1 PRO 1 N 0.0492 -0.0114 -0.0339 2 PRO 1 HN1 0.0471 -0.0111 -0.0326 3 PRO 1 HN2 0.0489 -0.0101 -0.0347 4 PRO 1 CA 0.0509 -0.0143 -0.0327 5 PRO 1 C 0.0523 -0.0145 -0.0336 6 PRO 1 O 0.0528 -0.0165 -0.0322 7 PRO 1 CB 0.0533 -0.0154 -0.0335 8 PRO 1 CG 0.0521 -0.0133 -0.0344 9 PRO 1 CD 0.0506 -0.0106 -0.0356 10 GLY 2 N 0.0530 -0.0124 -0.0359 11 GLY 2 HN 0.0527 -0.0108 -0.0369 12 GLY 2 CA 0.0543 -0.0123 -0.0369 13 GLY 2 C 0.0521 -0.0114 -0.0359 14 GLY 2 O 0.0528 -0.0119 -0.0361 15 SER 3 N 0.0487 -0.0101 -0.0346 16 SER 3 HN 0.0481 -0.0097 -0.0345 17 SER 3 CA 0.0466 -0.0092 -0.0337 18 SER 3 C 0.0463 -0.0114 -0.0313 19 SER 3 O 0.0470 -0.0133 -0.0300 20 SER 3 CB 0.0440 -0.0073 -0.0334 21 SER 3 OG 0.0442 -0.0052 -0.0357 22 SER 3 HG 0.0426 -0.0040 -0.0355 23 SER 4 N 0.0451 -0.0110 -0.0306 24 SER 4 HN 0.0444 -0.0093 -0.0318 25 SER 4 CA 0.0446 -0.0129 -0.0284 26 SER 4 C 0.0418 -0.0125 -0.0263 27 SER 4 O 0.0399 -0.0105 -0.0267 28 SER 4 CB 0.0453 -0.0129 -0.0289 29 SER 4 OG 0.0451 -0.0149 -0.0268 30 SER 4 HG 0.0455 -0.0149 -0.0271 31 GLY 5 N 0.0415 -0.0136 -0.0240 32 GLY 5 HN 0.0430 -0.0150 -0.0238 33 GLY 5 CA 0.0393 -0.0133 -0.0220 34 GLY 5 C 0.0380 -0.0130 -0.0210 35 GLY 5 O 0.0392 -0.0139 -0.0211 36 LEU 6 N 0.0357 -0.0118 -0.0201 37 LEU 6 HN 0.0349 -0.0112 -0.0201 38 LEU 6 CA 0.0342 -0.0114 -0.0190 39 LEU 6 C 0.0321 -0.0115 -0.0167 40 LEU 6 O 0.0315 -0.0112 -0.0163 41 LEU 6 CB 0.0332 -0.0092 -0.0209 42 LEU 6 CG 0.0348 -0.0090 -0.0230 43 LEU 6 CD1 0.0337 -0.0066 -0.0249 44 LEU 6 CD2 0.0352 -0.0100 -0.0220 45 PRO 7 N 0.0314 -0.0115 -0.0158 46 PRO 7 CA 0.0295 -0.0116 -0.0136 47 PRO 7 C 0.0273 -0.0096 -0.0143 48 PRO 7 O 0.0273 -0.0084 -0.0163 49 PRO 7 CB 0.0295 -0.0124 -0.0123 50 PRO 7 CG 0.0319 -0.0134 -0.0134 51 PRO 7 CD 0.0324 -0.0122 -0.0159 52 PRO 8 N 0.0254 -0.0093 -0.0127 53 PRO 8 CA 0.0233 -0.0075 -0.0133 54 PRO 8 C 0.0222 -0.0066 -0.0134 55 PRO 8 O 0.0221 -0.0075 -0.0119 56 PRO 8 CB 0.0218 -0.0077 -0.0112 57 PRO 8 CG 0.0235 -0.0095 -0.0102 58 PRO 8 CD 0.0252 -0.0106 -0.0104 59 GLU 9 N 0.0212 -0.0049 -0.0145 60 GLU 9 HN 0.0215 -0.0044 -0.0155 61 GLU 9 CA 0.0201 -0.0040 -0.0147 62 GLU 9 C 0.0179 -0.0038 -0.0132 63 GLU 9 O 0.0172 -0.0037 -0.0127 64 GLU 9 CB 0.0199 -0.0024 -0.0168 65 GLU 9 CG 0.0218 -0.0025 -0.0184 66 GLU 9 CD 0.0215 -0.0009 -0.0204 67 GLU 9 OE1 0.0200 0.0003 -0.0209 68 GLU 9 OE2 0.0227 -0.0009 -0.0215 69 LYS 10 N 0.0169 -0.0037 -0.0125 70 LYS 10 HN 0.0176 -0.0038 -0.0129 71 LYS 10 CA 0.0148 -0.0034 -0.0111 72 LYS 10 C 0.0134 -0.0018 -0.0121 73 LYS 10 O 0.0133 -0.0006 -0.0137 74 LYS 10 CB 0.0141 -0.0034 -0.0105 75 LYS 10 CG 0.0120 -0.0032 -0.0090 76 LYS 10 CD 0.0114 -0.0031 -0.0086 77 LYS 10 CE 0.0094 -0.0030 -0.0069 78 LYS 10 NZ 0.0089 -0.0030 -0.0064 79 LYS 10 HZ1 0.0075 -0.0030 -0.0053 80 LYS 10 HZ2 0.0088 -0.0021 -0.0077 81 LYS 10 HZ3 0.0101 -0.0040 -0.0062 82 PRO 11 N 0.0123 -0.0018 -0.0108 83 PRO 11 CA 0.0109 -0.0005 -0.0116 84 PRO 11 C 0.0093 0.0005 -0.0118 85 PRO 11 O 0.0087 0.0001 -0.0106 86 PRO 11 CB 0.0101 -0.0010 -0.0102 87 PRO 11 CG 0.0117 -0.0025 -0.0093 88 PRO 11 CD 0.0124 -0.0030 -0.0091 89 LYS 12 N 0.0088 0.0019 -0.0134 90 LYS 12 HN 0.0094 0.0022 -0.0143 91 LYS 12 CA 0.0073 0.0029 -0.0137 92 LYS 12 C 0.0058 0.0042 -0.0144 93 LYS 12 O 0.0061 0.0044 -0.0149 94 LYS 12 CB 0.0083 0.0034 -0.0152 95 LYS 12 CG 0.0093 0.0041 -0.0170 96 LYS 12 CD 0.0102 0.0046 -0.0185 97 LYS 12 CE 0.0108 0.0056 -0.0204 98 LYS 12 NZ 0.0118 0.0061 -0.0219 99 LYS 12 HZ1 0.0123 0.0067 -0.0232 100 LYS 12 HZ2 0.0130 0.0053 -0.0217 101 LYS 12 HZ3 0.0110 0.0066 -0.0220 102 ASN 13 N 0.0045 0.0048 -0.0138 103 ASN 13 HN 0.0044 0.0046 -0.0135 104 ASN 13 CA 0.0028 0.0060 -0.0145 105 ASN 13 C 0.0019 0.0057 -0.0133 106 ASN 13 O 0.0014 0.0064 -0.0140 107 ASN 13 CB 0.0034 0.0070 -0.0165 108 ASN 13 CG 0.0040 0.0076 -0.0178 109 ASN 13 OD1 0.0034 0.0076 -0.0173 110 ASN 13 ND2 0.0052 0.0081 -0.0194 111 ASN 13 1HD2 0.0056 0.0084 -0.0203 112 ASN 13 2HD2 0.0057 0.0081 -0.0198 113 LEU 14 N 0.0015 0.0047 -0.0114 114 LEU 14 HN 0.0020 0.0042 -0.0109 115 LEU 14 CA 0.0006 0.0043 -0.0101 116 LEU 14 C -0.0016 0.0053 -0.0101 117 LEU 14 O -0.0026 0.0057 -0.0100 118 LEU 14 CB 0.0009 0.0029 -0.0082 119 LEU 14 CG -0.0002 0.0025 -0.0066 120 LEU 14 CD1 0.0006 0.0023 -0.0069 121 LEU 14 CD2 0.0001 0.0012 -0.0048 122 SER 15 N -0.0032 0.0050 -0.0084 123 SER 15 HN -0.0025 0.0048 -0.0086 124 SER 15 CA -0.0049 0.0059 -0.0084 125 SER 15 C -0.0053 0.0058 -0.0078 126 SER 15 O -0.0043 0.0054 -0.0081 127 SER 15 CB -0.0052 0.0070 -0.0098 128 SER 15 OG -0.0045 0.0073 -0.0108 129 SER 15 HG -0.0047 0.0081 -0.0118 130 CYS 16 N -0.0067 0.0060 -0.0070 131 CYS 16 HN -0.0075 0.0063 -0.0068 132 CYS 16 CA -0.0073 0.0059 -0.0064 133 CYS 16 C -0.0086 0.0070 -0.0070 134 CYS 16 O -0.0095 0.0077 -0.0073 135 CYS 16 CB -0.0077 0.0050 -0.0048 136 CYS 16 SG -0.0061 0.0037 -0.0040 137 ILE 17 N -0.0091 0.0069 -0.0064 138 ILE 17 HN -0.0087 0.0066 -0.0064 139 ILE 17 CA -0.0095 0.0077 -0.0066 140 ILE 17 C -0.0098 0.0077 -0.0064 141 ILE 17 O -0.0094 0.0073 -0.0065 142 ILE 17 CB -0.0093 0.0081 -0.0075 143 ILE 17 CG1 -0.0098 0.0088 -0.0077 144 ILE 17 CG2 -0.0087 0.0077 -0.0079 145 ILE 17 CD1 -0.0095 0.0093 -0.0086 146 VAL 18 N -0.0104 0.0082 -0.0061 147 VAL 18 HN -0.0107 0.0084 -0.0060 148 VAL 18 CA -0.0107 0.0083 -0.0058 149 VAL 18 C -0.0109 0.0090 -0.0063 150 VAL 18 O -0.0114 0.0095 -0.0063 151 VAL 18 CB -0.0112 0.0082 -0.0050 152 VAL 18 CG1 -0.0115 0.0084 -0.0048 153 VAL 18 CG2 -0.0110 0.0075 -0.0045 154 ASN 19 N -0.0107 0.0089 -0.0068 155 ASN 19 HN -0.0106 0.0086 -0.0069 156 ASN 19 CA -0.0109 0.0093 -0.0072 157 ASN 19 C -0.0111 0.0097 -0.0069 158 ASN 19 O -0.0111 0.0095 -0.0067 159 ASN 19 CB -0.0108 0.0093 -0.0077 160 ASN 19 CG -0.0106 0.0089 -0.0080 161 ASN 19 OD1 -0.0106 0.0091 -0.0083 162 ASN 19 ND2 -0.0103 0.0085 -0.0080 163 ASN 19 1HD2 -0.0102 0.0083 -0.0082 164 ASN 19 2HD2 -0.0103 0.0083 -0.0078 165 GLU 20 N -0.0114 0.0101 -0.0068 166 GLU 20 HN -0.0114 0.0102 -0.0070 167 GLU 20 CA -0.0116 0.0104 -0.0065 168 GLU 20 C -0.0116 0.0105 -0.0067 169 GLU 20 O -0.0116 0.0105 -0.0071 170 GLU 20 CB -0.0118 0.0109 -0.0066 171 GLU 20 CG -0.0121 0.0113 -0.0062 172 GLU 20 CD -0.0123 0.0118 -0.0063 173 GLU 20 OE1 -0.0123 0.0118 -0.0065 174 GLU 20 OE2 -0.0126 0.0121 -0.0061 175 GLY 21 N -0.0122 0.0103 -0.0055 176 GLY 21 HN -0.0122 0.0102 -0.0050 177 GLY 21 CA -0.0122 0.0103 -0.0055 178 GLY 21 C -0.0117 0.0097 -0.0057 179 GLY 21 O -0.0117 0.0097 -0.0057 180 LYS 22 N -0.0113 0.0093 -0.0059 181 LYS 22 HN -0.0113 0.0093 -0.0059 182 LYS 22 CA -0.0108 0.0087 -0.0061 183 LYS 22 C -0.0104 0.0081 -0.0055 184 LYS 22 O -0.0106 0.0082 -0.0050 185 LYS 22 CB -0.0105 0.0085 -0.0070 186 LYS 22 CG -0.0108 0.0091 -0.0077 187 LYS 22 CD -0.0109 0.0092 -0.0078 188 LYS 22 CE -0.0111 0.0096 -0.0086 189 LYS 22 NZ -0.0117 0.0103 -0.0085 190 LYS 22 HZ1 -0.0118 0.0106 -0.0090 191 LYS 22 HZ2 -0.0117 0.0102 -0.0084 192 LYS 22 HZ3 -0.0119 0.0105 -0.0080 193 LYS 23 N -0.0096 0.0065 -0.0045 194 LYS 23 HN -0.0091 0.0064 -0.0049 195 LYS 23 CA -0.0091 0.0057 -0.0037 196 LYS 23 C -0.0085 0.0057 -0.0044 197 LYS 23 O -0.0081 0.0061 -0.0056 198 LYS 23 CB -0.0082 0.0049 -0.0033 199 LYS 23 CG -0.0088 0.0048 -0.0025 200 LYS 23 CD -0.0079 0.0040 -0.0022 201 LYS 23 CE -0.0084 0.0040 -0.0015 202 LYS 23 NZ -0.0092 0.0038 -0.0003 203 LYS 23 HZ1 -0.0095 0.0038 0.0003 204 LYS 23 HZ2 -0.0097 0.0043 -0.0003 205 LYS 23 HZ3 -0.0087 0.0032 0.0002 206 MET 24 N -0.0085 0.0053 -0.0038 207 MET 24 HN -0.0088 0.0050 -0.0029 208 MET 24 CA -0.0080 0.0053 -0.0043 209 MET 24 C -0.0067 0.0048 -0.0051 210 MET 24 O -0.0060 0.0041 -0.0047 211 MET 24 CB -0.0081 0.0048 -0.0033 212 MET 24 CG -0.0077 0.0048 -0.0038 213 MET 24 SD -0.0079 0.0042 -0.0025 214 MET 24 CE -0.0066 0.0030 -0.0021 215 ARG 25 N -0.0068 0.0050 -0.0058 216 ARG 25 HN -0.0075 0.0055 -0.0062 217 ARG 25 CA -0.0055 0.0048 -0.0066 218 ARG 25 C -0.0050 0.0047 -0.0071 219 ARG 25 O -0.0057 0.0053 -0.0075 220 ARG 25 CB -0.0056 0.0053 -0.0077 221 ARG 25 CG -0.0044 0.0052 -0.0088 222 ARG 25 CD -0.0045 0.0057 -0.0098 223 ARG 25 NE -0.0057 0.0065 -0.0104 224 ARG 25 HE -0.0065 0.0067 -0.0100 225 ARG 25 CZ -0.0057 0.0071 -0.0114 226 ARG 25 NH1 -0.0047 0.0068 -0.0120 227 ARG 25 1HH1 -0.0048 0.0072 -0.0128 228 ARG 25 2HH1 -0.0039 0.0063 -0.0116 229 ARG 25 NH2 -0.0069 0.0078 -0.0119 230 ARG 25 1HH2 -0.0069 0.0082 -0.0127 231 ARG 25 2HH2 -0.0076 0.0080 -0.0115 232 CYS 26 N -0.0037 0.0041 -0.0069 233 CYS 26 HN -0.0032 0.0037 -0.0065 234 CYS 26 CA -0.0031 0.0040 -0.0074 235 CYS 26 C -0.0019 0.0040 -0.0085 236 CYS 26 O -0.0012 0.0036 -0.0084 237 CYS 26 CB -0.0027 0.0033 -0.0062 238 CYS 26 SG -0.0041 0.0034 -0.0049 239 GLU 27 N -0.0008 0.0046 -0.0108 240 GLU 27 HN -0.0018 0.0051 -0.0108 241 GLU 27 CA 0.0007 0.0048 -0.0122 242 GLU 27 C 0.0016 0.0044 -0.0123 243 GLU 27 O 0.0008 0.0044 -0.0116 244 GLU 27 CB 0.0001 0.0061 -0.0139 245 GLU 27 CG -0.0011 0.0068 -0.0140 246 GLU 27 CD -0.0000 0.0064 -0.0142 247 GLU 27 OE1 0.0013 0.0065 -0.0154 248 GLU 27 OE2 -0.0006 0.0060 -0.0132 249 TRP 28 N 0.0033 0.0041 -0.0131 250 TRP 28 HN 0.0039 0.0041 -0.0136 251 TRP 28 CA 0.0044 0.0037 -0.0133 252 TRP 28 C 0.0061 0.0038 -0.0147 253 TRP 28 O 0.0065 0.0040 -0.0154 254 TRP 28 CB 0.0049 0.0024 -0.0116 255 TRP 28 CG 0.0060 0.0015 -0.0110 256 TRP 28 CD1 0.0078 0.0009 -0.0114 257 TRP 28 CD2 0.0054 0.0011 -0.0099 258 TRP 28 NE1 0.0084 0.0001 -0.0106 259 TRP 28 HE1 0.0097 -0.0005 -0.0107 260 TRP 28 CE2 0.0069 0.0002 -0.0097 261 TRP 28 CE3 0.0036 