1 LEU 1 N 0.0074 -0.0034 0.0155 2 LEU 1 CA 0.0023 -0.0086 0.0006 3 LEU 1 C -0.0037 -0.0101 -0.0150 4 LEU 1 O -0.0070 0.0029 -0.0172 5 LEU 1 CB -0.0009 0.0061 -0.0009 6 LEU 1 CG 0.0050 0.0053 0.0134 7 LEU 1 CD1 0.0021 0.0212 0.0132 8 LEU 1 CD2 0.0076 -0.0128 0.0119 9 PRO 2 N -0.0017 0.0002 -0.0001 10 PRO 2 CA -0.0004 -0.0005 0.0156 11 PRO 2 C -0.0258 -0.0102 0.0084 12 PRO 2 O -0.0316 -0.0106 -0.0173 13 PRO 2 CB 0.0258 0.0109 0.0051 14 PRO 2 CG 0.0298 0.0149 -0.0261 15 PRO 2 CD 0.0161 0.0093 -0.0257 16 VAL 3 N -0.0233 -0.0122 0.0105 17 VAL 3 CA -0.0084 -0.0041 0.0092 18 VAL 3 C -0.0101 -0.0065 0.0070 19 VAL 3 O -0.0059 -0.0114 -0.0056 20 VAL 3 CB 0.0041 -0.0044 -0.0038 21 VAL 3 CG1 0.0201 0.0051 -0.0036 22 VAL 3 CG2 0.0040 -0.0033 -0.0017 23 GLU 4 N -0.0072 -0.0086 0.0058 24 GLU 4 CA -0.0030 -0.0050 0.0069 25 GLU 4 C -0.0014 -0.0057 0.0077 26 GLU 4 O -0.0040 -0.0046 0.0065 27 GLU 4 CB -0.0043 0.0008 0.0056 28 GLU 4 CG -0.0046 0.0024 0.0052 29 GLU 4 CD -0.0052 0.0083 0.0041 30 GLU 4 OE1 -0.0019 0.0109 0.0051 31 GLU 4 OE2 -0.0090 0.0101 0.0023 32 ASP 5 N 0.0035 0.0002 0.0009 33 ASP 5 CA 0.0057 0.0020 -0.0000 34 ASP 5 C 0.0062 0.0048 0.0008 35 ASP 5 O 0.0073 0.0053 0.0002 36 ASP 5 CB 0.0078 0.0007 -0.0023 37 ASP 5 CG 0.0076 -0.0019 -0.0032 38 ASP 5 OD1 0.0074 -0.0015 -0.0029 39 ASP 5 OD2 0.0076 -0.0041 -0.0042 40 ALA 6 N 0.0095 0.0020 0.0055 41 ALA 6 CA 0.0097 -0.0020 0.0059 42 ALA 6 C 0.0057 0.0011 0.0014 43 ALA 6 O 0.0066 0.0010 0.0023 44 ALA 6 CB 0.0154 -0.0012 0.0121 45 ASP 7 N 0.0095 -0.0005 -0.0037 46 ASP 7 CA 0.0047 -0.0064 0.0037 47 ASP 7 C 0.0032 -0.0017 0.0115 48 ASP 7 O -0.0007 -0.0048 0.0190 49 ASP 7 CB 0.0027 -0.0084 0.0072 50 ASP 7 CG 0.0011 -0.0181 0.0033 51 ASP 7 OD1 0.0004 -0.0242 0.0000 52 ASP 7 OD2 0.0005 -0.0196 0.0037 53 SER 8 N 0.0019 0.0009 0.0011 54 SER 8 CA 0.0027 0.0032 0.0040 55 SER 8 C 0.0029 0.0048 0.0038 56 SER 8 O 0.0035 0.0074 0.0053 57 SER 8 CB 0.0032 0.0062 0.0043 58 SER 8 OG 0.0032 0.0048 0.0056 59 SER 9 N 0.0045 0.0002 0.0010 60 SER 9 CA 0.0057 -0.0024 -0.0041 61 SER 9 C -0.0000 -0.0087 0.0008 62 SER 9 O 0.0001 -0.0128 -0.0034 63 SER 9 CB 0.0086 -0.0075 -0.0148 64 SER 9 OG 0.0048 -0.0157 -0.0157 65 VAL 10 N -0.0110 -0.0083 0.0014 66 VAL 10 CA -0.0098 -0.0100 0.0089 67 VAL 10 C -0.0165 -0.0069 0.0088 68 VAL 10 O -0.0151 -0.0070 0.0053 69 VAL 10 CB -0.0010 -0.0139 0.0088 70 VAL 10 CG1 -0.0001 -0.0157 0.0176 71 VAL 10 CG2 0.0056 -0.0167 0.0080 72 GLY 11 N -0.0043 -0.0007 -0.0012 73 GLY 11 CA -0.0056 0.0014 0.0006 74 GLY 11 C -0.0076 0.0045 -0.0007 75 GLY 11 O -0.0088 0.0063 0.0007 76 GLN 12 N -0.0101 0.0136 0.0033 77 GLN 12 CA -0.0086 0.0146 0.0032 78 GLN 12 C -0.0048 0.0184 0.0020 79 GLN 12 O -0.0054 0.0218 -0.0007 80 GLN 12 CB -0.0126 0.0146 0.0015 81 GLN 12 CG -0.0129 0.0113 0.0037 82 GLN 12 CD -0.0171 0.0110 0.0022 83 GLN 12 OE1 -0.0205 0.0123 -0.0001 84 GLN 12 NE2 -0.0168 0.0092 0.0037 85 LEU 13 N 0.0019 0.0037 -0.0145 86 LEU 13 CA 0.0025 0.0020 -0.0162 87 LEU 13 C 0.0034 0.0003 -0.0156 88 LEU 13 O 0.0040 -0.0005 -0.0137 89 LEU 13 CB 0.0030 0.0008 -0.0166 90 LEU 13 CG 0.0022 0.0022 -0.0175 91 LEU 13 CD1 0.0027 0.0014 -0.0168 92 LEU 13 CD2 0.0019 0.0023 -0.0202 93 GLN 14 N 0.0039 -0.0081 -0.0181 94 GLN 14 CA 0.0014 -0.0076 -0.0165 95 GLN 14 C 0.0027 -0.0126 -0.0179 96 GLN 14 O 0.0066 -0.0126 -0.0204 97 GLN 14 CB 0.0029 -0.0019 -0.0168 98 GLN 14 CG -0.0010 -0.0001 -0.0141 99 GLN 14 CD 0.0001 0.0060 -0.0140 100 GLN 14 OE1 0.0040 0.0086 -0.0162 101 GLN 14 NE2 -0.0035 0.0084 -0.0115 102 GLY 15 N -0.0083 -0.0429 -0.0152 103 GLY 15 CA -0.0070 -0.0416 -0.0145 104 GLY 15 C -0.0064 -0.0274 -0.0128 105 GLY 15 O -0.0154 -0.0200 -0.0161 106 ARG 16 N -0.0057 -0.0099 -0.0114 107 ARG 16 CA -0.0053 -0.0081 -0.0112 108 ARG 16 C -0.0065 -0.0100 -0.0113 109 ARG 16 O -0.0065 -0.0128 -0.0116 110 ARG 16 CB -0.0018 -0.0072 -0.0115 111 ARG 16 CG -0.0006 -0.0048 -0.0114 112 ARG 16 CD 0.0027 -0.0037 -0.0116 113 ARG 16 NE 0.0034 -0.0009 -0.0114 114 ARG 16 CZ 0.0056 0.0012 -0.0114 115 ARG 16 NH1 0.0075 0.0009 -0.0116 116 ARG 16 NH2 0.0061 0.0036 -0.0112 117 GLY 17 N 0.0334 -0.0470 -0.0060 118 GLY 17 CA 0.0667 -0.0577 0.0120 119 GLY 17 C 0.0431 -0.0370 0.0021 120 GLY 17 O 0.0401 0.0158 0.0118 121 ASN 18 N -0.1410 0.0303 -0.0118 122 ASN 18 CA -0.0857 -0.0150 0.0009 123 ASN 18 C -0.0489 -0.0150 -0.0047 124 ASN 18 O -0.0374 0.0346 -0.0299 125 ASN 18 CB -0.0376 -0.0041 -0.0117 126 ASN 18 CG -0.0227 -0.0617 0.0132 127 ASN 18 OD1 -0.0600 -0.1035 0.0387 128 ASN 18 ND2 0.0331 -0.0651 0.0062 129 PRO 19 N -0.0213 -0.0015 -0.0190 130 PRO 19 CA -0.0212 -0.0009 -0.0200 131 PRO 19 C -0.0221 -0.0016 -0.0204 132 PRO 19 O -0.0231 -0.0024 -0.0207 133 PRO 19 CB -0.0212 -0.0002 -0.0213 134 PRO 19 CG -0.0219 -0.0009 -0.0213 135 PRO 19 CD -0.0216 -0.0015 -0.0197 136 TYR 20 N -0.0243 0.0008 -0.0152 137 TYR 20 CA -0.0202 0.0043 -0.0138 138 TYR 20 C -0.0201 0.0004 -0.0082 139 TYR 20 O -0.0241 -0.0037 -0.0086 140 TYR 20 CB -0.0214 0.0073 -0.0198 141 TYR 20 CG -0.0173 0.0108 -0.0184 142 TYR 20 CD1 -0.0183 0.0083 -0.0165 143 TYR 20 CD2 -0.0124 0.0163 -0.0186 144 TYR 20 CE1 -0.0145 0.0114 -0.0150 145 TYR 20 CE2 -0.0085 0.0194 -0.0170 146 TYR 20 CZ -0.0096 0.0170 -0.0153 147 TYR 20 OH -0.0058 0.0200 -0.0138 148 CYS 21 N -0.0146 -0.0024 0.0019 149 CYS 21 CA -0.0128 -0.0039 0.0033 150 CYS 21 C -0.0129 -0.0028 0.0070 151 CYS 21 O -0.0147 -0.0004 0.0081 152 CYS 21 CB -0.0135 -0.0036 0.0016 153 CYS 21 SG -0.0131 -0.0053 -0.0028 154 VAL 22 N -0.0193 -0.0059 0.0140 155 VAL 22 CA -0.0165 -0.0038 0.0116 156 VAL 22 C -0.0123 -0.0055 0.0151 157 VAL 22 O -0.0079 -0.0039 0.0139 158 VAL 22 CB -0.0208 -0.0030 0.0093 159 VAL 22 CG1 -0.0180 -0.0006 0.0063 160 VAL 22 CG2 -0.0252 -0.0016 0.0060 161 PHE 23 N -0.0087 -0.0128 0.0137 162 PHE 23 CA -0.0075 -0.0136 0.0143 163 PHE 23 C -0.0073 -0.0142 0.0145 164 PHE 23 O -0.0084 -0.0146 0.0144 165 PHE 23 CB -0.0076 -0.0148 0.0147 166 PHE 23 CG -0.0077 -0.0142 0.0145 167 PHE 23 CD1 -0.0065 -0.0136 0.0145 168 PHE 23 CD2 -0.0090 -0.0142 0.0142 169 PHE 23 CE1 -0.0066 -0.0130 0.0143 170 PHE 23 CE2 -0.0091 -0.0136 0.0140 171 PHE 23 CZ -0.0078 -0.0131 0.0140 172 PRO 24 N 0.0016 -0.0142 0.0151 173 PRO 24 CA 0.0031 -0.0143 0.0182 174 PRO 24 C 0.0068 -0.0103 0.0132 175 PRO 24 O 0.0098 -0.0092 0.0158 176 PRO 24 CB 0.0076 -0.0139 0.0256 177 PRO 24 CG 0.0113 -0.0110 0.0241 178 PRO 24 CD 0.0062 -0.0125 0.0187 179 GLY 25 N 0.0095 -0.0130 0.0124 180 GLY 25 CA 0.0133 -0.0094 0.0053 181 GLY 25 C 0.0110 -0.0070 0.0006 182 GLY 25 O 0.0158 -0.0048 -0.0036 183 ARG 26 N 0.0071 -0.0074 0.0031 184 ARG 26 CA 0.0078 -0.0056 0.0015 185 ARG 26 C 0.0102 -0.0146 0.0106 186 ARG 26 O 0.0072 -0.0228 0.0176 187 ARG 26 CB -0.0049 -0.0027 -0.0045 188 ARG 26 CG -0.0074 0.0071 -0.0144 189 ARG 26 CD -0.0184 0.0109 -0.0207 190 ARG 26 NE -0.0207 0.0200 -0.0299 191 ARG 26 CZ -0.0296 0.0252 -0.0372 192 ARG 26 NH1 -0.0371 0.0225 -0.0365 193 ARG 26 NH2 -0.0309 0.0334 -0.0452 194 ARG 27 N -0.0214 -0.0212 0.0214 195 ARG 27 CA -0.0105 -0.0231 0.0095 196 ARG 27 C 0.0053 -0.0223 0.0079 197 ARG 27 O 0.0122 -0.0191 0.0195 198 ARG 27 CB -0.0063 -0.0220 0.0130 199 ARG 27 CG -0.0212 -0.0233 0.0118 200 ARG 27 CD -0.0178 -0.0224 0.0149 201 ARG 27 NE -0.0073 -0.0247 0.0013 202 ARG 27 CZ 0.0015 -0.0240 0.0015 203 ARG 27 NH1 0.0014 -0.0211 0.0142 204 ARG 27 NH2 0.0105 -0.0263 -0.0111 205 THR 28 N 0.0250 -0.0183 -0.0053 206 THR 28 CA 0.0261 -0.0140 -0.0049 207 THR 28 C 0.0311 -0.0084 -0.0086 208 THR 28 O 0.0346 -0.0093 -0.0130 209 THR 28 CB 0.0259 -0.0186 -0.0064 210 THR 28 OG1 0.0284 -0.0240 -0.0114 211 THR 28 CG2 0.0204 -0.0227 -0.0016 212 SER 29 N 0.0261 -0.0147 -0.0104 213 SER 29 CA 0.0229 -0.0105 -0.0155 214 SER 29 C 0.0209 -0.0078 -0.0146 215 SER 29 O 0.0219 -0.0090 -0.0098 216 SER 29 CB 0.0196 -0.0060 -0.0152 217 SER 29 OG 0.0169 -0.0023 -0.0096 218 SER 30 N 0.0072 -0.0061 -0.0352 219 SER 30 CA -0.0115 0.0009 -0.0167 220 SER 30 C -0.0176 0.0025 -0.0116 221 SER 30 O -0.0286 0.0112 0.0058 222 SER 30 CB -0.0353 -0.0089 -0.0196 223 SER 30 OG -0.0420 -0.0248 -0.0392 224 THR 31 N -0.0004 0.0008 -0.0125 225 THR 31 CA 0.0000 0.0063 -0.0071 226 THR 31 C 0.0023 0.0035 -0.0006 227 THR 31 O 0.0029 0.0075 0.0042 228 THR 31 CB -0.0001 0.0095 -0.0053 229 THR 31 OG1 0.0011 0.0044 -0.0043 230 THR 31 CG2 -0.0025 0.0135 -0.0115 231 SER 32 N 0.0079 -0.0014 -0.0006 232 SER 32 CA 0.0098 -0.0034 0.0037 233 SER 32 C 0.0097 -0.0024 0.0058 234 SER 32 O 0.0090 -0.0020 0.0033 235 SER 32 CB 0.0124 -0.0083 0.0032 236 SER 32 OG 0.0127 -0.0097 0.0010 237 PHE 33 N 0.0063 -0.0067 0.0095 238 PHE 33 CA 0.0064 -0.0053 0.0107 239 PHE 33 C 0.0083 -0.0070 0.0119 240 PHE 33 O 0.0098 -0.0080 0.0131 241 PHE 33 CB 0.0063 -0.0029 0.0125 242 PHE 33 CG 0.0066 -0.0015 0.0140 243 PHE 33 CD1 0.0082 -0.0013 0.0163 244 PHE 33 CD2 0.0052 -0.0003 0.0131 245 PHE 33 CE1 0.0085 -0.0000 0.0178 246 PHE 33 CE2 0.0054 0.0010 0.0145 247 PHE 33 CZ 0.0071 0.0012 0.0168 248 THR 34 N 0.0145 -0.0104 0.0154 249 THR 34 CA 0.0156 -0.0119 0.0164 250 THR 34 C 0.0156 -0.0133 0.0181 251 THR 34 O 0.0160 -0.0135 0.0180 252 THR 34 CB 0.0177 -0.0124 0.0152 253 THR 34 OG1 0.0188 -0.0123 0.0142 254 THR 34 CG2 0.0176 -0.0111 0.0137 255 THR 35 N 0.0130 -0.0110 0.0169 256 THR 35 CA 0.0130 -0.0120 0.0165 257 THR 35 C 0.0120 -0.0121 0.0162 258 THR 35 O 0.0112 -0.0115 0.0162 259 THR 35 CB 0.0131 -0.0129 0.0162 260 THR 35 OG1 0.0132 -0.0139 0.0158 261 THR 35 CG2 0.0121 -0.0128 0.0159 262 SER 36 N 0.0144 -0.0124 0.0181 263 SER 36 CA 0.0129 -0.0102 0.0157 264 SER 36 C 0.0122 -0.0135 0.0140 265 SER 36 O 0.0135 -0.0167 0.0157 266 SER 36 CB 0.0138 -0.0063 0.0178 267 SER 36 OG 0.0158 -0.0077 0.0211 268 PHE 37 N 0.0100 -0.0067 0.0051 269 PHE 37 CA 0.0090 -0.0094 0.0043 270 PHE 37 C 0.0073 -0.0087 0.0030 271 PHE 37 O 0.0063 -0.0062 0.0024 272 PHE 37 CB 0.0078 -0.0114 0.0032 273 PHE 37 CG 0.0056 -0.0098 0.0017 274 PHE 37 CD1 0.0058 -0.0077 0.0020 275 PHE 37 CD2 0.0032 -0.0104 -0.0001 276 PHE 37 CE1 0.0038 -0.0062 0.0006 277 PHE 37 CE2 0.0012 -0.0090 -0.0015 278 PHE 37 CZ 0.0015 -0.0069 -0.0012 279 SER 38 N 0.0045 -0.0145 0.0063 280 SER 38 CA 0.0040 -0.0148 0.0062 281 SER 38 C 0.0002 -0.0174 0.0060 282 SER 38 O -0.0011 -0.0199 0.0070 283 SER 38 CB 0.0071 -0.0163 0.0087 284 SER 38 