1 MET 1 N -0.0274 0.0548 -0.0282 2 MET 1 CA -0.0279 0.0216 -0.0363 3 MET 1 C -0.0052 0.0028 -0.0155 4 MET 1 CB -0.0392 0.0162 -0.0500 5 MET 1 O -0.0018 -0.0237 -0.0177 6 MET 1 CG -0.0634 0.0263 -0.0745 7 MET 1 SD -0.0768 0.0133 -0.0922 8 MET 1 CE -0.1045 0.0304 -0.1189 9 ALA 2 N 0.0007 -0.0024 -0.0123 10 ALA 2 CA 0.0039 -0.0042 -0.0101 11 ALA 2 C 0.0042 -0.0047 -0.0100 12 ALA 2 CB 0.0057 -0.0018 -0.0069 13 ALA 2 O 0.0061 -0.0076 -0.0098 14 GLU 3 N 0.0035 -0.0023 -0.0153 15 GLU 3 CA 0.0058 -0.0036 -0.0136 16 GLU 3 C 0.0043 -0.0064 -0.0122 17 GLU 3 CB 0.0073 -0.0019 -0.0143 18 GLU 3 O 0.0057 -0.0083 -0.0104 19 GLU 3 CG 0.0094 0.0007 -0.0153 20 GLU 3 CD 0.0107 0.0024 -0.0161 21 GLU 3 OE1 0.0132 0.0021 -0.0151 22 GLU 3 OE2 0.0092 0.0042 -0.0178 23 ALA 4 N 0.0025 -0.0069 -0.0128 24 ALA 4 CA 0.0013 -0.0090 -0.0125 25 ALA 4 C 0.0022 -0.0097 -0.0127 26 ALA 4 CB -0.0015 -0.0085 -0.0118 27 ALA 4 O 0.0026 -0.0119 -0.0128 28 LEU 5 N 0.0042 -0.0113 -0.0136 29 LEU 5 CA 0.0049 -0.0120 -0.0136 30 LEU 5 C 0.0050 -0.0120 -0.0130 31 LEU 5 CB 0.0053 -0.0124 -0.0132 32 LEU 5 O 0.0053 -0.0125 -0.0133 33 LEU 5 CG 0.0060 -0.0132 -0.0132 34 LEU 5 CD1 0.0060 -0.0136 -0.0141 35 LEU 5 CD2 0.0064 -0.0135 -0.0127 36 PHE 6 N 0.0061 -0.0107 -0.0106 37 PHE 6 CA 0.0058 -0.0105 -0.0097 38 PHE 6 C 0.0053 -0.0098 -0.0104 39 PHE 6 CB 0.0052 -0.0099 -0.0086 40 PHE 6 O 0.0055 -0.0100 -0.0103 41 PHE 6 CG 0.0049 -0.0097 -0.0075 42 PHE 6 CD1 0.0042 -0.0088 -0.0076 43 PHE 6 CD2 0.0053 -0.0105 -0.0065 44 PHE 6 CE1 0.0040 -0.0086 -0.0066 45 PHE 6 CE2 0.0051 -0.0103 -0.0056 46 PHE 6 CZ 0.0044 -0.0094 -0.0056 47 LYS 7 N 0.0052 -0.0098 -0.0117 48 LYS 7 CA 0.0054 -0.0091 -0.0113 49 LYS 7 C 0.0053 -0.0090 -0.0111 50 LYS 7 CB 0.0061 -0.0088 -0.0116 51 LYS 7 O 0.0052 -0.0086 -0.0107 52 LYS 7 CG 0.0062 -0.0087 -0.0117 53 LYS 7 CD 0.0069 -0.0083 -0.0119 54 LYS 7 CE 0.0070 -0.0082 -0.0120 55 LYS 7 NZ 0.0076 -0.0077 -0.0122 56 GLU 8 N 0.0051 -0.0087 -0.0121 57 GLU 8 CA 0.0059 -0.0081 -0.0126 58 GLU 8 C 0.0056 -0.0078 -0.0129 59 GLU 8 CB 0.0070 -0.0084 -0.0124 60 GLU 8 O 0.0057 -0.0071 -0.0134 61 GLU 8 CG 0.0079 -0.0078 -0.0129 62 GLU 8 CD 0.0090 -0.0081 -0.0127 63 GLU 8 OE1 0.0095 -0.0085 -0.0124 64 GLU 8 OE2 0.0094 -0.0079 -0.0128 65 ILE 9 N 0.0068 -0.0074 -0.0108 66 ILE 9 CA 0.0066 -0.0075 -0.0106 67 ILE 9 C 0.0059 -0.0070 -0.0104 68 ILE 9 CB 0.0066 -0.0082 -0.0102 69 ILE 9 O 0.0057 -0.0068 -0.0104 70 ILE 9 CG1 0.0072 -0.0087 -0.0104 71 ILE 9 CG2 0.0063 -0.0084 -0.0099 72 ILE 9 CD1 0.0072 -0.0095 -0.0100 73 ASP 10 N 0.0054 -0.0084 -0.0096 74 ASP 10 CA 0.0047 -0.0082 -0.0098 75 ASP 10 C 0.0046 -0.0077 -0.0103 76 ASP 10 CB 0.0041 -0.0086 -0.0094 77 ASP 10 O 0.0043 -0.0076 -0.0104 78 ASP 10 CG 0.0034 -0.0084 -0.0095 79 ASP 10 OD1 0.0032 -0.0082 -0.0098 80 ASP 10 OD2 0.0029 -0.0086 -0.0094 81 VAL 11 N 0.0045 -0.0066 -0.0110 82 VAL 11 CA 0.0045 -0.0064 -0.0112 83 VAL 11 C 0.0036 -0.0073 -0.0123 84 VAL 11 CB 0.0050 -0.0047 -0.0117 85 VAL 11 O 0.0035 -0.0079 -0.0121 86 VAL 11 CG1 0.0049 -0.0045 -0.0120 87 VAL 11 CG2 0.0058 -0.0038 -0.0105 88 ASN 12 N 0.0034 -0.0076 -0.0125 89 ASN 12 CA 0.0023 -0.0075 -0.0130 90 ASN 12 C 0.0014 -0.0080 -0.0124 91 ASN 12 CB 0.0022 -0.0074 -0.0132 92 ASN 12 O 0.0004 -0.0080 -0.0127 93 ASN 12 CG 0.0022 -0.0079 -0.0123 94 ASN 12 ND2 0.0019 -0.0079 -0.0125 95 ASN 12 OD1 0.0024 -0.0084 -0.0115 96 GLY 13 N 0.0023 -0.0081 -0.0119 97 GLY 13 CA 0.0018 -0.0091 -0.0114 98 GLY 13 C 0.0004 -0.0098 -0.0113 99 GLY 13 O -0.0004 -0.0102 -0.0112 100 ASP 14 N 0.0007 -0.0094 -0.0106 101 ASP 14 CA 0.0002 -0.0096 -0.0106 102 ASP 14 C 0.0001 -0.0100 -0.0099 103 ASP 14 CB 0.0002 -0.0093 -0.0109 104 ASP 14 O -0.0003 -0.0102 -0.0098 105 ASP 14 CG 0.0008 -0.0093 -0.0107 106 ASP 14 OD1 0.0013 -0.0094 -0.0103 107 ASP 14 OD2 0.0008 -0.0092 -0.0109 108 GLY 15 N 0.0009 -0.0093 -0.0089 109 GLY 15 CA 0.0008 -0.0093 -0.0076 110 GLY 15 C 0.0019 -0.0097 -0.0069 111 GLY 15 O 0.0020 -0.0097 -0.0057 112 ALA 16 N 0.0020 -0.0097 -0.0071 113 ALA 16 CA 0.0024 -0.0098 -0.0069 114 ALA 16 C 0.0032 -0.0094 -0.0073 115 ALA 16 CB 0.0017 -0.0099 -0.0069 116 ALA 16 O 0.0032 -0.0088 -0.0080 117 VAL 17 N 0.0038 -0.0091 -0.0065 118 VAL 17 CA 0.0042 -0.0086 -0.0066 119 VAL 17 C 0.0036 -0.0085 -0.0066 120 VAL 17 CB 0.0050 -0.0091 -0.0066 121 VAL 17 O 0.0033 -0.0091 -0.0065 122 VAL 17 CG1 0.0054 -0.0087 -0.0067 123 VAL 17 CG2 0.0057 -0.0092 -0.0066 124 SER 18 N 0.0030 -0.0079 -0.0068 125 SER 18 CA 0.0023 -0.0069 -0.0078 126 SER 18 C 0.0024 -0.0055 -0.0073 127 SER 18 CB 0.0019 -0.0065 -0.0082 128 SER 18 O 0.0030 -0.0053 -0.0062 129 SER 18 OG 0.0018 -0.0078 -0.0086 130 TYR 19 N 0.0005 -0.0038 -0.0029 131 TYR 19 CA 0.0007 -0.0035 -0.0029 132 TYR 19 C 0.0013 -0.0024 -0.0027 133 TYR 19 CB -0.0004 -0.0033 -0.0031 134 TYR 19 O 0.0020 -0.0023 -0.0025 135 TYR 19 CG -0.0003 -0.0029 -0.0030 136 TYR 19 CD1 -0.0006 -0.0018 -0.0030 137 TYR 19 CD2 0.0000 -0.0036 -0.0030 138 TYR 19 CE1 -0.0005 -0.0015 -0.0029 139 TYR 19 CE2 0.0001 -0.0032 -0.0030 140 TYR 19 OH -0.0000 -0.0018 -0.0029 141 TYR 19 CZ -0.0001 -0.0022 -0.0029 142 GLU 20 N -0.0002 -0.0012 -0.0065 143 GLU 20 CA 0.0006 0.0001 -0.0071 144 GLU 20 C 0.0020 0.0001 -0.0073 145 GLU 20 CB -0.0005 0.0014 -0.0075 146 GLU 20 O 0.0032 0.0006 -0.0077 147 GLU 20 CG -0.0017 0.0017 -0.0074 148 GLU 20 CD -0.0026 0.0031 -0.0079 149 GLU 20 OE1 -0.0024 0.0041 -0.0083 150 GLU 20 OE2 -0.0035 0.0032 -0.0078 151 GLU 21 N 0.0031 -0.0021 -0.0099 152 GLU 21 CA 0.0038 -0.0026 -0.0089 153 GLU 21 C 0.0041 -0.0023 -0.0084 154 GLU 21 CB 0.0040 -0.0039 -0.0091 155 GLU 21 O 0.0046 -0.0020 -0.0075 156 GLU 21 CG 0.0039 -0.0043 -0.0094 157 GLU 21 CD 0.0041 -0.0056 -0.0095 158 GLU 21 OE1 0.0045 -0.0060 -0.0089 159 GLU 21 OE2 0.0038 -0.0062 -0.0101 160 VAL 22 N 0.0020 -0.0028 -0.0072 161 VAL 22 CA 0.0031 -0.0028 -0.0062 162 VAL 22 C 0.0043 -0.0018 -0.0067 163 VAL 22 CB 0.0030 -0.0032 -0.0056 164 VAL 22 O 0.0052 -0.0016 -0.0061 165 VAL 22 CG1 0.0043 -0.0031 -0.0047 166 VAL 22 CG2 0.0020 -0.0042 -0.0049 167 LYS 23 N 0.0027 0.0004 -0.0060 168 LYS 23 CA 0.0031 0.0008 -0.0061 169 LYS 23 C 0.0046 0.0023 -0.0071 170 LYS 23 CB 0.0013 0.0016 -0.0052 171 LYS 23 O 0.0058 0.0020 -0.0077 172 LYS 23 CG 0.0014 0.0018 -0.0053 173 LYS 23 CD -0.0004 0.0025 -0.0044 174 LYS 23 CE -0.0002 0.0028 -0.0045 175 LYS 23 NZ -0.0020 0.0036 -0.0036 176 ALA 24 N 0.0046 0.0031 -0.0086 177 ALA 24 CA 0.0054 0.0041 -0.0095 178 ALA 24 C 0.0066 0.0036 -0.0104 179 ALA 24 CB 0.0050 0.0057 -0.0094 180 ALA 24 O 0.0075 0.0038 -0.0112 181 PHE 25 N 0.0048 0.0021 -0.0111 182 PHE 25 CA 0.0065 0.0011 -0.0113 183 PHE 25 C 0.0068 0.0006 -0.0114 184 PHE 25 CB 0.0065 -0.0005 -0.0116 185 PHE 25 O 0.0083 0.0009 -0.0113 186 PHE 25 CG 0.0082 -0.0016 -0.0119 187 PHE 25 CD1 0.0083 -0.0031 -0.0122 188 PHE 25 CD2 0.0097 -0.0011 -0.0117 189 PHE 25 CE1 0.0099 -0.0040 -0.0124 190 PHE 25 CE2 0.0113 -0.0020 -0.0119 191 PHE 25 CZ 0.0114 -0.0035 -0.0123 192 VAL 26 N 0.0048 0.0013 -0.0096 193 VAL 26 CA 0.0062 0.0009 -0.0092 194 VAL 26 C 0.0072 0.0018 -0.0102 195 VAL 26 CB 0.0059 0.0003 -0.0085 196 VAL 26 O 0.0085 0.0016 -0.0102 197 VAL 26 CG1 0.0074 -0.0000 -0.0082 198 VAL 26 CG2 0.0050 -0.0006 -0.0074 199 SER 27 N 0.0070 0.0036 -0.0105 200 SER 27 CA 0.0081 0.0040 -0.0122 201 SER 27 C 0.0091 0.0050 -0.0145 202 SER 27 CB 0.0067 0.0054 -0.0120 203 SER 27 O 0.0108 0.0045 -0.0159 204 SER 27 OG 0.0060 0.0043 -0.0101 205 LYS 28 N 0.0100 0.0050 -0.0149 206 LYS 28 CA 0.0110 0.0058 -0.0160 207 LYS 28 C 0.0116 0.0047 -0.0174 208 LYS 28 CB 0.0115 0.0073 -0.0161 209 LYS 28 O 0.0121 0.0047 -0.0183 210 LYS 28 CG 0.0125 0.0084 -0.0170 211 LYS 28 CD 0.0129 0.0099 -0.0169 212 LYS 28 CE 0.0139 0.0110 -0.0179 213 LYS 28 NZ 0.0144 0.0125 -0.0178 214 LYS 29 N 0.0118 0.0046 -0.0128 215 LYS 29 CA 0.0127 0.0037 -0.0129 216 LYS 29 C 0.0123 0.0039 -0.0129 217 LYS 29 CB 0.0127 0.0022 -0.0134 218 LYS 29 O 0.0130 0.0034 -0.0130 219 LYS 29 CG 0.0135 0.0018 -0.0133 220 LYS 29 CD 0.0151 0.0017 -0.0131 221 LYS 29 CE 0.0159 0.0012 -0.0131 222 LYS 29 NZ 0.0175 0.0012 -0.0128 223 ARG 30 N 0.0075 0.0020 -0.0158 224 ARG 30 CA 0.0132 0.0023 -0.0161 225 ARG 30 C 0.0153 -0.0013 -0.0101 226 ARG 30 CB 0.0190 0.0043 -0.0190 227 ARG 30 O 0.0213 -0.0018 -0.0089 228 ARG 30 CG 0.0180 0.0082 -0.0253 229 ARG 30 CD 0.0243 0.0101 -0.0282 230 ARG 30 NE 0.0231 0.0138 -0.0342 231 ARG 30 NH1 0.0337 0.0158 -0.0369 232 ARG 30 NH2 0.0261 0.0197 -0.0435 233 ARG 30 CZ 0.0276 0.0164 -0.0382 234 ALA 31 N 0.0108 0.0032 -0.0095 235 ALA 31 CA 0.0109 0.0022 -0.0090 236 ALA 31 C 0.0106 0.0012 -0.0076 237 ALA 31 CB 0.0105 0.0030 -0.0088 238 ALA 31 O 0.0109 -0.0001 -0.0073 239 ILE 32 N 0.0097 0.0017 -0.0086 240 ILE 32 CA 0.0093 0.0006 -0.0067 241 ILE 32 C 0.0093 0.0014 -0.0078 242 ILE 32 CB 0.0068 0.0008 -0.0045 243 ILE 32 O 0.0077 0.0033 -0.0087 244 ILE 32 CG1 0.0068 -0.0000 -0.0034 245 ILE 32 CG2 0.0064 -0.0004 -0.0026 246 ILE 32 CD1 0.0044 0.0003 -0.0014 247 LYS 33 N 0.0128 0.0014 -0.0084 248 LYS 33 CA 0.0129 0.0041 -0.0112 249 LYS 33 C 0.0089 0.0024 -0.0067 250 LYS 33 CB 0.0202 0.0025 -0.0147 251 LYS 33 O 0.0061 0.0057 -0.0081 252 LYS 33 CG 0.0241 0.0051 -0.0202 253 LYS 33 CD 0.0312 0.0037 -0.0237 254 LYS 33 CE 0.0352 0.0062 -0.0291 255 LYS 33 NZ 0.0419 0.0052 -0.0328 256 ASN 34 N 0.0068 -0.0002 -0.0024 257 ASN 34 CA 0.0045 -0.0016 0.0001 258 ASN 34 C 0.0033 0.0005 0.0019 259 ASN 34 CB 0.0043 -0.0053 -0.0003 260 ASN 34 O 0.0038 0.0006 0.0012 261 ASN 34 CG 0.0020 -0.0071 0.0022 262 ASN 34 ND2 0.0018 -0.0102 0.0020 263 ASN 34 OD1 0.0003 -0.0058 0.0044 264 GLU 35 N 0.0024 0.0036 0.0031 265 GLU 35 CA 0.0003 0.0035 0.0031 266 GLU 35 C -0.0006 0.0020 0.0043 267 GLU 35 CB -0.0007 0.0049 0.0018 