0.0014 -0.0090 262 TRP 28 CZ2 0.0067 -0.0004 -0.0086 263 TRP 28 CZ3 0.0035 0.0008 -0.0080 264 TRP 28 CH2 0.0050 -0.0001 -0.0078 265 ASP 29 N 0.0076 0.0043 -0.0167 266 ASP 29 HN 0.0071 0.0042 -0.0160 267 ASP 29 CA 0.0094 0.0043 -0.0183 268 ASP 29 C 0.0111 0.0027 -0.0173 269 ASP 29 O 0.0113 0.0020 -0.0163 270 ASP 29 CB 0.0095 0.0051 -0.0197 271 ASP 29 CG 0.0114 0.0050 -0.0213 272 ASP 29 OD1 0.0124 0.0047 -0.0218 273 ASP 29 OD2 0.0119 0.0052 -0.0221 274 GLY 30 N 0.0124 0.0022 -0.0176 275 GLY 30 HN 0.0121 0.0029 -0.0184 276 GLY 30 CA 0.0141 0.0007 -0.0167 277 GLY 30 C 0.0158 0.0003 -0.0176 278 GLY 30 O 0.0171 -0.0009 -0.0167 279 GLY 31 N 0.0161 0.0024 -0.0203 280 GLY 31 HN 0.0149 0.0037 -0.0210 281 GLY 31 CA 0.0179 0.0019 -0.0213 282 GLY 31 C 0.0200 0.0017 -0.0230 283 GLY 31 O 0.0198 0.0024 -0.0238 284 ARG 32 N 0.0219 0.0008 -0.0234 285 ARG 32 HN 0.0219 0.0002 -0.0226 286 ARG 32 CA 0.0240 0.0004 -0.0250 287 ARG 32 C 0.0249 -0.0007 -0.0240 288 ARG 32 O 0.0245 -0.0018 -0.0220 289 ARG 32 CB 0.0259 -0.0004 -0.0255 290 ARG 32 CG 0.0265 -0.0021 -0.0235 291 ARG 32 CD 0.0287 -0.0031 -0.0242 292 ARG 32 NE 0.0289 -0.0020 -0.0260 293 ARG 32 HE 0.0279 -0.0016 -0.0257 294 ARG 32 CZ 0.0304 -0.0016 -0.0281 295 ARG 32 NH1 0.0317 -0.0022 -0.0286 296 ARG 32 1HH1 0.0328 -0.0018 -0.0302 297 ARG 32 2HH1 0.0317 -0.0029 -0.0274 298 ARG 32 NH2 0.0304 -0.0006 -0.0297 299 ARG 32 1HH2 0.0315 -0.0003 -0.0313 300 ARG 32 2HH2 0.0294 -0.0002 -0.0293 301 GLU 33 N 0.0260 0.0001 -0.0269 302 GLU 33 HN 0.0262 0.0010 -0.0286 303 GLU 33 CA 0.0270 -0.0010 -0.0265 304 GLU 33 C 0.0287 -0.0031 -0.0253 305 GLU 33 O 0.0300 -0.0037 -0.0261 306 GLU 33 CB 0.0282 -0.0003 -0.0290 307 GLU 33 CG 0.0296 -0.0015 -0.0290 308 GLU 33 CD 0.0282 -0.0012 -0.0277 309 GLU 33 OE1 0.0269 0.0005 -0.0285 310 GLU 33 OE2 0.0285 -0.0026 -0.0258 311 THR 34 N 0.0286 -0.0043 -0.0234 312 THR 34 HN 0.0274 -0.0037 -0.0228 313 THR 34 CA 0.0301 -0.0064 -0.0221 314 THR 34 C 0.0321 -0.0075 -0.0228 315 THR 34 O 0.0337 -0.0092 -0.0222 316 THR 34 CB 0.0289 -0.0072 -0.0193 317 THR 34 OG1 0.0281 -0.0070 -0.0188 318 THR 34 HG1 0.0294 -0.0076 -0.0193 319 THR 34 CG2 0.0269 -0.0061 -0.0185 320 HIS 35 N 0.0321 -0.0064 -0.0241 321 HIS 35 HN 0.0305 -0.0050 -0.0246 322 HIS 35 CA 0.0340 -0.0072 -0.0247 323 HIS 35 C 0.0343 -0.0090 -0.0223 324 HIS 35 O 0.0360 -0.0100 -0.0224 325 HIS 35 CB 0.0365 -0.0078 -0.0263 326 HIS 35 CG 0.0364 -0.0062 -0.0288 327 HIS 35 ND1 0.0362 -0.0048 -0.0307 328 HIS 35 HD1 0.0360 -0.0047 -0.0306 329 HIS 35 CD2 0.0366 -0.0057 -0.0296 330 HIS 35 CE1 0.0362 -0.0036 -0.0326 331 HIS 35 NE2 0.0364 -0.0041 -0.0320 332 HIS 35 HE2 0.0364 -0.0034 -0.0332 333 LEU 36 N 0.0326 -0.0092 -0.0202 334 LEU 36 HN 0.0311 -0.0082 -0.0202 335 LEU 36 CA 0.0326 -0.0108 -0.0178 336 LEU 36 C 0.0303 -0.0101 -0.0164 337 LEU 36 O 0.0298 -0.0112 -0.0142 338 LEU 36 CB 0.0329 -0.0121 -0.0161 339 LEU 36 CG 0.0354 -0.0131 -0.0169 340 LEU 36 CD1 0.0352 -0.0140 -0.0154 341 LEU 36 CD2 0.0375 -0.0146 -0.0167 342 GLU 37 N 0.0288 -0.0084 -0.0174 343 GLU 37 HN 0.0293 -0.0076 -0.0193 344 GLU 37 CA 0.0266 -0.0077 -0.0163 345 GLU 37 C 0.0249 -0.0081 -0.0141 346 GLU 37 O 0.0247 -0.0092 -0.0119 347 GLU 37 CB 0.0272 -0.0086 -0.0156 348 GLU 37 CG 0.0287 -0.0082 -0.0178 349 GLU 37 CD 0.0273 -0.0062 -0.0197 350 GLU 37 OE1 0.0252 -0.0053 -0.0191 351 GLU 37 OE2 0.0284 -0.0055 -0.0219 352 THR 38 N 0.0238 -0.0072 -0.0145 353 THR 38 HN 0.0241 -0.0063 -0.0163 354 THR 38 CA 0.0222 -0.0074 -0.0126 355 THR 38 C 0.0199 -0.0068 -0.0112 356 THR 38 O 0.0186 -0.0054 -0.0123 357 THR 38 CB 0.0214 -0.0064 -0.0136 358 THR 38 OG1 0.0236 -0.0070 -0.0147 359 THR 38 HG1 0.0232 -0.0063 -0.0153 360 THR 38 CG2 0.0198 -0.0066 -0.0115 361 ASN 39 N 0.0191 -0.0078 -0.0089 362 ASN 39 HN 0.0200 -0.0089 -0.0082 363 ASN 39 CA 0.0173 -0.0075 -0.0076 364 ASN 39 C 0.0155 -0.0068 -0.0068 365 ASN 39 O 0.0156 -0.0076 -0.0058 366 ASN 39 CB 0.0178 -0.0091 -0.0058 367 ASN 39 CG 0.0191 -0.0096 -0.0063 368 ASN 39 OD1 0.0187 -0.0100 -0.0053 369 ASN 39 ND2 0.0207 -0.0095 -0.0080 370 ASN 39 1HD2 0.0211 -0.0091 -0.0089 371 ASN 39 2HD2 0.0216 -0.0098 -0.0084 372 PHE 40 N 0.0138 -0.0054 -0.0074 373 PHE 40 HN 0.0138 -0.0049 -0.0082 374 PHE 40 CA 0.0119 -0.0046 -0.0067 375 PHE 40 C 0.0103 -0.0047 -0.0049 376 PHE 40 O 0.0099 -0.0045 -0.0049 377 PHE 40 CB 0.0111 -0.0028 -0.0085 378 PHE 40 CG 0.0125 -0.0026 -0.0103 379 PHE 40 CD1 0.0124 -0.0025 -0.0104 380 PHE 40 CD2 0.0138 -0.0024 -0.0119 381 PHE 40 CE1 0.0137 -0.0023 -0.0120 382 PHE 40 CE2 0.0151 -0.0022 -0.0136 383 PHE 40 CZ 0.0151 -0.0021 -0.0137 384 THR 41 N 0.0093 -0.0047 -0.0040 385 THR 41 HN 0.0097 -0.0048 -0.0042 386 THR 41 CA 0.0079 -0.0048 -0.0024 387 THR 41 C 0.0064 -0.0041 -0.0023 388 THR 41 O 0.0065 -0.0042 -0.0021 389 THR 41 CB 0.0086 -0.0061 -0.0008 390 THR 41 OG1 0.0100 -0.0068 -0.0009 391 THR 41 HG1 0.0109 -0.0068 -0.0019 392 THR 41 CG2 0.0072 -0.0062 0.0008 393 LEU 42 N 0.0049 -0.0032 -0.0023 394 LEU 42 HN 0.0048 -0.0031 -0.0026 395 LEU 42 CA 0.0032 -0.0024 -0.0021 396 LEU 42 C 0.0024 -0.0031 -0.0002 397 LEU 42 O 0.0019 -0.0033 0.0007 398 LEU 42 CB 0.0020 -0.0012 -0.0030 399 LEU 42 CG 0.0003 -0.0004 -0.0029 400 LEU 42 CD1 0.0006 0.0001 -0.0041 401 LEU 42 CD2 -0.0011 0.0006 -0.0034 402 LYS 43 N 0.0026 -0.0031 -0.0003 403 LYS 43 HN 0.0031 -0.0029 -0.0010 404 LYS 43 CA 0.0020 -0.0036 0.0013 405 LYS 43 C 0.0004 -0.0027 0.0014 406 LYS 43 O 0.0002 -0.0021 0.0005 407 LYS 43 CB 0.0030 -0.0044 0.0019 408 LYS 43 CG 0.0046 -0.0052 0.0015 409 LYS 43 CD 0.0051 -0.0060 0.0026 410 LYS 43 CE 0.0049 -0.0068 0.0042 411 LYS 43 NZ 0.0053 -0.0076 0.0053 412 LYS 43 HZ1 0.0052 -0.0081 0.0063 413 LYS 43 HZ2 0.0064 -0.0080 0.0048 414 LYS 43 HZ3 0.0048 -0.0073 0.0053 415 SER 44 N -0.0007 -0.0028 0.0026 416 SER 44 HN -0.0004 -0.0033 0.0033 417 SER 44 CA -0.0022 -0.0020 0.0029 418 SER 44 C -0.0029 -0.0026 0.0046 419 SER 44 O -0.0025 -0.0033 0.0054 420 SER 44 CB -0.0031 -0.0010 0.0020 421 SER 44 OG -0.0032 -0.0013 0.0025 422 SER 44 HG -0.0038 -0.0006 0.0019 423 GLU 45 N -0.0034 -0.0019 0.0036 424 GLU 45 HN -0.0037 -0.0013 0.0030 425 GLU 45 CA -0.0041 -0.0024 0.0048 426 GLU 45 C -0.0054 -0.0019 0.0052 427 GLU 45 O -0.0055 -0.0013 0.0046 428 GLU 45 CB -0.0033 -0.0035 0.0055 429 GLU 45 CG -0.0030 -0.0035 0.0052 430 GLU 45 CD -0.0021 -0.0045 0.0058 431 GLU 45 OE1 -0.0012 -0.0052 0.0058 432 GLU 45 OE2 -0.0022 -0.0048 0.0062 433 TRP 46 N -0.0063 -0.0019 0.0061 434 TRP 46 HN -0.0061 -0.0023 0.0065 435 TRP 46 CA -0.0075 -0.0015 0.0066 436 TRP 46 C -0.0073 -0.0023 0.0076 437 TRP 46 O -0.0065 -0.0032 0.0080 438 TRP 46 CB -0.0085 -0.0013 0.0072 439 TRP 46 CG -0.0090 -0.0004 0.0065 440 TRP 46 CD1 -0.0088 0.0004 0.0053 441 TRP 46 CD2 -0.0098 -0.0001 0.0069 442 TRP 46 NE1 -0.0094 0.0011 0.0049 443 TRP 46 HE1 -0.0094 0.0018 0.0041 444 TRP 46 CE2 -0.0100 0.0008 0.0059 445 TRP 46 CE3 -0.0104 -0.0006 0.0080 446 TRP 46 CZ2 -0.0108 0.0013 0.0059 447 TRP 46 CZ3 -0.0111 -0.0001 0.0081 448 TRP 46 CH2 -0.0114 0.0008 0.0070 449 ALA 47 N -0.0080 -0.0020 0.0076 450 ALA 47 HN -0.0087 -0.0013 0.0072 451 ALA 47 CA -0.0079 -0.0027 0.0085 452 ALA 47 C -0.0082 -0.0034 0.0098 453 ALA 47 O -0.0078 -0.0042 0.0106 454 ALA 47 CB -0.0089 -0.0022 0.0086 455 THR 48 N -0.0088 -0.0032 0.0098 456 THR 48 HN -0.0090 -0.0025 0.0091 457 THR 48 CA -0.0091 -0.0037 0.0109 458 THR 48 C -0.0083 -0.0041 0.0108 459 THR 48 O -0.0086 -0.0045 0.0116 460 THR 48 CB -0.0105 -0.0032 0.0112 461 THR 48 OG1 -0.0107 -0.0024 0.0102 462 THR 48 HG1 -0.0101 -0.0026 0.0100 463 THR 48 CG2 -0.0115 -0.0028 0.0115 464 HIS 49 N -0.0072 -0.0039 0.0106 465 HIS 49 HN -0.0070 -0.0037 0.0099 466 HIS 49 CA -0.0065 -0.0042 0.0103 467 HIS 49 C -0.0053 -0.0042 0.0091 468 HIS 49 O -0.0054 -0.0036 0.0081 469 HIS 49 CB -0.0075 -0.0035 0.0102 470 HIS 49 CG -0.0069 -0.0037 0.0100 471 HIS 49 ND1 -0.0067 -0.0032 0.0089 472 HIS 49 HD1 -0.0070 -0.0026 0.0080 473 HIS 49 CD2 -0.0065 -0.0045 0.0109 474 HIS 49 CE1 -0.0062 -0.0036 0.0090 475 HIS 49 NE2 -0.0061 -0.0044 0.0102 476 HIS 49 HE2 -0.0057 -0.0048 0.0106 477 LYS 50 N -0.0043 -0.0048 0.0092 478 LYS 50 HN -0.0043 -0.0053 0.0101 479 LYS 50 CA -0.0031 -0.0049 0.0081 480 LYS 50 C -0.0031 -0.0046 0.0075 481 LYS 50 O -0.0031 -0.0050 0.0081 482 LYS 50 CB -0.0019 -0.0059 0.0086 483 LYS 50 CG -0.0016 -0.0063 0.0088 484 LYS 50 CD -0.0002 -0.0072 0.0091 485 LYS 50 CE 0.0002 -0.0075 0.0092 486 LYS 50 NZ 0.0015 -0.0084 0.0094 487 LYS 50 HZ1 0.0018 -0.0086 0.0094 488 LYS 50 HZ2 0.0022 -0.0084 0.0086 489 LYS 50 HZ3 0.0016 -0.0090 0.0101 490 PHE 51 N -0.0031 -0.0036 0.0068 491 PHE 51 HN -0.0031 -0.0033 0.0062 492 PHE 51 CA -0.0031 -0.0032 0.0062 493 PHE 51 C -0.0017 -0.0037 0.0057 494 PHE 51 O -0.0007 -0.0042 0.0057 495 PHE 51 CB -0.0038 -0.0023 0.0050 496 PHE 51 CG -0.0053 -0.0017 0.0054 497 PHE 51 CD1 -0.0063 -0.0015 0.0059 498 PHE 51 CD2 -0.0056 -0.0015 0.0052 499 PHE 51 CE1 -0.0076 -0.0011 0.0062 500 PHE 51 CE2 -0.0070 -0.0010 0.0055 501 PHE 51 CZ -0.0080 -0.0008 0.0060 502 ALA 52 N -0.0017 -0.0036 0.0055 503 ALA 52 HN -0.0026 -0.0032 0.0056 504 ALA 52 CA -0.0004 -0.0039 0.0051 505 ALA 52 C 0.0003 -0.0036 0.0037 506 ALA 52 O -0.0002 -0.0028 0.0028 507 ALA 52 CB -0.0007 -0.0038 0.0050 508 ASP 53 N 0.0016 -0.0049 0.0043 509 ASP 53 HN 0.0021 -0.0056 0.0052 510 ASP 53 CA 0.0026 -0.0047 0.0029 511 ASP 53 C 0.0025 -0.0040 0.0016 512 ASP 53 O 0.0023 -0.0041 0.0019 513 ASP 53 CB 0.0042 -0.0057 0.0030 514 ASP 53 CG 0.0045 -0.0063 0.0041 515 ASP 53 OD1 0.0035 -0.0061 0.0046 516 ASP 53 OD2 0.0058 -0.0072 