1 GLY 1 N -0.0204 0.0179 -0.0213 2 GLY 1 CA -0.0112 0.0199 -0.0135 3 GLY 1 C -0.0072 0.0113 -0.0043 4 GLY 1 O -0.0096 0.0060 -0.0031 5 ARG 2 N -0.0043 0.0049 -0.0034 6 ARG 2 CA -0.0005 0.0034 -0.0054 7 ARG 2 C 0.0034 0.0026 -0.0077 8 ARG 2 O 0.0032 -0.0003 -0.0073 9 ARG 2 CB -0.0013 -0.0016 -0.0045 10 ARG 2 CG 0.0021 -0.0028 -0.0063 11 ARG 2 CD 0.0015 -0.0078 -0.0055 12 ARG 2 NE -0.0024 -0.0071 -0.0033 13 ARG 2 CZ -0.0030 -0.0095 -0.0026 14 ARG 2 NH1 -0.0002 -0.0130 -0.0040 15 ARG 2 NH2 -0.0067 -0.0084 -0.0006 16 ILE 3 N 0.0223 0.0051 0.0275 17 ILE 3 CA 0.0042 -0.0196 -0.0039 18 ILE 3 C -0.0042 -0.0174 -0.0271 19 ILE 3 O 0.0018 0.0144 -0.0323 20 ILE 3 CB -0.0022 -0.0081 -0.0281 21 ILE 3 CG1 0.0041 -0.0185 -0.0049 22 ILE 3 CG2 -0.0216 -0.0285 -0.0655 23 ILE 3 CD1 0.0006 -0.0029 -0.0241 24 ALA 4 N 0.0210 -0.0250 -0.0156 25 ALA 4 CA 0.0220 -0.0242 -0.0128 26 ALA 4 C 0.0212 -0.0267 -0.0097 27 ALA 4 O 0.0210 -0.0277 -0.0079 28 ALA 4 CB 0.0242 -0.0211 -0.0115 29 SER 5 N 0.0211 -0.0163 -0.0092 30 SER 5 CA 0.0208 -0.0214 -0.0072 31 SER 5 C 0.0230 -0.0233 -0.0041 32 SER 5 O 0.0237 -0.0272 -0.0017 33 SER 5 CB 0.0166 -0.0246 -0.0100 34 SER 5 OG 0.0149 -0.0240 -0.0119 35 ILE 6 N 0.0143 -0.0090 -0.0005 36 ILE 6 CA 0.0143 -0.0052 0.0021 37 ILE 6 C 0.0131 -0.0040 0.0039 38 ILE 6 O 0.0144 -0.0044 0.0025 39 ILE 6 CB 0.0180 -0.0025 0.0008 40 ILE 6 CG1 0.0190 -0.0035 -0.0007 41 ILE 6 CG2 0.0182 0.0016 0.0035 42 ILE 6 CD1 0.0228 -0.0020 -0.0030 43 PRO 7 N 0.0079 0.0022 0.0036 44 PRO 7 CA 0.0048 0.0031 0.0048 45 PRO 7 C 0.0070 0.0050 0.0043 46 PRO 7 O 0.0093 0.0086 0.0041 47 PRO 7 CB 0.0018 0.0066 0.0065 48 PRO 7 CG 0.0017 0.0053 0.0063 49 PRO 7 CD 0.0063 0.0038 0.0044 50 GLY 8 N 0.0110 -0.0038 -0.0038 51 GLY 8 CA 0.0110 -0.0028 -0.0040 52 GLY 8 C 0.0138 -0.0048 -0.0045 53 GLY 8 O 0.0136 -0.0049 -0.0044 54 GLU 9 N 0.0199 -0.0109 -0.0050 55 GLU 9 CA 0.0194 -0.0105 -0.0055 56 GLU 9 C 0.0194 -0.0097 -0.0051 57 GLU 9 O 0.0190 -0.0090 -0.0053 58 GLU 9 CB 0.0193 -0.0112 -0.0058 59 GLU 9 CG 0.0187 -0.0109 -0.0064 60 GLU 9 CD 0.0187 -0.0117 -0.0067 61 GLU 9 OE1 0.0192 -0.0124 -0.0065 62 GLU 9 OE2 0.0183 -0.0116 -0.0071 63 ALA 10 N 0.0249 -0.0144 -0.0037 64 ALA 10 CA 0.0254 -0.0090 0.0004 65 ALA 10 C 0.0243 -0.0092 0.0003 66 ALA 10 O 0.0207 -0.0057 0.0031 67 ALA 10 CB 0.0327 -0.0064 0.0023 68 GLU 11 N 0.0207 -0.0081 -0.0047 69 GLU 11 CA 0.0162 -0.0078 -0.0050 70 GLU 11 C 0.0136 -0.0075 -0.0055 71 GLU 11 O 0.0102 -0.0082 -0.0039 72 GLU 11 CB 0.0157 -0.0060 -0.0085 73 GLU 11 CG 0.0112 -0.0056 -0.0091 74 GLU 11 CD 0.0109 -0.0037 -0.0130 75 GLU 11 OE1 0.0141 -0.0027 -0.0150 76 GLU 11 OE2 0.0073 -0.0031 -0.0140 77 TYR 12 N 0.0071 -0.0057 -0.0062 78 TYR 12 CA 0.0046 -0.0050 -0.0073 79 TYR 12 C 0.0048 -0.0052 -0.0060 80 TYR 12 O 0.0033 -0.0047 -0.0072 81 TYR 12 CB 0.0045 -0.0045 -0.0110 82 TYR 12 CG 0.0034 -0.0041 -0.0122 83 TYR 12 CD1 0.0002 -0.0034 -0.0120 84 TYR 12 CD2 0.0056 -0.0044 -0.0134 85 TYR 12 CE1 -0.0008 -0.0031 -0.0129 86 TYR 12 CE2 0.0046 -0.0041 -0.0143 87 TYR 12 CZ 0.0014 -0.0034 -0.0140 88 TYR 12 OH 0.0005 -0.0031 -0.0146 89 LEU 13 N 0.0092 -0.0079 0.0006 90 LEU 13 CA 0.0070 -0.0063 0.0037 91 LEU 13 C -0.0003 -0.0029 0.0070 92 LEU 13 O -0.0014 -0.0012 0.0115 93 LEU 13 CB 0.0130 -0.0064 0.0093 94 LEU 13 CG 0.0119 -0.0053 0.0119 95 LEU 13 CD1 0.0121 -0.0073 0.0055 96 LEU 13 CD2 0.0178 -0.0053 0.0180 97 GLY 14 N -0.0021 -0.0035 0.0078 98 GLY 14 CA -0.0116 0.0061 0.0100 99 GLY 14 C -0.0159 0.0075 0.0069 100 GLY 14 O -0.0235 0.0152 0.0087 101 ARG 15 N -0.0066 0.0014 -0.0084 102 ARG 15 CA -0.0071 0.0003 -0.0098 103 ARG 15 C -0.0072 -0.0012 -0.0116 104 ARG 15 O -0.0065 -0.0023 -0.0130 105 ARG 15 CB -0.0052 0.0002 -0.0099 106 ARG 15 CG -0.0051 0.0015 -0.0083 107 ARG 15 CD -0.0038 0.0012 -0.0087 108 ARG 15 NE -0.0013 0.0010 -0.0091 109 ARG 15 CZ 0.0002 0.0002 -0.0102 110 ARG 15 NH1 -0.0004 -0.0006 -0.0111 111 ARG 15 NH2 0.0024 0.0001 -0.0103 112 GLY 16 N -0.0081 -0.0017 -0.0047 113 GLY 16 CA -0.0081 -0.0021 -0.0053 114 GLY 16 C -0.0076 -0.0019 -0.0051 115 GLY 16 O -0.0078 -0.0021 -0.0053 116 VAL 17 N -0.0046 -0.0060 -0.0058 117 VAL 17 CA -0.0011 -0.0071 -0.0056 118 VAL 17 C -0.0016 -0.0066 -0.0030 119 VAL 17 O -0.0029 -0.0057 0.0003 120 VAL 17 CB 0.0023 -0.0080 -0.0041 121 VAL 17 CG1 0.0059 -0.0092 -0.0038 122 VAL 17 CG2 0.0029 -0.0086 -0.0070 123 SER 18 N -0.0056 -0.0115 0.0018 124 SER 18 CA -0.0050 -0.0121 0.0030 125 SER 18 C -0.0023 -0.0128 0.0024 126 SER 18 O -0.0009 -0.0126 0.0007 127 SER 18 CB -0.0066 -0.0113 0.0021 128 SER 18 OG -0.0061 -0.0119 0.0033 129 TYR 19 N -0.0002 -0.0232 -0.0016 130 TYR 19 CA -0.0015 -0.0216 -0.0004 131 TYR 19 C -0.0030 -0.0218 0.0013 132 TYR 19 O -0.0041 -0.0203 0.0023 133 TYR 19 CB -0.0011 -0.0190 -0.0012 134 TYR 19 CG 0.0004 -0.0187 -0.0029 135 TYR 19 CD1 0.0006 -0.0187 -0.0031 136 TYR 19 CD2 0.0017 -0.0183 -0.0044 137 TYR 19 CE1 0.0021 -0.0183 -0.0047 138 TYR 19 CE2 0.0032 -0.0179 -0.0060 139 TYR 19 CZ 0.0033 -0.0179 -0.0062 140 TYR 19 OH 0.0048 -0.0176 -0.0079 141 CYS 20 N -0.0091 -0.0395 0.0110 142 CYS 20 CA 0.0106 -0.0451 0.0082 143 CYS 20 C 0.0098 -0.0236 0.0006 144 CYS 20 O -0.0063 -0.0219 0.0040 145 CYS 20 CB 0.0061 -0.0708 0.0184 146 CYS 20 SG 0.0342 -0.0816 0.0155 147 ALA 21 N -0.0065 -0.0212 -0.0026 148 ALA 21 CA -0.0038 -0.0100 -0.0056 149 ALA 21 C 0.0005 -0.0047 -0.0126 150 ALA 21 O 0.0012 0.0056 -0.0121 151 ALA 21 CB -0.0011 -0.0102 -0.0107 152 THR 22 N 0.0061 -0.0182 -0.0465 153 THR 22 CA 0.0175 0.0039 -0.0743 154 THR 22 C -0.0109 0.0233 -0.0329 155 THR 22 O -0.0103 0.0639 -0.0493 156 THR 22 CB 0.0496 -0.0445 -0.1112 157 THR 22 OG1 0.0449 -0.1066 -0.0797 158 THR 22 CG2 0.0809 -0.0528 -0.1619 159 CYS 23 N -0.0253 0.0015 -0.0216 160 CYS 23 CA -0.0288 0.0418 0.0201 161 CYS 23 C -0.0329 0.0510 0.0241 162 CYS 23 O -0.0588 0.0900 0.0262 163 CYS 23 CB 0.0049 0.0338 0.0682 164 CYS 23 SG -0.0047 0.0888 0.1171 165 ASP 24 N -0.0104 0.0125 0.0001 166 ASP 24 CA -0.0123 0.0151 0.0017 167 ASP 24 C -0.0138 0.0168 -0.0041 168 ASP 24 O -0.0156 0.0194 -0.0034 169 ASP 24 CB -0.0096 0.0115 0.0056 170 ASP 24 CG -0.0082 0.0100 0.0118 171 ASP 24 OD1 -0.0094 0.0118 0.0135 172 ASP 24 OD2 -0.0058 0.0068 0.0150 173 GLY 25 N -0.0070 0.0163 -0.0052 174 GLY 25 CA -0.0067 0.0166 -0.0039 175 GLY 25 C -0.0064 0.0135 -0.0037 176 GLY 25 O -0.0065 0.0135 -0.0041 177 ALA 26 N -0.0085 0.0129 -0.0027 178 ALA 26 CA -0.0074 0.0113 -0.0023 179 ALA 26 C -0.0071 0.0106 -0.0033 180 ALA 26 O -0.0064 0.0097 -0.0027 181 ALA 26 CB -0.0068 0.0103 -0.0026 182 PHE 27 N -0.0125 0.0091 0.0119 183 PHE 27 CA -0.0186 0.0027 -0.0065 184 PHE 27 C -0.0201 0.0136 -0.0134 185 PHE 27 O -0.0245 0.0074 -0.0264 186 PHE 27 CB -0.0229 0.0052 -0.0210 187 PHE 27 CG -0.0214 -0.0054 -0.0143 188 PHE 27 CD1 -0.0174 0.0047 -0.0033 189 PHE 27 CD2 -0.0240 -0.0251 -0.0191 190 PHE 27 CE1 -0.0160 -0.0044 0.0030 191 PHE 27 CE2 -0.0226 -0.0343 -0.0130 192 PHE 27 CZ -0.0186 -0.0240 -0.0018 193 TYR 28 N -0.0084 0.0102 -0.0081 194 TYR 28 CA -0.0090 0.0104 -0.0063 195 TYR 28 C -0.0079 0.0108 -0.0054 196 TYR 28 O -0.0085 0.0109 -0.0041 197 TYR 28 CB -0.0109 0.0100 -0.0061 198 TYR 28 CG -0.0119 0.0096 -0.0068 199 TYR 28 CD1 -0.0122 0.0097 -0.0057 200 TYR 28 CD2 -0.0125 0.0091 -0.0085 201 TYR 28 CE1 -0.0130 0.0094 -0.0064 202 TYR 28 CE2 -0.0133 0.0088 -0.0092 203 TYR 28 CZ -0.0135 0.0089 -0.0081 204 TYR 28 OH -0.0143 0.0086 -0.0089 205 ARG 29 N -0.0030 0.0137 -0.0036 206 ARG 29 CA -0.0006 0.0096 0.0037 207 ARG 29 C 0.0029 0.0060 0.0070 208 ARG 29 O 0.0078 0.0037 0.0030 209 ARG 29 CB 0.0042 0.0064 0.0026 210 ARG 29 CG 0.0055 0.0029 0.0107 211 ARG 29 CD 0.0106 -0.0006 0.0100 212 ARG 29 NE 0.0084 0.0027 0.0048 213 ARG 29 CZ 0.0035 0.0055 0.0073 214 ARG 29 NH1 0.0003 0.0055 0.0148 215 ARG 29 NH2 0.0019 0.0083 0.0020 216 ASN 30 N 0.0026 -0.0070 0.0052 217 ASN 30 CA 0.0062 -0.0104 0.0157 218 ASN 30 C -0.0025 -0.0020 -0.0044 219 ASN 30 O 0.0062 -0.0109 -0.0078 220 ASN 30 CB 0.0290 -0.0334 0.0239 221 ASN 30 CG 0.0343 -0.0383 0.0515 222 ASN 30 OD1 0.0452 -0.0493 0.0513 223 ASN 30 ND2 0.0263 -0.0297 0.0765 224 ARG 31 N -0.0037 0.0020 0.0057 225 ARG 31 CA -0.0051 0.0036 0.0030 226 ARG 31 C -0.0094 0.0066 0.0052 227 ARG 31 O -0.0115 0.0078 0.0077 228 ARG 31 CB -0.0049 0.0047 -0.0027 229 ARG 31 CG -0.0005 0.0017 -0.0053 230 ARG 31 CD -0.0002 0.0026 -0.0111 231 ARG 31 NE 0.0040 -0.0003 -0.0131 232 ARG 31 CZ 0.0073 -0.0028 -0.0136 233 ARG 31 NH1 0.0070 -0.0028 -0.0126 234 ARG 31 NH2 0.0109 -0.0054 -0.0151 235 GLU 32 N -0.0086 0.0061 0.0035 236 GLU 32 CA -0.0092 0.0039 0.0034 237 GLU 32 C -0.0103 0.0002 0.0034 238 GLU 32 O -0.0115 -0.0005 0.0052 239 GLU 32 CB -0.0106 0.0049 0.0062 240 GLU 32 CG -0.0097 0.0085 0.0065 241 GLU 32 CD -0.0089 0.0086 0.0052 242 GLU 32 OE1 -0.0071 0.0103 0.0030 243 GLU 32 OE2 -0.0100 0.0069 0.0062 244 VAL 33 N -0.0069 0.0008 0.0013 245 VAL 33 CA -0.0062 -0.0004 0.0021 246 VAL 33 C -0.0055 -0.0031 0.0016 247 VAL 33 O -0.0056 -0.0041 0.0001 248 VAL 33 CB -0.0068 0.0004 0.0011 249 VAL 33 CG1 -0.0075 0.0031 