268 GLU 35 O -0.0021 0.0013 0.0048 269 GLU 35 CG -0.0004 0.0063 0.0005 270 GLU 35 CD -0.0016 0.0076 -0.0007 271 GLU 35 OE1 -0.0032 0.0079 -0.0011 272 GLU 35 OE2 -0.0008 0.0084 -0.0013 273 GLN 36 N -0.0015 0.0071 0.0086 274 GLN 36 CA -0.0044 0.0021 0.0105 275 GLN 36 C -0.0011 -0.0001 0.0068 276 GLN 36 CB -0.0068 -0.0043 0.0117 277 GLN 36 O -0.0026 -0.0005 0.0083 278 GLN 36 CG -0.0110 -0.0029 0.0162 279 GLN 36 CD -0.0135 -0.0095 0.0175 280 GLN 36 NE2 -0.0177 -0.0126 0.0211 281 GLN 36 OE1 -0.0116 -0.0117 0.0151 282 LEU 37 N 0.0015 -0.0019 0.0059 283 LEU 37 CA 0.0020 -0.0021 0.0056 284 LEU 37 C 0.0015 -0.0008 0.0054 285 LEU 37 CB 0.0031 -0.0026 0.0044 286 LEU 37 O 0.0012 -0.0009 0.0059 287 LEU 37 CG 0.0037 -0.0030 0.0039 288 LEU 37 CD1 0.0035 -0.0044 0.0048 289 LEU 37 CD2 0.0048 -0.0033 0.0026 290 LEU 38 N 0.0049 -0.0015 0.0017 291 LEU 38 CA 0.0039 -0.0009 0.0015 292 LEU 38 C 0.0030 -0.0008 0.0023 293 LEU 38 CB 0.0038 -0.0003 0.0004 294 LEU 38 O 0.0023 -0.0007 0.0028 295 LEU 38 CG 0.0028 0.0003 0.0000 296 LEU 38 CD1 0.0029 0.0003 -0.0000 297 LEU 38 CD2 0.0027 0.0009 -0.0011 298 GLN 39 N 0.0021 -0.0010 0.0045 299 GLN 39 CA 0.0018 -0.0008 0.0051 300 GLN 39 C 0.0017 -0.0013 0.0050 301 GLN 39 CB 0.0013 -0.0011 0.0058 302 GLN 39 O 0.0017 -0.0010 0.0051 303 GLN 39 CG 0.0009 -0.0008 0.0065 304 GLN 39 CD 0.0004 -0.0009 0.0072 305 GLN 39 NE2 0.0001 -0.0006 0.0078 306 GLN 39 OE1 0.0003 -0.0013 0.0072 307 LEU 40 N 0.0020 0.0018 0.0117 308 LEU 40 CA 0.0019 0.0022 0.0108 309 LEU 40 C 0.0024 0.0019 0.0108 310 LEU 40 CB 0.0010 0.0028 0.0107 311 LEU 40 O 0.0028 0.0019 0.0100 312 LEU 40 CG 0.0005 0.0032 0.0104 313 LEU 40 CD1 -0.0004 0.0037 0.0105 314 LEU 40 CD2 0.0009 0.0033 0.0094 315 ILE 41 N 0.0031 -0.0010 0.0046 316 ILE 41 CA 0.0034 -0.0011 0.0046 317 ILE 41 C 0.0036 -0.0012 0.0046 318 ILE 41 CB 0.0035 -0.0010 0.0049 319 ILE 41 O 0.0037 -0.0013 0.0044 320 ILE 41 CG1 0.0033 -0.0009 0.0049 321 ILE 41 CG2 0.0038 -0.0011 0.0049 322 ILE 41 CD1 0.0034 -0.0008 0.0051 323 PHE 42 N 0.0049 -0.0015 0.0034 324 PHE 42 CA 0.0040 -0.0029 0.0025 325 PHE 42 C 0.0041 -0.0029 0.0021 326 PHE 42 CB 0.0041 -0.0034 0.0008 327 PHE 42 O 0.0033 -0.0039 0.0025 328 PHE 42 CG 0.0032 -0.0049 -0.0001 329 PHE 42 CD1 0.0034 -0.0051 -0.0014 330 PHE 42 CD2 0.0022 -0.0061 0.0004 331 PHE 42 CE1 0.0026 -0.0065 -0.0022 332 PHE 42 CE2 0.0014 -0.0075 -0.0004 333 PHE 42 CZ 0.0016 -0.0077 -0.0017 334 LYS 43 N 0.0057 -0.0012 0.0032 335 LYS 43 CA 0.0050 -0.0017 0.0037 336 LYS 43 C 0.0054 -0.0026 0.0024 337 LYS 43 CB 0.0036 -0.0028 0.0046 338 LYS 43 O 0.0054 -0.0025 0.0026 339 LYS 43 CG 0.0029 -0.0019 0.0061 340 LYS 43 CD 0.0015 -0.0030 0.0071 341 LYS 43 CE 0.0008 -0.0021 0.0086 342 LYS 43 NZ -0.0006 -0.0031 0.0096 343 SER 44 N 0.0053 -0.0019 0.0038 344 SER 44 CA 0.0055 -0.0025 0.0039 345 SER 44 C 0.0063 -0.0042 0.0044 346 SER 44 CB 0.0054 -0.0013 0.0051 347 SER 44 O 0.0064 -0.0052 0.0038 348 SER 44 OG 0.0047 0.0002 0.0044 349 ILE 45 N 0.0061 -0.0067 0.0014 350 ILE 45 CA 0.0059 -0.0076 0.0018 351 ILE 45 C 0.0052 -0.0083 0.0011 352 ILE 45 CB 0.0062 -0.0074 0.0022 353 ILE 45 O 0.0050 -0.0092 0.0013 354 ILE 45 CG1 0.0068 -0.0067 0.0029 355 ILE 45 CG2 0.0060 -0.0084 0.0026 356 ILE 45 CD1 0.0072 -0.0064 0.0032 357 ASP 46 N 0.0056 -0.0086 0.0016 358 ASP 46 CA 0.0050 -0.0094 0.0004 359 ASP 46 C 0.0048 -0.0095 0.0000 360 ASP 46 CB 0.0050 -0.0088 -0.0009 361 ASP 46 O 0.0049 -0.0089 -0.0010 362 ASP 46 CG 0.0043 -0.0096 -0.0021 363 ASP 46 OD1 0.0038 -0.0109 -0.0019 364 ASP 46 OD2 0.0043 -0.0091 -0.0033 365 ALA 47 N 0.0055 -0.0114 0.0006 366 ALA 47 CA 0.0051 -0.0121 -0.0001 367 ALA 47 C 0.0041 -0.0128 -0.0018 368 ALA 47 CB 0.0055 -0.0137 0.0011 369 ALA 47 O 0.0036 -0.0125 -0.0029 370 ASP 48 N 0.0035 -0.0131 -0.0023 371 ASP 48 CA 0.0025 -0.0135 -0.0032 372 ASP 48 C 0.0023 -0.0125 -0.0043 373 ASP 48 CB 0.0018 -0.0143 -0.0032 374 ASP 48 O 0.0015 -0.0127 -0.0051 375 ASP 48 CG 0.0019 -0.0138 -0.0035 376 ASP 48 OD1 0.0026 -0.0128 -0.0037 377 ASP 48 OD2 0.0014 -0.0144 -0.0036 378 GLY 49 N 0.0035 -0.0115 -0.0036 379 GLY 49 CA 0.0037 -0.0103 -0.0052 380 GLY 49 C 0.0028 -0.0106 -0.0066 381 GLY 49 O 0.0025 -0.0101 -0.0082 382 ASN 50 N 0.0023 -0.0112 -0.0061 383 ASN 50 CA 0.0017 -0.0115 -0.0070 384 ASN 50 C 0.0020 -0.0109 -0.0075 385 ASN 50 CB 0.0009 -0.0125 -0.0066 386 ASN 50 O 0.0015 -0.0110 -0.0083 387 ASN 50 CG 0.0012 -0.0126 -0.0057 388 ASN 50 ND2 0.0005 -0.0134 -0.0055 389 ASN 50 OD1 0.0020 -0.0120 -0.0053 390 GLY 51 N 0.0022 -0.0096 -0.0062 391 GLY 51 CA 0.0026 -0.0091 -0.0067 392 GLY 51 C 0.0024 -0.0094 -0.0062 393 GLY 51 O 0.0027 -0.0091 -0.0066 394 GLU 52 N 0.0030 -0.0100 -0.0057 395 GLU 52 CA 0.0030 -0.0103 -0.0052 396 GLU 52 C 0.0033 -0.0110 -0.0038 397 GLU 52 CB 0.0018 -0.0107 -0.0059 398 GLU 52 O 0.0029 -0.0116 -0.0032 399 GLU 52 CG 0.0015 -0.0101 -0.0073 400 