0.0044 517 CYS 54 N 0.0025 -0.0034 0.0003 518 CYS 54 HN 0.0025 -0.0033 0.0001 519 CYS 54 CA 0.0024 -0.0027 -0.0010 520 CYS 54 C 0.0040 -0.0031 -0.0020 521 CYS 54 O 0.0046 -0.0031 -0.0026 522 CYS 54 CB 0.0013 -0.0017 -0.0019 523 CYS 54 SG 0.0008 -0.0008 -0.0033 524 LYS 55 N 0.0053 -0.0035 -0.0017 525 LYS 55 HN 0.0046 -0.0035 -0.0010 526 LYS 55 CA 0.0070 -0.0039 -0.0027 527 LYS 55 C 0.0069 -0.0030 -0.0046 528 LYS 55 O 0.0062 -0.0025 -0.0049 529 LYS 55 CB 0.0078 -0.0047 -0.0019 530 LYS 55 CG 0.0097 -0.0058 -0.0018 531 LYS 55 CD 0.0099 -0.0065 -0.0003 532 LYS 55 CE 0.0090 -0.0069 0.0015 533 LYS 55 NZ 0.0097 -0.0074 0.0018 534 LYS 55 HZ1 0.0091 -0.0076 0.0030 535 LYS 55 HZ2 0.0110 -0.0080 0.0016 536 LYS 55 HZ3 0.0096 -0.0069 0.0008 537 ALA 56 N 0.0075 -0.0027 -0.0058 538 ALA 56 HN 0.0080 -0.0032 -0.0055 539 ALA 56 CA 0.0075 -0.0019 -0.0077 540 ALA 56 C 0.0085 -0.0021 -0.0083 541 ALA 56 O 0.0100 -0.0031 -0.0079 542 ALA 56 CB 0.0082 -0.0017 -0.0088 543 LYS 57 N 0.0081 -0.0014 -0.0093 544 LYS 57 HN 0.0067 -0.0005 -0.0095 545 LYS 57 CA 0.0092 -0.0016 -0.0101 546 LYS 57 C 0.0109 -0.0016 -0.0119 547 LYS 57 O 0.0110 -0.0012 -0.0127 548 LYS 57 CB 0.0078 -0.0005 -0.0107 549 LYS 57 CG 0.0061 -0.0004 -0.0090 550 LYS 57 CD 0.0049 0.0006 -0.0095 551 LYS 57 CE 0.0030 0.0009 -0.0080 552 LYS 57 NZ 0.0033 -0.0004 -0.0060 553 LYS 57 HZ1 0.0020 -0.0003 -0.0050 554 LYS 57 HZ2 0.0041 -0.0012 -0.0056 555 LYS 57 HZ3 0.0042 -0.0009 -0.0061 556 ARG 58 N 0.0122 -0.0021 -0.0124 557 ARG 58 HN 0.0120 -0.0025 -0.0116 558 ARG 58 CA 0.0140 -0.0023 -0.0140 559 ARG 58 C 0.0136 -0.0009 -0.0160 560 ARG 58 O 0.0144 -0.0008 -0.0171 561 ARG 58 CB 0.0153 -0.0030 -0.0142 562 ASP 59 N 0.0122 -0.0000 -0.0164 563 ASP 59 HN 0.0116 -0.0001 -0.0155 564 ASP 59 CA 0.0117 0.0013 -0.0182 565 ASP 59 C 0.0108 0.0020 -0.0183 566 ASP 59 O 0.0111 0.0026 -0.0198 567 ASP 59 CB 0.0103 0.0024 -0.0185 568 ASP 59 CG 0.0113 0.0022 -0.0192 569 ASP 59 OD1 0.0130 0.0015 -0.0201 570 ASP 59 OD2 0.0103 0.0027 -0.0191 571 THR 60 N 0.0096 0.0019 -0.0166 572 THR 60 HN 0.0093 0.0013 -0.0154 573 THR 60 CA 0.0086 0.0024 -0.0165 574 THR 60 C 0.0089 0.0013 -0.0148 575 THR 60 O 0.0077 0.0012 -0.0132 576 THR 60 CB 0.0065 0.0036 -0.0161 577 THR 60 OG1 0.0058 0.0031 -0.0145 578 THR 60 HG1 0.0061 0.0023 -0.0134 579 THR 60 CG2 0.0060 0.0049 -0.0179 580 PRO 61 N 0.0108 0.0007 -0.0154 581 PRO 61 CA 0.0113 -0.0005 -0.0140 582 PRO 61 C 0.0102 -0.0001 -0.0134 583 PRO 61 O 0.0101 -0.0009 -0.0119 584 PRO 61 CB 0.0133 -0.0013 -0.0149 585 PRO 61 CG 0.0133 -0.0002 -0.0169 586 PRO 61 CD 0.0122 0.0008 -0.0172 587 THR 62 N 0.0093 0.0012 -0.0146 588 THR 62 HN 0.0094 0.0019 -0.0158 589 THR 62 CA 0.0083 0.0017 -0.0142 590 THR 62 C 0.0062 0.0027 -0.0136 591 THR 62 O 0.0052 0.0036 -0.0138 592 THR 62 CB 0.0088 0.0023 -0.0159 593 THR 62 OG1 0.0084 0.0035 -0.0175 594 THR 62 HG1 0.0087 0.0039 -0.0185 595 THR 62 CG2 0.0108 0.0013 -0.0164 596 SER 63 N 0.0050 0.0024 -0.0121 597 SER 63 HN 0.0059 0.0017 -0.0117 598 SER 63 CA 0.0032 0.0029 -0.0115 599 SER 63 C 0.0029 0.0022 -0.0099 600 SER 63 O 0.0041 0.0014 -0.0096 601 SER 63 CB 0.0027 0.0040 -0.0129 602 SER 63 OG 0.0011 0.0045 -0.0123 603 SER 63 HG 0.0007 0.0052 -0.0131 604 CYS 64 N 0.0014 0.0023 -0.0089 605 CYS 64 HN 0.0005 0.0029 -0.0092 606 CYS 64 CA 0.0010 0.0016 -0.0073 607 CYS 64 C -0.0009 0.0022 -0.0066 608 CYS 64 O -0.0019 0.0027 -0.0066 609 CYS 64 CB 0.0018 0.0004 -0.0060 610 CYS 64 SG 0.0025 -0.0007 -0.0046 611 THR 65 N -0.0018 0.0022 -0.0064 612 THR 65 HN -0.0012 0.0019 -0.0066 613 THR 65 CA -0.0032 0.0027 -0.0058 614 THR 65 C -0.0033 0.0020 -0.0043 615 THR 65 O -0.0028 0.0015 -0.0039 616 THR 65 CB -0.0038 0.0034 -0.0065 617 THR 65 OG1 -0.0037 0.0039 -0.0079 618 THR 65 HG1 -0.0027 0.0036 -0.0083 619 THR 65 CG2 -0.0053 0.0039 -0.0058 620 VAL 66 N -0.0040 0.0020 -0.0034 621 VAL 66 HN -0.0044 0.0024 -0.0038 622 VAL 66 CA -0.0041 0.0014 -0.0019 623 VAL 66 C -0.0048 0.0014 -0.0013 624 VAL 66 O -0.0054 0.0021 -0.0020 625 VAL 66 CB -0.0048 0.0014 -0.0012 626 VAL 66 CG1 -0.0041 0.0012 -0.0017 627 VAL 66 CG2 -0.0062 0.0023 -0.0013 628 ASP 67 N -0.0043 0.0008 -0.0005 629 ASP 67 HN -0.0039 0.0003 -0.0000 630 ASP 67 CA -0.0048 0.0008 0.0002 631 ASP 67 C -0.0061 0.0013 0.0010 632 ASP 67 O -0.0067 0.0016 0.0014 633 ASP 67 CB -0.0039 -0.0001 0.0010 634 ASP 67 CG -0.0042 -0.0002 0.0016 635 ASP 67 OD1 -0.0042 0.0001 0.0009 636 ASP 67 OD2 -0.0046 -0.0005 0.0029 637 TYR 68 N -0.0064 0.0014 0.0014 638 TYR 68 HN -0.0059 0.0012 0.0011 639 TYR 68 CA -0.0076 0.0018 0.0023 640 TYR 68 C -0.0086 0.0027 0.0016 641 TYR 68 O -0.0084 0.0031 0.0005 642 TYR 68 CB -0.0075 0.0013 0.0033 643 TYR 68 CG -0.0069 0.0011 0.0027 644 TYR 68 CD1 -0.0057 0.0005 0.0024 645 TYR 68 CD2 -0.0076 0.0017 0.0025 646 TYR 68 CE1 -0.0052 0.0004 0.0018 647 TYR 68 CE2 -0.0071 0.0016 0.0019 648 TYR 68 CZ -0.0059 0.0009 0.0016 649 TYR 68 OH -0.0054 0.0008 0.0010 650 TYR 68 HH -0.0059 0.0012 0.0008 651 SER 69 N -0.0093 0.0038 0.0021 652 SER 69 HN -0.0094 0.0035 0.0030 653 SER 69 CA -0.0104 0.0046 0.0015 654 SER 69 C -0.0106 0.0047 0.0014 655 SER 69 O -0.0103 0.0043 0.0023 656 SER 69 CB -0.0116 0.0048 0.0023 657 SER 69 OG -0.0116 0.0049 0.0022 658 SER 69 HG -0.0124 0.0051 0.0027 659 THR 70 N -0.0111 0.0053 0.0004 660 THR 70 HN -0.0113 0.0057 -0.0003 661 THR 70 CA -0.0113 0.0055 0.0002 662 THR 70 C -0.0123 0.0056 0.0012 663 THR 70 O -0.0133 0.0059 0.0015 664 THR 70 CB -0.0116 0.0062 -0.0012 665 THR 70 OG1 -0.0107 0.0061 -0.0022 666 THR 70 HG1 -0.0107 0.0060 -0.0020 667 THR 70 CG2 -0.0116 0.0063 -0.0015 668 VAL 71 N -0.0106 0.0049 0.0008 669 VAL 71 HN -0.0098 0.0047 0.0005 670 VAL 71 CA -0.0116 0.0050 0.0017 671 VAL 71 C -0.0120 0.0054 0.0012 672 VAL 71 O -0.0113 0.0050 0.0013 673 VAL 71 CB -0.0114 0.0041 0.0030 674 VAL 71 CG1 -0.0125 0.0041 0.0038 675 VAL 71 CG2 -0.0112 0.0036 0.0035 676 TYR 72 N -0.0130 0.0062 0.0008 677 TYR 72 HN -0.0134 0.0065 0.0007 678 TYR 72 CA -0.0134 0.0067 0.0003 679 TYR 72 C -0.0139 0.0065 0.0013 680 TYR 72 O -0.0143 0.0060 0.0023 681 TYR 72 CB -0.0143 0.0077 -0.0004 682 TYR 72 CG -0.0138 0.0080 -0.0015 683 TYR 72 CD1 -0.0129 0.0082 -0.0025 684 TYR 72 CD2 -0.0141 0.0083 -0.0016 685 TYR 72 CE1 -0.0124 0.0085 -0.0035 686 TYR 72 CE2 -0.0136 0.0086 -0.0026 687 TYR 72 CZ -0.0127 0.0087 -0.0035 688 TYR 72 OH -0.0122 0.0090 -0.0046 689 TYR 72 HH -0.0116 0.0091 -0.0052 690 PHE 73 N -0.0135 0.0059 0.0015 691 PHE 73 HN -0.0131 0.0064 0.0010 692 PHE 73 CA -0.0142 0.0058 0.0020 693 PHE 73 C -0.0140 0.0049 0.0025 694 PHE 73 O -0.0146 0.0046 0.0030 695 PHE 73 CB -0.0151 0.0058 0.0024 696 PHE 73 CG -0.0153 0.0066 0.0020 697 PHE 73 CD1 -0.0153 0.0074 0.0014 698 PHE 73 CD2 -0.0155 0.0064 0.0022 699 PHE 73 CE1 -0.0155 0.0081 0.0010 700 PHE 73 CE2 -0.0157 0.0071 0.0018 701 PHE 73 CZ -0.0157 0.0080 0.0012 702 VAL 74 N -0.0130 0.0045 0.0023 703 VAL 74 HN -0.0125 0.0048 0.0019 704 VAL 74 CA -0.0127 0.0037 0.0027 705 VAL 74 C -0.0118 0.0039 0.0022 706 VAL 74 O -0.0112 0.0041 0.0017 707 VAL 74 CB -0.0123 0.0029 0.0031 708 VAL 74 CG1 -0.0119 0.0021 0.0035 709 VAL 74 CG2 -0.0131 0.0028 0.0036 710 ASN 75 N -0.0120 0.0029 0.0034 711 ASN 75 HN -0.0125 0.0028 0.0040 712 ASN 75 CA -0.0110 0.0029 0.0028 713 ASN 75 C -0.0099 0.0021 0.0030 714 ASN 75 O -0.0098 0.0014 0.0039 715 ASN 75 CB -0.0110 0.0028 0.0029 716 ASN 75 CG -0.0117 0.0037 0.0022 717 ASN 75 OD1 -0.0127 0.0041 0.0024 718 ASN 75 ND2 -0.0111 0.0039 0.0014 719 ASN 75 1HD2 -0.0102 0.0036 0.0013 720 ASN 75 2HD2 -0.0115 0.0045 0.0009 721 ILE 76 N -0.0090 0.0022 0.0021 722 ILE 76 HN -0.0091 0.0028 0.0014 723 ILE 76 CA -0.0079 0.0016 0.0022 724 ILE 76 C -0.0070 0.0015 0.0016 725 ILE 76 O -0.0071 0.0021 0.0009 726 ILE 76 CB -0.0076 0.0017 0.0017 727 ILE 76 CG1 -0.0073 0.0025 0.0005 728 ILE 76 CG2 -0.0085 0.0020 0.0021 729 ILE 76 CD1 -0.0072 0.0028 0.0000 730 GLU 77 N -0.0060 0.0002 0.0030 731 GLU 77 HN -0.0060 -0.0003 0.0038 732 GLU 77 CA -0.0049 -0.0002 0.0025 733 GLU 77 C -0.0039 -0.0004 0.0017 734 GLU 77 O -0.0037 -0.0008 0.0021 735 GLU 77 CB -0.0045 -0.0013 0.0036 736 GLU 77 CG -0.0033 -0.0018 0.0033 737 GLU 77 CD -0.0036 -0.0015 0.0032 738 GLU 77 OE1 -0.0045 -0.0007 0.0029 739 GLU 77 OE2 -0.0030 -0.0022 0.0036 740 VAL 78 N -0.0034 0.0000 0.0005 741 VAL 78 HN -0.0036 0.0003 0.0002 742 VAL 78 CA -0.0024 -0.0001 -0.0004 743 VAL 78 C -0.0013 -0.0004 -0.0011 744 VAL 78 O -0.0014 -0.0001 -0.0014 745 VAL 78 CB -0.0030 0.0010 -0.0013 746 VAL 78 CG1 -0.0021 0.0009 -0.0022 747 VAL 78 CG2 -0.0042 0.0013 -0.0006 748 TRP 79 N 0.0005 -0.0013 -0.0012 749 TRP 79 HN 0.0005 -0.0016 -0.0007 750 TRP 79 CA 0.0020 -0.0017 -0.0020 751 TRP 79 C 0.0032 -0.0021 -0.0025 752 TRP 79 O 0.0030 -0.0024 -0.0019 753 TRP 79 CB 0.0025 -0.0025 -0.0011 754 TRP 79 CG 0.0030 -0.0037 0.0002 755 TRP 79 CD1 0.0045 -0.0047 0.0003 756 TRP 79 CD2 0.0020 -0.0042 0.0017 757 TRP 79 NE1 0.0045 -0.0056 0.0017 758 TRP 79 HE1 0.0055 -0.0064 0.0020 759 TRP 79 CE2 0.0030 -0.0054 0.0026 760 TRP 79 CE3 0.0004 -0.0036 0.0024 761 TRP 79 CZ2 0.0025 -0.0060 0.0042 762 TRP 79 CZ3 -0.0001 -0.0043 0.0039 763 TRP 79 CH2 0.0009 -0.0055 0.0048 764 VAL 80 N 0.0045 -0.0021 -0.0036 765 VAL 80 HN 0.0046 -0.0019 -0.0041 766 VAL 80 CA 0.0057 -0.0026 -0.0041 767 VAL 80 C 0.0072 -0.0036 -0.0039 768 VAL 80 O 0.0076 -0.0036 -0.0042 769 VAL 80 CB 0.0060 -0.0016 -0.0058 770 VAL 80 CG1 0.0072 -0.0020 -0.0063 771 VAL 80 CG2 0.0045 -0.0005 -0.0061 772 GLU 81 N 0.0088 -0.0049 -0.0032 773 GLU 81 HN 0.0083 -0.0049 -0.0029 774 GLU 81 CA 0.0107 -0.0062 -0.0030 775 GLU 81 C 0.0122 -0.0063 -0.0043 776 GLU 81 O 0.0120 -0.0062 -0.0044 777 GLU 81 CB 0.0107 -0.0076 -0.0009 778 GLU 81 CG 0.0103 -0.0080 0.0000 779 GLU 81 CD 0.0107 -0.0094 0.0020 780 GLU 81 OE1 0.0124 -0.0105 0.0020 781 GLU 81 OE2 0.0093 -0.0095 0.0035 782 ALA 82 N 0.0136 -0.0064 -0.0056 783 ALA 82 HN 0.0136 -0.0064 -0.0056 784 ALA 82 CA 0.0152 -0.0065 -0.0070 785 ALA 82 C 0.0170 -0.0081 -0.0063 786 ALA 82 O 0.0174 -0.0088 -0.0055 787 ALA 82 CB 0.0156 -0.0055 -0.0089 788 GLU 83 N 0.0190 -0.0092 -0.0062 789 GLU 83 HN 0.0185 -0.0084 -0.0070 790 GLU 83 CA 0.0211 -0.0109 -0.0055 791 GLU 83 C 0.0229 -0.0113 -0.0068 792 GLU 83 O 0.0224 -0.0106 -0.0074 793 GLU 83 CB 0.0205 -0.0121 -0.0029 794 GLU 83 CG 0.0225 -0.0139 -0.0021 795 GLU 83 CD 0.0220 -0.0151 0.0005 796 GLU 83 OE1 0.0203 -0.0146 0.0015 797 GLU 83 OE2 0.0232 -0.0164 0.0015 798 ASN 84 N 0.0250 -0.0123 -0.0073 799 ASN 84 HN 0.0252 -0.0127 -0.0068 800 ASN 84 CA 0.0269 -0.0129 -0.0084 801 ASN 84 C 0.0288 -0.0147 -0.0073 802 ASN 84 O 0.0283 -0.0154 -0.0056 803 ASN 84 CB 0.0276 -0.0117 -0.0110 804 ASN 84 CG 0.0283 -0.0117 -0.0118 805 ASN 84 OD1 0.0290 -0.0128 -0.0106 806 ASN 84 ND2 0.0280 -0.0103 -0.0139 807 ASN 84 1HD2 0.0285 -0.0103 -0.0144 808 ASN 84 2HD2 0.0274 -0.0094 -0.0148 809 ALA 85 N 0.0310 -0.0159 -0.0082 810 ALA 85 HN 0.0313 -0.0152 -0.0096 811 ALA 85 CA 0.0329 -0.0177 -0.0073 812 ALA 85 C 0.0333 -0.0181 -0.0070 813 ALA 85 O 0.0336 -0.0193 -0.0053 814 ALA 85 CB 0.0351 -0.0182 -0.0087 815 LEU 86 N 0.0332 -0.0169 -0.0088 816 LEU 86 HN 0.0328 -0.0158 -0.0102 817 LEU 86 CA 0.0335 -0.0171 -0.0089 818 LEU 86 C 0.0317 -0.0167 -0.0075 819 LEU 86 O 0.0320 -0.0170 -0.0074 820 LEU 86 CB 0.0344 -0.0161 -0.0114 821 LEU 86 CG 0.0367 -0.0167 -0.0127 822 LEU 86 CD1 0.0374 -0.0157 -0.0152 823 LEU 86 CD2 0.0385 -0.0187 -0.0115 824 GLY 87 N 0.0290 -0.0154 -0.0068 825 GLY 87 HN 0.0288 -0.0152 -0.0070 826 GLY 87 CA 0.0272 -0.0151 -0.0055 827 GLY 87 C 0.0250 -0.0140 -0.0050 828 GLY 87 O 0.0247 -0.0132 -0.0058 829 LYS 88 N 0.0235 -0.0140 -0.0035 830 LYS 88 HN 0.0240 -0.0148 -0.0028 831 LYS 88 CA 0.0214 -0.0130 -0.0028 832 LYS 88 C 0.0201 -0.0121 -0.0029 833 LYS 88 O 0.0204 -0.0129 -0.0021 834 LYS 88 CB 0.0207 -0.0142 -0.0006 835 LYS 88 CG 0.0183 -0.0132 0.0003 836 LYS 88 CD 0.0176 -0.0143 0.0026 837 LYS 88 CE 0.0182 -0.0149 0.0029 838 LYS 88 NZ 0.0173 -0.0158 0.0051 839 LYS 88 HZ1 0.0177 -0.0162 0.0053 840 LYS 88 HZ2 0.0157 -0.0151 0.0056 841 LYS 88 HZ3 0.0177 -0.0168 0.0061 842 VAL 89 N 0.0179 -0.0099 -0.0043 843 VAL 89 HN 0.0178 -0.0095 -0.0048 844 VAL 89 CA 0.0166 -0.0090 -0.0046 845 VAL 89 C 0.0144 -0.0079 -0.0043 846 VAL 89 O 0.0142 -0.0075 -0.0047 847 VAL 89 CB 0.0174 -0.0080 -0.0067 848 VAL 89 CG1 0.0176 -0.0070 -0.0081 849 VAL 89 CG2 0.0160 -0.0070 -0.0069 850 THR 90 N 0.0129 -0.0076 -0.0035 851 THR 90 HN 0.0132 -0.0080 -0.0032 852 THR 90 CA 0.0108 -0.0066 -0.0031 853 THR 90 C 0.0097 -0.0051 -0.0044 854 THR 90 O 0.0102 -0.0051 -0.0048 855 THR 90 CB 0.0096 -0.0074 -0.0010 856 THR 90 OG1 0.0097 -0.0079 -0.0004 857 THR 90 HG1 0.0091 -0.0070 -0.0012 858 THR 90 CG2 0.0104 -0.0088 0.0003 859 SER 91 N 0.0082 -0.0036 -0.0048 860 SER 91 HN 0.0079 -0.0037 -0.0045 861 SER 91 CA 0.0072 -0.0024 -0.0058 862 SER 91 C 0.0058 -0.0023 -0.0045 863 SER 91 O 0.0056 -0.0033 -0.0029 864 SER 91 CB 0.0063 -0.0012 -0.0066 865 SER 91 OG 0.0049 -0.0012 -0.0054 866 SER 91 HG 0.0043 -0.0005 -0.0059 867 ASP 92 N 0.0048 -0.0013 -0.0052 868 ASP 92 HN 0.0051 -0.0006 -0.0065 869 ASP 92 CA 0.0034 -0.0011 -0.0041 870 ASP 92 C 0.0019 -0.0008 -0.0033 871 ASP 92 O 0.0018 -0.0002 -0.0040 872 ASP 92 CB 0.0027 0.0000 -0.0052 873 ASP 92 CG 0.0041 -0.0004 -0.0059 874 ASP 92 OD1 0.0050 -0.0015 -0.0049 875 ASP 92 OD2 0.0041 0.0006 -0.0073 876 HIS 93 N 0.0010 -0.0011 -0.0021 877 HIS 93 HN 0.0012 -0.0016 -0.0015 878 HIS 93 CA -0.0003 -0.0008 -0.0013 879 HIS 93 C -0.0017 0.0005 -0.0018 880 HIS 93 O -0.0020 0.0009 -0.0022 881 HIS 93 CB -0.0008 -0.0017 0.0004 882 HIS 93 CG 0.0005 -0.0030 0.0011 883 HIS 93 ND1 0.0001 -0.0038 0.0026 884 HIS 93 HD1 -0.0010 -0.0037 0.0034 885 HIS 93 CD2 0.0021 -0.0036 0.0006 886 HIS 93 CE1 0.0014 -0.0049 0.0029 887 HIS 93 NE2 0.0026 -0.0048 0.0017 888 HIS 93 HE2 0.0038 -0.0055 0.0016 889 ILE 94 N -0.0025 0.0011 -0.0019 890 ILE 94 HN -0.0021 0.0007 -0.0017 891 ILE 94 CA -0.0039 0.0023 -0.0023 892 ILE 94 C -0.0052 0.0021 -0.0010 893 ILE 94 O -0.0049 0.0014 -0.0003 894 ILE 94 CB -0.0038 0.0033 -0.0038 895 ILE 94 CG1 -0.0036 0.0030 -0.0037 896 ILE 94 CG2 -0.0026 0.0034 -0.0051 897 ILE 94 CD1 -0.0036 0.0041 -0.0051 898 ASN 95 N -0.0062 0.0025 -0.0011 899 ASN 95 HN -0.0063 0.0028 -0.0015 900 ASN 95 CA -0.0072 0.0026 -0.0001 901 ASN 95 C -0.0082 0.0036 -0.0005 902 ASN 95 O -0.0085 0.0041 -0.0010 903 ASN 95 CB -0.0074 0.0021 0.0010 904 ASN 95 CG -0.0082 0.0020 0.0021 905 ASN 95 OD1 -0.0092 0.0027 0.0023 906 ASN 95 ND2 -0.0077 0.0011 0.0029 907 ASN 95 1HD2 -0.0069 0.0006 0.0028 908 ASN 95 2HD2 -0.0082 0.0011 0.0037 909 PHE 96 N -0.0088 0.0040 -0.0004 910 PHE 96 HN -0.0085 0.0035 0.0001 911 PHE 96 CA -0.0098 0.0049 -0.0008 912 PHE 96 C -0.0105 0.0052 -0.0002 913 PHE 96 O -0.0102 0.0046 0.0003 914 PHE 96 CB -0.0094 0.0055 -0.0021 915 PHE 96 CG -0.0087 0.0052 -0.0025 916 PHE 96 CD1 -0.0076 0.0045 -0.0028 917 PHE 96 CD2 -0.0092 0.0056 -0.0026 918 PHE 96 CE1 -0.0069 0.0042 -0.0031 919 PHE 96 CE2 -0.0086 0.0053 -0.0029 920 PHE 96 CZ -0.0074 0.0046 -0.0032 921 ASP 97 N -0.0107 0.0059 -0.0008 922 ASP 97 HN -0.0109 0.0062 -0.0011 923 ASP 97 CA -0.0113 0.0061 -0.0005 924 ASP 97 C -0.0112 0.0067 -0.0014 925 ASP 97 O -0.0112 0.0072 -0.0021 926 ASP 97 CB -0.0123 0.0066 -0.0001 927 ASP 97 CG -0.0130 0.0069 0.0004 928 ASP 97 OD1 -0.0129 0.0070 0.0000 929 ASP 97 OD2 -0.0138 0.0070 0.0010 930 PRO 98 N -0.0110 0.0065 -0.0015 931 PRO 98 CA -0.0108 0.0070 -0.0023 932 PRO 98 C -0.0116 0.0079 -0.0027 933 PRO 98 O -0.0115 0.0084 -0.0035 934 PRO 98 CB -0.0105 0.0066 -0.0020 935 PRO 98 CG -0.0110 0.0062 -0.0009 936 PRO 98 CD -0.0108 0.0058 -0.0007 937 VAL 99 N -0.0120 0.0083 -0.0028 938 VAL 99 HN -0.0121 0.0080 -0.0025 939 VAL 99 CA -0.0125 0.0086 -0.0030 940 VAL 99 C -0.0124 0.0090 -0.0035 941 VAL 99 O -0.0126 0.0093 -0.0038 942 VAL 99 CB -0.0130 0.0087 -0.0026 943 VAL 99 CG1 -0.0131 0.0087 -0.0026 944 VAL 99 CG2 -0.0135 0.0090 -0.0028 945 TYR 100 N -0.0120 0.0088 -0.0036 946 TYR 100 HN -0.0119 0.0085 -0.0033 947 TYR 100 CA -0.0119 0.0091 -0.0040 948 TYR 100 C -0.0114 0.0091 -0.0044 949 TYR 100 O -0.0112 0.0093 -0.0048 950 TYR 100 CB -0.0119 0.0090 -0.0039 951 TYR 100 CG -0.0124 0.0090 -0.0035 952 TYR 100 CD1 -0.0129 0.0093 -0.0036 953 TYR 100 CD2 -0.0124 0.0086 -0.0030 954 TYR 100 CE1 -0.0133 0.0093 -0.0033 955 TYR 100 CE2 -0.0128 0.0086 -0.0027 956 TYR 100 CZ -0.0133 0.0090 -0.0028 957 TYR 100 OH -0.0138 0.0090 -0.0025 958 TYR 100 HH -0.0141 0.0092 -0.0026 959 LYS 101 N -0.0114 0.0091 -0.0045 960 LYS 101 HN -0.0115 0.0090 -0.0042 961 LYS 101 CA -0.0110 0.0090 -0.0049 962 LYS 101 C -0.0111 0.0092 -0.0051 963 LYS 101 O -0.0108 0.0091 -0.0053 964 LYS 101 CB -0.0106 0.0086 -0.0047 965 LYS 101 CG -0.0104 0.0083 -0.0045 966 LYS 101 CD -0.0103 0.0084 -0.0049 967 LYS 101 CE -0.0101 0.0082 -0.0046 968 LYS 101 NZ -0.0100 0.0083 -0.0050 969 LYS 101 HZ1 -0.0099 0.0081 -0.0048 970 LYS 101 HZ2 -0.0103 0.0086 -0.0051 971 LYS 101 HZ3 -0.0098 0.0083 -0.0053 972 VAL 102 N -0.0116 0.0095 -0.0050 973 VAL 102 HN -0.0118 0.0096 -0.0049 974 VAL 102 CA -0.0117 0.0098 -0.0052 975 VAL 102 C -0.0117 0.0100 -0.0058 976 VAL 102 O -0.0118 0.0102 -0.0060 977 VAL 102 CB -0.0122 0.0100 -0.0049 978 VAL 102 CG1 -0.0124 0.0102 -0.0051 979 VAL 102 CG2 -0.0122 0.0097 -0.0044 980 LYS 103 N -0.0119 0.0104 -0.0054 981 LYS 103 HN -0.0118 0.0104 -0.0055 982 LYS 103 CA -0.0118 0.0105 -0.0054 983 LYS 103 C -0.0117 0.0106 -0.0055 984 LYS 103 O -0.0116 0.0106 -0.0056 985 LYS 103 CB -0.0118 0.0105 -0.0055 986 LYS 103 CG -0.0117 0.0106 -0.0055 987 LYS 103 CD -0.0117 0.0106 -0.0056 988 LYS 103 CE -0.0116 0.0107 -0.0056 989 LYS 103 NZ -0.0115 0.0106 -0.0057 990 LYS 103 HZ1 -0.0115 0.0107 -0.0057 991 LYS 103 HZ2 -0.0115 0.0106 -0.0058 992 LYS 103 HZ3 -0.0116 0.0106 -0.0057 993 PRO 104 N -0.0117 0.0107 -0.0054 994 PRO 104 CA -0.0116 0.0108 -0.0055 995 PRO 104 C -0.0115 0.0109 -0.0056 996 PRO 104 O -0.0115 0.0109 -0.0056 997 PRO 104 CB -0.0116 0.0109 -0.0054 998 PRO 104 CG -0.0117 0.0109 -0.0053 999 PRO 104 CD -0.0117 0.0108 -0.0053 1000 ASN 105 N -0.0124 0.0112 -0.0056 1001 ASN 105 HN -0.0121 0.0113 -0.0060 1002 ASN 105 CA -0.0123 0.0111 -0.0054 1003 ASN 105 C -0.0119 0.0108 -0.0048 1004 ASN 105 O -0.0114 0.0108 -0.0048 1005 ASN 105 CB -0.0120 0.0113 -0.0059 1006 ASN 105 CG -0.0124 0.0115 -0.0065 1007 ASN 105 OD1 -0.0130 0.0115 -0.0064 1008 ASN 105 ND2 -0.0121 0.0118 -0.0070 1009 ASN 105 1HD2 -0.0116 0.0118 -0.0071 1010 ASN 105 2HD2 -0.0124 0.0119 -0.0074 1011 PRO 106 N -0.0120 0.0106 -0.0044 1012 PRO 106 CA -0.0115 0.0104 -0.0039 1013 PRO 106 C -0.0108 0.0105 -0.0040 1014 PRO 106 O -0.0106 0.0107 -0.0045 1015 PRO 106 CB -0.0118 0.0102 -0.0034 1016 PRO 106 CG -0.0121 0.0104 -0.0038 1017 PRO 106 CD -0.0125 0.0106 -0.0043 1018 PRO 107 N -0.0103 0.0101 -0.0034 1019 PRO 107 CA -0.0094 0.0099 -0.0036 1020 PRO 107 C -0.0096 0.0098 -0.0033 1021 PRO 107 O -0.0102 0.0096 -0.0027 1022 PRO 107 CB -0.0087 0.0094 -0.0031 1023 PRO 107 CG -0.0091 0.0095 -0.0032 1024 PRO 107 CD -0.0102 0.0097 -0.0030 1025 HIS 108 N -0.0091 0.0100 -0.0038 1026 HIS 108 HN -0.0086 0.0102 -0.0043 