0.0016 250 VAL 33 CG2 -0.0072 -0.0004 -0.0016 251 VAL 34 N -0.0041 -0.0029 0.0010 252 VAL 34 CA -0.0042 -0.0040 0.0011 253 VAL 34 C -0.0036 -0.0058 0.0003 254 VAL 34 O -0.0038 -0.0067 0.0004 255 VAL 34 CB -0.0055 -0.0045 0.0025 256 VAL 34 CG1 -0.0056 -0.0057 0.0024 257 VAL 34 CG2 -0.0061 -0.0027 0.0033 258 VAL 35 N 0.0009 -0.0005 -0.0011 259 VAL 35 CA 0.0009 0.0008 -0.0002 260 VAL 35 C 0.0018 0.0017 -0.0007 261 VAL 35 O 0.0019 0.0013 -0.0012 262 VAL 35 CB -0.0001 0.0008 0.0010 263 VAL 35 CG1 -0.0001 0.0022 0.0019 264 VAL 35 CG2 -0.0010 -0.0000 0.0015 265 VAL 36 N 0.0012 0.0012 0.0008 266 VAL 36 CA 0.0026 0.0021 0.0002 267 VAL 36 C 0.0019 0.0039 0.0014 268 VAL 36 O 0.0017 0.0056 0.0022 269 VAL 36 CB 0.0048 0.0029 -0.0007 270 VAL 36 CG1 0.0063 0.0030 -0.0016 271 VAL 36 CG2 0.0053 0.0015 -0.0016 272 GLY 37 N 0.0028 0.0091 0.0026 273 GLY 37 CA 0.0024 0.0115 0.0040 274 GLY 37 C 0.0011 0.0111 0.0059 275 GLY 37 O 0.0001 0.0091 0.0067 276 LEU 38 N -0.0050 0.0197 0.0209 277 LEU 38 CA -0.0073 0.0188 0.0203 278 LEU 38 C -0.0058 0.0226 0.0263 279 LEU 38 O 0.0003 0.0246 0.0273 280 LEU 38 CB -0.0029 0.0162 0.0142 281 LEU 38 CG -0.0044 0.0151 0.0129 282 LEU 38 CD1 -0.0125 0.0130 0.0123 283 LEU 38 CD2 0.0002 0.0125 0.0066 284 ASN 39 N 0.0005 0.0187 0.0189 285 ASN 39 CA 0.0016 0.0184 0.0210 286 ASN 39 C 0.0018 0.0162 0.0228 287 ASN 39 O 0.0009 0.0150 0.0221 288 ASN 39 CB 0.0010 0.0178 0.0203 289 ASN 39 CG -0.0008 0.0157 0.0188 290 ASN 39 OD1 -0.0012 0.0135 0.0195 291 ASN 39 ND2 -0.0018 0.0165 0.0165 292 PRO 40 N 0.0018 0.0179 0.0250 293 PRO 40 CA 0.0033 0.0172 0.0252 294 PRO 40 C 0.0023 0.0161 0.0251 295 PRO 40 O 0.0029 0.0166 0.0252 296 PRO 40 CB 0.0050 0.0158 0.0254 297 PRO 40 CG 0.0050 0.0167 0.0254 298 PRO 40 CD 0.0026 0.0173 0.0251 299 GLU 41 N 0.0080 0.0185 0.0235 300 GLU 41 CA 0.0042 0.0128 0.0220 301 GLU 41 C 0.0009 0.0129 0.0178 302 GLU 41 O -0.0005 0.0088 0.0184 303 GLU 41 CB 0.0020 0.0116 0.0199 304 GLU 41 CG -0.0016 0.0052 0.0191 305 GLU 41 CD -0.0039 0.0046 0.0166 306 GLU 41 OE1 -0.0031 0.0093 0.0149 307 GLU 41 OE2 -0.0064 -0.0006 0.0164 308 ALA 42 N -0.0004 0.0107 0.0156 309 ALA 42 CA -0.0004 0.0095 0.0144 310 ALA 42 C -0.0018 0.0084 0.0140 311 ALA 42 O -0.0026 0.0076 0.0136 312 ALA 42 CB 0.0012 0.0092 0.0134 313 VAL 43 N -0.0011 0.0104 0.0143 314 VAL 43 CA -0.0006 0.0115 0.0132 315 VAL 43 C -0.0006 0.0122 0.0128 316 VAL 43 O -0.0008 0.0136 0.0126 317 VAL 43 CB 0.0003 0.0107 0.0120 318 VAL 43 CG1 0.0008 0.0117 0.0107 319 VAL 43 CG2 0.0003 0.0102 0.0122 320 GLU 44 N 0.0026 0.0125 0.0166 321 GLU 44 CA -0.0011 0.0117 0.0197 322 GLU 44 C 0.0037 0.0077 0.0154 323 GLU 44 O 0.0013 0.0013 0.0170 324 GLU 44 CB -0.0043 0.0216 0.0232 325 GLU 44 CG -0.0106 0.0238 0.0287 326 GLU 44 CD -0.0134 0.0340 0.0318 327 GLU 44 OE1 -0.0154 0.0371 0.0336 328 GLU 44 OE2 -0.0138 0.0388 0.0324 329 GLU 45 N 0.0032 -0.0000 0.0077 330 GLU 45 CA 0.0003 -0.0021 0.0059 331 GLU 45 C 0.0005 0.0046 0.0096 332 GLU 45 O 0.0031 0.0031 0.0094 333 GLU 45 CB -0.0092 -0.0049 0.0021 334 GLU 45 CG -0.0093 -0.0133 -0.0024 335 GLU 45 CD -0.0050 -0.0204 -0.0053 336 GLU 45 OE1 -0.0103 -0.0243 -0.0087 337 GLU 45 OE2 0.0035 -0.0217 -0.0041 338 ALA 46 N 0.0029 0.0046 0.0056 339 ALA 46 CA 0.0038 0.0067 0.0078 340 ALA 46 C 0.0067 0.0080 0.0072 341 ALA 46 O 0.0082 0.0096 0.0082 342 ALA 46 CB 0.0020 0.0071 0.0096 343 GLN 47 N 0.0118 0.0216 0.0103 344 GLN 47 CA 0.0110 0.0203 0.0119 345 GLN 47 C 0.0140 0.0215 0.0095 346 GLN 47 O 0.0145 0.0199 0.0107 347 GLN 47 CB 0.0057 0.0219 0.0128 348 GLN 47 CG 0.0021 0.0208 0.0154 349 GLN 47 CD -0.0025 0.0210 0.0172 350 GLN 47 OE1 -0.0026 0.0184 0.0196 351 GLN 47 NE2 -0.0063 0.0241 0.0160 352 VAL 48 N 0.0147 0.0111 0.0063 353 VAL 48 CA 0.0169 0.0098 0.0045 354 VAL 48 C 0.0171 0.0116 0.0067 355 VAL 48 O 0.0205 0.0121 0.0068 356 VAL 48 CB 0.0148 0.0069 0.0013 357 VAL 48 CG1 0.0169 0.0056 -0.0004 358 VAL 48 CG2 0.0154 0.0050 -0.0010 359 LEU 49 N 0.0058 0.0044 0.0040 360 LEU 49 CA 0.0038 0.0054 0.0034 361 LEU 49 C 0.0052 0.0079 0.0046 362 LEU 49 O 0.0045 0.0079 0.0043 363 LEU 49 CB 0.0003 0.0069 0.0024 364 LEU 49 CG -0.0017 0.0043 0.0009 365 LEU 49 CD1 -0.0048 0.0061 0.0001 366 LEU 49 CD2 -0.0028 0.0014 -0.0002 367 THR 50 N 0.0127 0.0014 0.0034 368 THR 50 CA 0.0108 -0.0002 0.0011 369 THR 50 C 0.0074 0.0006 0.0013 370 THR 50 O 0.0057 -0.0006 -0.0005 371 THR 50 CB 0.0108 -0.0015 -0.0005 372 THR 50 OG1 0.0099 -0.0004 0.0007 373 THR 50 CG2 0.0140 -0.0027 -0.0012 374 LYS 51 N 0.0126 0.0109 0.0030 375 LYS 