GLU 52 CD 0.0002 -0.0105 -0.0080 401 GLU 52 OE1 0.0002 -0.0104 -0.0082 402 GLU 52 OE2 -0.0007 -0.0111 -0.0082 403 ILE 53 N 0.0036 -0.0104 -0.0030 404 ILE 53 CA 0.0040 -0.0110 -0.0024 405 ILE 53 C 0.0042 -0.0119 -0.0021 406 ILE 53 CB 0.0046 -0.0103 -0.0016 407 ILE 53 O 0.0045 -0.0118 -0.0017 408 ILE 53 CG1 0.0044 -0.0094 -0.0019 409 ILE 53 CG2 0.0050 -0.0110 -0.0010 410 ILE 53 CD1 0.0049 -0.0087 -0.0012 411 ASP 54 N 0.0037 -0.0117 -0.0023 412 ASP 54 CA 0.0034 -0.0116 -0.0023 413 ASP 54 C 0.0041 -0.0119 -0.0023 414 ASP 54 CB 0.0026 -0.0119 -0.0019 415 ASP 54 O 0.0047 -0.0123 -0.0022 416 ASP 54 CG 0.0026 -0.0127 -0.0015 417 ASP 54 OD1 0.0024 -0.0128 -0.0013 418 ASP 54 OD2 0.0029 -0.0132 -0.0012 419 GLN 55 N 0.0043 -0.0101 -0.0023 420 GLN 55 CA 0.0044 -0.0099 -0.0035 421 GLN 55 C 0.0047 -0.0107 -0.0027 422 GLN 55 CB 0.0034 -0.0081 -0.0039 423 GLN 55 O 0.0052 -0.0114 -0.0036 424 GLN 55 CG 0.0031 -0.0073 -0.0051 425 GLN 55 CD 0.0022 -0.0056 -0.0056 426 GLN 55 NE2 0.0020 -0.0049 -0.0069 427 GLN 55 OE1 0.0018 -0.0049 -0.0049 428 ASN 56 N 0.0049 -0.0125 -0.0016 429 ASN 56 CA 0.0050 -0.0132 -0.0013 430 ASN 56 C 0.0054 -0.0126 -0.0012 431 ASN 56 CB 0.0041 -0.0139 -0.0016 432 ASN 56 O 0.0060 -0.0129 -0.0007 433 ASN 56 CG 0.0042 -0.0147 -0.0013 434 ASN 56 ND2 0.0038 -0.0147 -0.0015 435 ASN 56 OD1 0.0046 -0.0154 -0.0007 436 GLU 57 N 0.0053 -0.0128 -0.0001 437 GLU 57 CA 0.0058 -0.0128 -0.0001 438 GLU 57 C 0.0067 -0.0125 -0.0003 439 GLU 57 CB 0.0054 -0.0123 -0.0005 440 GLU 57 O 0.0074 -0.0128 -0.0001 441 GLU 57 CG 0.0046 -0.0126 -0.0003 442 GLU 57 CD 0.0042 -0.0121 -0.0007 443 GLU 57 OE1 0.0039 -0.0123 -0.0005 444 GLU 57 OE2 0.0041 -0.0114 -0.0011 445 PHE 58 N 0.0078 -0.0106 -0.0000 446 PHE 58 CA 0.0079 -0.0109 -0.0013 447 PHE 58 C 0.0075 -0.0106 -0.0012 448 PHE 58 CB 0.0072 -0.0107 -0.0025 449 PHE 58 O 0.0080 -0.0111 -0.0016 450 PHE 58 CG 0.0074 -0.0112 -0.0039 451 PHE 58 CD1 0.0066 -0.0108 -0.0045 452 PHE 58 CD2 0.0083 -0.0121 -0.0045 453 PHE 58 CE1 0.0068 -0.0112 -0.0058 454 PHE 58 CE2 0.0085 -0.0125 -0.0057 455 PHE 58 CZ 0.0077 -0.0121 -0.0064 456 ALA 59 N 0.0070 -0.0108 -0.0016 457 ALA 59 CA 0.0066 -0.0106 -0.0008 458 ALA 59 C 0.0072 -0.0101 -0.0002 459 ALA 59 CB 0.0058 -0.0107 -0.0005 460 ALA 59 O 0.0071 -0.0099 0.0003 461 LYS 60 N 0.0079 -0.0115 0.0001 462 LYS 60 CA 0.0082 -0.0114 0.0004 463 LYS 60 C 0.0090 -0.0100 0.0007 464 LYS 60 CB 0.0072 -0.0115 -0.0007 465 LYS 60 O 0.0097 -0.0099 0.0015 466 LYS 60 CG 0.0065 -0.0130 -0.0008 467 LYS 60 CD 0.0057 -0.0131 -0.0018 468 LYS 60 CE 0.0050 -0.0146 -0.0019 469 LYS 60 NZ 0.0042 -0.0147 -0.0029 470 PHE 61 N 0.0094 -0.0096 -0.0006 471 PHE 61 CA 0.0093 -0.0088 -0.0002 472 PHE 61 C 0.0101 -0.0087 0.0005 473 PHE 61 CB 0.0088 -0.0080 -0.0000 474 PHE 61 O 0.0102 -0.0085 0.0006 475 PHE 61 CG 0.0088 -0.0072 0.0005 476 PHE 61 CD1 0.0093 -0.0067 0.0011 477 PHE 61 CD2 0.0082 -0.0068 0.0002 478 PHE 61 CE1 0.0092 -0.0059 0.0016 479 PHE 61 CE2 0.0082 -0.0060 0.0007 480 PHE 61 CZ 0.0087 -0.0056 0.0013 481 TYR 62 N 0.0143 -0.0107 0.0020 482 TYR 62 CA 0.0114 -0.0108 -0.0013 483 TYR 62 C 0.0102 -0.0087 -0.0006 484 TYR 62 CB 0.0085 -0.0092 -0.0029 485 TYR 62 O 0.0092 -0.0098 -0.0027 486 TYR 62 CG 0.0056 -0.0098 -0.0066 487 TYR 62 CD1 0.0027 -0.0071 -0.0072 488 TYR 62 CD2 0.0058 -0.0131 -0.0096 489 TYR 62 CE1 0.0000 -0.0076 -0.0106 490 TYR 62 CE2 0.0032 -0.0137 -0.0130 491 TYR 62 OH -0.0023 -0.0115 -0.0169 492 TYR 62 CZ 0.0003 -0.0109 -0.0135 493 GLY 63 N 0.0086 -0.0082 0.0006 494 GLY 63 CA 0.0081 -0.0070 0.0015 495 GLY 63 C 0.0090 -0.0067 0.0018 496 GLY 63 O 0.0083 -0.0061 0.0022 497 SER 64 N 0.0093 -0.0056 0.0017 498 SER 64 CA 0.0092 -0.0058 0.0017 499 SER 64 C 0.0093 -0.0058 0.0016 500 SER 64 CB 0.0090 -0.0058 0.0019 501 SER 64 O 0.0092 -0.0060 0.0015 502 SER 64 OG 0.0090 -0.0058 0.0019 503 ILE 65 N 0.0087 -0.0055 -0.0006 504 ILE 65 CA 0.0092 -0.0055 -0.0012 505 ILE 65 C 0.0090 -0.0054 -0.0015 506 ILE 65 CB 0.0092 -0.0054 -0.0019 507 ILE 65 O 0.0093 -0.0054 -0.0020 508 ILE 65 CG1 0.0084 -0.0051 -0.0022 509 ILE 65 CG2 0.0094 -0.0055 -0.0017 510 ILE 65 CD1 0.0083 -0.0049 -0.0029 511 GLN 66 N 0.0120 -0.0078 -0.0022 512 GLN 66 CA 0.0082 -0.0069 -0.0037 513 GLN 66 C 0.0095 -0.0072 -0.0033 514 GLN 66 CB 0.0045 -0.0042 -0.0011 515 GLN 66 O 0.0113 -0.0066 0.0002 516 GLN 66 CG 0.0000 -0.0033 -0.0033 517 GLN 66 CD -0.0036 -0.0006 -0.0004 518 GLN 66 NE2 -0.0061 0.0006 -0.0001 519 GLN 66 OE1 -0.0041 0.0004 0.0014 520 GLY 67 N 0.0114 -0.0056 -0.0040 521 GLY 67 CA 0.0137 -0.0061 -0.0036 522 GLY 67 C 0.0157 -0.0055 -0.0048 523 GLY 67 O 0.0177 -0.0058 -0.0047 524 GLN 68 N 0.0137 -0.0036 -0.0053 525 GLN 68 CA 0.0137 -0.0027 -0.0053 526 GLN 68 C 0.0145 -0.0010 -0.0054 527 GLN 68 CB 0.0119 -0.0024 -0.0053 528 GLN 68 O 0.0145 -0.0004 -0.0054 529 GLN 68 CG 0.0110 -0.0040 -0.0052 530 GLN 68 