1027 HIS 108 CA -0.0092 0.0098 -0.0036 1028 HIS 108 C -0.0083 0.0094 -0.0034 1029 HIS 108 O -0.0075 0.0092 -0.0035 1030 HIS 108 CB -0.0097 0.0104 -0.0042 1031 HIS 108 CG -0.0091 0.0109 -0.0050 1032 HIS 108 ND1 -0.0088 0.0112 -0.0055 1033 HIS 108 HD1 -0.0091 0.0111 -0.0054 1034 HIS 108 CD2 -0.0086 0.0110 -0.0054 1035 HIS 108 CE1 -0.0083 0.0115 -0.0062 1036 HIS 108 NE2 -0.0081 0.0114 -0.0062 1037 HIS 108 HE2 -0.0077 0.0116 -0.0066 1038 ASN 109 N -0.0082 0.0092 -0.0029 1039 ASN 109 HN -0.0090 0.0094 -0.0028 1040 ASN 109 CA -0.0071 0.0087 -0.0027 1041 ASN 109 C -0.0066 0.0079 -0.0019 1042 ASN 109 O -0.0055 0.0075 -0.0019 1043 ASN 109 CB -0.0061 0.0091 -0.0037 1044 ASN 109 CG -0.0065 0.0098 -0.0045 1045 ASN 109 OD1 -0.0073 0.0098 -0.0042 1046 ASN 109 ND2 -0.0059 0.0103 -0.0055 1047 ASN 109 1HD2 -0.0052 0.0102 -0.0057 1048 ASN 109 2HD2 -0.0061 0.0107 -0.0060 1049 LEU 110 N -0.0074 0.0076 -0.0011 1050 LEU 110 HN -0.0083 0.0079 -0.0011 1051 LEU 110 CA -0.0070 0.0068 -0.0002 1052 LEU 110 C -0.0065 0.0061 0.0005 1053 LEU 110 O -0.0072 0.0061 0.0008 1054 LEU 110 CB -0.0081 0.0067 0.0004 1055 LEU 110 CG -0.0078 0.0060 0.0013 1056 LEU 110 CD1 -0.0068 0.0059 0.0009 1057 LEU 110 CD2 -0.0090 0.0060 0.0018 1058 SER 111 N -0.0052 0.0057 0.0009 1059 SER 111 HN -0.0046 0.0058 0.0004 1060 SER 111 CA -0.0046 0.0048 0.0017 1061 SER 111 C -0.0037 0.0039 0.0025 1062 SER 111 O -0.0030 0.0040 0.0020 1063 SER 111 CB -0.0036 0.0050 0.0010 1064 SER 111 OG -0.0022 0.0050 0.0002 1065 SER 111 HG -0.0016 0.0051 -0.0002 1066 VAL 112 N -0.0037 0.0030 0.0037 1067 VAL 112 HN -0.0043 0.0030 0.0040 1068 VAL 112 CA -0.0029 0.0020 0.0045 1069 VAL 112 C -0.0016 0.0014 0.0047 1070 VAL 112 O -0.0018 0.0013 0.0049 1071 VAL 112 CB -0.0039 0.0014 0.0059 1072 VAL 112 CG1 -0.0031 0.0005 0.0067 1073 VAL 112 CG2 -0.0054 0.0021 0.0058 1074 ILE 113 N 0.0000 0.0010 0.0044 1075 ILE 113 HN 0.0002 0.0011 0.0041 1076 ILE 113 CA 0.0015 0.0002 0.0045 1077 ILE 113 C 0.0026 -0.0009 0.0053 1078 ILE 113 O 0.0026 -0.0009 0.0052 1079 ILE 113 CB 0.0026 0.0009 0.0030 1080 ILE 113 CG1 0.0032 0.0013 0.0021 1081 ILE 113 CG2 0.0015 0.0020 0.0022 1082 ILE 113 CD1 0.0044 0.0019 0.0006 1083 ASN 114 N 0.0034 -0.0018 0.0060 1084 ASN 114 HN 0.0033 -0.0018 0.0061 1085 ASN 114 CA 0.0045 -0.0029 0.0068 1086 ASN 114 C 0.0061 -0.0028 0.0056 1087 ASN 114 O 0.0066 -0.0022 0.0046 1088 ASN 114 CB 0.0049 -0.0040 0.0079 1089 ASN 114 CG 0.0034 -0.0042 0.0092 1090 ASN 114 OD1 0.0025 -0.0037 0.0091 1091 ASN 114 ND2 0.0031 -0.0049 0.0102 1092 ASN 114 1HD2 0.0038 -0.0052 0.0103 1093 ASN 114 2HD2 0.0020 -0.0050 0.0111 1094 SER 115 N 0.0071 -0.0035 0.0056 1095 SER 115 HN 0.0065 -0.0039 0.0066 1096 SER 115 CA 0.0087 -0.0035 0.0044 1097 SER 115 C 0.0099 -0.0046 0.0052 1098 SER 115 O 0.0093 -0.0052 0.0066 1099 SER 115 CB 0.0082 -0.0023 0.0029 1100 SER 115 OG 0.0071 -0.0021 0.0035 1101 SER 115 HG 0.0067 -0.0014 0.0026 1102 GLU 116 N 0.0116 -0.0049 0.0044 1103 GLU 116 HN 0.0120 -0.0043 0.0033 1104 GLU 116 CA 0.0129 -0.0058 0.0050 1105 GLU 116 C 0.0134 -0.0071 0.0067 1106 GLU 116 O 0.0144 -0.0080 0.0073 1107 GLU 116 CB 0.0124 -0.0056 0.0051 1108 GLU 116 CG 0.0123 -0.0045 0.0033 1109 GLU 116 CD 0.0116 -0.0042 0.0034 1110 GLU 116 OE1 0.0124 -0.0050 0.0041 1111 GLU 116 OE2 0.0103 -0.0032 0.0028 1112 GLU 117 N 0.0132 -0.0073 0.0067 1113 GLU 117 HN 0.0123 -0.0066 0.0060 1114 GLU 117 CA 0.0135 -0.0084 0.0083 1115 GLU 117 C 0.0126 -0.0090 0.0100 1116 GLU 117 O 0.0128 -0.0099 0.0114 1117 GLU 117 CB 0.0156 -0.0092 0.0084 1118 GLU 117 CG 0.0167 -0.0087 0.0068 1119 GLU 117 CD 0.0188 -0.0096 0.0070 1120 GLU 117 OE1 0.0199 -0.0099 0.0067 1121 GLU 117 OE2 0.0192 -0.0100 0.0074 1122 LEU 118 N 0.0116 -0.0084 0.0097 1123 LEU 118 HN 0.0115 -0.0076 0.0084 1124 LEU 118 CA 0.0106 -0.0089 0.0111 1125 LEU 118 C 0.0088 -0.0087 0.0120 1126 LEU 118 O 0.0077 -0.0078 0.0112 1127 LEU 118 CB 0.0103 -0.0083 0.0104 1128 LEU 118 CG 0.0119 -0.0088 0.0101 1129 LEU 118 CD1 0.0138 -0.0093 0.0097 1130 LEU 118 CD2 0.0115 -0.0078 0.0087 1131 SER 119 N 0.0091 -0.0099 0.0127 1132 SER 119 HN 0.0101 -0.0107 0.0133 1133 SER 119 CA 0.0072 -0.0099 0.0139 1134 SER 119 C 0.0055 -0.0093 0.0141 1135 SER 119 O 0.0039 -0.0092 0.0152 1136 SER 119 CB 0.0076 -0.0112 0.0158 1137 SER 119 OG 0.0084 -0.0121 0.0166 1138 SER 119 HG 0.0087 -0.0129 0.0178 1139 SER 120 N 0.0059 -0.0088 0.0131 1140 SER 120 HN 0.0073 -0.0088 0.0122 1141 SER 120 CA 0.0044 -0.0082 0.0132 1142 SER 120 C 0.0037 -0.0068 0.0114 1143 SER 120 O 0.0027 -0.0062 0.0112 1144 SER 120 CB 0.0053 -0.0089 0.0137 1145 SER 120 OG 0.0070 -0.0088 0.0123 1146 SER 120 HG 0.0075 -0.0092 0.0126 1147 ILE 121 N 0.0039 -0.0059 0.0109 1148 ILE 121 HN 0.0046 -0.0064 0.0111 1149 ILE 121 CA 0.0034 -0.0047 0.0095 1150 ILE 121 C 0.0028 -0.0040 0.0090 1151 ILE 121 O 0.0030 -0.0045 0.0095 1152 ILE 121 CB 0.0049 -0.0045 0.0082 1153 ILE 121 CG1 0.0062 -0.0048 0.0077 1154 ILE 121 CG2 0.0058 -0.0052 0.0086 1155 ILE 121 CD1 0.0075 -0.0044 0.0062 1156 LEU 122 N 0.0018 -0.0029 0.0080 1157 LEU 122 HN 0.0016 -0.0025 0.0077 1158 LEU 122 CA 0.0011 -0.0021 0.0074 1159 LEU 122 C 0.0011 -0.0009 0.0058 1160 LEU 122 O 0.0007 -0.0006 0.0056 1161 LEU 122 CB -0.0007 -0.0019 0.0083 1162 LEU 122 CG -0.0008 -0.0028 0.0098 1163 LEU 122 CD1 -0.0026 -0.0025 0.0106 1164 LEU 122 CD2 -0.0000 -0.0029 0.0093 1165 LYS 123 N 0.0010 -0.0001 0.0051 1166 LYS 123 HN 0.0014 -0.0004 0.0053 1167 LYS 123 CA 0.0011 0.0008 0.0037 1168 LYS 123 C -0.0002 0.0018 0.0031 1169 LYS 123 O -0.0006 0.0018 0.0034 1170 LYS 123 CB 0.0026 0.0008 0.0028 1171 LYS 123 CG 0.0028 0.0017 0.0013 1172 LYS 123 CD 0.0043 0.0016 0.0005 1173 LYS 123 CE 0.0046 0.0024 -0.0009 1174 LYS 123 NZ 0.0061 0.0023 -0.0016 1175 LYS 123 HZ1 0.0063 0.0028 -0.0026 1176 LYS 123 HZ2 0.0064 0.0022 -0.0017 1177 LYS 123 HZ3 0.0069 0.0016 -0.0011 1178 LEU 124 N -0.0009 0.0025 0.0024 1179 LEU 124 HN -0.0005 0.0025 0.0023 1180 LEU 124 CA -0.0020 0.0035 0.0018 1181 LEU 124 C -0.0014 0.0043 0.0003 1182 LEU 124 O -0.0006 0.0043 -0.0003 1183 LEU 124 CB -0.0033 0.0039 0.0021 1184 LEU 124 CG -0.0041 0.0032 0.0035 1185 LEU 124 CD1 -0.0054 0.0038 0.0036 1186 LEU 124 CD2 -0.0047 0.0031 0.0041 1187 THR 125 N -0.0024 0.0051 0.0003 1188 THR 125 HN -0.0029 0.0050 0.0008 1189 THR 125 CA -0.0021 0.0056 -0.0010 1190 THR 125 C -0.0033 0.0063 -0.0014 1191 THR 125 O -0.0040 0.0062 -0.0007 1192 THR 125 CB -0.0010 0.0054 -0.0014 1193 THR 125 OG1 -0.0014 0.0053 -0.0009 1194 THR 125 HG1 -0.0021 0.0057 -0.0012 1195 THR 125 CG2 0.0002 0.0047 -0.0009 1196 TRP 126 N -0.0035 0.0070 -0.0025 1197 TRP 126 HN -0.0028 0.0070 -0.0030 1198 TRP 126 CA -0.0046 0.0076 -0.0029 1199 TRP 126 C -0.0044 0.0083 -0.0043 1200 TRP 126 O -0.0035 0.0083 -0.0048 1201 TRP 126 CB -0.0058 0.0078 -0.0023 1202 TRP 126 CG -0.0057 0.0079 -0.0026 1203 TRP 126 CD1 -0.0061 0.0086 -0.0036 1204 TRP 126 CD2 -0.0053 0.0074 -0.0019 1205 TRP 126 NE1 -0.0059 0.0085 -0.0036 1206 TRP 126 HE1 -0.0061 0.0089 -0.0042 1207 TRP 126 CE2 -0.0054 0.0078 -0.0026 1208 TRP 126 CE3 -0.0049 0.0066 -0.0008 1209 TRP 126 CZ2 -0.0051 0.0074 -0.0021 1210 TRP 126 CZ3 -0.0045 0.0063 -0.0004 1211 TRP 126 CH2 -0.0047 0.0067 -0.0011 1212 THR 127 N -0.0061 0.0095 -0.0040 1213 THR 127 HN -0.0066 0.0094 -0.0036 1214 THR 127 CA -0.0061 0.0099 -0.0049 1215 THR 127 C -0.0069 0.0102 -0.0049 1216 THR 127 O -0.0077 0.0102 -0.0046 1217 THR 127 CB -0.0062 0.0102 -0.0054 1218 THR 127 OG1 -0.0055 0.0099 -0.0052 1219 THR 127 HG1 -0.0056 0.0097 -0.0046 1220 THR 127 CG2 -0.0061 0.0107 -0.0063 1221 ASN 128 N -0.0067 0.0104 -0.0054 1222 ASN 128 HN -0.0061 0.0103 -0.0056 1223 ASN 128 CA -0.0075 0.0106 -0.0055 1224 ASN 128 C -0.0080 0.0111 -0.0062 1225 ASN 128 O -0.0077 0.0113 -0.0067 1226 ASN 128 CB -0.0070 0.0106 -0.0058 1227 ASN 128 CG -0.0066 0.0102 -0.0051 1228 ASN 128 OD1 -0.0071 0.0099 -0.0044 1229 ASN 128 ND2 -0.0057 0.0100 -0.0052 1230 ASN 128 1HD2 -0.0055 0.0097 -0.0047 1231 ASN 128 2HD2 -0.0054 0.0102 -0.0058 1232 PRO 129 N -0.0091 0.0114 -0.0056 1233 PRO 129 CA -0.0094 0.0115 -0.0061 1234 PRO 129 C -0.0092 0.0118 -0.0063 1235 PRO 129 O -0.0089 0.0118 -0.0060 1236 PRO 129 CB -0.0099 0.0112 -0.0060 1237 PRO 129 CG -0.0097 0.0110 -0.0054 1238 PRO 129 CD -0.0093 0.0111 -0.0052 1239 SER 130 N -0.0093 0.0120 -0.0068 1240 SER 130 HN -0.0096 0.0120 -0.0070 1241 SER 130 CA -0.0091 0.0122 -0.0070 1242 SER 130 C -0.0092 0.0120 -0.0068 1243 SER 130 O -0.0089 0.0122 -0.0069 1244 SER 130 CB -0.0093 0.0124 -0.0075 1245 SER 130 OG -0.0091 0.0126 -0.0077 1246 SER 130 HG -0.0092 0.0128 -0.0080 1247 ILE 131 N -0.0100 0.0115 -0.0060 1248 ILE 131 HN -0.0101 0.0114 -0.0059 1249 ILE 131 CA -0.0104 0.0113 -0.0058 1250 ILE 131 C -0.0100 0.0113 -0.0054 1251 ILE 131 O -0.0102 0.0112 -0.0052 1252 ILE 131 CB -0.0110 0.0110 -0.0056 1253 ILE 131 CG1 -0.0115 0.0109 -0.0056 1254 ILE 131 CG2 -0.0109 0.0109 -0.0048 1255 ILE 131 CD1 -0.0118 0.0110 -0.0064 1256 LYS 132 N -0.0094 0.0114 -0.0051 1257 LYS 132 HN -0.0092 0.0115 -0.0052 1258 LYS 132 CA -0.0090 0.0114 -0.0046 1259 LYS 132 C -0.0088 0.0116 -0.0050 1260 LYS 132 O -0.0085 0.0116 -0.0046 1261 LYS 132 CB -0.0084 0.0116 -0.0044 1262 LYS 132 CG -0.0079 0.0118 -0.0049 1263 LYS 132 CD -0.0073 0.0119 -0.0046 1264 LYS 132 CE -0.0067 0.0122 -0.0051 1265 LYS 132 NZ -0.0069 0.0123 -0.0057 1266 LYS 132 HZ1 -0.0065 0.0125 -0.0060 1267 LYS 132 HZ2 -0.0073 0.0123 -0.0059 1268 LYS 132 HZ3 -0.0071 0.0122 -0.0056 1269 SER 133 N -0.0095 0.0120 -0.0036 1270 SER 133 HN -0.0096 0.0119 -0.0040 1271 SER 133 CA -0.0095 