1 GLY 1 N 0.0162 0.0250 -0.0257 2 GLY 1 CA 0.0132 0.0344 -0.0186 3 GLY 1 C 0.0099 0.0321 -0.0105 4 GLY 1 O 0.0088 0.0226 -0.0079 5 ARG 2 N 0.0039 0.0275 -0.0033 6 ARG 2 CA 0.0025 0.0284 -0.0033 7 ARG 2 C -0.0038 0.0297 0.0003 8 ARG 2 O -0.0076 0.0327 -0.0007 9 ARG 2 CB 0.0033 0.0321 -0.0092 10 ARG 2 CG 0.0031 0.0325 -0.0096 11 ARG 2 CD 0.0036 0.0363 -0.0155 12 ARG 2 NE 0.0098 0.0350 -0.0191 13 ARG 2 CZ 0.0125 0.0364 -0.0234 14 ARG 2 NH1 0.0100 0.0392 -0.0251 15 ARG 2 NH2 0.0180 0.0350 -0.0262 16 ILE 3 N -0.0131 0.0264 0.0023 17 ILE 3 CA -0.0279 0.0150 -0.0107 18 ILE 3 C -0.0343 0.0267 -0.0170 19 ILE 3 O -0.0334 0.0469 -0.0170 20 ILE 3 CB -0.0407 0.0133 -0.0222 21 ILE 3 CG1 -0.0347 -0.0025 -0.0161 22 ILE 3 CG2 -0.0575 0.0054 -0.0371 23 ILE 3 CD1 -0.0453 -0.0029 -0.0257 24 ALA 4 N -0.0182 0.0185 -0.0113 25 ALA 4 CA -0.0137 0.0155 -0.0047 26 ALA 4 C -0.0227 0.0239 -0.0037 27 ALA 4 O -0.0286 0.0275 -0.0153 28 ALA 4 CB -0.0038 0.0049 -0.0135 29 SER 5 N -0.0222 0.0265 0.0012 30 SER 5 CA -0.0277 0.0289 0.0048 31 SER 5 C -0.0275 0.0326 0.0100 32 SER 5 O -0.0324 0.0346 0.0131 33 SER 5 CB -0.0274 0.0300 0.0064 34 SER 5 OG -0.0212 0.0318 0.0088 35 ILE 6 N -0.0020 0.0005 0.0158 36 ILE 6 CA -0.0005 0.0010 0.0193 37 ILE 6 C 0.0020 0.0025 0.0206 38 ILE 6 O 0.0040 0.0041 0.0184 39 ILE 6 CB 0.0009 0.0020 0.0190 40 ILE 6 CG1 -0.0018 0.0004 0.0180 41 ILE 6 CG2 0.0029 0.0028 0.0226 42 ILE 6 CD1 -0.0006 0.0014 0.0163 43 PRO 7 N 0.0031 -0.0019 0.0259 44 PRO 7 CA 0.0039 0.0025 0.0310 45 PRO 7 C 0.0037 0.0091 0.0290 46 PRO 7 O 0.0033 0.0104 0.0262 47 PRO 7 CB 0.0045 -0.0000 0.0350 48 PRO 7 CG 0.0043 -0.0070 0.0340 49 PRO 7 CD 0.0033 -0.0076 0.0273 50 GLY 8 N 0.0030 0.0054 0.0203 51 GLY 8 CA 0.0061 0.0053 0.0200 52 GLY 8 C 0.0112 0.0019 0.0186 53 GLY 8 O 0.0133 0.0004 0.0180 54 GLU 9 N 0.0111 -0.0009 0.0142 55 GLU 9 CA 0.0136 -0.0023 0.0116 56 GLU 9 C 0.0150 -0.0049 0.0056 57 GLU 9 O 0.0198 -0.0062 0.0039 58 GLU 9 CB 0.0092 -0.0014 0.0122 59 GLU 9 CG 0.0111 -0.0025 0.0103 60 GLU 9 CD 0.0064 -0.0014 0.0112 61 GLU 9 OE1 0.0017 0.0000 0.0132 62 GLU 9 OE2 0.0074 -0.0022 0.0098 63 ALA 10 N 0.0107 -0.0051 0.0061 64 ALA 10 CA 0.0104 -0.0086 0.0031 65 ALA 10 C 0.0106 -0.0131 0.0006 66 ALA 10 O 0.0118 -0.0174 0.0004 67 ALA 10 CB 0.0079 -0.0058 -0.0004 68 GLU 11 N 0.0090 -0.0111 0.0101 69 GLU 11 CA 0.0085 -0.0126 0.0089 70 GLU 11 C 0.0146 -0.0143 0.0107 71 GLU 11 O 0.0157 -0.0183 0.0087 72 GLU 11 CB 0.0046 -0.0073 0.0104 73 GLU 11 CG 0.0026 -0.0081 0.0090 74 GLU 11 CD -0.0002 -0.0024 0.0112 75 GLU 11 OE1 -0.0011 0.0021 0.0136 76 GLU 11 OE2 -0.0013 -0.0025 0.0107 77 TYR 12 N 0.0134 -0.0109 0.0114 78 TYR 12 CA 0.0175 -0.0117 0.0130 79 TYR 12 C 0.0227 -0.0151 0.0144 80 TYR 12 O 0.0270 -0.0151 0.0162 81 TYR 12 CB 0.0189 -0.0057 0.0147 82 TYR 12 CG 0.0142 -0.0030 0.0133 83 TYR 12 CD1 0.0132 -0.0050 0.0125 84 TYR 12 CD2 0.0105 0.0014 0.0127 85 TYR 12 CE1 0.0085 -0.0028 0.0110 86 TYR 12 CE2 0.0058 0.0036 0.0112 87 TYR 12 CZ 0.0048 0.0014 0.0103 88 TYR 12 OH -0.0002 0.0033 0.0087 89 LEU 13 N 0.0226 -0.0160 0.0099 90 LEU 13 CA 0.0250 -0.0179 0.0092 91 LEU 13 C 0.0284 -0.0210 0.0077 92 LEU 13 O 0.0277 -0.0228 0.0052 93 LEU 13 CB 0.0222 -0.0185 0.0066 94 LEU 13 CG 0.0242 -0.0200 0.0061 95 LEU 13 CD1 0.0256 -0.0179 0.0097 96 LEU 13 CD2 0.0212 -0.0208 0.0032 97 GLY 14 N 0.0279 -0.0176 0.0095 98 GLY 14 CA 0.0291 -0.0216 0.0095 99 GLY 14 C 0.0296 -0.0238 0.0089 100 GLY 14 O 0.0307 -0.0272 0.0087 101 ARG 15 N 0.0278 -0.0263 0.0146 102 ARG 15 CA 0.0273 -0.0253 0.0146 103 ARG 15 C 0.0281 -0.0222 0.0162 104 ARG 15 O 0.0268 -0.0203 0.0161 105 ARG 15 CB 0.0242 -0.0250 0.0130 106 ARG 15 CG 0.0231 -0.0280 0.0113 107 ARG 15 CD 0.0204 -0.0277 0.0099 108 ARG 15 NE 0.0183 -0.0257 0.0094 109 ARG 15 CZ 0.0160 -0.0240 0.0087 110 ARG 15 NH1 0.0155 -0.0238 0.0085 111 ARG 15 NH2 0.0143 -0.0225 0.0083 112 GLY 16 N 0.0252 -0.0084 0.0097 113 GLY 16 CA 0.0256 -0.0088 0.0078 114 GLY 16 C 0.0274 -0.0088 0.0081 115 GLY 16 O 0.0274 -0.0090 0.0072 116 VAL 17 N 0.0287 -0.0072 0.0124 117 VAL 17 CA 0.0276 -0.0077 0.0120 118 VAL 17 C 0.0285 -0.0088 0.0103 119 VAL 17 O 0.0288 -0.0096 0.0091 120 VAL 17 CB 0.0254 -0.0081 0.0120 121 VAL 17 CG1 0.0243 -0.0087 0.0114 122 VAL 17 CG2 0.0245 -0.0070 0.0138 123 SER 18 N 0.0253 -0.0108 0.0031 124 SER 18 CA 0.0245 -0.0098 0.0003 125 SER 18 C 0.0217 -0.0113 -0.0008 126 SER 18 O 0.0205 -0.0132 0.0007 127 SER 18 CB 0.0256 -0.0085 -0.0005 128 SER 18 OG 0.0248 -0.0074 -0.0033 129 TYR 19 N 0.0189 -0.0073 -0.0026 130 