 -0.0012 2758 ARG 303 HH21 0.0035 0.0156 -0.0017 2759 ARG 303 HH22 0.0024 0.0168 -0.0005 2760 PHE 304 N 0.0006 0.0158 0.0012 2761 PHE 304 CA 0.0015 0.0168 0.0005 2762 PHE 304 C 0.0009 0.0180 0.0011 2763 PHE 304 O 0.0013 0.0195 0.0010 2764 PHE 304 CB 0.0022 0.0157 -0.0004 2765 PHE 304 CG 0.0031 0.0166 -0.0012 2766 PHE 304 CD1 0.0029 0.0169 -0.0010 2767 PHE 304 CD2 0.0041 0.0172 -0.0022 2768 PHE 304 CE1 0.0037 0.0177 -0.0018 2769 PHE 304 CE2 0.0050 0.0180 -0.0030 2770 PHE 304 CZ 0.0048 0.0183 -0.0028 2771 PHE 304 H 0.0006 0.0146 0.0012 2772 LEU 305 N 0.0001 0.0177 0.0020 2773 LEU 305 CA -0.0005 0.0187 0.0026 2774 LEU 305 C -0.0013 0.0198 0.0036 2775 LEU 305 O -0.0014 0.0213 0.0038 2776 LEU 305 CB -0.0011 0.0176 0.0032 2777 LEU 305 CG -0.0003 0.0167 0.0023 2778 LEU 305 CD1 -0.0010 0.0158 0.0029 2779 LEU 305 CD2 0.0006 0.0179 0.0015 2780 LEU 305 H -0.0002 0.0164 0.0021 2781 ASN 306 N -0.0020 0.0192 0.0042 2782 ASN 306 CA -0.0029 0.0202 0.0052 2783 ASN 306 C -0.0024 0.0211 0.0048 2784 ASN 306 O -0.0031 0.0218 0.0055 2785 ASN 306 CB -0.0040 0.0191 0.0062 2786 ASN 306 CG -0.0046 0.0186 0.0068 2787 ASN 306 ND2 -0.0052 0.0172 0.0072 2788 ASN 306 OD1 -0.0047 0.0196 0.0069 2789 ASN 306 H -0.0019 0.0181 0.0040 2790 ASN 306 HD21 -0.0051 0.0162 0.0070 2791 ASN 306 HD22 -0.0056 0.0169 0.0076 2792 SER 307 N -0.0013 0.0214 0.0038 2793 SER 307 CA -0.0007 0.0224 0.0033 2794 SER 307 C -0.0014 0.0220 0.0040 2795 SER 307 O -0.0014 0.0231 0.0041 2796 SER 307 CB -0.0005 0.0244 0.0034 2797 SER 307 OG 0.0003 0.0248 0.0027 2798 SER 307 H -0.0007 0.0206 0.0032 2799 SER 307 HG -0.0000 0.0240 0.0030 2800 FAD 318 P 0.0025 -0.0081 -0.0026 2801 FAD 318 PA 0.0023 -0.0092 -0.0025 2802 FAD 318 O1P 0.0019 -0.0072 -0.0017 2803 FAD 318 O2P 0.0031 -0.0075 -0.0033 2804 FAD 318 O3P 0.0029 -0.0087 -0.0031 2805 FAD 318 C5' 0.0024 -0.0104 -0.0029 2806 FAD 318 O5' 0.0020 -0.0094 -0.0022 2807 FAD 318 C4' 0.0018 -0.0117 -0.0023 2808 FAD 318 O4' 0.0013 -0.0118 -0.0017 2809 FAD 318 C3' 0.0023 -0.0130 -0.0030 2810 FAD 318 O3' 0.0027 -0.0129 -0.0035 2811 FAD 318 C2' 0.0017 -0.0142 -0.0025 2812 FAD 318 O2' 0.0013 -0.0144 -0.0021 2813 FAD 318 C1' 0.0021 -0.0155 -0.0032 2814 FAD 318 C1B 0.0028 -0.0048 -0.0025 2815 FAD 318 N1 0.0007 -0.0168 -0.0016 2816 FAD 318 N1A 0.0044 -0.0012 -0.0040 2817 FAD 318 O1A 0.0016 -0.0101 -0.0018 2818 FAD 318 C2 0.0001 -0.0173 -0.0010 2819 FAD 318 C2A 0.0037 -0.0012 -0.0031 2820 FAD 318 C2B 0.0025 -0.0062 -0.0024 2821 FAD 318 O2 -0.0001 -0.0167 -0.0006 2822 FAD 318 O2A 0.0029 -0.0097 -0.0033 2823 FAD 318 O2B 0.0023 -0.0063 -0.0021 2824 FAD 318 C3B 0.0018 -0.0067 -0.0016 2825 FAD 318 N3 -0.0003 -0.0185 -0.0007 2826 FAD 318 N3A 0.0034 -0.0022 -0.0029 2827 FAD 318 O3B 0.0011 -0.0063 -0.0005 2828 FAD 318 C4 0.0000 -0.0191 -0.0011 2829 FAD 318 C4A 0.0038 -0.0032 -0.0035 2830 FAD 318 C4B 0.0021 -0.0061 -0.0018 2831 FAD 318 C4X 0.0006 -0.0185 -0.0018 2832 FAD 318 O4 -0.0004 -0.0202 -0.0008 2833 FAD 318 O4B 0.0026 -0.0049 -0.0023 2834 FAD 318 C5A 0.0045 -0.0032 -0.0045 2835 FAD 318 C5B 0.0026 -0.0069 -0.0026 2836 FAD 318 C5X 0.0015 -0.0186 -0.0028 2837 FAD 318 N5 0.0009 -0.0191 -0.0022 2838 FAD 318 O5B 0.0020 -0.0079 -0.0020 2839 FAD 318 C6 0.0016 -0.0192 -0.0031 2840 FAD 318 C6A 0.0048 -0.0022 -0.0047 2841 FAD 318 N6A 0.0056 -0.0022 -0.0057 2842 FAD 318 C7 0.0022 -0.0186 -0.0038 2843 FAD 318 C7M 0.0024 -0.0193 -0.0041 2844 FAD 318 N7A 0.0048 -0.0043 -0.0050 2845 FAD 318 C8 0.0027 -0.0174 -0.0041 2846 FAD 318 C8A 0.0043 -0.0049 -0.0044 2847 FAD 318 C8M 0.0033 -0.0167 -0.0048 2848 FAD 318 C9 0.0025 -0.0167 -0.0038 2849 FAD 318 C9A 0.0019 -0.0173 -0.0032 2850 FAD 318 N9A 0.0036 -0.0042 -0.0034 2851 FAD 318 C10 0.0010 -0.0173 -0.0020 2852 FAD 318 N10 0.0017 -0.0167 -0.0028 2853 FAD 318 HN3 -0.0007 -0.0190 -0.0002 2854 FAD 318 HO2 0.0012 -0.0135 -0.0018 2855 FAD 318 HO2B 0.0018 -0.0058 -0.0014 2856 FAD 318 HO3 0.0032 -0.0125 -0.0042 2857 FAD 318 HO3A 0.0011 -0.0058 -0.0005 2858 FAD 318 HO4 0.0014 -0.0109 -0.0017 2859 FAD 318 H61A 0.0059 -0.0014 -0.0059 2860 FAD 318 H62A 0.0060 -0.0029 -0.0062