0.0120 -0.0037 1272 SER 133 C -0.0101 0.0115 -0.0037 1273 SER 133 O -0.0102 0.0115 -0.0037 1274 SER 133 CB -0.0092 0.0122 -0.0045 1275 SER 133 OG -0.0095 0.0119 -0.0051 1276 SER 133 HG -0.0093 0.0120 -0.0056 1277 VAL 134 N -0.0105 0.0112 -0.0036 1278 VAL 134 HN -0.0105 0.0112 -0.0036 1279 VAL 134 CA -0.0112 0.0107 -0.0035 1280 VAL 134 C -0.0114 0.0105 -0.0027 1281 VAL 134 O -0.0118 0.0102 -0.0024 1282 VAL 134 CB -0.0115 0.0103 -0.0041 1283 VAL 134 CG1 -0.0122 0.0098 -0.0040 1284 VAL 134 CG2 -0.0114 0.0104 -0.0049 1285 ILE 135 N -0.0103 0.0114 -0.0048 1286 ILE 135 HN -0.0105 0.0113 -0.0047 1287 ILE 135 CA -0.0101 0.0110 -0.0048 1288 ILE 135 C -0.0100 0.0105 -0.0047 1289 ILE 135 O -0.0102 0.0104 -0.0046 1290 ILE 135 CB -0.0105 0.0110 -0.0046 1291 ILE 135 CG1 -0.0109 0.0108 -0.0043 1292 ILE 135 CG2 -0.0106 0.0114 -0.0046 1293 ILE 135 CD1 -0.0113 0.0107 -0.0041 1294 ILE 136 N -0.0097 0.0102 -0.0048 1295 ILE 136 HN -0.0095 0.0104 -0.0049 1296 ILE 136 CA -0.0095 0.0097 -0.0047 1297 ILE 136 C -0.0099 0.0095 -0.0045 1298 ILE 136 O -0.0100 0.0096 -0.0045 1299 ILE 136 CB -0.0091 0.0095 -0.0049 1300 ILE 136 CG1 -0.0087 0.0098 -0.0052 1301 ILE 136 CG2 -0.0090 0.0090 -0.0049 1302 ILE 136 CD1 -0.0087 0.0099 -0.0052 1303 LEU 137 N -0.0087 0.0102 -0.0051 1304 LEU 137 HN -0.0083 0.0101 -0.0052 1305 LEU 137 CA -0.0090 0.0101 -0.0046 1306 LEU 137 C -0.0089 0.0099 -0.0040 1307 LEU 137 O -0.0084 0.0097 -0.0040 1308 LEU 137 CB -0.0089 0.0101 -0.0045 1309 LEU 137 CG -0.0091 0.0103 -0.0049 1310 LEU 137 CD1 -0.0089 0.0102 -0.0048 1311 LEU 137 CD2 -0.0097 0.0105 -0.0049 1312 LYS 138 N -0.0093 0.0099 -0.0037 1313 LYS 138 HN -0.0097 0.0100 -0.0037 1314 LYS 138 CA -0.0092 0.0096 -0.0031 1315 LYS 138 C -0.0094 0.0095 -0.0027 1316 LYS 138 O -0.0097 0.0097 -0.0029 1317 LYS 138 CB -0.0096 0.0097 -0.0030 1318 LYS 138 CG -0.0102 0.0098 -0.0029 1319 LYS 138 CD -0.0104 0.0098 -0.0026 1320 LYS 138 CE -0.0110 0.0100 -0.0025 1321 LYS 138 NZ -0.0112 0.0099 -0.0022 1322 LYS 138 HZ1 -0.0117 0.0100 -0.0021 1323 LYS 138 HZ2 -0.0111 0.0100 -0.0024 1324 LYS 138 HZ3 -0.0111 0.0097 -0.0019 1325 TYR 139 N -0.0086 0.0087 -0.0023 1326 TYR 139 HN -0.0082 0.0085 -0.0022 1327 TYR 139 CA -0.0090 0.0085 -0.0017 1328 TYR 139 C -0.0093 0.0081 -0.0010 1329 TYR 139 O -0.0091 0.0080 -0.0008 1330 TYR 139 CB -0.0084 0.0082 -0.0016 1331 TYR 139 CG -0.0079 0.0084 -0.0024 1332 TYR 139 CD1 -0.0073 0.0084 -0.0028 1333 TYR 139 CD2 -0.0082 0.0087 -0.0026 1334 TYR 139 CE1 -0.0069 0.0087 -0.0035 1335 TYR 139 CE2 -0.0078 0.0090 -0.0033 1336 TYR 139 CZ -0.0071 0.0090 -0.0037 1337 TYR 139 OH -0.0067 0.0092 -0.0044 1338 TYR 139 HH -0.0069 0.0094 -0.0045 1339 ASN 140 N -0.0097 0.0080 -0.0005 1340 ASN 140 HN -0.0099 0.0082 -0.0007 1341 ASN 140 CA -0.0100 0.0076 0.0003 1342 ASN 140 C -0.0097 0.0073 0.0006 1343 ASN 140 O -0.0100 0.0075 0.0005 1344 ASN 140 CB -0.0109 0.0079 0.0006 1345 ASN 140 CG -0.0112 0.0081 0.0005 1346 ASN 140 OD1 -0.0119 0.0083 0.0007 1347 ASN 140 ND2 -0.0107 0.0079 0.0003 1348 ASN 140 1HD2 -0.0109 0.0080 0.0003 1349 ASN 140 2HD2 -0.0101 0.0077 0.0002 1350 ILE 141 N -0.0087 0.0062 0.0022 1351 ILE 141 HN -0.0082 0.0060 0.0021 1352 ILE 141 CA -0.0083 0.0056 0.0027 1353 ILE 141 C -0.0088 0.0050 0.0039 1354 ILE 141 O -0.0086 0.0046 0.0043 1355 ILE 141 CB -0.0070 0.0051 0.0024 1356 ILE 141 CG1 -0.0065 0.0057 0.0012 1357 ILE 141 CG2 -0.0067 0.0043 0.0031 1358 ILE 141 CD1 -0.0052 0.0052 0.0008 1359 GLN 142 N -0.0095 0.0049 0.0045 1360 GLN 142 HN -0.0097 0.0053 0.0042 1361 GLN 142 CA -0.0100 0.0043 0.0057 1362 GLN 142 C -0.0096 0.0036 0.0063 1363 GLN 142 O -0.0094 0.0038 0.0060 1364 GLN 142 CB -0.0113 0.0049 0.0060 1365 GLN 142 CG -0.0117 0.0055 0.0055 1366 GLN 142 CD -0.0130 0.0059 0.0060 1367 GLN 142 OE1 -0.0137 0.0060 0.0065 1368 GLN 142 NE2 -0.0133 0.0063 0.0058 1369 GLN 142 1HE2 -0.0142 0.0066 0.0061 1370 GLN 142 2HE2 -0.0128 0.0063 0.0054 1371 TYR 143 N -0.0098 0.0023 0.0084 1372 TYR 143 HN -0.0101 0.0023 0.0088 1373 TYR 143 CA -0.0093 0.0015 0.0092 1374 TYR 143 C -0.0100 0.0009 0.0107 1375 TYR 143 O -0.0106 0.0009 0.0111 1376 TYR 143 CB -0.0077 0.0008 0.0089 1377 TYR 143 CG -0.0071 0.0002 0.0093 1378 TYR 143 CD1 -0.0070 0.0008 0.0084 1379 TYR 143 CD2 -0.0068 -0.0008 0.0105 1380 TYR 143 CE1 -0.0066 0.0003 0.0087 1381 TYR 143 CE2 -0.0063 -0.0013 0.0108 1382 TYR 143 CZ -0.0062 -0.0007 0.0099 1383 TYR 143 OH -0.0058 -0.0011 0.0102 1384 TYR 143 HH -0.0056 -0.0018 0.0110 1385 ARG 144 N -0.0100 0.0003 0.0116 1386 ARG 144 HN -0.0095 0.0002 0.0112 1387 ARG 144 CA -0.0106 -0.0004 0.0131 1388 ARG 144 C -0.0101 -0.0011 0.0138 1389 ARG 144 O -0.0098 -0.0009 0.0131 1390 ARG 144 CB -0.0122 0.0003 0.0134 1391 ARG 144 CG -0.0129 0.0009 0.0130 1392 ARG 144 CD -0.0145 0.0015 0.0136 1393 ARG 144 NE -0.0152 0.0021 0.0132 1394 ARG 144 HE -0.0157 0.0029 0.0124 1395 ARG 144 CZ -0.0152 0.0017 0.0138 1396 ARG 144 NH1 -0.0146 0.0007 0.0148 1397 ARG 144 1HH1 -0.0146 0.0004 0.0152 1398 ARG 144 2HH1 -0.0141 0.0002 0.0151 1399 ARG 144 NH2 -0.0158 0.0024 0.0133 1400 ARG 144 1HH2 -0.0158 0.0021 0.0138 1401 ARG 144 2HH2 -0.0163 0.0032 0.0126 1402 THR 145 N -0.0104 -0.0025 0.0155 1403 THR 145 HN -0.0107 -0.0028 0.0160 1404 THR 145 CA -0.0102 -0.0032 0.0162 1405 THR 145 C -0.0116 -0.0026 0.0164 1406 THR 145 O -0.0127 -0.0019 0.0163 1407 THR 145 CB -0.0100 -0.0044 0.0176 1408 THR 145 OG1 -0.0114 -0.0043 0.0185 1409 THR 145 HG1 -0.0113 -0.0050 0.0194 1410 THR 145 CG2 -0.0088 -0.0050 0.0175 1411 LYS 146 N -0.0114 -0.0029 0.0166 1412 LYS 146 HN -0.0104 -0.0035 0.0167 1413 LYS 146 CA -0.0127 -0.0023 0.0168 1414 LYS 146 C -0.0141 -0.0024 0.0180 1415 LYS 146 O -0.0154 -0.0016 0.0179 1416 LYS 146 CB -0.0123 -0.0027 0.0171 1417 LYS 146 CG -0.0137 -0.0025 0.0177 1418 LYS 146 CD -0.0133 -0.0028 0.0179 1419 LYS 146 CE -0.0132 -0.0019 0.0166 1420 LYS 146 NZ -0.0147 -0.0008 0.0162 1421 LYS 146 HZ1 -0.0146 -0.0001 0.0154 1422 LYS 146 HZ2 -0.0150 -0.0005 0.0161 1423 LYS 146 HZ3 -0.0156 -0.0009 0.0170 1424 ASP 147 N -0.0137 -0.0035 0.0191 1425 ASP 147 HN -0.0127 -0.0041 0.0191 1426 ASP 147 CA -0.0149 -0.0037 0.0203 1427 ASP 147 C -0.0153 -0.0033 0.0201 1428 ASP 147 O -0.0164 -0.0033 0.0210 1429 ASP 147 CB -0.0145 -0.0050 0.0215 1430 ASP 147 CG -0.0142 -0.0054 0.0218 1431 ASP 147 OD1 -0.0151 -0.0048 0.0218 1432 ASP 147 OD2 -0.0131 -0.0064 0.0221 1433 ALA 148 N -0.0146 -0.0029 0.0191 1434 ALA 148 HN -0.0137 -0.0029 0.0184 1435 ALA 148 CA -0.0149 -0.0024 0.0188 1436 ALA 148 C -0.0164 -0.0013 0.0186 1437 ALA 148 O -0.0168 -0.0006 0.0181 1438 ALA 148 CB -0.0138 -0.0022 0.0176 1439 SER 149 N -0.0171 -0.0010 0.0191 1440 SER 149 HN -0.0166 -0.0017 0.0195 1441 SER 149 CA -0.0186 0.0001 0.0190 1442 SER 149 C -0.0184 0.0012 0.0176 1443 SER 149 O -0.0195 0.0023 0.0172 1444 SER 149 CB -0.0196 -0.0003 0.0203 1445 SER 149 OG -0.0188 -0.0010 0.0205 1446 SER 149 HG -0.0194 -0.0013 0.0213 1447 THR 150 N -0.0171 0.0009 0.0169 1448 THR 150 HN -0.0162 -0.0000 0.0172 1449 THR 150 CA -0.0168 0.0018 0.0155 1450 THR 150 C -0.0154 0.0018 0.0143 1451 THR 150 O -0.0143 0.0009 0.0146 1452 THR 150 CB -0.0168 0.0016 0.0157 1453 THR 150 OG1 -0.0156 0.0004 0.0162 1454 THR 150 HG1 -0.0146 0.0003 0.0155 1455 THR 150 CG2 -0.0183 0.0018 0.0168 1456 TRP 151 N -0.0151 0.0026 0.0128 1457 TRP 151 HN -0.0160 0.0032 0.0127 1458 TRP 151 CA -0.0139 0.0027 0.0116 1459 TRP 151 C -0.0132 0.0024 0.0114 1460 TRP 151 O -0.0138 0.0026 0.0116 1461 TRP 151 CB -0.0144 0.0037 0.0104 1462 TRP 151 CG -0.0149 0.0040 0.0104 1463 TRP 151 CD1 -0.0162 0.0045 0.0107 1464 TRP 151 CD2 -0.0141 0.0038 0.0099 1465 TRP 151 NE1 -0.0163 0.0047 0.0105 1466 TRP 151 HE1 -0.0171 0.0050 0.0107 1467 TRP 151 CE2 -0.0150 0.0043 0.0100 1468 TRP 151 CE3 -0.0127 0.0034 0.0094 1469 TRP 151 CZ2 -0.0145 0.0043 0.0096 1470 TRP 151 CZ3 -0.0122 0.0034 0.0091 1471 TRP 151 CH2 -0.0132 0.0038 0.0092 1472 SER 152 N -0.0118 0.0019 0.0110 1473 SER 152 HN -0.0114 0.0018 0.0109 1474 SER 152 CA -0.0110 0.0017 0.0106 1475 SER 152 C -0.0105 0.0023 0.0092 1476 SER 152 O -0.0105 0.0027 0.0085 1477 SER 152 CB -0.0098 0.0006 0.0112 1478 SER 152 OG -0.0102 -0.0000 0.0126 1479 SER 152 HG -0.0094 -0.0007 0.0130 1480 GLN 153 N -0.0099 0.0033 0.0077 1481 GLN 153 HN -0.0099 0.0030 0.0081 1482 GLN 153 CA -0.0096 0.0038 0.0065 1483 GLN 153 C -0.0084 0.0035 0.0060 1484 GLN 153 O -0.0082 0.0031 0.0064 1485 GLN 153 CB -0.0105 0.0047 0.0062 1486 GLN 153 CG -0.0103 0.0054 0.0050 1487 GLN 153 CD -0.0112 0.0062 0.0046 1488 GLN 153 OE1 -0.0119 0.0067 0.0044 1489 GLN 153 NE2 -0.0113 0.0062 0.0046 1490 GLN 153 1HE2 -0.0120 0.0068 0.0044 1491 GLN 153 2HE2 -0.0107 0.0058 0.0048 1492 ILE 154 N -0.0078 0.0037 0.0052 1493 ILE 154 HN -0.0081 0.0041 0.0050 1494 ILE 154 CA -0.0067 0.0035 0.0046 1495 ILE 154 C -0.0069 0.0041 0.0040 1496 ILE 154 O -0.0077 0.0048 0.0036 1497 ILE 154 CB -0.0061 0.0037 0.0038 1498 ILE 154 CG1 -0.0058 0.0032 0.0043 1499 ILE 154 CG2 -0.0050 0.0036 0.0031 1500 ILE 154 CD1 -0.0051 0.0022 0.0051 1501 PRO 155 N -0.0070 0.0040 0.0039 1502 PRO 155 CA -0.0073 0.0045 0.0033 1503 PRO 155 C -0.0073 0.0052 0.0023 1504 PRO 155 O -0.0066 0.0051 0.0017 1505 PRO 155 CB -0.0064 0.0040 0.0033 1506 PRO 155 CG -0.0062 0.0033 0.0043 1507 PRO 155 CD -0.0063 0.0032 0.0044 1508 PRO 156 N -0.0081 0.0058 0.0021 1509 PRO 156 CA -0.0082 0.0065 0.0011 1510 PRO 156 C -0.0075 0.0066 0.0002 1511 PRO 156 O -0.0072 0.0069 -0.0006 1512 PRO 156 CB -0.0093 0.0071 0.0011 1513 PRO 156 CG -0.0098 0.0067 0.0022 1514 PRO 156 CD -0.0091 0.0060 0.0027 1515 GLU 