51 CA 0.0075 0.0124 0.0039 376 LYS 51 C 0.0019 0.0139 0.0061 377 LYS 51 O -0.0029 0.0154 0.0067 378 LYS 51 CB 0.0089 0.0110 0.0089 379 LYS 51 CG 0.0144 0.0095 0.0071 380 LYS 51 CD 0.0166 0.0077 0.0126 381 LYS 51 CE 0.0218 0.0063 0.0106 382 LYS 51 NZ 0.0274 0.0040 0.0131 383 PHE 52 N -0.0029 0.0135 0.0092 384 PHE 52 CA -0.0022 0.0135 0.0090 385 PHE 52 C -0.0026 0.0138 0.0105 386 PHE 52 O -0.0015 0.0141 0.0112 387 PHE 52 CB -0.0028 0.0130 0.0075 388 PHE 52 CG -0.0025 0.0126 0.0060 389 PHE 52 CD1 -0.0009 0.0125 0.0055 390 PHE 52 CD2 -0.0038 0.0123 0.0052 391 PHE 52 CE1 -0.0006 0.0122 0.0041 392 PHE 52 CE2 -0.0036 0.0120 0.0038 393 PHE 52 CZ -0.0020 0.0119 0.0032 394 ALA 53 N -0.0063 0.0098 0.0093 395 ALA 53 CA -0.0048 0.0084 0.0095 396 ALA 53 C -0.0049 0.0056 0.0113 397 ALA 53 O -0.0069 0.0048 0.0127 398 ALA 53 CB -0.0056 0.0097 0.0091 399 SER 54 N -0.0007 0.0103 0.0098 400 SER 54 CA -0.0011 0.0094 0.0074 401 SER 54 C 0.0006 0.0022 0.0050 402 SER 54 O -0.0005 0.0007 -0.0004 403 SER 54 CB -0.0001 0.0114 0.0131 404 SER 54 OG -0.0020 0.0185 0.0147 405 THR 55 N -0.0041 0.0007 -0.0041 406 THR 55 CA -0.0013 -0.0022 -0.0054 407 THR 55 C 0.0006 -0.0039 -0.0026 408 THR 55 O 0.0004 -0.0034 0.0010 409 THR 55 CB -0.0003 -0.0032 -0.0055 410 THR 55 OG1 -0.0020 -0.0017 -0.0081 411 THR 55 CG2 0.0026 -0.0063 -0.0069 412 VAL 56 N 0.0063 -0.0081 -0.0060 413 VAL 56 CA 0.0075 -0.0073 -0.0052 414 VAL 56 C 0.0088 -0.0075 -0.0061 415 VAL 56 O 0.0088 -0.0079 -0.0066 416 VAL 56 CB 0.0070 -0.0067 -0.0042 417 VAL 56 CG1 0.0083 -0.0059 -0.0034 418 VAL 56 CG2 0.0057 -0.0065 -0.0033 419 HIS 57 N -0.0019 -0.0100 -0.0065 420 HIS 57 CA -0.0019 -0.0120 -0.0056 421 HIS 57 C -0.0012 -0.0153 -0.0059 422 HIS 57 O -0.0016 -0.0164 -0.0043 423 HIS 57 CB -0.0030 -0.0116 -0.0024 424 HIS 57 CG -0.0037 -0.0084 -0.0018 425 HIS 57 ND1 -0.0036 -0.0075 -0.0028 426 HIS 57 CD2 -0.0046 -0.0060 -0.0005 427 HIS 57 CE1 -0.0043 -0.0046 -0.0020 428 HIS 57 NE2 -0.0050 -0.0036 -0.0006 429 TRP 58 N 0.0007 -0.0045 -0.0072 430 TRP 58 CA 0.0014 -0.0020 -0.0060 431 TRP 58 C 0.0051 -0.0031 -0.0069 432 TRP 58 O 0.0052 -0.0062 -0.0086 433 TRP 58 CB -0.0025 -0.0019 -0.0055 434 TRP 58 CG -0.0024 0.0012 -0.0039 435 TRP 58 CD1 0.0000 0.0044 -0.0025 436 TRP 58 CD2 -0.0049 0.0011 -0.0037 437 TRP 58 NE1 -0.0008 0.0063 -0.0014 438 TRP 58 CE2 -0.0038 0.0045 -0.0021 439 TRP 58 CE3 -0.0079 -0.0013 -0.0047 440 TRP 58 CZ2 -0.0057 0.0053 -0.0015 441 TRP 58 CZ3 -0.0098 -0.0005 -0.0041 442 TRP 58 CH2 -0.0087 0.0028 -0.0025 443 ILE 59 N 0.0010 -0.0006 -0.0019 444 ILE 59 CA 0.0024 -0.0016 -0.0016 445 ILE 59 C 0.0027 -0.0019 -0.0016 446 ILE 59 O 0.0027 -0.0009 -0.0009 447 ILE 59 CB 0.0035 -0.0011 -0.0004 448 ILE 59 CG1 0.0033 -0.0009 -0.0005 449 ILE 59 CG2 0.0051 -0.0021 -0.0001 450 ILE 59 CD1 0.0042 -0.0002 0.0008 451 THR 60 N -0.0009 0.0010 -0.0003 452 THR 60 CA -0.0024 0.0002 -0.0012 453 THR 60 C -0.0012 -0.0025 -0.0003 454 THR 60 O -0.0004 -0.0046 0.0004 455 THR 60 CB -0.0052 -0.0006 -0.0030 456 THR 60 OG1 -0.0056 -0.0032 -0.0032 457 THR 60 CG2 -0.0064 0.0020 -0.0040 458 PRO 61 N -0.0045 -0.0030 0.0089 459 PRO 61 CA -0.0017 -0.0053 0.0090 460 PRO 61 C 0.0002 -0.0069 0.0049 461 PRO 61 O 0.0024 -0.0088 0.0044 462 PRO 61 CB 0.0003 -0.0071 0.0126 463 PRO 61 CG -0.0004 -0.0065 0.0127 464 PRO 61 CD -0.0040 -0.0035 0.0117 465 LYS 62 N -0.0059 -0.0112 0.0056 466 LYS 62 CA 0.0153 -0.0088 -0.0183 467 LYS 62 C -0.0088 -0.0069 -0.0267 468 LYS 62 O -0.0382 -0.0081 -0.0108 469 LYS 62 CB 0.0525 -0.0121 -0.0015 470 LYS 62 CG 0.0489 -0.0162 0.0308 471 LYS 62 CD 0.0852 -0.0197 0.0495 472 LYS 62 CE 0.0977 -0.0237 0.0774 473 LYS 62 NZ 0.1312 -0.0271 0.0959 474 ASP 63 N -0.0096 -0.0137 -0.0119 475 ASP 63 CA -0.0143 -0.0128 -0.0146 476 ASP 63 C -0.0179 -0.0076 -0.0159 477 ASP 63 O -0.0185 -0.0067 -0.0161 478 ASP 63 CB -0.0167 -0.0187 -0.0170 479 ASP 63 CG -0.0222 -0.0184 -0.0203 480 ASP 63 OD1 -0.0254 -0.0160 -0.0218 481 ASP 63 OD2 -0.0232 -0.0206 -0.0213 482 PRO 64 N -0.0182 -0.0007 -0.0153 483 PRO 64 CA -0.0191 0.0017 -0.0172 484 PRO 64 C -0.0219 0.0013 -0.0186 485 PRO 64 O -0.0229 0.0032 -0.0202 486 PRO 64 CB -0.0174 0.0034 -0.0171 487 PRO 64 CG -0.0153 0.0021 -0.0152 488 PRO 64 CD -0.0165 -0.0008 -0.0143 489 HIS 65 N -0.0193 0.0072 -0.0293 490 HIS 65 CA -0.0168 0.0090 -0.0242 491 HIS 65 C -0.0202 0.0118 -0.0258 492 HIS 65 O -0.0185 0.0125 -0.0229 493 HIS 65 CB -0.0154 0.0133 -0.0182 494 HIS 65 CG -0.0114 0.0103 -0.0162 495 HIS 65 ND1 -0.0130 0.0118 -0.0168 496 HIS 65 CD2 -0.0060 