CD 0.0115 -0.0048 -0.0052 531 GLN 68 NE2 0.0122 -0.0063 -0.0052 532 GLN 68 OE1 0.0112 -0.0041 -0.0052 533 ASP 69 N 0.0181 -0.0027 -0.0101 534 ASP 69 CA 0.0197 0.0004 -0.0120 535 ASP 69 C 0.0174 0.0029 -0.0109 536 ASP 69 CB 0.0228 -0.0014 -0.0138 537 ASP 69 O 0.0165 0.0014 -0.0099 538 ASP 69 CG 0.0250 0.0016 -0.0162 539 ASP 69 OD1 0.0252 0.0030 -0.0166 540 ASP 69 OD2 0.0267 0.0026 -0.0177 541 LEU 70 N 0.0159 0.0028 -0.0086 542 LEU 70 CA 0.0147 0.0042 -0.0094 543 LEU 70 C 0.0157 0.0060 -0.0098 544 LEU 70 CB 0.0137 0.0043 -0.0097 545 LEU 70 O 0.0148 0.0073 -0.0104 546 LEU 70 CG 0.0123 0.0028 -0.0095 547 LEU 70 CD1 0.0120 0.0026 -0.0095 548 LEU 70 CD2 0.0105 0.0030 -0.0099 549 SER 71 N 0.0190 0.0054 -0.0114 550 SER 71 CA 0.0198 0.0069 -0.0114 551 SER 71 C 0.0180 0.0048 -0.0110 552 SER 71 CB 0.0233 0.0073 -0.0133 553 SER 71 O 0.0181 0.0059 -0.0107 554 SER 71 OG 0.0250 0.0094 -0.0137 555 ASP 72 N 0.0172 0.0044 -0.0110 556 ASP 72 CA 0.0153 0.0029 -0.0110 557 ASP 72 C 0.0130 0.0039 -0.0093 558 ASP 72 CB 0.0147 0.0004 -0.0123 559 ASP 72 O 0.0122 0.0047 -0.0085 560 ASP 72 CG 0.0136 -0.0014 -0.0129 561 ASP 72 OD1 0.0113 -0.0019 -0.0121 562 ASP 72 OD2 0.0150 -0.0022 -0.0141 563 ASP 73 N 0.0137 0.0032 -0.0086 564 ASP 73 CA 0.0123 0.0040 -0.0081 565 ASP 73 C 0.0106 0.0024 -0.0070 566 ASP 73 CB 0.0135 0.0044 -0.0088 567 ASP 73 O 0.0090 0.0031 -0.0065 568 ASP 73 CG 0.0121 0.0046 -0.0082 569 ASP 73 OD1 0.0119 0.0029 -0.0077 570 ASP 73 OD2 0.0112 0.0064 -0.0082 571 LYS 74 N 0.0080 0.0001 -0.0052 572 LYS 74 CA 0.0048 -0.0026 -0.0052 573 LYS 74 C 0.0091 0.0008 -0.0064 574 LYS 74 CB 0.0011 -0.0079 -0.0112 575 LYS 74 O 0.0076 -0.0013 -0.0086 576 LYS 74 CG -0.0039 -0.0118 -0.0099 577 LYS 74 CD -0.0076 -0.0170 -0.0158 578 LYS 74 CE -0.0127 -0.0210 -0.0144 579 LYS 74 NZ -0.0162 -0.0261 -0.0204 580 ILE 75 N 0.0094 0.0007 -0.0058 581 ILE 75 CA 0.0087 0.0009 -0.0053 582 ILE 75 C 0.0065 0.0006 -0.0038 583 ILE 75 CB 0.0092 0.0031 -0.0059 584 ILE 75 O 0.0057 -0.0005 -0.0032 585 ILE 75 CG1 0.0086 0.0031 -0.0055 586 ILE 75 CG2 0.0083 0.0052 -0.0054 587 ILE 75 CD1 0.0096 0.0012 -0.0059 588 GLY 76 N 0.0061 0.0009 -0.0022 589 GLY 76 CA 0.0047 0.0007 0.0003 590 GLY 76 C 0.0040 -0.0018 0.0008 591 GLY 76 O 0.0034 -0.0016 0.0020 592 LEU 77 N 0.0019 -0.0040 0.0002 593 LEU 77 CA 0.0019 -0.0047 0.0005 594 LEU 77 C 0.0018 -0.0027 -0.0007 595 LEU 77 CB 0.0009 -0.0073 -0.0006 596 LEU 77 O 0.0023 -0.0022 0.0003 597 LEU 77 CG 0.0011 -0.0097 0.0008 598 LEU 77 CD1 -0.0000 -0.0120 -0.0008 599 LEU 77 CD2 0.0019 -0.0103 0.0032 600 LYS 78 N 0.0011 -0.0018 -0.0013 601 LYS 78 CA 0.0016 -0.0020 -0.0021 602 LYS 78 C 0.0005 -0.0006 -0.0004 603 LYS 78 CB 0.0030 -0.0009 -0.0044 604 LYS 78 O 0.0002 -0.0016 0.0001 605 LYS 78 CG 0.0043 -0.0026 -0.0063 606 LYS 78 CD 0.0057 -0.0015 -0.0086 607 LYS 78 CE 0.0069 -0.0033 -0.0104 608 LYS 78 NZ 0.0083 -0.0022 -0.0127 609 VAL 79 N 0.0010 -0.0010 0.0015 610 VAL 79 CA 0.0013 -0.0006 0.0017 611 VAL 79 C 0.0011 -0.0009 0.0020 612 VAL 79 CB 0.0015 -0.0003 0.0022 613 VAL 79 O 0.0012 -0.0007 0.0019 614 VAL 79 CG1 0.0018 0.0001 0.0026 615 VAL 79 CG2 0.0018 -0.0000 0.0019 616 LEU 80 N 0.0016 -0.0008 0.0030 617 LEU 80 CA 0.0020 -0.0009 0.0036 618 LEU 80 C 0.0019 -0.0005 0.0034 619 LEU 80 CB 0.0021 -0.0017 0.0038 620 LEU 80 O 0.0023 -0.0001 0.0037 621 LEU 80 CG 0.0024 -0.0021 0.0042 622 LEU 80 CD1 0.0023 -0.0030 0.0043 623 LEU 80 CD2 0.0029 -0.0017 0.0047 624 TYR 81 N -0.0006 -0.0023 0.0017 625 TYR 81 CA -0.0011 0.0010 0.0020 626 TYR 81 C -0.0014 0.0040 0.0023 627 TYR 81 CB -0.0044 0.0009 0.0016 628 TYR 81 O 0.0003 0.0066 0.0028 629 TYR 81 CG -0.0050 0.0041 0.0019 630 TYR 81 CD1 -0.0071 0.0068 0.0020 631 TYR 81 CD2 -0.0035 0.0045 0.0021 632 TYR 81 CE1 -0.0077 0.0098 0.0023 633 TYR 81 CE2 -0.0041 0.0075 0.0024 634 TYR 81 OH -0.0067 0.0131 0.0027 635 TYR 81 CZ -0.0062 0.0101 0.0025 636 LYS 82 N -0.0016 0.0016 0.0023 637 LYS 82 CA -0.0014 0.0017 0.0022 638 LYS 82 C -0.0019 0.0019 0.0027 639 LYS 82 CB -0.0009 0.0023 0.0018 640 LYS 82 O -0.0019 0.0017 0.0026 641 LYS 82 CG -0.0004 0.0020 0.0012 642 LYS 82 CD 0.0000 0.0023 0.0009 643 LYS 82 CE 0.0006 0.0021 0.0003 644 LYS 82 NZ 0.0009 0.0021 -0.0000 645 LEU 83 N 0.0012 0.0010 0.0038 646 LEU 83 CA 0.0023 0.0010 0.0037 647 LEU 83 C 0.0033 0.0019 0.0038 648 LEU 83 CB 0.0028 -0.0003 0.0033 649 LEU 83 O 0.0040 0.0025 0.0039 650 LEU 83 CG 0.0021 -0.0012 0.0032 651 LEU 83 CD1 0.0026 -0.0024 0.0029 652 LEU 83 CD2 0.0020 -0.0007 0.0033 653 MET 84 N 0.0025 0.0044 0.0074 654 MET 84 CA 0.0036 0.0052 0.0076 655 MET 84 C 0.0032 0.0067 0.0082 656 MET 84 CB 0.0041 0.0047 0.0074 657 MET 84 O 0.0041 0.0076 0.0085 658 MET 84 CG 0.0048 0.0034 0.0069 659 MET 84 SD 0.0056 0.0030 0.0067 660 MET 84 CE 0.0040 0.0025 0.0066 661 ASP 85 N 0.0013 0.0077 0.0075 662 ASP 85 CA 0.0000 0.0107 0.0086 663 ASP 85 