157 N -0.0072 0.0062 0.0008 1516 GLU 157 HN -0.0074 0.0059 0.0014 1517 GLU 157 CA -0.0065 0.0062 0.0001 1518 GLU 157 C -0.0055 0.0059 -0.0001 1519 GLU 157 O -0.0049 0.0060 -0.0008 1520 GLU 157 CB -0.0063 0.0060 0.0003 1521 GLU 157 CG -0.0058 0.0053 0.0011 1522 GLU 157 CD -0.0065 0.0051 0.0020 1523 GLU 157 OE1 -0.0073 0.0053 0.0022 1524 GLU 157 OE2 -0.0062 0.0046 0.0024 1525 ASP 158 N -0.0055 0.0055 0.0005 1526 ASP 158 HN -0.0060 0.0054 0.0010 1527 ASP 158 CA -0.0046 0.0051 0.0004 1528 ASP 158 C -0.0047 0.0055 -0.0001 1529 ASP 158 O -0.0040 0.0053 -0.0003 1530 ASP 158 CB -0.0044 0.0045 0.0013 1531 ASP 158 CG -0.0040 0.0040 0.0017 1532 ASP 158 OD1 -0.0037 0.0041 0.0012 1533 ASP 158 OD2 -0.0042 0.0036 0.0025 1534 THR 159 N -0.0060 0.0067 -0.0002 1535 THR 159 HN -0.0065 0.0067 -0.0000 1536 THR 159 CA -0.0061 0.0069 -0.0008 1537 THR 159 C -0.0067 0.0074 -0.0014 1538 THR 159 O -0.0073 0.0076 -0.0016 1539 THR 159 CB -0.0065 0.0068 -0.0003 1540 THR 159 OG1 -0.0073 0.0069 0.0001 1541 THR 159 HG1 -0.0076 0.0072 -0.0003 1542 THR 159 CG2 -0.0059 0.0064 0.0003 1543 ALA 160 N -0.0065 0.0074 -0.0018 1544 ALA 160 HN -0.0059 0.0072 -0.0016 1545 ALA 160 CA -0.0070 0.0078 -0.0023 1546 ALA 160 C -0.0067 0.0081 -0.0032 1547 ALA 160 O -0.0071 0.0085 -0.0038 1548 ALA 160 CB -0.0071 0.0078 -0.0021 1549 SER 161 N -0.0067 0.0083 -0.0028 1550 SER 161 HN -0.0065 0.0081 -0.0025 1551 SER 161 CA -0.0064 0.0085 -0.0034 1552 SER 161 C -0.0063 0.0086 -0.0036 1553 SER 161 O -0.0061 0.0084 -0.0032 1554 SER 161 CB -0.0059 0.0085 -0.0035 1555 SER 161 OG -0.0058 0.0087 -0.0042 1556 SER 161 HG -0.0054 0.0087 -0.0042 1557 THR 162 N -0.0062 0.0088 -0.0042 1558 THR 162 HN -0.0063 0.0090 -0.0045 1559 THR 162 CA -0.0061 0.0089 -0.0044 1560 THR 162 C -0.0054 0.0087 -0.0042 1561 THR 162 O -0.0049 0.0086 -0.0042 1562 THR 162 CB -0.0061 0.0092 -0.0051 1563 THR 162 OG1 -0.0067 0.0094 -0.0053 1564 THR 162 HG1 -0.0066 0.0096 -0.0057 1565 THR 162 CG2 -0.0060 0.0093 -0.0053 1566 ARG 163 N -0.0039 0.0086 -0.0051 1567 ARG 163 HN -0.0047 0.0089 -0.0049 1568 ARG 163 CA -0.0030 0.0080 -0.0047 1569 ARG 163 C -0.0034 0.0080 -0.0043 1570 ARG 163 O -0.0044 0.0083 -0.0042 1571 ARG 163 CB -0.0027 0.0073 -0.0037 1572 ARG 163 CG -0.0037 0.0072 -0.0028 1573 ARG 163 CD -0.0035 0.0066 -0.0020 1574 ARG 163 NE -0.0025 0.0059 -0.0016 1575 ARG 163 HE -0.0023 0.0058 -0.0014 1576 ARG 163 CZ -0.0017 0.0054 -0.0014 1577 ARG 163 NH1 -0.0018 0.0056 -0.0016 1578 ARG 163 1HH1 -0.0024 0.0061 -0.0019 1579 ARG 163 2HH1 -0.0011 0.0052 -0.0014 1580 ARG 163 NH2 -0.0008 0.0048 -0.0010 1581 ARG 163 1HH2 -0.0007 0.0047 -0.0008 1582 ARG 163 2HH2 -0.0002 0.0045 -0.0008 1583 SER 164 N -0.0026 0.0075 -0.0042 1584 SER 164 HN -0.0018 0.0072 -0.0043 1585 SER 164 CA -0.0029 0.0075 -0.0038 1586 SER 164 C -0.0025 0.0067 -0.0028 1587 SER 164 O -0.0025 0.0066 -0.0026 1588 SER 164 CB -0.0025 0.0078 -0.0048 1589 SER 164 OG -0.0014 0.0077 -0.0053 1590 SER 164 HG -0.0011 0.0079 -0.0059 1591 SER 165 N -0.0012 0.0061 -0.0029 1592 SER 165 HN -0.0012 0.0063 -0.0032 1593 SER 165 CA -0.0009 0.0053 -0.0019 1594 SER 165 C -0.0009 0.0049 -0.0013 1595 SER 165 O -0.0008 0.0052 -0.0018 1596 SER 165 CB 0.0004 0.0048 -0.0021 1597 SER 165 OG 0.0012 0.0046 -0.0026 1598 SER 165 HG 0.0020 0.0043 -0.0027 1599 PHE 166 N -0.0010 0.0043 -0.0002 1600 PHE 166 HN -0.0011 0.0041 0.0002 1601 PHE 166 CA -0.0010 0.0038 0.0005 1602 PHE 166 C -0.0008 0.0030 0.0016 1603 PHE 166 O -0.0013 0.0029 0.0021 1604 PHE 166 CB -0.0022 0.0043 0.0007 1605 PHE 166 CG -0.0022 0.0040 0.0013 1606 PHE 166 CD1 -0.0025 0.0034 0.0024 1607 PHE 166 CD2 -0.0020 0.0042 0.0006 1608 PHE 166 CE1 -0.0025 0.0030 0.0029 1609 PHE 166 CE2 -0.0020 0.0039 0.0011 1610 PHE 166 CZ -0.0022 0.0033 0.0023 1611 THR 167 N 0.0013 0.0016 0.0019 1612 THR 167 HN 0.0019 0.0018 0.0013 1613 THR 167 CA 0.0017 0.0006 0.0031 1614 THR 167 C 0.0009 0.0002 0.0042 1615 THR 167 O 0.0011 0.0001 0.0042 1616 THR 167 CB 0.0033 -0.0000 0.0030 1617 THR 167 OG1 0.0040 0.0003 0.0020 1618 THR 167 HG1 0.0050 -0.0001 0.0019 1619 THR 167 CG2 0.0036 -0.0011 0.0042 1620 VAL 168 N -0.0000 -0.0000 0.0052 1621 VAL 168 HN -0.0002 0.0001 0.0051 1622 VAL 168 CA -0.0008 -0.0005 0.0063 1623 VAL 168 C 0.0001 -0.0016 0.0073 1624 VAL 168 O 0.0006 -0.0020 0.0076 1625 VAL 168 CB -0.0022 -0.0002 0.0069 1626 VAL 168 CG1 -0.0031 -0.0006 0.0080 1627 VAL 168 CG2 -0.0031 0.0009 0.0059 1628 GLN 169 N 0.0009 -0.0026 0.0077 1629 GLN 169 HN 0.0005 -0.0021 0.0074 1630 GLN 169 CA 0.0019 -0.0038 0.0087 1631 GLN 169 C 0.0010 -0.0043 0.0102 1632 GLN 169 O -0.0004 -0.0038 0.0105 1633 GLN 169 CB 0.0032 -0.0040 0.0081 1634 GLN 169 CG 0.0041 -0.0034 0.0066 1635 GLN 169 CD 0.0051 -0.0034 0.0058 1636 GLN 169 OE1 0.0046 -0.0026 0.0050 1637 GLN 169 NE2 0.0065 -0.0042 0.0061 1638 GLN 169 1HE2 0.0069 -0.0049 0.0068 1639 GLN 169 2HE2 0.0071 -0.0042 0.0056 1640 ASP 170 N 0.0019 -0.0054 0.0112 1641 ASP 170 HN 0.0030 -0.0058 0.0109 1642 ASP 170 CA 0.0012 -0.0061 0.0127 1643 ASP 170 C -0.0001 -0.0060 0.0135 1644 ASP 170 O -0.0012 -0.0061 0.0144 1645 ASP 170 CB 0.0007 -0.0058 0.0126 1646 ASP 170 CG 0.0008 -0.0067 0.0140 1647 ASP 170 OD1 0.0013 -0.0076 0.0149 1648 ASP 170 OD2 0.0003 -0.0066 0.0140 1649 LEU 171 N 0.0002 -0.0061 0.0133 1650 LEU 171 HN 0.0012 -0.0061 0.0125 1651 LEU 171 CA -0.0010 -0.0060 0.0143 1652 LEU 171 C -0.0005 -0.0073 0.0157 1653 LEU 171 O 0.0009 -0.0081 0.0156 1654 LEU 171 CB -0.0012 -0.0053 0.0133 1655 LEU 171 CG -0.0017 -0.0040 0.0119 1656 LEU 171 CD1 -0.0019 -0.0034 0.0112 1657 LEU 171 CD2 -0.0032 -0.0034 0.0123 1658 LYS 172 N -0.0016 -0.0074 0.0169 1659 LYS 172 HN -0.0027 -0.0067 0.0168 1660 LYS 172 CA -0.0013 -0.0085 0.0183 1661 LYS 172 C -0.0005 -0.0088 0.0180 1662 LYS 172 O -0.0008 -0.0080 0.0171 1663 LYS 172 CB -0.0028 -0.0085 0.0196 1664 LYS 172 CG -0.0035 -0.0085 0.0203 1665 LYS 172 CD -0.0050 -0.0085 0.0216 1666 LYS 172 CE -0.0064 -0.0073 0.0210 1667 LYS 172 NZ -0.0079 -0.0072 0.0222 1668 LYS 172 HZ1 -0.0088 -0.0063 0.0218 1669 LYS 172 HZ2 -0.0081 -0.0074 0.0228 1670 LYS 172 HZ3 -0.0078 -0.0078 0.0231 1671 PRO 173 N 0.0002 -0.0109 0.0196 1672 PRO 173 CA 0.0010 -0.0112 0.0195 1673 PRO 173 C -0.0002 -0.0111 0.0203 1674 PRO 173 O -0.0015 -0.0112 0.0214 1675 PRO 173 CB 0.0025 -0.0127 0.0203 1676 PRO 173 CG 0.0028 -0.0128 0.0202 1677 PRO 173 CD 0.0010 -0.0120 0.0206 1678 PHE 174 N 0.0001 -0.0109 0.0196 1679 PHE 174 HN 0.0012 -0.0108 0.0187 1680 PHE 174 CA -0.0009 -0.0107 0.0202 1681 PHE 174 C -0.0029 -0.0099 0.0206 1682 PHE 174 O -0.0039 -0.0103 0.0219 1683 PHE 174 CB -0.0005 -0.0121 0.0217 1684 PHE 174 CG -0.0009 -0.0120 0.0220 1685 PHE 174 CD1 -0.0006 -0.0113 0.0207 1686 PHE 174 CD2 -0.0017 -0.0127 0.0236 1687 PHE 174 CE1 -0.0010 -0.0112 0.0210 1688 PHE 174 CE2 -0.0021 -0.0127 0.0239 1689 PHE 174 CZ -0.0018 -0.0119 0.0226 1690 THR 175 N -0.0027 -0.0080 0.0184 1691 THR 175 HN -0.0019 -0.0078 0.0175 1692 THR 175 CA -0.0044 -0.0074 0.0185 1693 THR 175 C -0.0049 -0.0062 0.0171 1694 THR 175 O -0.0040 -0.0058 0.0159 1695 THR 175 CB -0.0048 -0.0074 0.0187 1696 THR 175 OG1 -0.0043 -0.0085 0.0200 1697 THR 175 HG1 -0.0045 -0.0086 0.0202 1698 THR 175 CG2 -0.0065 -0.0068 0.0189 1699 GLU 176 N -0.0064 -0.0057 0.0172 1700 GLU 176 HN -0.0071 -0.0061 0.0182 1701 GLU 176 CA -0.0070 -0.0046 0.0159 1702 GLU 176 C -0.0079 -0.0039 0.0154 1703 GLU 176 O -0.0089 -0.0041 0.0163 1704 GLU 176 CB -0.0082 -0.0044 0.0163 1705 GLU 176 CG -0.0087 -0.0032 0.0150 1706 GLU 176 CD -0.0094 -0.0031 0.0152 1707 GLU 176 OE1 -0.0098 -0.0038 0.0165 1708 GLU 176 OE2 -0.0097 -0.0023 0.0141 1709 TYR 177 N -0.0068 -0.0027 0.0135 1710 TYR 177 HN -0.0060 -0.0027 0.0129 1711 TYR 177 CA -0.0075 -0.0020 0.0128 1712 TYR 177 C -0.0082 -0.0009 0.0117 1713 TYR 177 O -0.0077 -0.0006 0.0110 1714 TYR 177 CB -0.0063 -0.0021 0.0122 1715 TYR 177 CG -0.0058 -0.0030 0.0132 1716 TYR 177 CD1 -0.0066 -0.0029 0.0136 1717 TYR 177 CD2 -0.0046 -0.0040 0.0138 1718 TYR 177 CE1 -0.0061 -0.0038 0.0146 1719 TYR 177 CE2 -0.0042 -0.0048 0.0148 1720 TYR 177 CZ -0.0050 -0.0047 0.0152 1721 TYR 177 OH -0.0046 -0.0056 0.0162 1722 TYR 177 HH -0.0051 -0.0055 0.0164 1723 VAL 178 N -0.0095 -0.0003 0.0116 1724 VAL 178 HN -0.0099 -0.0005 0.0123 1725 VAL 178 CA -0.0104 0.0008 0.0106 1726 VAL 178 C -0.0102 0.0014 0.0096 1727 VAL 178 O -0.0102 0.0011 0.0101 1728 VAL 178 CB -0.0121 0.0011 0.0113 1729 VAL 178 CG1 -0.0129 0.0022 0.0103 1730 VAL 178 CG2 -0.0123 0.0004 0.0126 1731 PHE 179 N -0.0093 0.0025 0.0075 1732 PHE 179 HN -0.0094 0.0027 0.0073 1733 PHE 179 CA -0.0091 0.0031 0.0066 1734 PHE 179 C -0.0099 0.0041 0.0058 1735 PHE 179 O -0.0105 0.0045 0.0058 1736 PHE 179 CB -0.0077 0.0029 0.0058 1737 PHE 179 CG -0.0067 0.0019 0.0064 1738 PHE 179 CD1 -0.0064 0.0013 0.0070 1739 PHE 179 CD2 -0.0060 0.0016 0.0064 1740 PHE 179 CE1 -0.0054 0.0004 0.0076 1741 PHE 179 CE2 -0.0051 0.0007 0.0069 1742 PHE 179 CZ -0.0048 0.0001 0.0075 1743 ARG 180 N -0.0101 0.0047 0.0052 1744 ARG 180 HN -0.0096 0.0043 0.0054 1745 ARG 180 CA -0.0108 0.0057 0.0044 1746 ARG 180 C -0.0104 0.0061 0.0036 1747 ARG 180 O -0.0098 0.0056 0.0039 1748 ARG 180 CB -0.0123 0.0060 0.0050 1749 ARG 180 CG -0.0127 0.0058 0.0056 1750 ARG 180 CD -0.0141 0.0061 0.0061 1751 ARG 180 NE -0.0146 0.0061 0.0065 1752 ARG 180 HE -0.0139 0.0058 0.0064 1753 ARG 180 CZ -0.0158 0.0064 0.0070 1754 ARG 180 NH1 -0.0167 0.0067 0.0071 1755 ARG 180 1HH1 -0.0164 0.0068 0.0069 1756 ARG 180 2HH1 -0.0176 0.0070 0.0075 1757 ARG 180 NH2 -0.0162 0.0063 0.0073 1758 ARG 180 1HH2 -0.0155 0.0060 0.0072 