0.0063 -0.0136 497 HIS 65 CE1 -0.0087 0.0087 -0.0145 498 HIS 65 NE2 -0.0043 0.0052 -0.0125 499 THR 66 N -0.0506 0.0049 -0.0299 500 THR 66 CA -0.0554 0.0083 -0.0345 501 THR 66 C -0.0608 0.0269 -0.0464 502 THR 66 O -0.0706 0.0286 -0.0533 503 THR 66 CB -0.0410 0.0075 -0.0251 504 THR 66 OG1 -0.0251 0.0201 -0.0208 505 THR 66 CG2 -0.0373 -0.0122 -0.0138 506 LEU 67 N -0.0131 -0.0067 -0.0232 507 LEU 67 CA -0.0122 -0.0068 -0.0256 508 LEU 67 C -0.0101 -0.0048 -0.0324 509 LEU 67 O -0.0095 -0.0032 -0.0348 510 LEU 67 CB -0.0142 -0.0024 -0.0221 511 LEU 67 CG -0.0160 -0.0049 -0.0157 512 LEU 67 CD1 -0.0175 -0.0004 -0.0135 513 LEU 67 CD2 -0.0150 -0.0118 -0.0158 514 ASP 68 N -0.0451 0.0122 -0.0439 515 ASP 68 CA 0.0053 0.0267 -0.0042 516 ASP 68 C 0.0843 -0.0091 0.0019 517 ASP 68 O 0.1186 -0.0430 -0.0129 518 ASP 68 CB -0.0219 0.0312 -0.0139 519 ASP 68 CG 0.0102 0.0691 0.0389 520 ASP 68 OD1 0.0561 0.0455 0.0398 521 ASP 68 OD2 -0.0113 0.1226 0.0791 522 GLY 69 N 0.0161 -0.0048 -0.0138 523 GLY 69 CA 0.0218 -0.0048 -0.0142 524 GLY 69 C 0.0169 -0.0140 -0.0129 525 GLY 69 O 0.0190 -0.0130 -0.0132 526 HIS 70 N -0.0005 -0.0253 -0.0217 527 HIS 70 CA 0.0007 -0.0140 -0.0166 528 HIS 70 C 0.0031 -0.0055 -0.0089 529 HIS 70 O 0.0025 0.0063 -0.0085 530 HIS 70 CB 0.0037 -0.0184 -0.0093 531 HIS 70 CG 0.0036 -0.0089 -0.0081 532 HIS 70 ND1 0.0065 0.0002 0.0012 533 HIS 70 CD2 0.0009 -0.0076 -0.0151 534 HIS 70 CE1 0.0055 0.0071 -0.0003 535 HIS 70 NE2 0.0022 0.0028 -0.0101 536 ALA 71 N 0.0026 -0.0070 -0.0167 537 ALA 71 CA 0.0002 -0.0048 -0.0160 538 ALA 71 C 0.0039 0.0000 -0.0139 539 ALA 71 O 0.0024 0.0021 -0.0132 540 ALA 71 CB -0.0064 -0.0025 -0.0155 541 ASP 72 N 0.0082 -0.0051 -0.0153 542 ASP 72 CA 0.0106 0.0008 -0.0162 543 ASP 72 C 0.0097 -0.0002 -0.0161 544 ASP 72 O 0.0073 0.0043 -0.0172 545 ASP 72 CB 0.0183 0.0026 -0.0160 546 ASP 72 CG 0.0194 0.0057 -0.0165 547 ASP 72 OD1 0.0143 0.0058 -0.0169 548 ASP 72 OD2 0.0255 0.0079 -0.0164 549 GLU 73 N 0.0319 -0.0089 -0.0197 550 GLU 73 CA 0.0029 -0.0056 -0.0149 551 GLU 73 C 0.0108 -0.0070 -0.0169 552 GLU 73 O -0.0064 -0.0172 -0.0297 553 GLU 73 CB -0.0121 0.0153 0.0125 554 GLU 73 CG -0.0461 0.0196 0.0187 555 GLU 73 CD -0.0599 0.0406 0.0461 556 GLU 73 OE1 -0.0440 0.0521 0.0607 557 GLU 73 OE2 -0.0874 0.0449 0.0523 558 LEU 74 N 0.0107 0.0043 -0.0064 559 LEU 74 CA 0.0103 0.0045 -0.0060 560 LEU 74 C 0.0102 0.0048 -0.0063 561 LEU 74 O 0.0097 0.0052 -0.0062 562 LEU 74 CB 0.0104 0.0040 -0.0055 563 LEU 74 CG 0.0099 0.0041 -0.0051 564 LEU 74 CD1 0.0095 0.0044 -0.0048 565 LEU 74 CD2 0.0100 0.0036 -0.0046 566 LEU 75 N 0.0086 0.0027 -0.0136 567 LEU 75 CA 0.0067 0.0069 -0.0082 568 LEU 75 C 0.0127 0.0094 -0.0038 569 LEU 75 O 0.0124 0.0126 0.0004 570 LEU 75 CB 0.0009 0.0094 -0.0061 571 LEU 75 CG -0.0062 0.0079 -0.0094 572 LEU 75 CD1 -0.0111 0.0098 -0.0079 573 LEU 75 CD2 -0.0094 0.0092 -0.0084 574 ALA 76 N 0.0161 0.0241 0.0241 575 ALA 76 CA 0.0554 0.0350 0.0466 576 ALA 76 C 0.0785 0.0202 0.0371 577 ALA 76 O 0.1088 0.0300 0.0560 578 ALA 76 CB 0.0865 0.0281 0.0478 579 HIS 77 N 0.0212 -0.0163 -0.0040 580 HIS 77 CA 0.0170 -0.0209 -0.0048 581 HIS 77 C 0.0161 -0.0237 -0.0123 582 HIS 77 O 0.0196 -0.0212 -0.0167 583 HIS 77 CB 0.0174 -0.0197 -0.0016 584 HIS 77 CG 0.0125 -0.0243 0.0002 585 HIS 77 ND1 0.0104 -0.0278 -0.0051 586 HIS 77 CD2 0.0094 -0.0259 0.0063 587 HIS 77 CE1 0.0060 -0.0316 -0.0021 588 HIS 77 NE2 0.0052 -0.0306 0.0048 589 PRO 78 N 0.0073 -0.0340 -0.0032 590 PRO 78 CA 0.0033 -0.0360 -0.0170 591 PRO 78 C -0.0075 -0.0448 -0.0582 592 PRO 78 O -0.0146 -0.0402 -0.0737 593 PRO 78 CB 0.0216 -0.0661 0.0024 594 PRO 78 CG 0.0344 -0.0690 0.0363 595 PRO 78 CD 0.0265 -0.0600 0.0234 596 SER 79 N 0.0093 -0.0216 -0.0237 597 SER 79 CA 0.0117 -0.0207 -0.0240 598 SER 79 C 0.0167 -0.0187 -0.0249 599 SER 79 O 0.0193 -0.0181 -0.0258 600 SER 79 CB 0.0101 -0.0186 -0.0202 601 SER 79 OG 0.0054 -0.0203 -0.0193 602 VAL 80 N 0.0148 -0.0152 -0.0224 603 VAL 80 CA 0.0146 -0.0108 -0.0244 604 VAL 80 C 0.0142 -0.0078 -0.0272 605 VAL 80 O 0.0147 -0.0066 -0.0255 606 VAL 80 CB 0.0158 -0.0078 -0.0207 607 VAL 80 CG1 0.0157 -0.0028 -0.0227 608 VAL 80 CG2 0.0160 -0.0107 -0.0189 609 LYS 81 N 0.0058 -0.0132 -0.0157 610 LYS 81 CA 0.0060 -0.0121 -0.0169 611 LYS 81 C 0.0075 -0.0131 -0.0160 612 LYS 81 O 0.0069 -0.0144 -0.0145 613 LYS 81 CB 0.0035 -0.0114 -0.0172 614 LYS 81 CG 0.0021 -0.0100 -0.0185 615 LYS 81 CD -0.0001 -0.0091 -0.0191 616 LYS 81 CE -0.0014 -0.0076 -0.0205 617 LYS 81 NZ -0.0030 -0.0082 -0.0196 618 LEU 82 N 0.0017 -0.0094 -0.0097 619 LEU 82 CA 0.0007 -0.0080 -0.0102 620 LEU 82 C 0.0024 -0.0090 -0.0100 621 LEU 82 O 0.0024 -0.0112 -0.0089 622 LEU 82 CB -0.0024 -0.0083 -0.0093 623 LEU 82 CG -0.0036 -0.0069 -0.0097 624 LEU 82 CD1 -0.0035 -0.0041 -0.0112 625 LEU 82 CD2 -0.0065 -0.0076 -0.0087 626 TRP 83 N 0.0025 -0.0130 -0.0051 627 TRP 83 CA 0.0021 -0.0127 -0.0055 628 TRP 83 C 0.0037 -0.0131 -0.0051 629 TRP 83 O 0.0036 -0.0140 -0.0042 630 TRP 83 CB 0.0004 -0.0132 -0.0049 631 TRP 83 CG -0.0011 -0.0128 -0.0053 632 TRP 83 CD1 -0.0019 -0.0134 -0.0047 633 TRP 83 CD2 -0.0020 -0.0116 -0.0065 634 TRP 83 NE1 -0.0032 -0.0127 -0.0054 635 TRP 83 CE2 -0.0033 -0.0116 -0.0065 636 TRP 83 CE3 -0.0018 -0.0107 -0.0075 637 TRP 83 CZ2 -0.0044 -0.0106 -0.0075 638 TRP 83 CZ3 -0.0029 -0.0097 -0.0086 639 TRP 83 CH2 -0.0042 -0.0096 -0.0085 640 GLU 84 N 0.0107 -0.0170 -0.0021 641 GLU 84 CA 0.0016 -0.0160 -0.0036 642 GLU 84 C -0.0029 -0.0159 -0.0021 643 GLU 84 O -0.0008 -0.0172 0.0035 644 GLU 84 CB -0.0028 -0.0167 0.0017 645 GLU 84 CG -0.0032 -0.0185 0.0112 646 GLU 84 CD -0.0098 -0.0189 0.0159 647 GLU 84 OE1 -0.0129 -0.0179 0.0122 648 GLU 84 OE2 -0.0123 -0.0201 0.0230 649 LYS 85 N 0.0090 -0.0208 -0.0027 650 LYS 85 CA -0.0049 -0.0140 -0.0072 651 LYS 85 C 0.0125 -0.0182 -0.0177 652 LYS 85 O 0.0081 -0.0183 -0.0107 653 LYS 85 CB -0.0223 -0.0136 0.0177 654 LYS 85 CG -0.0413 -0.0095 0.0307 655 LYS 85 CD -0.0635 -0.0053 0.0486 656 LYS 85 CE -0.0706 -0.0093 0.0749 657 LYS 85 NZ -0.0549 -0.0211 0.0965 658 THR 86 N -0.0018 -0.0118 -0.0048 659 THR 86 CA 0.0012 -0.0111 -0.0037 660 THR 86 C 0.0022 -0.0080 -0.0036 661 THR 86 O 0.0005 -0.0060 -0.0044 662 THR 86 CB 0.0019 -0.0110 -0.0034 663 THR 86 OG1 0.0008 -0.0083 -0.0041 664 THR 86 CG2 0.0005 -0.0140 -0.0037 665 ARG 87 N 0.0000 -0.0047 0.0004 666 ARG 87 CA 0.0031 0.0009 0.0057 667 ARG 87 C 0.0029 0.0045 0.0082 668 ARG 87 O 0.0051 0.0016 0.0070 669 ARG 87 CB 0.0112 -0.0011 0.0076 670 ARG 87 CG 0.0133 0.0042 0.0123 671 ARG 87 CD 0.0213 0.0050 0.0162 672 ARG 87 NE 0.0263 -0.0008 0.0140 673 ARG 87 CZ 0.0297 -0.0008 0.0155 674 ARG 87 NH1 0.0284 0.0043 0.0186 675 ARG 87 NH2 0.0346 -0.0061 0.0136 676 LEU 88 N 0.0105 0.0091 0.0118 677 LEU 88 CA 0.0092 0.0086 0.0120 678 LEU 88 C 0.0081 0.0081 0.0122 679 LEU 88 O 0.0083 0.0072 0.0125 680 LEU 88 CB 0.0097 0.0074 0.0125 681 LEU 88 CG 0.0084 0.0067 0.0128 682 LEU 88 CD1 0.0073 0.0076 0.0124 683 LEU 88 CD2 0.0090 0.0057 0.0132 684 ILE 89 N 0.0074 0.0186 0.0145 685 ILE 89 CA 0.0091 0.0190 0.0140 686 ILE 89 C 0.0084 0.0193 0.0150 687 ILE 89 O 0.0097 0.0202 0.0156 688 ILE 89 CB 0.0096 0.0180 0.0117 689 ILE 89 CG1 0.0102 0.0176 0.0105 690 ILE 89 CG2 0.0114 0.0185 0.0112 691 ILE 89 CD1 0.0121 0.0187 0.0111 692 ARG 90 N 0.0098 0.0227 0.0122 693 ARG 90 CA 0.0067 0.0189 0.0116 694 ARG 90 C 0.0060 0.0155 0.0136 695 ARG 90 O 0.0067 0.0163 0.0138 696 ARG 90 CB 0.0038 0.0198 0.0072 697 ARG 90 CG 0.0003 0.0165 0.0058 698 ARG 90 CD -0.0019 0.0183 0.0014 699 ARG 90 NE -0.0002 0.0213 0.0009 700 ARG 90 CZ 0.0011 0.0254 -0.0009 701 ARG 90 NH1 0.0009 0.0274 -0.0028 702 ARG 90 NH2 0.0027 0.0277 -0.0008 703 ILE 91 N 0.0023 0.0066 0.0026 704 ILE 91 CA 0.0042 0.0059 0.0025 705 ILE 91 C 0.0022 0.0057 0.0023 706 ILE 91 O -0.0002 0.0045 0.0017 707 ILE 91 CB 0.0060 0.0031 0.0016 708 ILE 91 CG1 0.0080 0.0034 0.0019 709 ILE 91 CG2 0.0079 0.0022 0.0015 710 ILE 91 CD1 0.0092 0.0006 0.0010 711 LYS 92 N -0.0036 0.0059 -0.0009 712 LYS 92 CA -0.0040 0.0053 -0.0019 713 LYS 92 C -0.0020 0.0031 -0.0022 714 LYS 92 O -0.0001 0.0026 -0.0009 715 LYS 92 CB -0.0043 0.0070 -0.0004 716 LYS 92 CG -0.0064 0.0093 -0.0001 717 LYS 92 CD -0.0063 0.0109 0.0016 718 LYS 92 CE -0.0085 0.0123 0.0009 719 LYS 92 NZ -0.0103 0.0140 0.0010 720 GLY 93 N -0.0010 -0.0010 -0.0113 721 GLY 93 CA 0.0000 -0.0031 -0.0114 722 GLY 93 C 0.0018 -0.0043 -0.0138 723 GLY 93 O 0.0024 -0.0040 -0.0153 724 GLU 94 N -0.0030 -0.0026 -0.0123 725 GLU 94 CA -0.0013 -0.0006 -0.0106 726 GLU 94 C -0.0001 -0.0026 -0.0170 727 GLU 94 O -0.0009 -0.0056 -0.0222 728 GLU 94 CB 0.0043 0.0048 -0.0079 729 GLU 94 CG 0.0038 0.0073 -0.0016 730 GLU 94 CD 0.0096 0.0125 0.0005 731 GLU 94 OE1 0.0094 0.0151 0.0066 732 GLU 94 OE2 0.0143 0.0138 -0.0040 733 GLU 95 N -0.0051 0.0173 0.0013 734 GLU 95 CA -0.0034 0.0141 -0.0048 735 GLU 95 C 0.0035 0.0155 -0.0143 736 GLU 95 O 0.0039 0.0094 -0.0215 737 GLU 95 CB -0.0029 0.0191 -0.0003 738 GLU 95 CG -0.0019 0.0156 -0.0057 739 GLU 95 CD -0.0090 0.0073 -0.0034 740 GLU 95 OE1 -0.0135 0.0083 0.0048 741 GLU 95 OE2 -0.0100 -0.0000 -0.0098 742 ALA 96 N 0.0011 0.0138 -0.0106 743 ALA 96 CA 0.0006 0.0150 -0.0138 744 ALA 96 C -0.0006 0.0126 -0.0163 745 ALA 96 O -0.0010 0.0133 -0.0188 746 ALA 96 CB 0.0009 0.0166 -0.0139 747 GLY 97 N -0.0016 0.0029 -0.0162 748 GLY 97 CA -0.0027 0.0013 -0.0176 749 GLY 97 C -0.0029 -0.0011 -0.0175 750 GLY 97 O -0.0020 -0.0017 -0.0159 751 VAL 98 N -0.0035 -0.0009 -0.0091 752 VAL 98 CA -0.0044 0.0002 -0.0073 753 VAL 98 C -0.0032 0.0002 -0.0055 754 VAL 98 O -0.0015 -0.0005 -0.0050 755 VAL 98 CB -0.0051 0.0008 -0.0067 756 VAL 98 CG1 -0.0061 0.0019 -0.0048 757 VAL 98 CG2 -0.0064 0.0009 -0.0085 758 THR 99 N -0.0045 0.0004 -0.0024 759 THR 99 CA -0.0023 -0.0027 0.0026 760 THR 99 C -0.0064 -0.0020 0.0075 761 THR 99 O -0.0056 -0.0042 0.0124 762 THR 99 CB 0.0015 -0.0046 0.0019 763 THR 99 OG1 -0.0007 -0.0027 -0.0000 764 THR 99 CG2 0.0062 -0.0058 -0.0026 765 ALA 100 N -0.0090 -0.0015 0.0106 766 ALA 100 CA -0.0106 -0.0004 0.0127 767 ALA 100 C -0.0126 0.0028 0.0122 768 ALA 100 O -0.0126 0.0043 0.0098 769 ALA 100 CB -0.0099 -0.0012 0.0125 770 VAL 101 N -0.0111 0.0046 0.0163 771 VAL 101 CA -0.0114 0.0046 0.0163 772 VAL 101 C -0.0115 0.0048 0.0165 773 VAL 101 O -0.0114 0.0049 0.0166 774 VAL 101 CB -0.0113 0.0046 0.0162 775 VAL 101 CG1 -0.0112 0.0044 0.0160 776 VAL 101 CG2 -0.0111 0.0047 0.0164 777 GLU 102 N -0.0038 0.0146 0.0165 778 GLU 102 CA -0.0017 0.0157 0.0133 779 GLU 102 C 0.0001 0.0184 0.0153 780 GLU 102 O 0.0016 0.0208 0.0175 781 GLU 102 CB 0.0002 0.0168 0.0107 782 GLU 102 CG 0.0024 0.0179 0.0068 783 GLU 102 CD 0.0043 0.0193 0.0047 784 GLU 102 OE1 0.0034 0.0185 0.0054 785 GLU 102 OE2 0.0067 0.0211 0.0024 786 VAL 103 N -0.0014 0.0054 0.0105 787 VAL 103 CA 0.0016 0.0063 0.0108 788 VAL 103 C 0.0040 0.0069 0.0073 789 VAL 103 O 0.0029 0.0065 0.0041 790 VAL 103 CB 0.0003 0.0060 0.0115 791 VAL 103 CG1 -0.0021 0.0054 0.0152 792 VAL 103 CG2 -0.0018 0.0053 0.0081 793 ARG 104 N 0.0069 0.0003 -0.0066 794 ARG 104 CA 0.0056 0.0012 -0.0055 795 ARG 104 C 0.0021 0.0038 -0.0024 796 ARG 104 O 0.0004 0.0067 -0.0029 797 ARG 104 CB 0.0064 0.0035 -0.0096 798 ARG 104 CG 0.0051 0.0048 -0.0089 799 ARG 104 CD 0.0051 0.0078 -0.0128 800 ARG 104 NE 0.0085 0.0057 -0.0162 801 ARG 104 CZ 0.0094 0.0075 -0.0202 802 ARG 104 NH1 0.0074 0.0115 -0.0217 803 ARG 104 NH2 0.0124 0.0053 -0.0228 804 HIS 105 N 0.0113 -0.0226 -0.0188 805 HIS 105 CA 0.0024 -0.0173 -0.0126 806 HIS 105 C -0.0008 -0.0086 -0.0179 807 HIS 105 O 0.0032 -0.0097 -0.0222 808 HIS 105 CB 0.0007 -0.0236 -0.0032 809 HIS 105 CG -0.0071 -0.0221 0.0059 810 HIS 105 ND1 -0.0070 -0.0270 0.0111 811 HIS 105 CD2 -0.0149 -0.0166 0.0103 812 HIS 105 CE1 -0.0146 -0.0242 0.0186 813 HIS 105 NE2 -0.0197 -0.0179 0.0184 814 PRO 106 N -0.0027 -0.0169 -0.0106 815 PRO 106 CA 0.0007 -0.0200 -0.0083 816 PRO 106 C 0.0024 -0.0197 -0.0116 817 PRO 106 O 0.0045 -0.0191 -0.0164 818 PRO 106 CB 0.0050 -0.0229 -0.0077 819 PRO 106 CG 0.0026 -0.0217 -0.0072 820 PRO 106 CD -0.0012 -0.0178 -0.0109 821 GLY 107 N -0.0727 -0.0048 -0.0393 822 GLY 107 CA -0.1155 0.0430 -0.0130 823 GLY 107 C -0.0798 0.0155 0.0107 824 GLY 107 O -0.1146 0.0474 0.0067 825 GLU 108 N -0.0054 -0.0238 0.0026 826 GLU 108 CA -0.0172 -0.0124 -0.0054 827 GLU 108 C -0.0192 -0.0072 0.0174 828 GLU 108 O -0.0186 -0.0085 0.0130 829 GLU 108 CB -0.0374 0.0073 -0.0173 830 GLU 108 CG -0.0378 0.0037 -0.0476 831 GLU 108 CD -0.0353 -0.0017 -0.0682 832 GLU 108 OE1 -0.0362 0.0003 -0.0603 833 GLU 108 OE2 -0.0327 -0.0077 -0.0923 834 SER 109 N -0.0374 0.0073 0.0022 835 SER 109 CA -0.0048 0.0125 -0.0015 836 SER 109 C -0.0051 0.0058 -0.0033 837 SER 109 O 0.0134 0.0218 -0.0019 838 SER 109 CB 0.0245 -0.0039 -0.0105 839 SER 109 OG 0.0554 0.0100 -0.0116 840 ASP 110 N -0.0030 0.0163 -0.0004 841 ASP 110 CA 0.0103 0.0190 0.0003 842 ASP 110 C 0.0122 0.0246 -0.0093 843 ASP 110 O 0.0037 0.0244 -0.0127 844 ASP 110 CB 0.0143 0.0134 0.0126 845 ASP 110 CG 0.0165 0.0092 0.0215 846 ASP 110 OD1 0.0257 0.0121 0.0201 847 ASP 110 OD2 0.0092 0.0032 0.0296 848 SER 111 N 0.0144 0.0146 -0.0094 849 SER 111 CA 0.0133 0.0128 -0.0061 850 SER 111 C 0.0122 0.0076 -0.0043 851 SER 111 O 0.0125 0.0045 -0.0068 852 SER 111 CB 0.0139 0.0126 -0.0086 853 SER 111 OG 0.0149 0.0174 -0.0103 854 GLN 112 N 0.0082 0.0034 0.0003 855 GLN 112 CA 0.0010 -0.0004 0.0001 856 GLN 112 C -0.0029 0.0018 0.0051 857 GLN 112 O -0.0022 0.0064 0.0103 858 GLN 112 CB -0.0029 -0.0015 0.0011 859 GLN 112 CG -0.0090 -0.0070 -0.0019 860 GLN 112 CD -0.0146 -0.0071 0.0013 861 GLN 112 OE1 -0.0189 -0.0052 