C -0.0000 0.0118 0.0089 664 ASP 85 CB -0.0033 0.0107 0.0091 665 ASP 85 O -0.0025 0.0116 0.0092 666 ASP 85 CG -0.0046 0.0140 0.0102 667 ASP 85 OD1 -0.0027 0.0162 0.0106 668 ASP 85 OD2 -0.0076 0.0142 0.0108 669 VAL 86 N 0.0017 0.0122 0.0098 670 VAL 86 CA 0.0023 0.0129 0.0098 671 VAL 86 C -0.0001 0.0159 0.0113 672 VAL 86 CB 0.0064 0.0139 0.0091 673 VAL 86 O -0.0017 0.0156 0.0116 674 VAL 86 CG1 0.0069 0.0149 0.0093 675 VAL 86 CG2 0.0089 0.0108 0.0076 676 ASP 87 N -0.0020 0.0208 0.0138 677 ASP 87 CA -0.0042 0.0246 0.0149 678 ASP 87 C -0.0089 0.0239 0.0150 679 ASP 87 CB -0.0026 0.0279 0.0157 680 ASP 87 O -0.0114 0.0266 0.0159 681 ASP 87 CG -0.0034 0.0270 0.0155 682 ASP 87 OD1 -0.0053 0.0239 0.0148 683 ASP 87 OD2 -0.0022 0.0296 0.0161 684 GLY 88 N -0.0059 0.0192 0.0132 685 GLY 88 CA -0.0084 0.0184 0.0139 686 GLY 88 C -0.0093 0.0203 0.0152 687 GLY 88 O -0.0115 0.0204 0.0161 688 ASP 89 N -0.0153 0.0246 0.0168 689 ASP 89 CA -0.0168 0.0272 0.0181 690 ASP 89 C -0.0183 0.0249 0.0174 691 ASP 89 CB -0.0132 0.0304 0.0190 692 ASP 89 O -0.0201 0.0266 0.0183 693 ASP 89 CG -0.0095 0.0285 0.0178 694 ASP 89 OD1 -0.0091 0.0248 0.0162 695 ASP 89 OD2 -0.0069 0.0308 0.0184 696 GLY 90 N -0.0123 0.0202 0.0102 697 GLY 90 CA -0.0137 0.0187 0.0102 698 GLY 90 C -0.0129 0.0184 0.0102 699 GLY 90 O -0.0140 0.0173 0.0102 700 LYS 91 N -0.0135 0.0195 0.0144 701 LYS 91 CA -0.0091 0.0199 0.0138 702 LYS 91 C -0.0032 0.0188 0.0125 703 LYS 91 CB -0.0090 0.0256 0.0156 704 LYS 91 O -0.0016 0.0207 0.0129 705 LYS 91 CG -0.0148 0.0271 0.0170 706 LYS 91 CD -0.0144 0.0329 0.0188 707 LYS 91 CE -0.0203 0.0345 0.0203 708 LYS 91 NZ -0.0200 0.0404 0.0221 709 LEU 92 N -0.0011 0.0149 0.0112 710 LEU 92 CA 0.0020 0.0142 0.0110 711 LEU 92 C 0.0050 0.0158 0.0122 712 LEU 92 CB 0.0028 0.0109 0.0090 713 LEU 92 O 0.0059 0.0155 0.0120 714 LEU 92 CG 0.0003 0.0091 0.0077 715 LEU 92 CD1 0.0013 0.0059 0.0057 716 LEU 92 CD2 0.0002 0.0099 0.0082 717 THR 93 N 0.0015 0.0160 0.0136 718 THR 93 CA 0.0042 0.0178 0.0142 719 THR 93 C 0.0067 0.0170 0.0120 720 THR 93 CB 0.0038 0.0195 0.0161 721 THR 93 O 0.0062 0.0150 0.0102 722 THR 93 CG2 0.0013 0.0203 0.0182 723 THR 93 OG1 0.0033 0.0183 0.0152 724 LYS 94 N 0.0038 0.0164 0.0107 725 LYS 94 CA 0.0027 0.0175 0.0090 726 LYS 94 C 0.0013 0.0162 0.0079 727 LYS 94 CB 0.0027 0.0184 0.0087 728 LYS 94 O 0.0005 0.0169 0.0067 729 LYS 94 CG 0.0018 0.0197 0.0071 730 LYS 94 CD 0.0019 0.0205 0.0069 731 LYS 94 CE 0.0009 0.0218 0.0053 732 LYS 94 NZ 0.0009 0.0225 0.0050 733 GLU 95 N 0.0019 0.0162 0.0075 734 GLU 95 CA 0.0028 0.0158 0.0069 735 GLU 95 C 0.0011 0.0130 0.0060 736 GLU 95 CB 0.0022 0.0183 0.0085 737 GLU 95 O 0.0025 0.0115 0.0046 738 GLU 95 CG 0.0042 0.0211 0.0092 739 GLU 95 CD 0.0035 0.0235 0.0107 740 GLU 95 OE1 0.0049 0.0240 0.0104 741 GLU 95 OE2 0.0016 0.0249 0.0123 742 GLU 96 N 0.0052 0.0144 0.0101 743 GLU 96 CA 0.0048 0.0128 0.0103 744 GLU 96 C 0.0054 0.0108 0.0103 745 GLU 96 CB 0.0027 0.0128 0.0108 746 GLU 96 O 0.0062 0.0095 0.0102 747 GLU 96 CG 0.0022 0.0145 0.0108 748 GLU 96 CD 0.0001 0.0145 0.0112 749 GLU 96 OE1 -0.0003 0.0145 0.0113 750 GLU 96 OE2 -0.0012 0.0145 0.0115 751 VAL 97 N 0.0020 0.0084 0.0074 752 VAL 97 CA 0.0021 0.0082 0.0070 753 VAL 97 C 0.0025 0.0081 0.0067 754 VAL 97 CB 0.0023 0.0083 0.0071 755 VAL 97 O 0.0024 0.0078 0.0064 756 VAL 97 CG1 0.0025 0.0081 0.0067 757 VAL 97 CG2 0.0020 0.0083 0.0073 758 THR 98 N 0.0019 0.0123 0.0069 759 THR 98 CA -0.0011 0.0132 0.0013 760 THR 98 C -0.0035 0.0081 -0.0014 761 THR 98 CB -0.0017 0.0138 0.0001 762 THR 98 O -0.0056 0.0091 -0.0054 763 THR 98 CG2 -0.0047 0.0149 -0.0057 764 THR 98 OG1 0.0006 0.0186 0.0026 765 SER 99 N -0.0004 0.0068 -0.0036 766 SER 99 CA 0.0011 0.0009 -0.0064 767 SER 99 C 0.0026 -0.0013 -0.0033 768 SER 99 CB 0.0029 -0.0037 -0.0060 769 SER 99 O 0.0028 -0.0038 -0.0064 770 SER 99 OG 0.0038 -0.0088 -0.0103 771 PHE 100 N 0.0049 0.0025 0.0033 772 PHE 100 CA 0.0055 0.0022 0.0046 773 PHE 100 C 0.0050 0.0028 0.0049 774 PHE 100 CB 0.0057 0.0023 0.0059 775 PHE 100 O 0.0055 0.0023 0.0051 776 PHE 100 CG 0.0065 0.0019 0.0072 777 PHE 100 CD1 0.0061 0.0025 0.0083 778 PHE 100 CD2 0.0075 0.0008 0.0073 779 PHE 100 CE1 0.0068 0.0020 0.0094 780 PHE 100 CE2 0.0083 0.0004 0.0084 781 PHE 100 CZ 0.0079 0.0010 0.0095 782 PHE 101 N 0.0014 0.0007 0.0024 783 PHE 101 CA -0.0022 0.0043 0.0052 784 PHE 101 C -0.0054 0.0039 0.0033 785 PHE 101 CB -0.0060 0.0060 0.0058 786 PHE 101 O -0.0066 0.0063 0.0058 787 PHE 101 CG -0.0035 0.0078 0.0090 788 PHE 101 CD1 -0.0037 0.0115 0.0135 789 PHE 101 CD2 -0.0009 0.0058 0.0077 790 PHE 101 CE1 -0.0014 0.0131 0.0165 791 PHE 101 CE2 0.0014 0.0075 0.0107 792 PHE 101 CZ 0.0012 0.0111 0.0151 793 LYS 102 N -0.0121 0.0105 -0.0018 794 LYS 102 CA -0.0145 0.0080 -0.0133 795 LYS 102 C 0.0003 0.0007 -0.0104 796 LYS 102 CB -0.0180 0.0035 -0.0326 797 LYS 102 O -0.0013 