TYR 19 CA 0.0170 -0.0088 -0.0041 131 TYR 19 C 0.0169 -0.0078 -0.0065 132 TYR 19 O 0.0155 -0.0086 -0.0083 133 TYR 19 CB 0.0159 -0.0096 -0.0048 134 TYR 19 CG 0.0161 -0.0105 -0.0025 135 TYR 19 CD1 0.0151 -0.0123 -0.0009 136 TYR 19 CD2 0.0172 -0.0094 -0.0021 137 TYR 19 CE1 0.0152 -0.0130 0.0012 138 TYR 19 CE2 0.0173 -0.0102 -0.0001 139 TYR 19 CZ 0.0163 -0.0120 0.0016 140 TYR 19 OH 0.0164 -0.0127 0.0037 141 CYS 20 N 0.0176 -0.0060 -0.0073 142 CYS 20 CA 0.0156 -0.0040 -0.0101 143 CYS 20 C 0.0159 -0.0035 -0.0100 144 CYS 20 O 0.0179 -0.0010 -0.0093 145 CYS 20 CB 0.0161 -0.0002 -0.0113 146 CYS 20 SG 0.0132 0.0020 -0.0151 147 ALA 21 N 0.0092 -0.0050 -0.0070 148 ALA 21 CA 0.0094 -0.0048 -0.0068 149 ALA 21 C 0.0092 -0.0017 -0.0092 150 ALA 21 O 0.0106 -0.0002 -0.0087 151 ALA 21 CB 0.0073 -0.0080 -0.0069 152 THR 22 N 0.0085 0.0006 -0.0132 153 THR 22 CA 0.0077 0.0042 -0.0157 154 THR 22 C 0.0083 0.0079 -0.0132 155 THR 22 O 0.0079 0.0116 -0.0145 156 THR 22 CB 0.0068 0.0030 -0.0189 157 THR 22 OG1 0.0074 0.0008 -0.0172 158 THR 22 CG2 0.0059 -0.0000 -0.0221 159 CYS 23 N 0.0073 0.0086 -0.0139 160 CYS 23 CA 0.0107 0.0143 -0.0109 161 CYS 23 C 0.0137 0.0106 -0.0111 162 CYS 23 O 0.0116 0.0135 -0.0109 163 CYS 23 CB 0.0173 0.0180 -0.0075 164 CYS 23 SG 0.0192 0.0277 -0.0039 165 ASP 24 N 0.0138 0.0050 -0.0117 166 ASP 24 CA 0.0153 0.0045 -0.0107 167 ASP 24 C 0.0132 0.0020 -0.0140 168 ASP 24 O 0.0140 0.0016 -0.0136 169 ASP 24 CB 0.0201 0.0017 -0.0085 170 ASP 24 CG 0.0226 0.0041 -0.0049 171 ASP 24 OD1 0.0210 0.0081 -0.0039 172 ASP 24 OD2 0.0265 0.0019 -0.0030 173 GLY 25 N 0.0080 0.0026 -0.0114 174 GLY 25 CA 0.0067 0.0002 -0.0138 175 GLY 25 C 0.0039 -0.0011 -0.0145 176 GLY 25 O 0.0038 -0.0031 -0.0168 177 ALA 26 N 0.0001 -0.0013 -0.0143 178 ALA 26 CA -0.0049 -0.0037 -0.0149 179 ALA 26 C -0.0038 -0.0058 -0.0179 180 ALA 26 O -0.0070 -0.0090 -0.0203 181 ALA 26 CB -0.0084 -0.0011 -0.0102 182 PHE 27 N -0.0045 -0.0014 -0.0227 183 PHE 27 CA 0.0003 -0.0024 -0.0219 184 PHE 27 C 0.0036 -0.0104 -0.0262 185 PHE 27 O 0.0062 -0.0125 -0.0268 186 PHE 27 CB 0.0076 0.0021 -0.0170 187 PHE 27 CG 0.0046 0.0101 -0.0128 188 PHE 27 CD1 0.0039 0.0126 -0.0113 189 PHE 27 CD2 0.0025 0.0152 -0.0100 190 PHE 27 CE1 0.0011 0.0198 -0.0074 191 PHE 27 CE2 -0.0002 0.0225 -0.0061 192 PHE 27 CZ -0.0009 0.0248 -0.0048 193 TYR 28 N -0.0016 -0.0012 -0.0177 194 TYR 28 CA 0.0001 -0.0025 -0.0227 195 TYR 28 C -0.0031 -0.0034 -0.0262 196 TYR 28 O -0.0016 -0.0045 -0.0303 197 TYR 28 CB 0.0056 -0.0029 -0.0232 198 TYR 28 CG 0.0088 -0.0022 -0.0202 199 TYR 28 CD1 0.0099 -0.0027 -0.0217 200 TYR 28 CD2 0.0105 -0.0011 -0.0156 201 TYR 28 CE1 0.0124 -0.0020 -0.0186 202 TYR 28 CE2 0.0130 -0.0004 -0.0125 203 TYR 28 CZ 0.0140 -0.0008 -0.0140 204 TYR 28 OH 0.0164 -0.0001 -0.0108 205 ARG 29 N -0.0085 -0.0152 -0.0274 206 ARG 29 CA -0.0109 -0.0190 -0.0260 207 ARG 29 C -0.0124 -0.0213 -0.0336 208 ARG 29 O -0.0146 -0.0249 -0.0383 209 ARG 29 CB -0.0145 -0.0251 -0.0205 210 ARG 29 CG -0.0164 -0.0282 -0.0175 211 ARG 29 CD -0.0203 -0.0345 -0.0124 212 ARG 29 NE -0.0192 -0.0330 -0.0059 213 ARG 29 CZ -0.0172 -0.0298 0.0007 214 ARG 29 NH1 -0.0159 -0.0277 0.0022 215 ARG 29 NH2 -0.0163 -0.0286 0.0059 216 ASN 30 N -0.0137 -0.0133 -0.0254 217 ASN 30 CA -0.0146 -0.0145 -0.0329 218 ASN 30 C -0.0119 -0.0127 -0.0383 219 ASN 30 O -0.0141 -0.0149 -0.0440 220 ASN 30 CB -0.0208 -0.0198 -0.0343 221 ASN 30 CG -0.0226 -0.0210 -0.0307 222 ASN 30 OD1 -0.0257 -0.0232 -0.0252 223 ASN 30 ND2 -0.0205 -0.0195 -0.0339 224 ARG 31 N -0.0075 -0.0027 -0.0304 225 ARG 31 CA -0.0047 0.0009 -0.0369 226 ARG 31 C -0.0009 0.0076 -0.0369 227 ARG 31 O -0.0002 0.0101 -0.0311 228 ARG 31 CB -0.0041 0.0021 -0.0365 229 ARG 31 CG -0.0078 -0.0045 -0.0370 230 ARG 31 CD -0.0071 -0.0035 -0.0380 231 ARG 31 NE -0.0110 -0.0101 -0.0372 232 ARG 31 CZ -0.0131 -0.0150 -0.0428 233 ARG 31 NH1 -0.0119 -0.0143 -0.0498 234 ARG 31 NH2 -0.0166 -0.0208 -0.0414 235 GLU 32 N -0.0034 0.0135 -0.0294 236 GLU 32 CA -0.0028 0.0168 -0.0292 237 GLU 32 C -0.0030 0.0170 -0.0295 238 GLU 32 O -0.0046 0.0157 -0.0312 239 GLU 32 CB -0.0042 0.0192 -0.0312 240 GLU 32 CG -0.0040 0.0194 -0.0311 241 GLU 32 CD -0.0025 0.0221 -0.0297 242 GLU 32 OE1 -0.0010 0.0213 -0.0277 243 GLU 32 OE2 -0.0027 0.0250 -0.0304 244 VAL 33 N 0.0012 0.0124 -0.0211 245 VAL 33 CA 0.0004 0.0122 -0.0220 246 VAL 33 C -0.0003 0.0145 -0.0215 247 VAL 33 O 0.0003 0.0161 -0.0202 248 VAL 33 CB 0.0017 0.0105 -0.0216 249 VAL 33 CG1 0.0025 0.0081 -0.0220 250 VAL 33 CG2 0.0034 0.0114 -0.0196 