0.0062 862 GLN 112 NE2 -0.0146 -0.0094 -0.0016 863 GLU 113 N -0.0109 0.0010 0.0129 864 GLU 113 CA -0.0133 0.0019 0.0158 865 GLU 113 C -0.0189 -0.0001 0.0182 866 GLU 113 O -0.0214 -0.0040 0.0161 867 GLU 113 CB -0.0120 0.0004 0.0132 868 GLU 113 CG -0.0137 0.0021 0.0162 869 GLU 113 CD -0.0109 0.0021 0.0140 870 GLU 113 OE1 -0.0064 0.0048 0.0132 871 GLU 113 OE2 -0.0134 -0.0005 0.0133 872 LEU 114 N -0.0221 -0.0054 0.0251 873 LEU 114 CA -0.0229 -0.0043 0.0238 874 LEU 114 C -0.0247 -0.0035 0.0259 875 LEU 114 O -0.0243 -0.0046 0.0281 876 LEU 114 CB -0.0211 -0.0055 0.0227 877 LEU 114 CG -0.0193 -0.0062 0.0202 878 LEU 114 CD1 -0.0173 -0.0078 0.0198 879 LEU 114 CD2 -0.0202 -0.0046 0.0175 880 LEU 115 N -0.0255 -0.0062 0.0363 881 LEU 115 CA -0.0154 -0.0052 0.0274 882 LEU 115 C -0.0170 -0.0033 0.0195 883 LEU 115 O -0.0204 -0.0040 0.0240 884 LEU 115 CB -0.0026 -0.0079 0.0337 885 LEU 115 CG -0.0001 -0.0099 0.0420 886 LEU 115 CD1 0.0094 -0.0130 0.0517 887 LEU 115 CD2 0.0044 -0.0088 0.0347 888 ALA 116 N -0.0119 -0.0000 0.0155 889 ALA 116 CA -0.0117 -0.0001 0.0120 890 ALA 116 C -0.0100 0.0000 0.0089 891 ALA 116 O -0.0105 -0.0001 0.0088 892 ALA 116 CB -0.0156 -0.0010 0.0108 893 GLU 117 N -0.0092 0.0011 0.0001 894 GLU 117 CA -0.0085 0.0009 -0.0014 895 GLU 117 C -0.0094 0.0006 -0.0029 896 GLU 117 O -0.0093 0.0005 -0.0042 897 GLU 117 CB -0.0067 0.0011 -0.0015 898 GLU 117 CG -0.0057 0.0014 -0.0002 899 GLU 117 CD -0.0041 0.0016 0.0001 900 GLU 117 OE1 -0.0040 0.0018 0.0009 901 GLU 117 OE2 -0.0028 0.0017 -0.0006 902 GLY 118 N -0.0093 -0.0005 -0.0008 903 GLY 118 CA -0.0090 -0.0014 -0.0011 904 GLY 118 C -0.0090 -0.0020 -0.0012 905 GLY 118 O -0.0088 -0.0016 -0.0014 906 VAL 119 N -0.0057 -0.0008 -0.0021 907 VAL 119 CA -0.0040 -0.0027 -0.0026 908 VAL 119 C -0.0027 -0.0049 -0.0024 909 VAL 119 O -0.0032 -0.0059 -0.0005 910 VAL 119 CB -0.0046 -0.0037 -0.0008 911 VAL 119 CG1 -0.0027 -0.0056 -0.0016 912 VAL 119 CG2 -0.0061 -0.0015 -0.0008 913 PHE 120 N -0.0055 -0.0060 -0.0017 914 PHE 120 CA -0.0037 -0.0078 -0.0013 915 PHE 120 C -0.0017 -0.0090 -0.0016 916 PHE 120 O -0.0005 -0.0082 -0.0033 917 PHE 120 CB -0.0027 -0.0070 -0.0028 918 PHE 120 CG -0.0046 -0.0060 -0.0023 919 PHE 120 CD1 -0.0063 -0.0039 -0.0031 920 PHE 120 CD2 -0.0046 -0.0073 -0.0011 921 PHE 120 CE1 -0.0079 -0.0029 -0.0027 922 PHE 120 CE2 -0.0063 -0.0063 -0.0007 923 PHE 120 CZ -0.0079 -0.0042 -0.0015 924 VAL 121 N 0.0001 -0.0080 -0.0036 925 VAL 121 CA 0.0024 -0.0077 -0.0039 926 VAL 121 C 0.0018 -0.0059 -0.0024 927 VAL 121 O 0.0017 -0.0039 -0.0008 928 VAL 121 CB 0.0053 -0.0069 -0.0040 929 VAL 121 CG1 0.0077 -0.0067 -0.0044 930 VAL 121 CG2 0.0058 -0.0086 -0.0054 931 TYR 122 N -0.0030 0.0013 -0.0020 932 TYR 122 CA -0.0011 0.0019 0.0006 933 TYR 122 C -0.0006 0.0055 0.0001 934 TYR 122 O 0.0008 0.0080 0.0011 935 TYR 122 CB 0.0008 0.0015 0.0034 936 TYR 122 CG 0.0002 -0.0021 0.0038 937 TYR 122 CD1 0.0001 -0.0050 0.0046 938 TYR 122 CD2 -0.0003 -0.0026 0.0033 939 TYR 122 CE1 -0.0006 -0.0084 0.0048 940 TYR 122 CE2 -0.0009 -0.0059 0.0035 941 TYR 122 CZ -0.0011 -0.0088 0.0043 942 TYR 122 OH -0.0018 -0.0122 0.0044 943 LEU 123 N -0.0028 0.0004 -0.0023 944 LEU 123 CA -0.0044 0.0002 -0.0019 945 LEU 123 C -0.0060 0.0022 -0.0039 946 LEU 123 O -0.0047 0.0038 -0.0056 947 LEU 123 CB -0.0025 -0.0007 -0.0012 948 LEU 123 CG -0.0008 -0.0027 0.0007 949 LEU 123 CD1 0.0014 -0.0032 0.0010 950 LEU 123 CD2 -0.0028 -0.0046 0.0027 951 GLN 124 N -0.0170 -0.0030 -0.0065 952 GLN 124 CA -0.0167 0.0013 -0.0043 953 GLN 124 C -0.0177 0.0067 -0.0116 954 GLN 124 O -0.0184 0.0101 -0.0168 955 GLN 124 CB -0.0155 0.0066 0.0038 956 GLN 124 CG -0.0144 0.0007 0.0114 957 GLN 124 CD -0.0133 0.0058 0.0191 958 GLN 124 OE1 -0.0133 0.0113 0.0186 959 GLN 124 NE2 -0.0122 0.0036 0.0265 960 GLY 125 N -0.0251 -0.0117 -0.0346 961 GLY 125 CA -0.0129 -0.0164 -0.0187 962 GLY 125 C -0.0118 -0.0133 -0.0147 963 GLY 125 O -0.0202 -0.0091 -0.0249 964 SER 126 N 0.0740 0.1020 0.0134 965 SER 126 CA 0.0931 0.0218 0.0300 966 SER 126 C 0.0373 -0.1100 0.0311 967 SER 126 O 0.0079 -0.1725 0.0308 968 SER 126 CB 0.0351 0.0817 0.0045 969 SER 126 OG -0.0948 0.0922 -0.0360 970 LYS 127 N -0.0177 -0.0137 0.0101 971 LYS 127 CA -0.0031 0.0029 0.0015 972 LYS 127 C 0.0048 0.0201 -0.0211 973 LYS 127 O -0.0014 0.0185 -0.0294 974 LYS 127 CB 0.0174 0.0100 0.0247 975 LYS 127 CG 0.0118 -0.0061 0.0494 976 LYS 127 CD 0.0059 -0.0102 0.0470 977 LYS 127 CE -0.0109 -0.0316 0.0620 978 LYS 127 NZ -0.0324 -0.0417 0.0432 979 LYS 127 OXT 0.0186 0.0359 -0.0295