OG 0.0108 -0.0140 0.0091 285 THR 39 N -0.0007 -0.0164 0.0046 286 THR 39 CA -0.0022 -0.0166 0.0064 287 THR 39 C -0.0010 -0.0176 0.0086 288 THR 39 O 0.0011 -0.0181 0.0087 289 THR 39 CB -0.0025 -0.0164 0.0058 290 THR 39 OG1 -0.0037 -0.0154 0.0037 291 THR 39 CG2 -0.0041 -0.0167 0.0077 292 GLU 40 N -0.0184 -0.0323 0.0288 293 GLU 40 CA -0.0196 -0.0287 0.0256 294 GLU 40 C -0.0178 -0.0286 0.0261 295 GLU 40 O -0.0141 -0.0303 0.0286 296 GLU 40 CB -0.0175 -0.0244 0.0228 297 GLU 40 CG -0.0199 -0.0237 0.0216 298 GLU 40 CD -0.0177 -0.0261 0.0241 299 GLU 40 OE1 -0.0199 -0.0262 0.0235 300 GLU 40 OE2 -0.0139 -0.0278 0.0266 301 PRO 41 N -0.0300 -0.0495 0.0095 302 PRO 41 CA -0.0283 -0.0547 0.0222 303 PRO 41 C -0.0099 -0.0374 0.0342 304 PRO 41 O -0.0003 -0.0183 0.0233 305 PRO 41 CB -0.0404 -0.0592 0.0024 306 PRO 41 CG -0.0539 -0.0663 -0.0160 307 PRO 41 CD -0.0433 -0.0523 -0.0158 308 LEU 42 N 0.0175 -0.0207 0.0293 309 LEU 42 CA 0.0157 -0.0190 0.0315 310 LEU 42 C 0.0151 -0.0161 0.0374 311 LEU 42 O 0.0122 -0.0141 0.0394 312 LEU 42 CB 0.0197 -0.0209 0.0307 313 LEU 42 CG 0.0199 -0.0237 0.0247 314 LEU 42 CD1 0.0241 -0.0254 0.0244 315 LEU 42 CD2 0.0143 -0.0228 0.0217 316 GLY 43 N 0.0177 -0.0230 0.0438 317 GLY 43 CA 0.0251 0.0160 0.0174 318 GLY 43 C 0.0176 0.0403 -0.0041 319 GLY 43 O 0.0263 0.0741 -0.0260 320 TYR 44 N -0.0004 0.0299 0.0125 321 TYR 44 CA 0.0049 0.0492 -0.0083 322 TYR 44 C 0.0354 0.0653 0.0032 323 TYR 44 O 0.0464 0.0564 0.0277 324 TYR 44 CB -0.0145 0.0391 -0.0159 325 TYR 44 CG -0.0449 0.0279 -0.0341 326 TYR 44 CD1 -0.0554 0.0263 -0.0435 327 TYR 44 CD2 -0.0637 0.0190 -0.0428 328 TYR 44 CE1 -0.0838 0.0154 -0.0601 329 TYR 44 CE2 -0.0922 0.0084 -0.0597 330 TYR 44 CZ -0.1022 0.0064 -0.0680 331 TYR 44 OH -0.1307 -0.0046 -0.0845 332 ALA 45 N 0.0345 -0.0477 -0.0021 333 ALA 45 CA -0.0097 -0.0785 -0.0138 334 ALA 45 C 0.0244 -0.0471 -0.0060 335 ALA 45 O 0.0963 -0.0407 0.0200 336 ALA 45 CB -0.0174 -0.1753 -0.0013 337 ARG 46 N 0.0240 0.0434 0.0337 338 ARG 46 CA 0.0217 0.0455 0.0298 339 ARG 46 C 0.0264 0.0567 0.0355 340 ARG 46 O 0.0327 0.0585 0.0453 341 ARG 46 CB 0.0225 0.0336 0.0328 342 ARG 46 CG 0.0175 0.0213 0.0268 343 ARG 46 CD 0.0202 0.0095 0.0326 344 ARG 46 NE 0.0149 -0.0020 0.0259 345 ARG 46 CZ 0.0165 -0.0123 0.0299 346 ARG 46 NH1 0.0197 -0.0112 0.0348 347 ARG 46 NH2 0.0146 -0.0238 0.0285 348 MET 47 N 0.0490 -0.0052 0.0495 349 MET 47 CA 0.0496 0.0172 0.0593 350 MET 47 C 0.0493 0.0282 0.0666 351 MET 47 O 0.0535 0.0340 0.0530 352 MET 47 CB 0.0558 0.0324 0.0428 353 MET 47 CG 0.0557 0.0240 0.0384 354 MET 47 SD 0.0618 0.0445 0.0250 355 MET 47 CE 0.0683 0.0432 -0.0022 356 LEU 48 N 0.0200 0.0197 0.0252 357 LEU 48 CA 0.0197 0.0204 0.0249 358 LEU 48 C 0.0185 0.0238 0.0250 359 LEU 48 O 0.0178 0.0253 0.0271 360 LEU 48 CB 0.0202 0.0190 0.0276 361 LEU 48 CG 0.0214 0.0156 0.0279 362 LEU 48 CD1 0.0218 0.0143 0.0307 363 LEU 48 CD2 0.0222 0.0140 0.0248 364 HIS 49 N 0.0187 -0.0022 0.0340 365 HIS 49 CA 0.0076 -0.0083 0.0311 366 HIS 49 C 0.0051 -0.0062 0.0172 367 HIS 49 O 0.0121 -0.0003 0.0111 368 HIS 49 CB 0.0056 -0.0112 0.0377 369 HIS 49 CG -0.0062 -0.0185 0.0379 370 HIS 49 ND1 -0.0121 -0.0239 0.0449 371 HIS 49 CD2 -0.0126 -0.0209 0.0322 372 HIS 49 CE1 -0.0220 -0.0296 0.0434 373 HIS 49 NE2 -0.0227 -0.0281 0.0357 374 ARG 50 N -0.0067 -0.0071 0.0069 375 ARG 50 CA -0.0037 -0.0116 0.0084 376 ARG 50 C -0.0064 -0.0161 0.0102 377 ARG 50 O -0.0058 -0.0200 0.0116 378 ARG 50 CB 0.0016 -0.0114 0.0079 379 ARG 50 CG 0.0052 -0.0075 0.0062 380 ARG 50 CD 0.0106 -0.0080 0.0060 381 ARG 50 NE 0.0133 -0.0033 0.0041 382 ARG 50 CZ 0.0175 -0.0021 0.0033 383 ARG 50 NH1 0.0197 -0.0053 0.0043 384 ARG 50 NH2 0.0194 0.0023 0.0016 385 ASP 51 N -0.0105 -0.0056 0.0110 386 ASP 51 CA -0.0082 -0.0001 0.0055 387 ASP 51 C -0.0026 -0.0026 0.0002 388 ASP 51 O -0.0018 0.0000 -0.0021 389 ASP 51 CB -0.0119 0.0070 0.0063 390 ASP 51 CG -0.0104 0.0135 0.0013 391 ASP 51 OD1 -0.0089 0.0137 -0.0005 392 ASP 51 OD2 -0.0108 0.0184 -0.0007 393 PRO 52 N 0.0008 -0.0047 0.0046 394 PRO 52 CA 0.0070 -0.0072 0.0005 395 PRO 52 C 0.0102 -0.0012 -0.0045 396 PRO 52 O 0.0086 0.0042 -0.0055 397 PRO 52 CB 0.0102 -0.0123 0.0001 398 PRO 52 CG 0.0050 -0.0146 0.0052 399 PRO 52 CD -0.0001 -0.0079 0.0066 400 PRO 53 N 0.0178 0.0044 -0.0367 401 PRO 53 CA 0.0352 0.0149 -0.0311 402 PRO 53 C 0.0236 0.0145 -0.0137 403 PRO 53 O 0.0027 0.0035 -0.0154 404 PRO 53 CB 0.0464 0.0120 -0.0581 405 PRO 53 CG 0.0267 -0.0034 -0.0758 406 PRO 53 CD 0.0147 -0.0059 -0.0644 407 TYR 54 N 0.0086 0.0073 0.0013 408 TYR 54 CA 0.0087 0.0092 0.0033 409 TYR 54 C 0.0092 0.0092 0.0072 410 TYR 54 O 0.0096 0.0066 0.0086 411 TYR 54 CB 0.0088 0.0072 0.0028 412 TYR 54 CG 0.0083 0.0084 -0.0005 413 TYR 54 CD1 0.0080 0.0113 -0.0005 414 TYR 54 CD2 0.0081 0.0065 -0.0037 415 TYR 54 CE1 0.0076 0.0123 -0.0036 416 TYR 54 CE2 0.0076 0.0075 -0.0068 417 TYR 54 CZ 0.0074 0.0104 -0.0067 418 TYR 54 OH 0.0069 0.0113 -0.0098 419 GLU 55 N -0.0027 0.0174 0.0239 420 GLU 55 CA -0.0100 0.0183 0.0328 421 GLU 55 C -0.0121 0.0111 0.0312 422 GLU 55 O -0.0069 0.0086 0.0237 423 GLU 55 CB -0.0086 0.0303 0.0378 424 GLU 55 CG -0.0072 0.0379 