251 VAL 34 N 0.0028 0.0124 -0.0093 252 VAL 34 CA 0.0038 0.0116 -0.0095 253 VAL 34 C 0.0060 0.0081 -0.0095 254 VAL 34 O 0.0052 0.0054 -0.0085 255 VAL 34 CB 0.0007 0.0114 -0.0080 256 VAL 34 CG1 0.0019 0.0104 -0.0083 257 VAL 34 CG2 -0.0015 0.0150 -0.0080 258 VAL 35 N -0.0013 -0.0035 -0.0037 259 VAL 35 CA -0.0015 -0.0040 -0.0043 260 VAL 35 C -0.0026 -0.0039 -0.0040 261 VAL 35 O -0.0028 -0.0034 -0.0034 262 VAL 35 CB -0.0007 -0.0040 -0.0044 263 VAL 35 CG1 -0.0010 -0.0045 -0.0049 264 VAL 35 CG2 0.0003 -0.0042 -0.0047 265 VAL 36 N -0.0012 -0.0042 0.0000 266 VAL 36 CA -0.0024 -0.0046 0.0004 267 VAL 36 C -0.0034 -0.0048 -0.0006 268 VAL 36 O -0.0033 -0.0048 -0.0017 269 VAL 36 CB -0.0026 -0.0046 0.0002 270 VAL 36 CG1 -0.0038 -0.0049 0.0010 271 VAL 36 CG2 -0.0014 -0.0043 0.0007 272 GLY 37 N -0.0092 -0.0132 0.0031 273 GLY 37 CA -0.0106 -0.0121 0.0030 274 GLY 37 C -0.0110 -0.0121 0.0050 275 GLY 37 O -0.0100 -0.0130 0.0061 276 LEU 38 N -0.0067 -0.0220 0.0107 277 LEU 38 CA -0.0084 -0.0225 0.0107 278 LEU 38 C -0.0086 -0.0206 0.0122 279 LEU 38 O -0.0071 -0.0198 0.0124 280 LEU 38 CB -0.0073 -0.0240 0.0094 281 LEU 38 CG -0.0088 -0.0247 0.0092 282 LEU 38 CD1 -0.0114 -0.0256 0.0092 283 LEU 38 CD2 -0.0075 -0.0262 0.0078 284 ASN 39 N -0.0100 -0.0108 0.0207 285 ASN 39 CA -0.0123 -0.0084 0.0190 286 ASN 39 C -0.0100 -0.0107 0.0204 287 ASN 39 O -0.0065 -0.0138 0.0218 288 ASN 39 CB -0.0124 -0.0062 0.0132 289 ASN 39 CG -0.0079 -0.0083 0.0099 290 ASN 39 OD1 -0.0047 -0.0106 0.0097 291 ASN 39 ND2 -0.0075 -0.0076 0.0074 292 PRO 40 N -0.0013 -0.0111 0.0228 293 PRO 40 CA 0.0023 -0.0136 0.0241 294 PRO 40 C -0.0008 -0.0176 0.0235 295 PRO 40 O 0.0004 -0.0172 0.0239 296 PRO 40 CB 0.0068 -0.0168 0.0258 297 PRO 40 CG 0.0073 -0.0133 0.0256 298 PRO 40 CD 0.0013 -0.0116 0.0236 299 GLU 41 N -0.0078 -0.0133 0.0124 300 GLU 41 CA -0.0038 -0.0153 0.0092 301 GLU 41 C -0.0006 -0.0184 0.0106 302 GLU 41 O 0.0026 -0.0212 0.0112 303 GLU 41 CB -0.0040 -0.0129 0.0039 304 GLU 41 CG -0.0002 -0.0144 -0.0000 305 GLU 41 CD -0.0005 -0.0121 -0.0051 306 GLU 41 OE1 -0.0034 -0.0096 -0.0055 307 GLU 41 OE2 0.0021 -0.0128 -0.0086 308 ALA 42 N -0.0052 -0.0138 0.0119 309 ALA 42 CA -0.0061 -0.0127 0.0114 310 ALA 42 C -0.0051 -0.0118 0.0115 311 ALA 42 O -0.0056 -0.0117 0.0113 312 ALA 42 CB -0.0068 -0.0114 0.0110 313 VAL 43 N -0.0042 -0.0129 0.0184 314 VAL 43 CA -0.0036 -0.0125 0.0186 315 VAL 43 C -0.0032 -0.0132 0.0187 316 VAL 43 O -0.0032 -0.0130 0.0187 317 VAL 43 CB -0.0029 -0.0122 0.0188 318 VAL 43 CG1 -0.0022 -0.0120 0.0190 319 VAL 43 CG2 -0.0032 -0.0115 0.0187 320 GLU 44 N 0.0004 -0.0094 0.0148 321 GLU 44 CA 0.0009 -0.0136 0.0168 322 GLU 44 C -0.0059 -0.0156 0.0168 323 GLU 44 O -0.0068 -0.0155 0.0167 324 GLU 44 CB 0.0051 -0.0191 0.0199 325 GLU 44 CG 0.0126 -0.0168 0.0198 326 GLU 44 CD 0.0169 -0.0216 0.0227 327 GLU 44 OE1 0.0171 -0.0268 0.0251 328 GLU 44 OE2 0.0203 -0.0199 0.0223 329 GLU 45 N -0.0022 -0.0114 0.0050 330 GLU 45 CA -0.0003 -0.0112 0.0049 331 GLU 45 C 0.0011 -0.0110 0.0075 332 GLU 45 O 0.0034 -0.0108 0.0076 333 GLU 45 CB -0.0016 -0.0114 0.0039 334 GLU 45 CG -0.0023 -0.0115 0.0010 335 GLU 45 CD 0.0001 -0.0113 -0.0008 336 GLU 45 OE1 0.0006 -0.0113 -0.0018 337 GLU 45 OE2 0.0015 -0.0112 -0.0011 338 ALA 46 N -0.0040 -0.0080 0.0081 339 ALA 46 CA -0.0051 -0.0033 0.0068 340 ALA 46 C -0.0028 -0.0009 0.0047 341 ALA 46 O -0.0046 0.0023 0.0044 342 ALA 46 CB -0.0042 -0.0017 0.0058 343 GLN 47 N -0.0020 0.0023 0.0075 344 GLN 47 CA -0.0015 0.0008 0.0095 345 GLN 47 C 0.0001 -0.0006 0.0082 346 GLN 47 O 0.0010 -0.0024 0.0096 347 GLN 47 CB -0.0032 0.0021 0.0114 348 GLN 47 CG -0.0050 0.0036 0.0131 349 GLN 47 CD -0.0062 0.0040 0.0156 350 GLN 47 OE1 -0.0056 0.0024 0.0176 351 GLN 47 NE2 -0.0078 0.0061 0.0154 352 VAL 48 N 0.0031 -0.0008 0.0038 353 VAL 48 CA 0.0035 -0.0022 0.0031 354 VAL 48 C 0.0033 -0.0021 0.0030 355 VAL 48 O 0.0042 -0.0028 0.0032 356 VAL 48 CB 0.0029 -0.0031 0.0020 357 VAL 48 CG1 0.0032 -0.0046 0.0012 358 VAL 48 CG2 0.0034 -0.0034 0.0022 359 LEU 49 N 0.0033 -0.0002 -0.0039 360 LEU 49 CA 0.0019 -0.0002 -0.0052 361 LEU 49 C 0.0013 0.0001 -0.0066 362 LEU 49 O -0.0002 -0.0000 -0.0074 363 LEU 49 CB 0.0025 0.0003 -0.0060 364 LEU 49 CG 0.0028 -0.0001 -0.0046 365 LEU 49 CD1 0.0037 0.0004 -0.0054 366 LEU 49 CD2 0.0010 -0.0009 -0.0040 367 THR 50 N -0.0050 0.0086 -0.0012 368 THR 50 CA -0.0035 0.0101 0.0004 369 THR 50 C -0.0012 0.0084 0.0008 370 THR 50 O 0.0000 0.0093 0.0020 371 THR 50 CB -0.0024 0.0122 0.0020 372 THR 50 OG1 -0.0009 0.0111 0.0023 