0.0018 -0.0099 798 LYS 102 CG -0.0249 0.0031 -0.0451 799 LYS 102 CD -0.0301 -0.0002 -0.0637 800 LYS 102 CE -0.0366 -0.0008 -0.0763 801 LYS 102 NZ -0.0417 -0.0041 -0.0946 802 LYS 103 N 0.0050 -0.0005 -0.0031 803 LYS 103 CA 0.0070 -0.0018 -0.0027 804 LYS 103 C 0.0072 -0.0022 -0.0006 805 LYS 103 CB 0.0080 -0.0025 -0.0027 806 LYS 103 O 0.0085 -0.0030 -0.0005 807 LYS 103 CG 0.0102 -0.0038 -0.0027 808 LYS 103 CD 0.0112 -0.0044 -0.0029 809 LYS 103 CE 0.0133 -0.0058 -0.0029 810 LYS 103 NZ 0.0143 -0.0063 -0.0033 811 HIS 104 N 0.0044 0.0011 0.0083 812 HIS 104 CA 0.0049 0.0013 0.0116 813 HIS 104 C 0.0023 0.0010 0.0138 814 HIS 104 CB 0.0050 0.0013 0.0118 815 HIS 104 O 0.0024 0.0012 0.0168 816 HIS 104 CG 0.0079 0.0017 0.0103 817 HIS 104 CD2 0.0107 0.0023 0.0117 818 HIS 104 ND1 0.0082 0.0016 0.0070 819 HIS 104 CE1 0.0110 0.0020 0.0064 820 HIS 104 NE2 0.0126 0.0024 0.0092 821 GLY 105 N -0.0034 0.0063 0.0135 822 GLY 105 CA -0.0169 0.0117 0.0174 823 GLY 105 C -0.0243 0.0180 0.0267 824 GLY 105 O -0.0314 0.0240 0.0355 825 ILE 106 N -0.0135 0.0131 0.0184 826 ILE 106 CA -0.0144 0.0176 0.0223 827 ILE 106 C -0.0171 0.0181 0.0203 828 ILE 106 CB -0.0094 0.0176 0.0272 829 ILE 106 O -0.0145 0.0160 0.0206 830 ILE 106 CG1 -0.0064 0.0164 0.0289 831 ILE 106 CG2 -0.0104 0.0225 0.0314 832 ILE 106 CD1 -0.0010 0.0155 0.0332 833 GLU 107 N -0.0503 0.0230 0.0267 834 GLU 107 CA -0.0597 0.0136 0.0181 835 GLU 107 C -0.0618 0.0183 0.0225 836 GLU 107 CB -0.0777 0.0106 0.0156 837 GLU 107 O -0.0618 0.0105 0.0153 838 GLU 107 CG -0.0769 0.0033 0.0089 839 GLU 107 CD -0.0948 0.0007 0.0067 840 GLU 107 OE1 -0.1027 -0.0095 -0.0027 841 GLU 107 OE2 -0.1011 0.0090 0.0144 842 LYS 108 N -0.0623 0.0170 0.0191 843 LYS 108 CA -0.0780 0.0370 0.0392 844 LYS 108 C -0.0274 0.0307 0.0348 845 LYS 108 CB -0.0918 0.0839 0.0872 846 LYS 108 O -0.0391 0.0241 0.0274 847 LYS 108 CG -0.1550 0.0939 0.0949 848 LYS 108 CD -0.1704 0.1407 0.1428 849 LYS 108 CE -0.2334 0.1508 0.1507 850 LYS 108 NZ -0.2478 0.1969 0.1977 851 VAL 109 N -0.0228 0.0278 0.0308 852 VAL 109 CA -0.0129 0.0275 0.0282 853 VAL 109 C -0.0109 0.0182 0.0220 854 VAL 109 CB -0.0051 0.0325 0.0293 855 VAL 109 O -0.0057 0.0160 0.0194 856 VAL 109 CG1 0.0052 0.0318 0.0263 857 VAL 109 CG2 -0.0069 0.0420 0.0355 858 ALA 110 N -0.0147 0.0097 0.0186 859 ALA 110 CA -0.0133 0.0001 0.0131 860 ALA 110 C -0.0159 -0.0040 0.0116 861 ALA 110 CB -0.0198 -0.0051 0.0119 862 ALA 110 O -0.0106 -0.0093 0.0074 863 GLU 111 N -0.0251 -0.0054 0.0171 864 GLU 111 CA -0.0325 -0.0114 0.0151 865 GLU 111 C -0.0100 -0.0022 0.0169 866 GLU 111 CB -0.0596 0.0000 0.0232 867 GLU 111 O -0.0035 -0.0152 0.0102 868 GLU 111 CG -0.0847 -0.0134 0.0197 869 GLU 111 CD -0.1116 -0.0034 0.0272 870 GLU 111 OE1 -0.1231 -0.0130 0.0239 871 GLU 111 OE2 -0.1214 0.0142 0.0364 872 GLN 112 N -0.0154 0.0021 0.0194 873 GLN 112 CA -0.0064 0.0055 0.0146 874 GLN 112 C 0.0033 0.0015 0.0072 875 GLN 112 CB -0.0046 0.0189 0.0173 876 GLN 112 O 0.0096 -0.0026 0.0020 877 GLN 112 CG -0.0130 0.0234 0.0241 878 GLN 112 CD -0.0092 0.0351 0.0251 879 GLN 112 NE2 -0.0119 0.0448 0.0296 880 GLN 112 OE1 -0.0039 0.0354 0.0217 881 VAL 113 N 0.0055 -0.0009 0.0083 882 VAL 113 CA 0.0078 -0.0014 0.0062 883 VAL 113 C 0.0084 -0.0061 0.0058 884 VAL 113 CB 0.0068 0.0008 0.0071 885 VAL 113 O 0.0110 -0.0075 0.0033 886 VAL 113 CG1 0.0091 -0.0002 0.0050 887 VAL 113 CG2 0.0065 0.0055 0.0073 888 MET 114 N 0.0020 -0.0074 0.0092 889 MET 114 CA 0.0032 -0.0133 0.0102 890 MET 114 C 0.0087 -0.0111 0.0102 891 MET 114 CB -0.0039 -0.0156 0.0100 892 MET 114 O 0.0128 -0.0156 0.0112 893 MET 114 CG -0.0092 -0.0194 0.0102 894 MET 114 SD -0.0172 -0.0229 0.0101 895 MET 114 CE -0.0223 -0.0265 0.0103 896 LYS 115 N 0.0105 -0.0163 0.0060 897 LYS 115 CA 0.0128 -0.0156 0.0056 898 LYS 115 C 0.0189 -0.0152 0.0043 899 LYS 115 CB 0.0107 -0.0107 0.0069 900 LYS 115 O 0.0216 -0.0162 0.0035 901 LYS 115 CG 0.0051 -0.0114 0.0080 902 LYS 115 CD 0.0034 -0.0066 0.0092 903 LYS 115 CE -0.0023 -0.0073 0.0104 904 LYS 115 NZ -0.0040 -0.0025 0.0116 905 ALA 116 N 0.0132 -0.0108 0.0036 906 ALA 116 CA 0.0106 -0.0100 0.0011 907 ALA 116 C 0.0099 -0.0085 0.0027 908 ALA 116 CB 0.0077 -0.0083 0.0000 909 ALA 116 O 0.0083 -0.0083 0.0008 910 ASP 117 N 0.0163 -0.0125 0.0072 911 ASP 117 CA 0.0149 -0.0084 0.0095 912 ASP 117 C 0.0160 -0.0107 0.0084 913 ASP 117 CB 0.0183 -0.0046 0.0144 914 ASP 117 O 0.0204 -0.0110 0.0108 915 ASP 117 CG 0.0166 0.0001 0.0169 916 ASP 117 OD1 0.0118 0.0016 0.0151 917 ASP 117 OD2 0.0202 0.0023 0.0207 918 ALA 118 N 0.0120 -0.0114 0.0056 919 ALA 118 CA 0.0124 -0.0144 0.0037 920 ALA 118 C 0.0125 -0.0106 0.0064 921 ALA 118 CB 0.0073 -0.0170 -0.0012 922 ALA 118 O 0.0157 -0.0124 0.0070 923 ASN 119 N 0.0100 -0.0040 0.0086 924 ASN 119 CA 0.0084 0.0018 0.0108 925 ASN 119 C 0.0147 0.0069 0.0157 926 ASN 119 CB 0.0003 0.0066 0.0099 927 