0.0405 425 GLU 55 CD -0.0066 0.0495 0.0463 426 GLU 55 OE1 -0.0056 0.0562 0.0489 427 GLU 55 OE2 -0.0072 0.0516 0.0482 428 ARG 56 N -0.0150 0.0235 0.0319 429 ARG 56 CA -0.0141 0.0243 0.0250 430 ARG 56 C -0.0119 0.0117 0.0221 431 ARG 56 O -0.0099 0.0040 0.0161 432 ARG 56 CB -0.0134 0.0318 0.0128 433 ARG 56 CG -0.0128 0.0349 0.0058 434 ARG 56 CD -0.0123 0.0436 -0.0055 435 ARG 56 NE -0.0099 0.0367 -0.0149 436 ARG 56 CZ -0.0090 0.0416 -0.0258 437 ARG 56 NH1 -0.0102 0.0533 -0.0290 438 ARG 56 NH2 -0.0068 0.0348 -0.0338 439 ALA 57 N -0.0048 0.0144 0.0164 440 ALA 57 CA -0.0018 0.0130 0.0150 441 ALA 57 C -0.0036 0.0118 0.0129 442 ALA 57 O -0.0034 0.0097 0.0098 443 ALA 57 CB 0.0009 0.0114 0.0131 444 GLY 58 N -0.0065 0.0141 0.0111 445 GLY 58 CA -0.0070 0.0135 0.0056 446 GLY 58 C -0.0105 0.0157 0.0012 447 GLY 58 O -0.0144 0.0193 0.0021 448 ASN 59 N -0.0099 0.0201 -0.0019 449 ASN 59 CA -0.0117 0.0201 -0.0042 450 ASN 59 C -0.0078 0.0167 0.0007 451 ASN 59 O -0.0090 0.0147 -0.0009 452 ASN 59 CB -0.0163 0.0147 -0.0103 453 ASN 59 CG -0.0206 0.0184 -0.0157 454 ASN 59 OD1 -0.0211 0.0257 -0.0159 455 ASN 59 ND2 -0.0241 0.0133 -0.0203 456 SER 60 N -0.0058 0.0117 0.0053 457 SER 60 CA -0.0041 0.0100 0.0091 458 SER 60 C -0.0017 0.0129 0.0109 459 SER 60 O -0.0003 0.0116 0.0138 460 SER 60 CB -0.0030 0.0085 0.0118 461 SER 60 OG -0.0011 0.0118 0.0124 462 GLY 61 N -0.0069 0.0147 0.0097 463 GLY 61 CA -0.0102 0.0092 0.0071 464 GLY 61 C -0.0089 0.0094 0.0033 465 GLY 61 O -0.0112 0.0052 0.0005 466 LEU 62 N -0.0072 0.0055 0.0013 467 LEU 62 CA -0.0050 0.0064 0.0036 468 LEU 62 C -0.0049 0.0086 0.0047 469 LEU 62 O -0.0063 0.0091 0.0038 470 LEU 62 CB -0.0026 0.0038 0.0043 471 LEU 62 CG -0.0023 0.0013 0.0034 472 LEU 62 CD1 -0.0000 -0.0012 0.0041 473 LEU 62 CD2 -0.0021 0.0024 0.0041 474 ASN 63 N -0.0030 0.0041 -0.0026 475 ASN 63 CA -0.0024 0.0076 -0.0015 476 ASN 63 C 0.0009 0.0073 -0.0007 477 ASN 63 O 0.0034 0.0050 -0.0006 478 ASN 63 CB -0.0018 0.0104 -0.0006 479 ASN 63 CG -0.0052 0.0114 -0.0013 480 ASN 63 OD1 -0.0082 0.0112 -0.0022 481 ASN 63 ND2 -0.0048 0.0126 -0.0009 482 HIS 64 N 0.0050 0.0077 0.0078 483 HIS 64 CA 0.0088 0.0097 0.0073 484 HIS 64 C 0.0091 0.0110 0.0108 485 HIS 64 O 0.0067 0.0108 0.0140 486 HIS 64 CB 0.0120 0.0114 0.0071 487 HIS 64 CG 0.0125 0.0131 0.0112 488 HIS 64 ND1 0.0094 0.0122 0.0136 489 HIS 64 CD2 0.0157 0.0155 0.0131 490 HIS 64 CE1 0.0107 0.0140 0.0170 491 HIS 64 NE2 0.0145 0.0160 0.0168 492 ARG 65 N 0.0127 0.0139 -0.0023 493 ARG 65 CA 0.0127 0.0132 -0.0013 494 ARG 65 C 0.0134 0.0146 -0.0020 495 ARG 65 O 0.0131 0.0156 -0.0037 496 ARG 65 CB 0.0111 0.0114 -0.0016 497 ARG 65 CG 0.0098 0.0115 -0.0038 498 ARG 65 CD 0.0083 0.0097 -0.0039 499 ARG 65 NE 0.0070 0.0099 -0.0060 500 ARG 65 CZ 0.0055 0.0084 -0.0066 501 ARG 65 NH1 0.0050 0.0067 -0.0054 502 ARG 65 NH2 0.0045 0.0088 -0.0085 503 ILE 66 N 0.0212 0.0077 0.0052 504 ILE 66 CA 0.0168 0.0050 0.0056 505 ILE 66 C 0.0161 0.0031 0.0028 506 ILE 66 O 0.0180 0.0023 -0.0010 507 ILE 66 CB 0.0153 0.0032 0.0040 508 ILE 66 CG1 0.0165 0.0053 0.0066 509 ILE 66 CG2 0.0106 0.0004 0.0046 510 ILE 66 CD1 0.0152 0.0038 0.0052 511 TYR 67 N 0.0152 -0.0022 -0.0004 512 TYR 67 CA 0.0138 -0.0045 0.0006 513 TYR 67 C 0.0126 -0.0043 0.0000 514 TYR 67 O 0.0127 -0.0023 -0.0012 515 TYR 67 CB 0.0116 -0.0057 0.0006 516 TYR 67 CG 0.0092 -0.0044 -0.0010 517 TYR 67 CD1 0.0094 -0.0024 -0.0022 518 TYR 67 CD2 0.0068 -0.0054 -0.0012 519 TYR 67 CE1 0.0071 -0.0013 -0.0037 520 TYR 67 CE2 0.0045 -0.0043 -0.0026 521 TYR 67 CZ 0.0046 -0.0023 -0.0039 522 TYR 67 OH 0.0023 -0.0013 -0.0053 523 GLU 68 N 0.0128 -0.0101 0.0123 524 GLU 68 CA 0.0157 -0.0108 0.0145 525 GLU 68 C 0.0161 -0.0088 0.0166 526 GLU 68 O 0.0144 -0.0062 0.0170 527 GLU 68 CB 0.0167 -0.0105 0.0157 528 GLU 68 CG 0.0168 -0.0129 0.0139 529 GLU 68 CD 0.0179 -0.0125 0.0152 530 GLU 68 OE1 0.0180 -0.0141 0.0140 531 GLU 68 OE2 0.0188 -0.0107 0.0176 532 ARG 69 N 0.0117 -0.0037 0.0050 533 ARG 69 CA 0.0060 -0.0071 0.0024 534 ARG 69 C 0.0085 -0.0046 0.0008 535 ARG 69 O 0.0137 0.0003 -0.0015 536 ARG 69 CB 0.0011 -0.0081 -0.0052 537 ARG 69 CG 0.0040 -0.0030 -0.0128 538 ARG 69 CD -0.0012 -0.0045 -0.0198 539 ARG 69 NE 0.0023 0.0007 -0.0265 540 ARG 69 CZ -0.0009 0.0010 -0.0338 541 ARG 69 NH1 -0.0075 -0.0035 -0.0355 542 ARG 69 NH2 0.0025 0.0057 -0.0394 543 SER 70 N 0.0119 -0.0017 -0.0029 544 SER 70 CA 0.0090 0.0022 -0.0114 545 SER 70 C 0.0075 0.0044 -0.0155 546 SER 70 O 0.0095 -0.0002 -0.0149 547 SER 70 CB 0.0102 -0.0031 -0.0183 548 SER 70 OG 0.0072 0.0014 -0.0260 549 ARG 71 N -0.0217 0.0013 -0.0238 550 ARG 71 CA -0.0203 0.0018 -0.0300 551 ARG 71 C -0.0171 0.0042 -0.0294 552 ARG 71 O -0.0148 0.0063 -0.0247 553 ARG 71 CB -0.0171 0.0039 -0.0335 554 ARG 71 CG -0.0151 0.0048 -0.0403 555 ARG 71 CD -0.0115 0.0072 -0.0427 556 ARG 71 NE -0.0097 0.0080 -0.0493 557 ARG 71 CZ -0.0058 0.0106 -0.0523 558 ARG 71 NH1 -0.0036 0.0125 -0.0500 559 ARG 71 NH2 -0.0041 0.0114 -0.0578 560 VAL 72 N -0.0205 0.0233 0.0049 561 VAL 72 CA -0.0003 0.0270 0.0134 562 VAL 72 C -0.0409 -0.0082 0.0097 563 VAL 72 O -0.0519 -0.0589 0.0286 564 VAL 72 CB 0.0547 0.0090 0.0501 565 