373 THR 50 CG2 -0.0047 0.0145 0.0018 374 LYS 51 N -0.0014 0.0023 0.0008 375 LYS 51 CA 0.0003 -0.0016 0.0020 376 LYS 51 C -0.0028 -0.0042 -0.0002 377 LYS 51 O -0.0018 -0.0074 0.0004 378 LYS 51 CB 0.0023 -0.0052 0.0034 379 LYS 51 CG 0.0055 -0.0028 0.0058 380 LYS 51 CD 0.0069 -0.0060 0.0067 381 LYS 51 CE 0.0103 -0.0038 0.0092 382 LYS 51 NZ 0.0091 -0.0023 0.0084 383 PHE 52 N -0.0007 -0.0027 -0.0064 384 PHE 52 CA -0.0028 -0.0056 -0.0095 385 PHE 52 C -0.0035 -0.0045 -0.0139 386 PHE 52 O -0.0051 -0.0071 -0.0158 387 PHE 52 CB -0.0030 -0.0057 -0.0102 388 PHE 52 CG -0.0023 -0.0067 -0.0060 389 PHE 52 CD1 -0.0034 -0.0106 -0.0037 390 PHE 52 CD2 -0.0006 -0.0037 -0.0044 391 PHE 52 CE1 -0.0027 -0.0116 0.0002 392 PHE 52 CE2 0.0000 -0.0046 -0.0005 393 PHE 52 CZ -0.0010 -0.0085 0.0018 394 ALA 53 N -0.0023 0.0018 -0.0158 395 ALA 53 CA -0.0042 0.0046 -0.0202 396 ALA 53 C -0.0040 0.0064 -0.0208 397 ALA 53 O -0.0016 0.0077 -0.0177 398 ALA 53 CB -0.0035 0.0093 -0.0215 399 SER 54 N -0.0082 0.0075 -0.0242 400 SER 54 CA -0.0081 0.0094 -0.0240 401 SER 54 C -0.0076 0.0180 -0.0227 402 SER 54 O -0.0059 0.0202 -0.0182 403 SER 54 CB -0.0110 0.0075 -0.0313 404 SER 54 OG -0.0113 -0.0007 -0.0323 405 THR 55 N -0.0056 0.0198 -0.0196 406 THR 55 CA -0.0069 0.0222 -0.0189 407 THR 55 C -0.0083 0.0212 -0.0204 408 THR 55 O -0.0097 0.0195 -0.0224 409 THR 55 CB -0.0091 0.0245 -0.0187 410 THR 55 OG1 -0.0080 0.0257 -0.0173 411 THR 55 CG2 -0.0104 0.0270 -0.0180 412 VAL 56 N -0.0115 0.0220 -0.0140 413 VAL 56 CA -0.0112 0.0191 -0.0132 414 VAL 56 C -0.0113 0.0205 -0.0136 415 VAL 56 O -0.0089 0.0220 -0.0146 416 VAL 56 CB -0.0078 0.0169 -0.0133 417 VAL 56 CG1 -0.0075 0.0140 -0.0125 418 VAL 56 CG2 -0.0076 0.0155 -0.0129 419 HIS 57 N -0.0100 0.0203 -0.0113 420 HIS 57 CA -0.0099 0.0205 -0.0115 421 HIS 57 C -0.0086 0.0185 -0.0110 422 HIS 57 O -0.0092 0.0168 -0.0098 423 HIS 57 CB -0.0121 0.0210 -0.0106 424 HIS 57 CG -0.0135 0.0230 -0.0110 425 HIS 57 ND1 -0.0132 0.0249 -0.0122 426 HIS 57 CD2 -0.0153 0.0233 -0.0104 427 HIS 57 CE1 -0.0147 0.0264 -0.0123 428 HIS 57 NE2 -0.0160 0.0255 -0.0112 429 TRP 58 N -0.0185 -0.0003 -0.0012 430 TRP 58 CA -0.0166 -0.0009 -0.0001 431 TRP 58 C -0.0164 0.0005 -0.0011 432 TRP 58 O -0.0157 0.0025 -0.0023 433 TRP 58 CB -0.0140 -0.0008 0.0006 434 TRP 58 CG -0.0121 -0.0019 0.0020 435 TRP 58 CD1 -0.0125 -0.0034 0.0029 436 TRP 58 CD2 -0.0094 -0.0014 0.0025 437 TRP 58 NE1 -0.0103 -0.0039 0.0040 438 TRP 58 CE2 -0.0083 -0.0027 0.0038 439 TRP 58 CE3 -0.0078 -0.0001 0.0021 440 TRP 58 CZ2 -0.0057 -0.0027 0.0046 441 TRP 58 CZ3 -0.0052 0.0000 0.0028 442 TRP 58 CH2 -0.0041 -0.0013 0.0041 443 ILE 59 N -0.0155 -0.0001 0.0006 444 ILE 59 CA -0.0155 -0.0013 0.0014 445 ILE 59 C -0.0160 -0.0022 0.0007 446 ILE 59 O -0.0161 -0.0020 0.0003 447 ILE 59 CB -0.0150 -0.0010 0.0026 448 ILE 59 CG1 -0.0146 -0.0001 0.0033 449 ILE 59 CG2 -0.0151 -0.0022 0.0034 450 ILE 59 CD1 -0.0141 0.0004 0.0044 451 THR 60 N -0.0194 -0.0104 0.0059 452 THR 60 CA -0.0197 -0.0126 0.0046 453 THR 60 C -0.0223 -0.0130 0.0062 454 THR 60 O -0.0230 -0.0110 0.0081 455 THR 60 CB -0.0172 -0.0119 0.0032 456 THR 60 OG1 -0.0168 -0.0095 0.0046 457 THR 60 CG2 -0.0145 -0.0114 0.0017 458 PRO 61 N -0.0265 -0.0156 0.0053 459 PRO 61 CA -0.0301 -0.0153 0.0069 460 PRO 61 C -0.0303 -0.0142 0.0084 461 PRO 61 O -0.0332 -0.0138 0.0100 462 PRO 61 CB -0.0325 -0.0178 0.0045 463 PRO 61 CG -0.0300 -0.0193 0.0017 464 PRO 61 CD -0.0264 -0.0181 0.0021 465 LYS 62 N -0.0397 -0.0248 0.0054 466 LYS 62 CA -0.0311 -0.0184 0.0036 467 LYS 62 C -0.0213 -0.0139 0.0015 468 LYS 62 O -0.0214 -0.0171 0.0015 469 LYS 62 CB -0.0260 -0.0267 0.0024 470 LYS 62 CG -0.0178 -0.0372 0.0006 471 LYS 62 CD -0.0134 -0.0461 -0.0004 472 LYS 62 CE -0.0225 -0.0563 0.0015 473 LYS 62 NZ -0.0171 -0.0649 0.0002 474 ASP 63 N -0.0056 -0.0161 -0.0030 475 ASP 63 CA -0.0025 -0.0113 -0.0082 476 ASP 63 C 0.0016 -0.0175 -0.0063 477 ASP 63 O 0.0074 -0.0254 -0.0041 478 ASP 63 CB 0.0048 -0.0066 -0.0160 479 ASP 63 CG 0.0105 -0.0027 -0.0220 480 ASP 63 OD1 0.0171 -0.0087 -0.0217 481 ASP 63 OD2 0.0084 0.0059 -0.0269 482 PRO 64 N 0.0055 -0.0128 -0.0019 483 PRO 64 CA 0.0064 -0.0169 0.0039 484 PRO 64 C 0.0140 -0.0173 0.0019 485 PRO 64 O 0.0159 -0.0211 0.0069 486 PRO 64 CB -0.0026 -0.0155 0.0049 487 PRO 64 CG -0.0088 -0.0110 0.0005 488 PRO 64 CD -0.0024 -0.0084 -0.0056 489 HIS 65 N 0.0234 -0.0251 0.0043 490 HIS 65 CA 0.0306 -0.0259 0.0009 491 HIS 65 C 0.0388 -0.0312 0.0046 492 HIS 65 O 0.0450 -0.0332 0.0041 493 HIS 65 CB 0.0327 -0.0213 -0.0086 494 HIS 65 CG 0.0250 -0.0162 -0.0125 495 HIS 65 ND1 0.0199 -0.0123 -0.0159 496 HIS 65 CD2 0.0219 -0.0144 -0.0135 497 HIS 65 CE1 0.0140 -0.0083 -0.0189 498 HIS 65 NE2 0.0148 -0.0094 -0.0176 499 THR 66 N 0.0455 -0.0312 0.0021 500 THR 66 CA 0.0556 -0.0343 0.0113 501 THR 66 C 0.0550 -0.0400 0.0250 502 THR 66 O 0.0654 -0.0421 0.0322 503 THR 66 CB 0.0545 -0.0348 0.0124 504 THR 66 OG1 0.0408 -0.0372 0.0156 505 THR 66 CG2 0.0584 -0.0293 -0.0001 506 LEU 67 N 0.0266 -0.0141 0.0191 507 LEU 67 CA 0.0258 -0.0157 0.0245 508 LEU 67 C 0.0261 -0.0156 0.0243 509 LEU 67 O 0.0242 -0.0170 0.0279 510 LEU 67 CB 0.0202 -0.0173 0.0268 511 LEU 67 CG 0.0198 -0.0180 0.0294 512 LEU 67 CD1 0.0143 -0.0197 0.0322 513 LEU 67 CD2 0.0247 -0.0184 0.0334 514 ASP 68 N 0.0525 -0.0237 0.0092 515 ASP 68 CA 0.0175 -0.0293 0.0361 516 ASP 68 C 0.0364 -0.0370 0.0370 517 ASP 68 O 0.0177 -0.0180 0.0199 518 ASP 68 CB -0.0369 -0.0010 0.0250 519 ASP 68 CG -0.0778 -0.0128 0.0640 520 ASP 68 OD1 -0.1000 -0.0011 0.0593 521 ASP 68 OD2 -0.0870 -0.0340 0.0993 522 GLY 69 N 0.0308 -0.0283 0.0283 523 GLY 69 CA 0.0243 -0.0248 0.0266 524 GLY 69 C 0.0213 -0.0202 0.0321 525 GLY 69 O 0.0159 -0.0171 0.0311 526 HIS 70 N 0.0164 -0.0116 0.0286 527 HIS 70 CA 0.0143 -0.0108 0.0317 528 HIS 70 C 0.0114 -0.0097 0.0313 529 HIS 70 O 0.0087 -0.0086 0.0325 530 HIS 70 CB 0.0164 -0.0117 0.0350 531 HIS 70 CG 0.0151 -0.0113 0.0385 532 HIS 70 ND1 0.0129 -0.0104 0.0405 533 HIS 70 CD2 0.0157 -0.0116 0.0403 534 HIS 70 CE1 0.0122 -0.0102 0.0433 535 HIS 70 NE2 0.0139 -0.0109 0.0434 536 ALA 71 N 0.0082 -0.0126 0.0223 537 ALA 71 CA 0.0019 -0.0110 0.0202 538 ALA 71 C -0.0000 -0.0078 0.0153 539 ALA 71 O -0.0054 -0.0063 0.0133 540 ALA 71 CB 0.0019 -0.0098 0.0184 541 ASP 72 N 0.0006 -0.0066 0.0153 542 ASP 72 CA -0.0023 -0.0062 0.0092 543 ASP 72 C -0.0082 -0.0019 0.0092 544 ASP 72 O -0.0105 -0.0009 0.0065 545 ASP 72 CB -0.0015 -0.0081 0.0043 546 ASP 72 CG 0.0040 -0.0126 0.0027 547 ASP 72 OD1 0.0075 -0.0142 0.0058 548 ASP 72 OD2 0.0048 -0.0144 -0.0018 549 GLU 73 N -0.0009 0.0054 0.0112 550 GLU 73 CA -0.0209 0.0018 0.0148 551 GLU 73 C -0.0257 -0.0005 0.0095 552 GLU 73 O -0.0392 -0.0056 -0.0001 553 GLU 73 CB -0.0266 0.0053 0.0358 554 GLU 73 CG -0.0481 0.0017 0.0410 555 GLU 73 CD -0.0532 0.0053 0.0620 556 GLU 73 OE1 -0.0402 0.0106 0.0729 557 GLU 73 OE2 -0.0705 0.0026 0.0671 558 LEU 74 N -0.0086 0.0034 0.0092 559 LEU 74 CA -0.0095 0.0034 0.0089 560 LEU 74 C -0.0097 0.0037 0.0069 561 LEU 74 O -0.0112 0.0036 0.0062 562 LEU 74 CB -0.0084 0.0033 0.0100 563 LEU 74 CG -0.0093 0.0032 0.0098 564 LEU 74 CD1 -0.0112 0.0029 0.0106 565 LEU 74 CD2 -0.0080 0.0032 0.0108 566 LEU 75 N -0.0162 0.0042 0.0033 567 LEU 75 CA -0.0163 0.0052 -0.0003 568 LEU 75 C -0.0185 0.0069 -0.0040 569 LEU 75 O -0.0198 0.0081 -0.0068 570 LEU 75 CB -0.0118 0.0040 -0.0019 571 LEU 75 CG -0.0098 0.0025 0.0012 572 LEU 75 CD1 -0.0050 0.0012 -0.0001 573 LEU 75 CD2 -0.0118 0.0032 0.0013 574 ALA 76 N -0.0251 0.0029 -0.0035 575 ALA 76 CA -0.0349 0.0009 -0.0096 576 ALA 76 C -0.0340 0.0117 -0.0062 577 ALA 76 O -0.0402 0.0100 -0.0101 578 ALA 76 CB -0.0497 0.0037 -0.0172 579 HIS 77 N -0.0125 0.0242 0.0103 580 HIS 77 CA -0.0096 0.0236 0.0093 581 HIS 77 C -0.0102 0.0255 0.0122 582 HIS 77 O -0.0142 0.0260 0.0129 583 HIS 77 CB -0.0107 0.0208 0.0051 584 HIS 77 CG -0.0068 0.0197 0.0034 585 HIS 77 ND1 -0.0063 0.0205 0.0047 586 HIS 77 CD2 -0.0032 0.0180 0.0009 587 HIS 77 CE1 -0.0024 0.0194 0.0030 588 HIS 77 NE2 -0.0004 0.0179 0.0007 589 PRO 78 N -0.0035 0.0370 0.0074 590 PRO 78 CA -0.0021 0.0394 0.0158 591 PRO 78 C -0.0043 0.0381 0.0106 592 PRO 78 O -0.0058 0.0401 0.0171 593 PRO 78 CB 0.0110 0.0399 0.0205 594 PRO 78 CG 0.0146 0.0389 0.0179 595 PRO 78 CD 0.0076 0.0360 0.0066 596 SER 79 N -0.0061 0.0256 0.0016 597 SER 79 CA -0.0069 0.0249 -0.0028 598 SER 79 C -0.0107 0.0279 -0.0045 599 SER 79 O -0.0118 0.0278 -0.0079 600 SER 79 CB -0.0055 0.0224 -0.0062 601 SER 79 OG -0.0019 0.0194 -0.0049 602 VAL 80 N -0.0168 0.0249 0.0000 603 VAL 80 CA -0.0173 0.0224 0.0011 604 VAL 80 C -0.0185 0.0242 0.0015 605 VAL 80 O -0.0173 0.0263 0.0000 606 VAL 80 CB -0.0147 0.0196 -0.0002 607 VAL 80 CG1 -0.0152 0.0172 0.0008 608 VAL 80 CG2 -0.0141 0.0175 -0.0001 609 LYS 81 N -0.0142 0.0269 -0.0095 610 LYS 81 CA -0.0160 0.0279 -0.0081 611 LYS 81 C -0.0168 0.0240 -0.0077 612 LYS 81 O -0.0185 0.0212 -0.0067 613 LYS 81 CB -0.0191 0.0303 -0.0056 614 LYS 81 CG -0.0183 0.0347 -0.0058 615 LYS 81 CD -0.0214 0.0372 -0.0033 616 LYS 81 CE -0.0206 0.0418 -0.0036 617 LYS 81 NZ -0.0202 0.0425 -0.0039 618 LEU 82 N -0.0195 0.0165 -0.0030 619 LEU 82 CA -0.0183 0.0125 -0.0022 620 LEU 82 C -0.0196 0.0121 -0.0000 621 LEU 82 O -0.0197 0.0140 -0.0011 622 LEU 82 CB -0.0152 0.0111 -0.0055 623 LEU 82 CG -0.0138 0.0069 -0.0048 624 LEU 82 CD1 -0.0139 0.0038 -0.0028 625 LEU 82 CD2 -0.0110 0.0060 -0.0083 626 TRP 83 N -0.0170 0.0093 -0.0047 627 TRP 83 CA -0.0185 0.0082 -0.0021 628 TRP 83 C -0.0169 0.0036 -0.0021 629 TRP 83 O -0.0176 0.0006 0.0002 630 TRP 83 CB -0.0214 0.0087 0.0018 631 TRP 83 CG -0.0230 0.0132 0.0019 632 TRP 83 CD1 -0.0232 0.0148 0.0015 633 TRP 83 CD2 -0.0243 0.0167 0.0021 634 TRP 83 NE1 -0.0247 0.0191 0.0016 635 TRP 83 CE2 -0.0254 0.0204 0.0019 636 TRP 83 CE3 -0.0246 0.0170 0.0024 637 TRP 83 CZ2 -0.0268 0.0243 0.0021 638 TRP 83 CZ3 -0.0261 0.0210 0.0026 639 TRP 83 CH2 -0.0272 0.0246 0.0024 640 GLU 84 N -0.0195 -0.0030 0.0066 641 GLU 84 CA -0.0225 -0.0060 0.0053 642 GLU 84 C -0.0295 -0.0063 0.0080 643 GLU 84 O -0.0316 -0.0026 0.0120 644 GLU 84 CB -0.0194 -0.0041 0.0056 645 GLU 84 CG -0.0202 0.0013 0.0105 646 GLU 84 CD -0.0189 0.0024 0.0109 647 GLU 84 OE1 -0.0162 -0.0005 0.0073 648 GLU 84 OE2 -0.0212 0.0058 0.0147 649 LYS 85 N -0.0241 -0.0125 0.0125 650 LYS 85 CA -0.0329 -0.0089 0.0103 651 LYS 85 C -0.0231 -0.0111 0.0046 652 LYS 85 O -0.0261 -0.0111 0.0092 653 LYS 85 CB -0.0432 -0.0084 0.0250 654 LYS 85 CG -0.0538 -0.0062 0.0322 655 LYS 85 CD -0.0671 -0.0038 0.0429 656 LYS 85 CE -0.0708 -0.0058 0.0581 657 LYS 85 NZ -0.0615 -0.0120 0.0710 658 THR 86 N -0.0162 -0.0106 0.0015 659 THR 86 CA -0.0136 -0.0100 0.0024 660 THR 86 C -0.0126 -0.0070 0.0032 661 THR 86 O -0.0142 -0.0050 0.0031 662 THR 86 CB -0.0138 -0.0102 0.0023 663 THR 86 OG1 -0.0155 -0.0078 0.0022 664 THR 86 CG2 -0.0152 -0.0131 0.0013 665 ARG 87 N 0.0011 -0.0092 -0.0030 666 ARG 87 CA 0.0041 -0.0032 -0.0009 667 ARG 87 C 0.0035 -0.0067 -0.0031 668 ARG 87 O 0.0054 -0.0119 -0.0091 669 ARG 87 CB 0.0123 0.0021 -0.0041 670 ARG 87 CG 0.0145 0.0104 0.0006 671 ARG 87 CD 0.0222 0.0145 -0.0033 672 ARG 87 NE 0.0275 0.0161 -0.0067 673 ARG 87 CZ 0.0311 0.0231 -0.0045 674 ARG 87 NH1 0.0299 0.0291 0.0015 675 ARG 87 NH2 0.0361 0.0239 -0.0083 676 LEU 88 N 0.0077 -0.0029 -0.0020 677 LEU 88 CA 0.0058 -0.0008 0.0006 678 LEU 88 C 0.0056 -0.0023 0.0042 679 LEU 88 O 0.0067 -0.0048 0.0056 680 LEU 88 CB 0.0053 0.0002 0.0003 681 LEU 88 CG 0.0033 0.0023 0.0031 682 LEU 88 CD1 0.0015 0.0052 0.0031 683 LEU 88 CD2 0.0029 0.0033 0.0022 684 ILE 89 N 0.0091 -0.0066 0.0027 685 ILE 89 CA 0.0117 -0.0086 0.0100 686 ILE 89 C 0.0055 -0.0054 0.0198 687 ILE 89 O 0.0084 -0.0075 0.0286 688 ILE 89 CB 0.0109 -0.0079 0.0048 689 ILE 89 CG1 0.0166 -0.0108 -0.0057 690 ILE 89 CG2 0.0134 -0.0098 0.0125 691 ILE 89 CD1 0.0267 -0.0170 -0.0045 692 ARG 90 N 0.0051 -0.0032 0.0189 693 ARG 90 CA 0.0036 0.0035 0.0253 694 ARG 90 C 0.0031 0.0133 0.0199 695 ARG 90 O 0.0034 0.0173 0.0136 696 ARG 90 CB 0.0022 0.0058 0.0349 697 ARG 90 CG 0.0005 0.0112 0.0438 698 ARG 90 CD -0.0005 0.0099 0.0536 699 ARG 90 NE 0.0005 -0.0012 0.0565 700 ARG 90 CZ 0.0012 -0.0075 0.0566 701 ARG 90 NH1 0.0010 -0.0044 0.0546 702 ARG 90 NH2 0.0020 -0.0173 0.0587 703 ILE 91 N 0.0025 0.0108 0.0233 704 ILE 91 CA 0.0060 0.0120 0.0222 705 ILE 91 C 0.0037 0.0132 0.0240 706 ILE 91 O -0.0000 0.0110 0.0246 707 ILE 91 CB 0.0085 0.0082 0.0189 708 ILE 91 CG1 0.0109 0.0071 0.0172 709 ILE 91 CG2 0.0121 0.0094 0.0178 710 ILE 91 CD1 0.0124 0.0026 0.0140 711 LYS 92 N -0.0009 0.0157 0.0202 712 LYS 92 CA -0.0048 0.0189 0.0234 713 LYS 92 C -0.0002 0.0198 0.0218 714 LYS 92 O 0.0065 0.0207 0.0193 715 LYS 92 CB -0.0063 0.0265 0.0276 716 LYS 92 CG -0.0114 0.0269 0.0300 717 LYS 92 CD -0.0116 0.0349 0.0339 718 LYS 92 CE -0.0193 0.0369 0.0382 719 LYS 92 NZ -0.0225 0.0339 0.0382 720 GLY 93 N 0.0044 0.0216 0.0175 721 GLY 93 CA 0.0071 0.0145 0.0176 722 GLY 93 C 0.0029 0.0108 0.0123 723 GLY 93 O -0.0019 0.0142 0.0088 724 GLU 94 N 0.0183 -0.0027 0.0032 725 GLU 94 CA 0.0135 -0.0130 -0.0069 726 GLU 94 C 0.0143 -0.0229 -0.0067 727 GLU 94 O 0.0182 -0.0209 0.0007 728 GLU 94 CB 0.0150 -0.0217 -0.0054 729 GLU 94 CG 0.0147 -0.0128 -0.0047 730 GLU 94 CD 0.0165 -0.0221 -0.0025 731 GLU 94 OE1 0.0129 -0.0199 -0.0089 732 GLU 94 OE2 0.0216 -0.0314 0.0055 733 GLU 95 N 0.0345 -0.0668 -0.0476 734 GLU 95 CA 0.0260 -0.0564 -0.0147 735 GLU 95 C 0.0075 -0.0493 -0.0192 736 GLU 95 O 0.0148 -0.0488 -0.0010 737 GLU 95 CB 0.0048 -0.0434 0.0044 738 GLU 95 CG -0.0027 -0.0326 0.0414 739 GLU 95 CD 0.0251 -0.0391 0.0684 740 