ASN 119 O 0.0144 0.0120 0.0181 928 ASN 119 CG -0.0002 0.0113 0.0120 929 ASN 119 ND2 -0.0070 0.0158 0.0115 930 ASN 119 OD1 0.0055 0.0110 0.0141 931 GLY 120 N 0.0184 0.0041 0.0182 932 GLY 120 CA 0.0277 0.0095 0.0228 933 GLY 120 C 0.0259 0.0208 0.0257 934 GLY 120 O 0.0313 0.0272 0.0293 935 ASP 121 N 0.0191 0.0220 0.0232 936 ASP 121 CA 0.0165 0.0300 0.0264 937 ASP 121 C 0.0199 0.0321 0.0283 938 ASP 121 CB 0.0070 0.0316 0.0247 939 ASP 121 O 0.0186 0.0387 0.0311 940 ASP 121 CG 0.0029 0.0276 0.0218 941 ASP 121 OD1 0.0073 0.0230 0.0207 942 ASP 121 OD2 -0.0047 0.0291 0.0206 943 GLY 122 N 0.0235 0.0257 0.0247 944 GLY 122 CA 0.0239 0.0252 0.0241 945 GLY 122 C 0.0172 0.0223 0.0224 946 GLY 122 O 0.0169 0.0215 0.0216 947 TYR 123 N 0.0128 0.0228 0.0189 948 TYR 123 CA 0.0072 0.0199 0.0174 949 TYR 123 C 0.0053 0.0142 0.0137 950 TYR 123 CB 0.0010 0.0235 0.0205 951 TYR 123 O 0.0055 0.0138 0.0134 952 TYR 123 CG 0.0023 0.0291 0.0243 953 TYR 123 CD1 0.0018 0.0298 0.0248 954 TYR 123 CD2 0.0042 0.0338 0.0273 955 TYR 123 CE1 0.0030 0.0350 0.0283 956 TYR 123 CE2 0.0055 0.0391 0.0308 957 TYR 123 OH 0.0061 0.0448 0.0347 958 TYR 123 CZ 0.0049 0.0396 0.0313 959 ILE 124 N 0.0023 0.0094 0.0100 960 ILE 124 CA 0.0011 0.0065 0.0071 961 ILE 124 C -0.0031 0.0072 0.0060 962 ILE 124 CB 0.0029 0.0043 0.0061 963 ILE 124 O -0.0047 0.0083 0.0063 964 ILE 124 CG1 0.0071 0.0038 0.0073 965 ILE 124 CG2 0.0016 0.0013 0.0031 966 ILE 124 CD1 0.0090 0.0021 0.0067 967 THR 125 N -0.0044 0.0091 0.0043 968 THR 125 CA -0.0102 0.0099 0.0022 969 THR 125 C -0.0118 0.0051 -0.0009 970 THR 125 CB -0.0135 0.0110 0.0015 971 THR 125 O -0.0086 0.0009 -0.0018 972 THR 125 CG2 -0.0124 0.0159 0.0046 973 THR 125 OG1 -0.0121 0.0067 -0.0002 974 LEU 126 N -0.0093 0.0050 -0.0085 975 LEU 126 CA -0.0097 0.0026 -0.0079 976 LEU 126 C -0.0119 -0.0008 -0.0082 977 LEU 126 CB -0.0109 0.0044 -0.0093 978 LEU 126 O -0.0113 -0.0037 -0.0069 979 LEU 126 CG -0.0113 0.0022 -0.0088 980 LEU 126 CD1 -0.0080 0.0016 -0.0066 981 LEU 126 CD2 -0.0130 0.0040 -0.0104 982 GLU 127 N -0.0165 0.0019 -0.0128 983 GLU 127 CA -0.0200 -0.0044 -0.0147 984 GLU 127 C -0.0157 -0.0097 -0.0116 985 GLU 127 CB -0.0250 -0.0020 -0.0181 986 GLU 127 O -0.0164 -0.0164 -0.0116 987 GLU 127 CG -0.0302 0.0021 -0.0216 988 GLU 127 CD -0.0353 0.0042 -0.0250 989 GLU 127 OE1 -0.0401 0.0001 -0.0278 990 GLU 127 OE2 -0.0346 0.0100 -0.0249 991 GLU 128 N -0.0125 -0.0037 -0.0077 992 GLU 128 CA -0.0080 -0.0070 -0.0058 993 GLU 128 C -0.0062 -0.0091 -0.0055 994 GLU 128 CB -0.0051 -0.0042 -0.0018 995 GLU 128 O -0.0039 -0.0135 -0.0060 996 GLU 128 CG -0.0059 -0.0030 -0.0018 997 GLU 128 CD -0.0030 -0.0002 0.0021 998 GLU 128 OE1 -0.0006 -0.0021 0.0031 999 GLU 128 OE2 -0.0032 0.0039 0.0043 1000 PHE 129 N -0.0053 -0.0068 -0.0045 1001 PHE 129 CA -0.0034 -0.0078 -0.0028 1002 PHE 129 C -0.0049 -0.0109 -0.0041 1003 PHE 129 CB -0.0028 -0.0040 -0.0022 1004 PHE 129 O -0.0034 -0.0137 -0.0028 1005 PHE 129 CG -0.0005 -0.0046 -0.0001 1006 PHE 129 CD1 -0.0014 -0.0050 -0.0009 1007 PHE 129 CD2 0.0024 -0.0047 0.0026 1008 PHE 129 CE1 0.0007 -0.0055 0.0010 1009 PHE 129 CE2 0.0046 -0.0052 0.0045 1010 PHE 129 CZ 0.0037 -0.0056 0.0037 1011 LEU 130 N -0.0094 -0.0122 -0.0090 1012 LEU 130 CA -0.0113 -0.0155 -0.0084 1013 LEU 130 C -0.0141 -0.0200 -0.0077 1014 LEU 130 CB -0.0138 -0.0136 -0.0117 1015 LEU 130 O -0.0144 -0.0235 -0.0057 1016 LEU 130 CG -0.0113 -0.0098 -0.0122 1017 LEU 130 CD1 -0.0142 -0.0080 -0.0158 1018 LEU 130 CD2 -0.0086 -0.0113 -0.0089 1019 GLU 131 N -0.0167 -0.0172 -0.0088 1020 GLU 131 CA -0.0184 -0.0220 -0.0089 1021 GLU 131 C -0.0179 -0.0243 -0.0042 1022 GLU 131 CB -0.0196 -0.0238 -0.0114 1023 GLU 131 O -0.0189 -0.0278 -0.0035 1024 GLU 131 CG -0.0210 -0.0236 -0.0165 1025 GLU 131 CD -0.0225 -0.0262 -0.0188 1026 GLU 131 OE1 -0.0240 -0.0302 -0.0193 1027 GLU 131 OE2 -0.0221 -0.0241 -0.0202 1028 PHE 132 N -0.0052 -0.0124 -0.0017 1029 PHE 132 CA -0.0013 -0.0134 -0.0036 1030 PHE 132 C -0.0008 -0.0186 -0.0039 1031 PHE 132 CB 0.0024 -0.0115 -0.0052 1032 PHE 132 O 0.0011 -0.0202 -0.0048 1033 PHE 132 CG 0.0065 -0.0120 -0.0072 1034 PHE 132 CD1 0.0093 -0.0154 -0.0086 1035 PHE 132 CD2 0.0077 -0.0090 -0.0077 1036 PHE 132 CE1 0.0132 -0.0158 -0.0104 1037 PHE 132 CE2 0.0116 -0.0094 -0.0096 1038 PHE 132 CZ 0.0143 -0.0128 -0.0109 1039 SER 133 N -0.0061 -0.0356 0.0032 1040 SER 133 CA -0.0035 -0.0407 0.0078 1041 SER 133 C -0.0113 -0.0486 0.0058 1042 SER 133 CB 0.0007 -0.0334 0.0072 1043 SER 133 O -0.0102 -0.0552 0.0100 1044 SER 133 OG 0.0039 -0.0383 0.0121 1045 LEU 134 N -0.0160 -0.0562 0.0060 1046 LEU 134 CA -0.0321 -0.0690 0.0108 1047 LEU 134 C -0.0423 -0.0784 0.0153 1048 LEU 134 CB -0.0463 -0.0638 -0.0021 1049 LEU 134 O -0.0490 -0.0922 0.0261 1050 LEU 134 CG -0.0463 -0.0660 0.0003 1051 LEU 134 CD1 -0.0416 -0.0510 -0.0129 1052 LEU 134 CD2 -0.0655 -0.0769 0.0014