VAL 72 CG1 0.0767 0.0164 0.0576 566 VAL 72 CG2 0.0960 0.0434 0.0544 567 GLY 73 N -0.0777 -0.0328 -0.0448 568 GLY 73 CA -0.0891 -0.0246 -0.0420 569 GLY 73 C -0.0307 -0.0227 -0.0339 570 GLY 73 O -0.0373 -0.0161 -0.0313 571 GLY 74 N -0.0162 -0.0127 -0.0179 572 GLY 74 CA -0.0076 -0.0133 -0.0184 573 GLY 74 C -0.0014 -0.0109 -0.0184 574 GLY 74 O -0.0031 -0.0105 -0.0183 575 LEU 75 N 0.0135 -0.0007 0.0019 576 LEU 75 CA 0.0110 -0.0022 0.0023 577 LEU 75 C 0.0124 0.0010 -0.0033 578 LEU 75 O 0.0173 0.0045 -0.0055 579 LEU 75 CB 0.0139 -0.0033 0.0088 580 LEU 75 CG 0.0122 -0.0068 0.0150 581 LEU 75 CD1 0.0160 -0.0075 0.0213 582 LEU 75 CD2 0.0051 -0.0107 0.0151 583 ARG 76 N 0.0081 0.0036 -0.0110 584 ARG 76 CA 0.0088 0.0061 -0.0146 585 ARG 76 C 0.0090 0.0043 -0.0105 586 ARG 76 O 0.0054 -0.0004 -0.0088 587 ARG 76 CB 0.0045 0.0045 -0.0210 588 ARG 76 CG 0.0054 0.0080 -0.0259 589 ARG 76 CD 0.0014 0.0069 -0.0325 590 ARG 76 NE 0.0027 0.0104 -0.0367 591 ARG 76 CZ 0.0003 0.0110 -0.0431 592 ARG 76 NH1 -0.0039 0.0081 -0.0462 593 ARG 76 NH2 0.0022 0.0146 -0.0463 594 THR 77 N 0.0091 0.0015 -0.0077 595 THR 77 CA 0.0099 0.0015 -0.0071 596 THR 77 C 0.0092 0.0019 -0.0079 597 THR 77 O 0.0088 0.0029 -0.0090 598 THR 77 CB 0.0113 0.0026 -0.0066 599 THR 77 OG1 0.0120 0.0023 -0.0058 600 THR 77 CG2 0.0121 0.0024 -0.0058 601 VAL 78 N 0.0109 0.0052 -0.0105 602 VAL 78 CA 0.0100 0.0055 -0.0114 603 VAL 78 C 0.0122 0.0055 -0.0094 604 VAL 78 O 0.0135 0.0036 -0.0073 605 VAL 78 CB 0.0078 0.0026 -0.0124 606 VAL 78 CG1 0.0068 0.0032 -0.0137 607 VAL 78 CG2 0.0057 0.0022 -0.0143 608 ILE 79 N 0.0106 0.0057 -0.0061 609 ILE 79 CA 0.0113 0.0056 -0.0053 610 ILE 79 C 0.0119 0.0054 -0.0048 611 ILE 79 O 0.0116 0.0058 -0.0044 612 ILE 79 CB 0.0108 0.0062 -0.0044 613 ILE 79 CG1 0.0101 0.0064 -0.0049 614 ILE 79 CG2 0.0116 0.0061 -0.0036 615 ILE 79 CD1 0.0097 0.0069 -0.0041 616 ASP 80 N 0.0096 0.0105 -0.0070 617 ASP 80 CA 0.0087 0.0088 -0.0080 618 ASP 80 C 0.0086 0.0084 -0.0064 619 ASP 80 O 0.0087 0.0082 -0.0042 620 ASP 80 CB 0.0076 0.0067 -0.0082 621 ASP 80 CG 0.0075 0.0068 -0.0100 622 ASP 80 OD1 0.0080 0.0082 -0.0116 623 ASP 80 OD2 0.0068 0.0053 -0.0096 624 VAL 81 N 0.0072 0.0038 -0.0025 625 VAL 81 CA 0.0057 0.0023 -0.0012 626 VAL 81 C 0.0055 -0.0002 -0.0021 627 VAL 81 O 0.0065 -0.0011 -0.0038 628 VAL 81 CB 0.0056 0.0027 -0.0010 629 VAL 81 CG1 0.0040 0.0012 0.0004 630 VAL 81 CG2 0.0059 0.0052 -0.0002 631 ALA 82 N 0.0025 -0.0014 -0.0052 632 ALA 82 CA 0.0003 -0.0027 -0.0065 633 ALA 82 C -0.0031 -0.0036 -0.0069 634 ALA 82 O -0.0042 -0.0027 -0.0052 635 ALA 82 CB -0.0002 -0.0016 -0.0048 636 PRO 83 N -0.0063 -0.0090 -0.0091 637 PRO 83 CA -0.0057 -0.0083 -0.0097 638 PRO 83 C -0.0042 -0.0060 -0.0122 639 PRO 83 O -0.0027 -0.0049 -0.0128 640 PRO 83 CB -0.0036 -0.0090 -0.0070 641 PRO 83 CG -0.0040 -0.0106 -0.0047 642 PRO 83 CD -0.0046 -0.0099 -0.0063 643 PRO 84 N -0.0080 0.0017 -0.0160 644 PRO 84 CA -0.0067 0.0059 -0.0184 645 PRO 84 C -0.0010 0.0045 -0.0179 646 PRO 84 O 0.0008 -0.0002 -0.0155 647 PRO 84 CB -0.0125 0.0060 -0.0182 648 PRO 84 CG -0.0150 0.0003 -0.0149 649 PRO 84 CD -0.0132 -0.0016 -0.0140 650 ASP 85 N 0.0116 0.0184 -0.0387 651 ASP 85 CA 0.0229 0.0197 -0.0384 652 ASP 85 C 0.0349 0.0133 -0.0318 653 ASP 85 O 0.0429 0.0109 -0.0289 654 ASP 85 CB 0.0177 0.0181 -0.0377 655 ASP 85 CG 0.0070 0.0258 -0.0452 656 ASP 85 OD1 0.0081 0.0346 -0.0522 657 ASP 85 OD2 -0.0026 0.0228 -0.0440 658 GLY 86 N 0.0053 0.0006 -0.0187 659 GLY 86 CA 0.0046 0.0022 -0.0143 660 GLY 86 C 0.0049 0.0040 -0.0111 661 GLY 86 O 0.0047 0.0056 -0.0073 662 HIS 87 N 0.0087 0.0001 -0.0158 663 HIS 87 CA 0.0078 0.0001 -0.0073 664 HIS 87 C 0.0008 -0.0006 -0.0020 665 HIS 87 O -0.0049 -0.0012 -0.0053 666 HIS 87 CB 0.0064 -0.0000 -0.0072 667 HIS 87 CG 0.0141 0.0008 -0.0101 668 HIS 87 ND1 0.0140 0.0007 -0.0095 669 HIS 87 CD2 0.0217 0.0015 -0.0134 670 HIS 87 CE1 0.0214 0.0015 -0.0125 671 HIS 87 NE2 0.0263 0.0020 -0.0150 672 GLN 88 N -0.0074 -0.0001 -0.0018 673 GLN 88 CA -0.0093 0.0005 -0.0006 674 GLN 88 C 0.0001 -0.0022 -0.0063 675 GLN 88 O 0.0080 -0.0002 -0.0120 676 GLN 88 CB -0.0144 0.0126 -0.0000 677 GLN 88 CG -0.0249 0.0146 0.0066 678 GLN 88 CD -0.0299 0.0267 0.0072 679 GLN 88 OE1 -0.0254 0.0350 0.0022 680 GLN 88 NE2 -0.0399 0.0280 0.0135 681 ALA 89 N -0.0081 -0.0122 0.0023 682 ALA 89 CA -0.0096 -0.0127 0.0027 683 ALA 89 C -0.0104 -0.0150 0.0030 684 ALA 89 O -0.0092 -0.0166 0.0028 685 ALA 89 CB -0.0086 -0.0122 0.0024 686 ILE 90 N -0.0185 -0.0189 0.0146 687 ILE 90 CA -0.0193 -0.0212 0.0157 688 ILE 90 C -0.0173 -0.0152 0.0147 689 ILE 90 O -0.0176 -0.0164 0.0139 690 ILE 90 CB -0.0207 -0.0241 0.0234 691 ILE 90 CG1 -0.0192 -0.0189 0.0297 692 ILE 90 CG2 -0.0229 -0.0309 0.0237 693 ILE 90 CD1 -0.0205 -0.0215 0.0373 694 ALA 91 N -0.0099 -0.0149 0.0180 695 ALA 91 CA -0.0061 -0.0078 0.0162 696 ALA 91 C -0.0052 -0.0042 0.0127 697 ALA 91 O -0.0071 -0.0073 0.0127 698 ALA 91 CB -0.0019 -0.0049 0.0234 699 ASN 92 N -0.0008 0.0010 0.0140 700 ASN 92 CA -0.0027 0.0038 0.0107 701 ASN 92 C 0.0006 0.0049 0.0147 702 ASN 92 O 0.0044 0.0075 0.0190 703 ASN 92 CB -0.0038 0.0110 0.0074 704 ASN 92 CG -0.0073 0.0103 0.0031 705 ASN 92 OD1 -0.0109 0.0063 -0.0005 706 ASN 92 ND2 -0.0064 0.0142 0.0033 707 TYR 93 N -0.0012 0.0030 0.0114 708 TYR 93 CA 0.0016 0.0023 0.0140 709 TYR 93 C 0.0016 0.0036 0.0130 710 TYR 93 O -0.0013 0.0028 0.0115 711 TYR 93 CB 0.0012 -0.0018 0.0166 712 TYR 93 CG 0.0014 -0.0034 0.0178 713 TYR 93 CD1 0.0046 -0.0037 0.0204 714 TYR 93 CD2 -0.0017 -0.0046 0.0164 715 TYR 93 CE1 0.0047 -0.0052 0.0216 716 TYR 93 CE2 -0.0016 -0.0061 0.0176 717 TYR 93 CZ 0.0017 -0.0064 0.0202 718 TYR 93 OH 0.0018 -0.0081 0.0214 719 GLU 94 N -0.0012 0.0009 0.0119 720 GLU 94 CA -0.0035 0.0013 0.0109 721 GLU 94 C -0.0032 -0.0012 0.0097 722 GLU 94 O -0.0010 -0.0022 0.0103 723 GLU 94 CB -0.0038 0.0039 0.0121 724 GLU 94 CG -0.0062 0.0045 0.0112 725 GLU 94 CD -0.0090 0.0053 0.0102 726 GLU 94 OE1 -0.0104 0.0076 0.0107 727 GLU 94 OE2 -0.0098 0.0036 0.0089 728 ILE 95 N -0.0039 -0.0028 0.0040 729 ILE 95 CA -0.0041 -0.0037 0.0023 730 ILE 95 C -0.0061 -0.0031 0.0017 731 ILE 95 O -0.0072 -0.0028 0.0014 732 ILE 95 CB -0.0034 -0.0048 0.0010 733 ILE 95 CG1 -0.0014 -0.0054 0.0015 734 ILE 95 CG2 -0.0038 -0.0057 -0.0009 735 ILE 95 CD1 -0.0008 -0.0061 0.0006 736 GLU 96 N -0.0033 -0.0049 0.0024 737 GLU 96 CA -0.0051 -0.0048 0.0022 738 GLU 96 C -0.0058 -0.0036 0.0001 739 GLU 96 O -0.0061 -0.0031 -0.0009 740 GLU 96 CB -0.0071 -0.0056 0.0034 741 GLU 96 CG -0.0066 -0.0068 0.0056 742 GLU 96 CD -0.0087 -0.0075 0.0068 743 GLU 96 OE1 -0.0084 -0.0086 0.0086 744 GLU 96 OE2 -0.0105 -0.0071 0.0060 745 VAL 97 N -0.0074 -0.0012 -0.0049 746 VAL 97 CA -0.0079 0.0002 -0.0058 747 VAL 97 C -0.0089 0.0022 -0.0058 748 VAL 97 O -0.0090 0.0028 -0.0068 749 VAL 97 CB -0.0071 -0.0000 -0.0080 750 VAL 97 CG1 -0.0077 0.0015 -0.0088 751 VAL 97 CG2 -0.0060 -0.0021 -0.0081 752 ARG 98 N -0.0034 0.0022 -0.0012 753 ARG 98 CA -0.0031 0.0028 -0.0012 754 ARG 98 C -0.0030 0.0029 -0.0009 755 ARG 98 O -0.0032 0.0026 -0.0005 756 ARG 98 CB -0.0029 0.0030 -0.0008 757 ARG 98 CG -0.0030 0.0029 -0.0011 758 ARG 98 CD -0.0029 0.0031 -0.0007 759 ARG 98 NE -0.0025 0.0038 -0.0008 760 ARG 98 CZ -0.0023 0.0041 -0.0003 761 ARG 98 NH1 -0.0024 0.0040 0.0003 762 ARG 98 NH2 -0.0020 0.0046 -0.0004 763 ARG 99 N -0.0034 0.0076 -0.0034 764 ARG 99 CA -0.0030 0.0084 -0.0024 765 ARG 99 C -0.0015 0.0121 -0.0008 766 ARG 99 O -0.0009 0.0147 -0.0021 767 ARG 99 CB -0.0037 0.0081 -0.0058 768 ARG 99 CG -0.0033 0.0110 -0.0090 769 ARG 99 CD -0.0040 0.0103 -0.0122 770 ARG 99 NE -0.0035 0.0132 -0.0152 771 ARG 99 CZ -0.0040 0.0135 -0.0184 772 ARG 99 NH1 -0.0049 0.0111 -0.0191 773 ARG 99 NH2 -0.0035 0.0163 -0.0209 774 ILE 100 N 0.0026 0.0099 -0.0002 775 ILE 100 CA 0.0034 0.0107 0.0003 776 ILE 100 C 0.0045 0.0126 0.0018 777 ILE 100 O 0.0033 0.0133 0.0031 778 ILE 100 CB 0.0016 0.0105 0.0008 779 ILE 100 CG1 0.0004 0.0086 -0.0006 780 ILE 100 CG2 0.0028 0.0113 0.0012 781 ILE 100 CD1 -0.0013 0.0082 -0.0003 782 PRO 101 N 0.0066 0.0115 0.0032 783 PRO 101 CA 0.0074 0.0106 0.0053 784 PRO 101 C 0.0078 0.0103 0.0055 785 PRO 101 O 0.0088 0.0100 0.0040 786 PRO 101 CB 0.0093 0.0094 0.0054 787 PRO 101 CG 0.0090 0.0099 0.0038 788 PRO 101 CD 0.0077 0.0110 0.0021 789 VAL 102 N 0.0087 0.0050 0.0034 790 VAL 102 CA 0.0116 0.0029 0.0009 791 VAL 102 C 0.0131 -0.0008 -0.0006 792 VAL 102 O 0.0162 -0.0015 -0.0031 793 VAL 102 CB 0.0108 0.0013 0.0013 794 VAL 102 CG1 0.0102 0.0052 0.0022 795 VAL 102 CG2 0.0077 -0.0021 0.0035 796 ALA 103 N 0.0134 -0.0112 -0.0077 797 ALA 103 CA 0.0140 -0.0235 -0.0119 798 ALA 103 C 0.0157 0.0167 0.0020 799 ALA 103 O 0.0103 0.0128 0.0002 800 ALA 103 CB -0.0297 -0.0505 -0.0253 801 THR 104 N 0.0067 -0.0002 -0.0019 802 THR 104 CA 0.0070 -0.0022 -0.0030 803 THR 104 C 0.0041 -0.0039 -0.0034 804 THR 104 O 0.0038 -0.0060 -0.0045 805 THR 104 CB 0.0095 -0.0040 -0.0044 806 THR 104 OG1 0.0122 -0.0024 -0.0040 807 THR 104 CG2 0.0102 -0.0057 -0.0054 808 PRO 105 N -0.0018 -0.0062 -0.0039 809 PRO 105 CA -0.0042 -0.0112 0.0041 810 PRO 105 C -0.0042 -0.0122 0.0035 811 PRO 105 O -0.0060 -0.0187 0.0077 812 PRO 105 CB -0.0055 -0.0050 0.0129 813 PRO 105 CG -0.0043 -0.0006 0.0102 814 PRO 105 CD -0.0016 0.0011 -0.0004 815 ASN 106 N 0.0076 -0.0165 -0.0053 816 ASN 106 CA 0.0018 0.0061 0.0190 817 ASN 106 C -0.0112 0.0201 0.0354 818 ASN 106 O -0.0223 0.0383 0.0559 819 ASN 106 CB -0.0241 0.0047 0.0213 820 ASN 106 CG -0.0117 -0.0076 0.0067 821 ASN 106 OD1 0.0176 -0.0070 0.0031 822 ASN 106 ND2 -0.0343 -0.0194 -0.0022 823 ALA 107 N -0.0025 -0.0329 -0.0229 824 ALA 107 CA 0.0051 -0.0370 -0.0219 825 ALA 107 C -0.0004 -0.0434 -0.0255 826 ALA 107 O -0.0085 -0.0395 -0.0268 827 ALA 107 CB 0.0110 -0.0280 -0.0174 828 ALA 108 N 0.0035 -0.0365 -0.0159 829 ALA 108 CA -0.0042 -0.0419 -0.0248 830 ALA 108 C -0.0040 -0.0193 -0.0174 831 ALA 108 O -0.0179 -0.0126 -0.0280 832 ALA 108 CB 0.0087 -0.0688 -0.0216 833 GLY 109 N 0.0031 0.0047 0.0016 834 GLY 109 CA 0.0002 0.0077 0.0037 835 GLY 109 C -0.0005 0.0082 0.0030 836 GLY 109 O -0.0004 0.0074 -0.0006 837 ASP 110 N -0.0063 0.0081 -0.0045 838 ASP 110 CA -0.0051 0.0069 -0.0047 839 ASP 110 C -0.0055 0.0063 -0.0048 840 ASP 110 O -0.0061 0.0072 -0.0046 841 ASP 110 CB -0.0033 0.0077 -0.0048 842 ASP 110 CG -0.0028 0.0085 -0.0048 843 ASP 110 OD1 -0.0030 0.0078 -0.0048 844 ASP 110 OD2 -0.0021 0.0099 -0.0046 845 CYS 111 N -0.0133 0.0055 -0.0069 846 CYS 111 CA -0.0143 0.0015 -0.0083 847 CYS 111 C -0.0165 -0.0006 -0.0126 848 CYS 111 O -0.0179 0.0021 -0.0160 849 CYS 111 CB -0.0146 0.0032 -0.0092 850 CYS 111 SG -0.0154 -0.0020 -0.0100 851 PHE 112 N -0.0126 0.0037 -0.0119 852 PHE 112 CA -0.0113 0.0042 -0.0143 853 PHE 112 C -0.0107 0.0010 -0.0163 854 PHE 112 O -0.0093 0.0010 -0.0191 855 PHE 112 CB -0.0119 0.0055 -0.0127 856 PHE 112 CG -0.0106 0.0065 -0.0150 857 PHE 112 CD1 -0.0111 0.0060 -0.0142 858 PHE 112 CD2 -0.0089 0.0080 -0.0178 859 PHE 112 CE1 -0.0099 0.0069 -0.0162 860 PHE 112 CE2 -0.0078 0.0088 -0.0198 861 PHE 112 CZ -0.0083 0.0082 -0.0190 862 HIS 113 N -0.0139 0.0026 -0.0150 863 HIS 113 CA -0.0112 -0.0001 -0.0156 864 HIS 113 C -0.0130 -0.0033 -0.0139 865 HIS 113 O -0.0161 -0.0027 -0.0124 866 HIS 113 CB -0.0094 0.0018 -0.0170 867 HIS 113 CG -0.0069 0.0046 -0.0190 868 HIS 113 ND1 -0.0038 0.0032 -0.0202 869 HIS 113 CD2 -0.0071 0.0085 -0.0200 870 HIS 113 CE1 -0.0022 0.0063 -0.0218 871 HIS 113 NE2 -0.0041 0.0095 -0.0218 872 THR 114 N -0.0136 -0.0014 -0.0130 873 THR 114 CA -0.0122 -0.0019 -0.0112 874 THR 114 C -0.0103 -0.0027 -0.0114 875 THR 114 O -0.0102 -0.0028 -0.0124 876 THR 114 CB -0.0130 -0.0014 -0.0088 877 THR 114 OG1 -0.0138 -0.0011 -0.0086 878 THR 114 CG2 -0.0149 -0.0006 -0.0084 879 ALA 115 N -0.0106 0.0001 -0.0058 880 ALA 115 CA -0.0062 -0.0003 -0.0052 881 ALA 115 C -0.0054 -0.0017 -0.0026 882 ALA 115 O -0.0078 -0.0019 -0.0022 883 ALA 115 CB -0.0037 0.0015 -0.0088 884 ARG 116 N -0.0122 0.0004 -0.0053 885 ARG 116 CA -0.0089 0.0008 -0.0019 886 ARG 116 C -0.0061 -0.0030 -0.0029 887 ARG 116 O -0.0074 -0.0049 -0.0057 888 ARG 116 CB -0.0103 0.0040 -0.0003 889 ARG 116 CG -0.0124 0.0081 0.0017 890 ARG 116 CD -0.0094 0.0095 0.0057 891 ARG 116 NE -0.0117 0.0134 0.0072 892 ARG 116 CZ -0.0102 0.0159 0.0109 893 ARG 116 NH1 -0.0070 0.0155 0.0134 894 ARG 116 NH2 -0.0115 0.0186 0.0121 895 LEU 117 N -0.0057 -0.0037 0.0015 896 LEU 117 CA -0.0050 -0.0056 0.0015 897 LEU 117 C -0.0045 -0.0054 0.0026 898 LEU 117 O -0.0039 -0.0049 0.0043 899 LEU 117 CB -0.0041 -0.0069 0.0023 900 LEU 117 CG -0.0033 -0.0090 0.0022 901 LEU 117 CD1 -0.0038 -0.0100 0.0002 902 LEU 117 CD2 -0.0022 -0.0099 0.0035 903 SER 118 N -0.0089 -0.0070 -0.0010 904 SER 118 CA -0.0091 -0.0050 -0.0021 905 SER 118 C -0.0092 -0.0086 -0.0007 906 SER 118 O -0.0106 -0.0130 -0.0005 907 SER 118 CB -0.0122 -0.0033 -0.0067 908 SER 118 OG -0.0124 -0.0001 -0.0084 909 THR 119 N -0.0087 -0.0100 -0.0018 910 THR 119 CA -0.0117 -0.0149 -0.0007 911 THR 119 C -0.0122 -0.0184 -0.0042 912 THR 119 O -0.0105 -0.0186 -0.0088 913 THR 119 CB -0.0127 -0.0170 -0.0013 914 THR 119 OG1 -0.0123 -0.0140 0.0018 915 THR 119 CG2 -0.0160 -0.0219 0.0004 916 GLY 120 N -0.0166 -0.0159 -0.0038 917 GLY 120 CA -0.0164 -0.0158 -0.0037 918 GLY 120 C -0.0136 -0.0123 -0.0013 919 GLY 120 O -0.0139 -0.0115 -0.0007 920 SER 121 N -0.0092 -0.0093 -0.0011 921 SER 121 CA -0.0088 -0.0092 0.0005 922 SER 121 C -0.0096 -0.0088 0.0014 923 SER 121 O -0.0099 -0.0087 0.0010 924 SER 121 CB -0.0072 -0.0098 0.0009 925 SER 121 OG -0.0066 -0.0100 0.0011 926 ARG 122 N -0.0140 -0.0059 0.0039 927 ARG 122 CA -0.0142 -0.0094 0.0078 928 ARG 122 C -0.0076 -0.0233 0.0148 929 ARG 122 O -0.0065 -0.0279 0.0184 930 ARG 122 CB -0.0270 -0.0038 0.0170 931 ARG 122 CG -0.0339 0.0103 0.0102 932 ARG 122 CD -0.0459 0.0154 0.0190 933 ARG 122 NE -0.0518 0.0292 0.0113 934 ARG 122 CZ -0.0617 0.0378 0.0139 935 ARG 122 NH1 -0.0672 0.0349 0.0234 936 ARG 122 NH2 -0.0665 0.0497 0.0069 937 GLY 123 N -0.0034 -0.0062 -0.0011 938 GLY 123 CA -0.0038 -0.0040 -0.0018 939 GLY 123 C -0.0028 -0.0034 -0.0035 940 GLY 123 O -0.0016 -0.0046 -0.0045 941 PRO 124 N 0.0035 -0.0003 -0.0086 942 PRO 124 CA 0.0018 0.0013 -0.0077 943 PRO 124 C 0.0026 0.0009 -0.0081 944 PRO 124 O 0.0049 0.0006 -0.0095 945 PRO 124 CB 0.0019 0.0045 -0.0080 946 PRO 124 CG 0.0046 0.0047 -0.0096 947 PRO 124 CD 0.0052 0.0016 -0.0097 948 ALA 125 N 0.0040 -0.0010 -0.0082 949 ALA 125 CA 0.0042 0.0004 -0.0086 950 ALA 125 C 0.0040 0.0036 -0.0090 951 ALA 125 O 0.0024 0.0049 -0.0077 952 ALA 125 CB 0.0024 -0.0004 -0.0066 953 THR 126 N 0.0056 0.0072 -0.0145 954 THR 126 CA 0.0056 0.0089 -0.0154 955 THR 126 C 0.0053 0.0110 -0.0157 956 THR 126 O 0.0057 0.0112 -0.0168 957 THR 126 CB 0.0065 0.0085 -0.0174 958 THR 126 OG1 0.0069 0.0065 -0.0173 959 THR 126 CG2 0.0065 0.0103 -0.0183 960 ILE 127 N 0.0073 0.0085 -0.0145 961 ILE 127 CA 0.0062 0.0084 -0.0145 962 ILE 127 C 0.0066 0.0117 -0.0163 963 ILE 127 O 0.0056 0.0140 -0.0175 964 ILE 127 CB 0.0023 0.0074 -0.0142 965 ILE 127 CG1 0.0017 0.0040 -0.0125 966 ILE 127 CG2 0.0013 0.0076 -0.0144 967 ILE 127 CD1 -0.0022 0.0028 -0.0121 968 SER 128 N 0.0057 0.0128 -0.0212 969 SER 128 CA 0.0056 0.0128 -0.0217 970 SER 128 C 0.0054 0.0151 -0.0232 971 SER 128 O 0.0049 0.0161 -0.0251 972 SER 128 CB 0.0050 0.0102 -0.0230 973 SER 128 OG 0.0043 0.0097 -0.0254 974 TRP 129 N 0.0040 0.0036 -0.0213 975 TRP 129 CA 0.0048 0.0062 -0.0223 976 TRP 129 C 0.0050 0.0081 -0.0223 977 TRP 129 O 0.0043 0.0077 -0.0211 978 TRP 129 CB 0.0040 0.0076 -0.0206 979 TRP 129 CG 0.0026 0.0082 -0.0180 980 TRP 129 CD1 0.0023 0.0106 -0.0170 981 TRP 129 CD2 0.0013 0.0065 -0.0160 982 TRP 129 NE1 0.0009 0.0105 -0.0145 983 TRP 129 CE2 0.0003 0.0079 -0.0140 984 TRP 129 CE3 0.0010 0.0038 -0.0160 985 TRP 129 CZ2 -0.0011 0.0068 -0.0117 986 TRP 129 CZ3 -0.0004 0.0027 -0.0137 987 TRP 129 CH2 -0.0014 0.0041 -0.0116 988 ASP 130 N 0.0059 0.0125 -0.0272 989 ASP 130 CA 0.0068 0.0126 -0.0235 990 ASP 130 C 0.0102 0.0147 -0.0146 991 ASP 130 O 0.0140 0.0200 -0.0130 992 ASP 130 CB 0.0085 0.0173 -0.0293 993 ASP 130 CG 0.0046 0.0143 -0.0376 994 ASP 130 OD1 0.0003 0.0076 -0.0377 995 ASP 130 OD2 0.0058 0.0186 -0.0442 996 ALA 131 N 0.0068 0.0003 -0.0059 997 ALA 131 CA 0.0114 -0.0016 -0.0048 998 ALA 131 C 0.0150 -0.0031 -0.0039 999 ALA 131 O 0.0137 -0.0056 -0.0023 1000 ALA 131 CB 0.0101 -0.0054 -0.0024 1001 ASP 132 N 0.0041 -0.0103 -0.0126 1002 ASP 132 CA 0.0031 -0.0070 -0.0120 1003 ASP 132 C 0.0033 -0.0068 -0.0087 1004 ASP 132 O 0.0037 -0.0079 -0.0062 1005 ASP 132 CB 0.0025 -0.0048 -0.0123 1006 ASP 132 CG 0.0015 -0.0012 -0.0122 1007 ASP 132 OD1 0.0013 -0.0004 -0.0116 1008 ASP 132 OD2 0.0009 0.0007 -0.0126 1009 ALA 133 N -0.0036 -0.0170 -0.0029 1010 ALA 133 CA -0.0029 -0.0165 0.0025 1011 ALA 133 C 0.0003 -0.0123 0.0034 1012 ALA 133 O 0.0012 -0.0114 0.0078 1013 ALA 133 CB -0.0030 -0.0168 0.0058 1014 SER 134 N -0.0024 -0.0047 -0.0004 1015 SER 134 CA 0.0017 0.0003 0.0003 1016 SER 134 C 0.0031 0.0024 0.0002 1017 SER 134 O 0.0066 0.0064 0.0012 1018 SER 134 CB 0.0020 0.0042 -0.0038 1019 SER 134 OG 0.0001 0.0061 -0.0091 1020 TYR 135 N 0.0025 0.0028 -0.0020 1021 TYR 135 CA 0.0035 0.0040 -0.0008 1022 TYR 135 C 0.0043 0.0010 0.0015 1023 TYR 135 O 0.0034 -0.0023 0.0012 1024 TYR 135 CB 0.0019 0.0049 -0.0035 1025 TYR 135 CG 0.0011 0.0080 -0.0060 1026 TYR 135 CD1 0.0020 0.0116 -0.0058 1027 TYR 135 CD2 -0.0008 0.0073 -0.0085 1028 TYR 135 CE1 0.0011 0.0145 -0.0082 1029 TYR 135 CE2 -0.0017 0.0101 -0.0108 1030 TYR 135 CZ -0.0007 0.0137 -0.0107 1031 TYR 135 OH -0.0016 0.0166 -0.0130 1032 THR 136 N 0.0040 0.0027 0.0021 1033 THR 136 CA 0.0048 0.0012 0.0035 1034 THR 136 C 0.0038 0.0023 0.0020 1035 THR 136 O 0.0040 0.0051 0.0010 1036 THR 136 CB 0.0074 0.0019 0.0060 1037 THR 136 OG1 0.0085 0.0009 0.0075 1038 THR 136 CG2 0.0081 0.0002 0.0075 1039 TYR 137 N 0.0023 0.0013 0.0011 1040 TYR 137 CA 0.0017 0.0008 -0.0003 1041 TYR 137 C 0.0026 -0.0003 0.0024 1042 TYR 137 O 0.0033 -0.0022 0.0047 1043 TYR 137 CB 0.0003 -0.0021 -0.0028 1044 TYR 137 CG -0.0007 -0.0013 -0.0055 1045 TYR 137 CD1 -0.0016 0.0007 -0.0083 1046 TYR 137 CD2 -0.0008 -0.0025 -0.0054 1047 TYR 137 CE1 -0.0025 0.0015 -0.0108 1048 TYR 137 CE2 -0.0018 -0.0017 -0.0079 1049 TYR 137 CZ -0.0026 0.0002 -0.0107 1050 TYR 137 OH -0.0036 0.0007 -0.0133 1051 TYR 138 N 0.0010 -0.0033 0.0033 1052 TYR 138 CA 0.0035 -0.0033 0.0066 1053 TYR 138 C 0.0029 -0.0041 0.0057 1054 TYR 138 O 0.0013 -0.0013 0.0041 1055 TYR 138 CB 0.0045 0.0012 0.0091 1056 TYR 138 CG 0.0053 0.0022 0.0103 1057 TYR 138 CD1 0.0080 0.0014 0.0138 1058 TYR 138 CD2 0.0033 0.0039 0.0079 1059 TYR 138 CE1 0.0087 0.0023 0.0149 1060 TYR 138 CE2 0.0040 0.0046 0.0090 1061 TYR 138 CZ 0.0067 0.0039 0.0126 1062 TYR 138 OH 0.0074 0.0048 0.0137 1063 LEU 139 N 0.0044 -0.0063 0.0076 1064 LEU 139 CA 0.0043 -0.0061 0.0076 1065 LEU 139 C 0.0050 -0.0056 0.0079 1066 LEU 139 O 0.0056 -0.0059 0.0081 1067 LEU 139 CB 0.0044 -0.0067 0.0074 1068 LEU 139 CG 0.0044 -0.0066 0.0075 1069 LEU 139 CD1 0.0037 -0.0062 0.0074 1070 LEU 139 CD2 0.0045 -0.0073 0.0073 1071 THR 140 N 0.0050 -0.0096 0.0111 1072 THR 140 CA 0.0051 -0.0094 0.0109 1073 THR 140 C 0.0051 -0.0089 0.0111 1074 THR 140 O 0.0050 -0.0089 0.0115 1075 THR 140 CB 0.0051 -0.0096 0.0108 1076 THR 140 OG1 0.0051 -0.0100 0.0106 1077 THR 140 CG2 0.0052 -0.0093 0.0106 1078 ILE 141 N 0.0048 -0.0058 0.0103 1079 ILE 141 CA 0.0055 -0.0050 0.0110 1080 ILE 141 C 0.0055 -0.0050 0.0109 1081 ILE 141 O 0.0055 -0.0048 0.0099 1082 ILE 141 CB 0.0062 -0.0041 0.0106 1083 ILE 141 CG1 0.0062 -0.0041 0.0105 1084 ILE 141 CG2 0.0070 -0.0033 0.0114 1085 ILE 141 CD1 0.0068 -0.0032 0.0099 1086 SER 142 N 0.0092 -0.0056 0.0164 1087 SER 142 CA 0.0115 -0.0030 0.0164 1088 SER 142 C 0.0111 0.0005 0.0188 1089 SER 142 O 0.0084 0.0008 0.0209 1090 SER 142 CB 0.0106 -0.0038 0.0165 1091 SER 142 OG 0.0132 -0.0017 0.0159 1092 GLU 143 N 0.0143 0.0043 0.0293 1093 GLU 143 CA 0.0142 0.0077 0.0312 1094 GLU 143 C 0.0115 0.0137 0.0331 1095 GLU 143 O 0.0120 0.0155 0.0344 1096 GLU 143 CB 0.0202 0.0068 0.0339 1097 GLU 143 CG 0.0208 0.0089 0.0354 1098 GLU 143 CD 0.0268 0.0073 0.0378 1099 GLU 143 OE1 0.0278 0.0095 0.0396 1100 GLU 143 OE2 0.0303 0.0039 0.0378 1101 ASP 144 N 0.0139 0.0231 0.0319 1102 ASP 144 CA 0.0145 0.0334 0.0284 1103 ASP 144 C 0.0211 0.0397 0.0311 1104 ASP 144 O 0.0251 0.0360 0.0356 1105 ASP 144 CB 0.0062 0.0357 0.0211 1106 ASP 144 CG -0.0001 0.0341 0.0170 1107 ASP 144 OD1 0.0019 0.0363 0.0176 1108 ASP 144 OD2 -0.0074 0.0310 0.0126 1109 ASP 144 OXT 0.0221 0.0487 0.0284