GLU 95 OE1 0.0319 -0.0412 0.0728 741 GLU 95 OE2 0.0400 -0.0423 0.0842 742 ALA 96 N 0.0204 -0.0499 -0.0089 743 ALA 96 CA 0.0267 -0.0543 0.0004 744 ALA 96 C 0.0255 -0.0464 0.0084 745 ALA 96 O 0.0288 -0.0495 0.0120 746 ALA 96 CB 0.0319 -0.0581 0.0077 747 GLY 97 N 0.0219 -0.0284 0.0079 748 GLY 97 CA 0.0199 -0.0163 0.0176 749 GLY 97 C 0.0167 -0.0037 0.0235 750 GLY 97 O 0.0143 -0.0021 0.0171 751 VAL 98 N 0.0163 -0.0001 0.0170 752 VAL 98 CA 0.0170 0.0021 0.0167 753 VAL 98 C 0.0172 0.0053 0.0164 754 VAL 98 O 0.0185 0.0058 0.0161 755 VAL 98 CB 0.0200 0.0013 0.0161 756 VAL 98 CG1 0.0208 0.0036 0.0158 757 VAL 98 CG2 0.0197 -0.0018 0.0164 758 THR 99 N 0.0051 0.0154 0.0114 759 THR 99 CA 0.0052 0.0179 0.0111 760 THR 99 C 0.0057 0.0168 0.0101 761 THR 99 O 0.0062 0.0186 0.0089 762 THR 99 CB 0.0041 0.0196 0.0138 763 THR 99 OG1 0.0032 0.0177 0.0159 764 THR 99 CG2 0.0037 0.0211 0.0148 765 ALA 100 N -0.0034 0.0230 0.0099 766 ALA 100 CA 0.0002 0.0274 0.0083 767 ALA 100 C 0.0026 0.0234 0.0090 768 ALA 100 O 0.0005 0.0174 0.0107 769 ALA 100 CB -0.0048 0.0338 0.0074 770 VAL 101 N -0.0034 0.0238 0.0017 771 VAL 101 CA -0.0008 0.0195 0.0022 772 VAL 101 C -0.0005 0.0201 0.0012 773 VAL 101 O -0.0011 0.0238 -0.0013 774 VAL 101 CB 0.0030 0.0170 -0.0008 775 VAL 101 CG1 0.0029 0.0157 0.0006 776 VAL 101 CG2 0.0048 0.0200 -0.0057 777 GLU 102 N -0.0011 0.0169 0.0034 778 GLU 102 CA 0.0013 0.0145 0.0017 779 GLU 102 C 0.0067 0.0093 -0.0023 780 GLU 102 O 0.0094 0.0049 0.0007 781 GLU 102 CB 0.0010 0.0124 0.0090 782 GLU 102 CG 0.0030 0.0102 0.0083 783 GLU 102 CD 0.0030 0.0076 0.0157 784 GLU 102 OE1 0.0001 0.0092 0.0215 785 GLU 102 OE2 0.0059 0.0040 0.0159 786 VAL 103 N 0.0055 0.0044 -0.0099 787 VAL 103 CA 0.0077 0.0016 -0.0126 788 VAL 103 C 0.0131 -0.0039 -0.0172 789 VAL 103 O 0.0131 -0.0059 -0.0202 790 VAL 103 CB 0.0012 0.0020 -0.0165 791 VAL 103 CG1 -0.0041 0.0076 -0.0118 792 VAL 103 CG2 -0.0031 -0.0004 -0.0232 793 ARG 104 N 0.0229 -0.0221 -0.0323 794 ARG 104 CA 0.0212 -0.0191 -0.0313 795 ARG 104 C 0.0230 -0.0186 -0.0310 796 ARG 104 O 0.0237 -0.0212 -0.0319 797 ARG 104 CB 0.0169 -0.0198 -0.0318 798 ARG 104 CG 0.0147 -0.0169 -0.0309 799 ARG 104 CD 0.0108 -0.0181 -0.0315 800 ARG 104 NE 0.0084 -0.0183 -0.0318 801 ARG 104 CZ 0.0049 -0.0195 -0.0325 802 ARG 104 NH1 0.0034 -0.0210 -0.0331 803 ARG 104 NH2 0.0028 -0.0193 -0.0325 804 HIS 105 N 0.0263 -0.0234 -0.0284 805 HIS 105 CA 0.0138 -0.0176 -0.0209 806 HIS 105 C 0.0091 -0.0073 -0.0274 807 HIS 105 O 0.0146 -0.0090 -0.0318 808 HIS 105 CB 0.0115 -0.0263 -0.0082 809 HIS 105 CG 0.0005 -0.0248 0.0025 810 HIS 105 ND1 0.0009 -0.0302 0.0084 811 HIS 105 CD2 -0.0104 -0.0187 0.0080 812 HIS 105 CE1 -0.0098 -0.0273 0.0173 813 HIS 105 NE2 -0.0171 -0.0203 0.0175 814 PRO 106 N 0.0056 -0.0120 -0.0164 815 PRO 106 CA 0.0061 -0.0066 -0.0193 816 PRO 106 C 0.0066 -0.0074 -0.0196 817 PRO 106 O 0.0041 -0.0088 -0.0156 818 PRO 106 CB 0.0023 -0.0012 -0.0163 819 PRO 106 CG 0.0011 -0.0031 -0.0139 820 PRO 106 CD 0.0022 -0.0102 -0.0124 821 GLY 107 N -0.0192 -0.0120 -0.0267 822 GLY 107 CA -0.0361 0.0087 -0.0181 823 GLY 107 C -0.0319 0.0129 -0.0102 824 GLY 107 O -0.0487 0.0267 -0.0090 825 GLU 108 N -0.0234 0.0060 -0.0164 826 GLU 108 CA -0.0150 0.0058 -0.0067 827 GLU 108 C -0.0161 0.0043 -0.0133 828 GLU 108 O -0.0178 0.0074 -0.0047 829 GLU 108 CB 0.0022 0.0004 -0.0035 830 GLU 108 CG 0.0051 0.0032 0.0098 831 GLU 108 CD 0.0029 0.0089 0.0263 832 GLU 108 OE1 0.0017 0.0099 0.0284 833 GLU 108 OE2 0.0028 0.0121 0.0371 834 SER 109 N -0.0068 0.0011 -0.0239 835 SER 109 CA -0.0312 -0.0035 -0.0259 836 SER 109 C -0.0063 0.0014 -0.0237 837 SER 109 O -0.0149 -0.0128 -0.0381 838 SER 109 CB -0.0711 0.0112 -0.0048 839 SER 109 OG -0.0975 -0.0009 -0.0146 840 ASP 110 N -0.0090 -0.0057 -0.0186 841 ASP 110 CA 0.0043 -0.0040 -0.0181 842 ASP 110 C 0.0296 -0.0181 -0.0293 843 ASP 110 O 0.0451 -0.0204 -0.0317 844 ASP 110 CB 0.0115 0.0206 -0.0013 845 ASP 110 CG -0.0142 0.0327 0.0085 846 ASP 110 OD1 -0.0266 0.0263 0.0047 847 ASP 110 OD2 -0.0217 0.0481 0.0197 848 SER 111 N 0.0168 -0.0070 -0.0236 849 SER 111 CA 0.0173 -0.0050 -0.0265 850 SER 111 C 0.0175 0.0006 -0.0289 851 SER 111 O 0.0168 0.0038 -0.0269 852 SER 111 CB 0.0165 -0.0045 -0.0229 853 SER 111 OG 0.0163 -0.0096 -0.0206 854 GLN 112 N 0.0155 0.0125 -0.0313 855 GLN 112 CA 0.0049 0.0170 -0.0369 856 GLN 112 C -0.0025 0.0216 -0.0272 857 GLN 112 O 0.0007 0.0210 -0.0194 858 GLN 112 CB 0.0055 0.0156 -0.0462 859 GLN 112 CG -0.0035 0.0188 -0.0563 860 GLN 112 CD -0.0058 0.0192 -0.0618 861 GLN 112 OE1 -0.0110 0.0222 -0.0567 862 GLN 112 NE2 -0.0019 0.0161 -0.0727 863 GLU 113 N -0.0042 0.0348 -0.0214 864 GLU 113 CA -0.0078 0.0388 -0.0170 865 GLU 113 C -0.0097 0.0444 -0.0242 866 GLU 113 O -0.0116 0.0495 -0.0300 867 GLU 113 CB -0.0129 0.0435 -0.0089 868 GLU 113 CG -0.0163 0.0464 -0.0028 869 GLU 113 CD -0.0199 0.0483 0.0070 870 GLU 113 OE1 -0.0175 0.0423 0.0129 871 GLU 113 OE2 -0.0250 0.0555 0.0087 872 LEU 114 N -0.0047 0.0259 -0.0144 873 LEU 114 CA -0.0067 0.0273 -0.0158 874 LEU 114 C -0.0063 0.0303 -0.0152 875 LEU 114 O -0.0059 0.0318 -0.0148 876 LEU 114 CB -0.0088 0.0270 -0.0173 877 LEU 114 CG -0.0096 0.0241 -0.0182 878 LEU 114 CD1 -0.0113 0.0240 -0.0195 879 LEU 114 CD2 -0.0108 0.0232 -0.0192 880 LEU 115 N 0.0015 0.0311 -0.0173 881 LEU 115 CA -0.0011 0.0326 -0.0148 882 LEU 115 C 0.0038 0.0288 -0.0191 883 LEU 115 O 0.0090 0.0298 -0.0259 884 LEU 115 CB -0.0043 0.0428 -0.0151 885 LEU 115 CG -0.0094 0.0474 -0.0109 886 LEU 115 CD1 -0.0103 0.0577 -0.0140 887 LEU 115 CD2 -0.0156 0.0455 -0.0025 888 ALA 116 N 0.0056 0.0191 -0.0156 889 ALA 116 CA 0.0070 0.0176 -0.0174 890 ALA 116 C 0.0061 0.0170 -0.0163 891 ALA 116 O 0.0044 0.0164 -0.0140 892 ALA 116 CB 0.0078 0.0144 -0.0184 893 GLU 117 N 0.0144 0.0132 -0.0279 894 GLU 117 CA 0.0097 0.0092 -0.0211 895 GLU 117 C 0.0155 0.0058 -0.0142 896 GLU 117 O 0.0132 0.0024 -0.0082 897 GLU 117 CB 0.0030 0.0082 -0.0205 898 GLU 117 CG -0.0044 0.0108 -0.0262 899 GLU 117 CD -0.0094 0.0112 -0.0278 900 GLU 117 OE1 -0.0060 0.0137 -0.0318 901 GLU 117 OE2 -0.0164 0.0090 -0.0248 902 GLY 118 N 0.0125 0.0040 -0.0124 903 GLY 118 CA 0.0137 0.0009 -0.0131 904 GLY 118 C 0.0131 0.0021 -0.0129 905 GLY 118 O 0.0143 0.0054 -0.0121 906 VAL 119 N 0.0194 -0.0001 -0.0002 907 VAL 119 CA 0.0187 -0.0001 -0.0000 908 VAL 119 C 0.0194 -0.0021 -0.0011 909 VAL 119 O 0.0187 -0.0039 -0.0017 910 VAL 119 CB 0.0161 0.0000 0.0005 911 VAL 119 CG1 0.0155 0.0002 0.0007 912 VAL 119 CG2 0.0153 0.0020 0.0015 913 PHE 120 N 0.0123 -0.0081 -0.0037 914 PHE 120 CA 0.0124 -0.0092 -0.0054 915 PHE 120 C 0.0114 -0.0108 -0.0054 916 PHE 120 O 0.0113 -0.0109 -0.0052 917 PHE 120 CB 0.0135 -0.0084 -0.0069 918 PHE 120 CG 0.0145 -0.0069 -0.0071 919 PHE 120 CD1 0.0150 -0.0054 -0.0060 920 PHE 120 CD2 0.0150 -0.0071 -0.0084 921 PHE 120 CE1 0.0159 -0.0040 -0.0063 922 PHE 120 CE2 0.0159 -0.0057 -0.0087 923 PHE 120 CZ 0.0164 -0.0041 -0.0076 924 VAL 121 N 0.0143 -0.0052 0.0006 925 VAL 121 CA 0.0101 -0.0044 0.0009 926 VAL 121 C 0.0085 -0.0045 -0.0010 927 VAL 121 O 0.0087 -0.0054 -0.0045 928 VAL 121 CB 0.0081 -0.0044 -0.0009 929 VAL 121 CG1 0.0036 -0.0035 -0.0004 930 VAL 121 CG2 0.0097 -0.0043 0.0008 931 TYR 122 N 0.0039 -0.0096 -0.0022 932 TYR 122 CA 0.0023 -0.0085 -0.0021 933 TYR 122 C 0.0006 -0.0074 -0.0018 934 TYR 122 O -0.0006 -0.0074 -0.0001 935 TYR 122 CB 0.0020 -0.0091 -0.0003 936 TYR 122 CG 0.0037 -0.0102 -0.0006 937 TYR 122 CD1 0.0042 -0.0098 -0.0022 938 TYR 122 CD2 0.0049 -0.0118 0.0007 939 TYR 122 CE1 0.0059 -0.0108 -0.0026 940 TYR 122 CE2 0.0066 -0.0128 0.0003 941 TYR 122 CZ 0.0071 -0.0123 -0.0013 942 TYR 122 OH 0.0089 -0.0134 -0.0017 943 LEU 123 N 0.0020 0.0089 -0.0074 944 LEU 123 CA -0.0016 0.0127 -0.0077 945 LEU 123 C -0.0043 0.0178 -0.0109 946 LEU 123 O -0.0024 0.0188 -0.0157 947 LEU 123 CB 0.0006 0.0123 -0.0105 948 LEU 123 CG 0.0036 0.0074 -0.0078 949 LEU 123 CD1 0.0061 0.0072 -0.0116 950 LEU 123 CD2 0.0006 0.0066 -0.0016 951 GLN 124 N 0.0162 0.0224 -0.0101 952 GLN 124 CA 0.0037 0.0366 -0.0213 953 GLN 124 C 0.0168 0.0376 -0.0167 954 GLN 124 O 0.0278 0.0203 -0.0046 955 GLN 124 CB -0.0252 0.0255 -0.0277 956 GLN 124 CG -0.0389 0.0283 -0.0343 957 GLN 124 CD -0.0663 0.0137 -0.0385 958 GLN 124 OE1 -0.0709 -0.0087 -0.0303 959 GLN 124 NE2 -0.0850 0.0265 -0.0515 960 GLY 125 N 0.0370 0.0573 -0.0004 961 GLY 125 CA 0.0296 0.0536 -0.0001 962 GLY 125 C 0.0328 0.0434 0.0024 963 GLY 125 O 0.0414 0.0397 0.0038 964 SER 126 N 0.0154 0.0072 -0.0081 965 SER 126 CA 0.0127 -0.0274 -0.0151 966 SER 126 C 0.0072 -0.0356 -0.0107 967 SER 126 O -0.0025 -0.0633 -0.0067 968 SER 126 CB -0.0057 -0.0479 0.0018 969 SER 126 OG -0.0261 -0.0401 0.0295 970 LYS 127 N 0.0210 -0.0036 -0.0055 971 LYS 127 CA 0.0137 -0.0038 0.0060 972 LYS 127 C 0.0136 0.0009 0.0014 973 LYS 127 O 0.0193 0.0044 -0.0112 974 LYS 127 CB 0.0023 0.0058 0.0136 975 LYS 127 CG 0.0014 0.0028 0.0181 976 LYS 127 CD 0.0010 -0.0093 0.0312 977 LYS 127 CE 0.0061 -0.0171 0.0313 978 LYS 127 NZ 0.0164 -0.0304 0.0292 979 LYS 127 OXT 0.0070 0.0019 0.0103