1759 ARG 180 2HH2 -0.0171 0.0065 0.0076 1760 ILE 181 N -0.0103 0.0071 0.0011 1761 ILE 181 HN -0.0106 0.0073 0.0010 1762 ILE 181 CA -0.0099 0.0074 0.0004 1763 ILE 181 C -0.0106 0.0081 -0.0001 1764 ILE 181 O -0.0110 0.0085 -0.0003 1765 ILE 181 CB -0.0089 0.0072 -0.0001 1766 ILE 181 CG1 -0.0085 0.0075 -0.0007 1767 ILE 181 CG2 -0.0089 0.0075 -0.0005 1768 ILE 181 CD1 -0.0075 0.0073 -0.0012 1769 ARG 182 N -0.0106 0.0084 -0.0004 1770 ARG 182 HN -0.0103 0.0081 -0.0003 1771 ARG 182 CA -0.0112 0.0091 -0.0010 1772 ARG 182 C -0.0106 0.0094 -0.0017 1773 ARG 182 O -0.0099 0.0089 -0.0016 1774 ARG 182 CB -0.0121 0.0093 -0.0006 1775 ARG 182 CG -0.0121 0.0090 -0.0002 1776 ARG 182 CD -0.0131 0.0092 0.0002 1777 ARG 182 NE -0.0131 0.0090 0.0005 1778 ARG 182 HE -0.0124 0.0087 0.0004 1779 ARG 182 CZ -0.0138 0.0092 0.0008 1780 ARG 182 NH1 -0.0147 0.0096 0.0008 1781 ARG 182 1HH1 -0.0153 0.0097 0.0011 1782 ARG 182 2HH1 -0.0147 0.0097 0.0007 1783 ARG 182 NH2 -0.0138 0.0090 0.0010 1784 ARG 182 1HH2 -0.0144 0.0091 0.0012 1785 ARG 182 2HH2 -0.0132 0.0087 0.0009 1786 CYS 183 N -0.0109 0.0098 -0.0031 1787 CYS 183 HN -0.0112 0.0099 -0.0032 1788 CYS 183 CA -0.0106 0.0099 -0.0033 1789 CYS 183 C -0.0110 0.0101 -0.0036 1790 CYS 183 O -0.0114 0.0103 -0.0036 1791 CYS 183 CB -0.0102 0.0100 -0.0036 1792 CYS 183 SG -0.0105 0.0103 -0.0040 1793 MET 184 N -0.0108 0.0102 -0.0037 1794 MET 184 HN -0.0105 0.0101 -0.0037 1795 MET 184 CA -0.0111 0.0104 -0.0040 1796 MET 184 C -0.0107 0.0105 -0.0042 1797 MET 184 O -0.0103 0.0104 -0.0041 1798 MET 184 CB -0.0115 0.0103 -0.0037 1799 MET 184 CG -0.0113 0.0101 -0.0035 1800 MET 184 SD -0.0118 0.0101 -0.0033 1801 MET 184 CE -0.0119 0.0104 -0.0038 1802 LYS 185 N -0.0111 0.0100 -0.0040 1803 LYS 185 HN -0.0113 0.0100 -0.0041 1804 LYS 185 CA -0.0111 0.0100 -0.0041 1805 LYS 185 C -0.0110 0.0100 -0.0039 1806 LYS 185 O -0.0112 0.0100 -0.0037 1807 LYS 185 CB -0.0113 0.0100 -0.0043 1808 LYS 185 CG -0.0112 0.0101 -0.0045 1809 LYS 185 CD -0.0115 0.0101 -0.0047 1810 LYS 185 CE -0.0114 0.0101 -0.0049 1811 LYS 185 NZ -0.0114 0.0101 -0.0048 1812 LYS 185 HZ1 -0.0113 0.0101 -0.0049 1813 LYS 185 HZ2 -0.0112 0.0101 -0.0046 1814 LYS 185 HZ3 -0.0115 0.0101 -0.0047 1815 GLU 186 N -0.0108 0.0100 -0.0039 1816 GLU 186 HN -0.0107 0.0100 -0.0041 1817 GLU 186 CA -0.0108 0.0100 -0.0037 1818 GLU 186 C -0.0110 0.0100 -0.0036 1819 GLU 186 O -0.0110 0.0100 -0.0034 1820 GLU 186 CB -0.0105 0.0099 -0.0039 1821 GLU 186 CG -0.0106 0.0100 -0.0041 1822 GLU 186 CD -0.0105 0.0099 -0.0041 1823 GLU 186 OE1 -0.0103 0.0099 -0.0040 1824 GLU 186 OE2 -0.0105 0.0100 -0.0044 1825 ASP 187 N -0.0115 0.0103 -0.0037 1826 ASP 187 HN -0.0115 0.0102 -0.0039 1827 ASP 187 CA -0.0118 0.0103 -0.0036 1828 ASP 187 C -0.0119 0.0104 -0.0035 1829 ASP 187 O -0.0122 0.0104 -0.0034 1830 ASP 187 CB -0.0121 0.0101 -0.0038 1831 ASP 187 CG -0.0121 0.0100 -0.0041 1832 ASP 187 OD1 -0.0119 0.0100 -0.0041 1833 ASP 187 OD2 -0.0122 0.0098 -0.0043 1834 GLY 188 N -0.0117 0.0104 -0.0035 1835 GLY 188 HN -0.0115 0.0104 -0.0036 1836 GLY 188 CA -0.0118 0.0105 -0.0034 1837 GLY 188 C -0.0120 0.0103 -0.0036 1838 GLY 188 O -0.0121 0.0103 -0.0036 1839 LYS 189 N -0.0121 0.0103 -0.0041 1840 LYS 189 HN -0.0121 0.0103 -0.0041 1841 LYS 189 CA -0.0122 0.0101 -0.0042 1842 LYS 189 C -0.0120 0.0100 -0.0044 1843 LYS 189 O -0.0119 0.0099 -0.0045 1844 LYS 189 CB -0.0124 0.0100 -0.0042 1845 LYS 189 CG -0.0127 0.0100 -0.0041 1846 LYS 189 CD -0.0129 0.0099 -0.0041 1847 LYS 189 CE -0.0131 0.0100 -0.0039 1848 LYS 189 NZ -0.0132 0.0100 -0.0039 1849 LYS 189 HZ1 -0.0134 0.0100 -0.0038 1850 LYS 189 HZ2 -0.0133 0.0098 -0.0040 1851 LYS 189 HZ3 -0.0131 0.0101 -0.0039 1852 GLY 190 N -0.0118 0.0100 -0.0044 1853 GLY 190 HN -0.0119 0.0101 -0.0043 1854 GLY 190 CA -0.0116 0.0100 -0.0045 1855 GLY 190 C -0.0115 0.0101 -0.0045 1856 GLY 190 O -0.0116 0.0102 -0.0044 1857 TYR 191 N -0.0117 0.0102 -0.0041 1858 TYR 191 HN -0.0116 0.0104 -0.0042 1859 TYR 191 CA -0.0118 0.0102 -0.0041 1860 TYR 191 C -0.0116 0.0103 -0.0040 1861 TYR 191 O -0.0115 0.0105 -0.0042 1862 TYR 191 CB -0.0120 0.0101 -0.0043 1863 TYR 191 CG -0.0121 0.0100 -0.0044 1864 TYR 191 CD1 -0.0121 0.0101 -0.0045 1865 TYR 191 CD2 -0.0123 0.0098 -0.0043 1866 TYR 191 CE1 -0.0123 0.0099 -0.0045 1867 TYR 191 CE2 -0.0125 0.0097 -0.0043 1868 TYR 191 CZ -0.0125 0.0097 -0.0045 1869 TYR 191 OH -0.0127 0.0096 -0.0045 1870 TYR 191 HH -0.0128 0.0095 -0.0044 1871 TRP 192 N -0.0116 0.0102 -0.0039 1872 TRP 192 HN -0.0117 0.0101 -0.0038 1873 TRP 192 CA -0.0114 0.0104 -0.0039 1874 TRP 192 C -0.0115 0.0105 -0.0042 1875 TRP 192 O -0.0117 0.0104 -0.0043 1876 TRP 192 CB -0.0115 0.0102 -0.0037 1877 TRP 192 CG -0.0114 0.0102 -0.0034 1878 TRP 192 CD1 -0.0115 0.0100 -0.0032 1879 TRP 192 CD2 -0.0111 0.0103 -0.0033 1880 TRP 192 NE1 -0.0113 0.0100 -0.0030 1881 TRP 192 HE1 -0.0114 0.0099 -0.0028 1882 TRP 192 CE2 -0.0111 0.0102 -0.0030 1883 TRP 192 CE3 -0.0110 0.0105 -0.0033 1884 TRP 192 CZ2 -0.0109 0.0103 -0.0028 1885 TRP 192 CZ3 -0.0108 0.0106 -0.0032 1886 TRP 192 CH2 -0.0107 0.0105 -0.0029 1887 SER 193 N -0.0128 0.0103 -0.0034 1888 SER 193 HN -0.0122 0.0102 -0.0034 1889 SER 193 CA -0.0130 0.0106 -0.0036 1890 SER 193 C -0.0134 0.0101 -0.0031 1891 SER 193 O -0.0134 0.0097 -0.0026 1892 SER 193 CB -0.0124 0.0106 -0.0038 1893 SER 193 OG -0.0120 0.0102 -0.0034 1894 SER 193 HG -0.0117 0.0102 -0.0035 1895 ASP 194 N -0.0139 0.0103 -0.0031 1896 ASP 194 HN -0.0139 0.0107 -0.0035 1897 ASP 194 CA -0.0142 0.0099 -0.0027 1898 ASP 194 C -0.0136 0.0095 -0.0024 1899 ASP 194 O -0.0130 0.0097 -0.0027 1900 ASP 194 CB -0.0147 0.0102 -0.0028 1901 ASP 194 CG -0.0154 0.0105 -0.0030 1902 ASP 194 OD1 -0.0157 0.0104 -0.0028 1903 ASP 194 OD2 -0.0156 0.0109 -0.0034 1904 TRP 195 N -0.0152 0.0094 0.0002 1905 TRP 195 HN -0.0159 0.0094 0.0006 1906 TRP 195 CA -0.0142 0.0089 0.0007 1907 TRP 195 C -0.0137 0.0089 0.0002 1908 TRP 195 O -0.0142 0.0092 0.0000 1909 TRP 195 CB -0.0145 0.0084 0.0018 1910 TRP 195 CG -0.0148 0.0082 0.0023 1911 TRP 195 CD1 -0.0158 0.0083 0.0027 1912 TRP 195 CD2 -0.0142 0.0079 0.0025 1913 TRP 195 NE1 -0.0158 0.0081 0.0031 1914 TRP 195 HE1 -0.0165 0.0082 0.0035 1915 TRP 195 CE2 -0.0148 0.0079 0.0030 1916 TRP 195 CE3 -0.0131 0.0077 0.0023 1917 TRP 195 CZ2 -0.0144 0.0076 0.0033 1918 TRP 195 CZ3 -0.0127 0.0074 0.0025 1919 TRP 195 CH2 -0.0134 0.0074 0.0031 1920 SER 196 N -0.0127 0.0086 0.0001 1921 SER 196 HN -0.0123 0.0084 0.0003 1922 SER 196 CA -0.0121 0.0086 -0.0003 1923 SER 196 C -0.0122 0.0083 0.0005 1924 SER 196 O -0.0128 0.0081 0.0013 1925 SER 196 CB -0.0109 0.0083 -0.0004 1926 SER 196 OG -0.0105 0.0078 0.0005 1927 SER 196 HG -0.0098 0.0076 0.0004 1928 GLU 197 N -0.0135 0.0083 0.0008 1929 GLU 197 HN -0.0129 0.0086 -0.0002 1930 GLU 197 CA -0.0137 0.0077 0.0019 1931 GLU 197 C -0.0127 0.0067 0.0029 1932 GLU 197 O -0.0116 0.0065 0.0024 1933 GLU 197 CB -0.0131 0.0078 0.0013 1934 GLU 197 CG -0.0141 0.0087 0.0005 1935 GLU 197 CD -0.0156 0.0089 0.0014 1936 GLU 197 OE1 -0.0157 0.0083 0.0024 1937 GLU 197 OE2 -0.0167 0.0095 0.0011 1938 GLU 198 N -0.0132 0.0062 0.0042 1939 GLU 198 HN -0.0142 0.0064 0.0046 1940 GLU 198 CA -0.0123 0.0052 0.0053 1941 GLU 198 C -0.0110 0.0047 0.0051 1942 GLU 198 O -0.0111 0.0049 0.0048 1943 GLU 198 CB -0.0133 0.0047 0.0067 1944 GLU 198 CG -0.0145 0.0051 0.0070 1945 GLU 198 CD -0.0155 0.0047 0.0085 1946 GLU 198 OE1 -0.0152 0.0041 0.0093 1947 GLU 198 OE2 -0.0166 0.0050 0.0088 1948 ALA 199 N -0.0108 0.0047 0.0056 1949 ALA 199 HN -0.0107 0.0046 0.0058 1950 ALA 199 CA -0.0095 0.0041 0.0056 1951 ALA 199 C -0.0090 0.0029 0.0067 1952 ALA 199 O -0.0090 0.0027 0.0071 1953 ALA 199 CB -0.0083 0.0045 0.0043 1954 SER 200 N -0.0085 0.0022 0.0073 1955 SER 200 HN -0.0085 0.0025 0.0070 1956 SER 200 CA -0.0080 0.0010 0.0085 1957 SER 200 C -0.0064 0.0003 0.0083 1958 SER 200 O -0.0058 0.0007 0.0074 1959 SER 200 CB -0.0090 0.0006 0.0097 1960 SER 200 OG -0.0105 0.0012 0.0099 1961 SER 200 HG -0.0111 0.0010 0.0106 1962 GLY 201 N -0.0062 -0.0004 0.0099 1963 GLY 201 HN -0.0068 -0.0007 0.0106 1964 GLY 201 CA -0.0045 -0.0012 0.0099 1965 GLY 201 C -0.0043 -0.0025 0.0113 1966 GLY 201 O -0.0051 -0.0027 0.0121 1967 ILE 202 N -0.0031 -0.0034 0.0117 1968 ILE 202 HN -0.0024 -0.0032 0.0110 1969 ILE 202 CA -0.0028 -0.0046 0.0131 1970 ILE 202 C -0.0011 -0.0053 0.0129 1971 ILE 202 O 0.0001 -0.0053 0.0121 1972 ILE 202 CB -0.0032 -0.0052 0.0140 1973 ILE 202 CG1 -0.0048 -0.0044 0.0140 1974 ILE 202 CG2 -0.0031 -0.0065 0.0155 1975 ILE 202 CD1 -0.0052 -0.0048 0.0148 1976 THR 203 N -0.0013 -0.0057 0.0140 1977 THR 203 HN -0.0025 -0.0056 0.0146 1978 THR 203 CA 0.0005 -0.0065 0.0139 1979 THR 203 C 0.0016 -0.0077 0.0148 1980 THR 203 O 0.0007 -0.0081 0.0158 1981 THR 203 CB 0.0005 -0.0070 0.0146 1982 THR 203 OG1 -0.0008 -0.0076 0.0162 1983 THR 203 HG1 -0.0009 -0.0080 0.0166 1984 THR 203 CG2 -0.0000 -0.0059 0.0135 1985 TYR 204 N 0.0034 -0.0081 0.0143 1986 TYR 204 HN 0.0040 -0.0077 0.0133 1987 TYR 204 CA 0.0046 -0.0093 0.0150 1988 TYR 204 C 0.0044 -0.0106 0.0167 1989 TYR 204 O 0.0037 -0.0106 0.0172 1990 TYR 204 CB 0.0067 -0.0095 0.0141 1991 TYR 204 CG 0.0073 -0.0085 0.0124 1992 TYR 204 CD1 0.0069 -0.0081 0.0121 1993 TYR 204 CD2 0.0083 -0.0079 0.0110 1994 TYR 204 CE1 0.0076 -0.0073 0.0106 1995 TYR 204 CE2 0.0089 -0.0071 0.0095 1996 TYR 204 CZ 0.0086 -0.0067 0.0093 1997 TYR 204 OH 0.0092 -0.0058 0.0078 1998 TYR 204 HH 0.0099 -0.0055 0.0069 1999 GLU 205 N 0.0039 -0.0119 0.0178 2000 GLU 205 HN 0.0046 -0.0116 0.0171 2001 GLU 205 CA 0.0038 -0.0142 0.0203 2002 GLU 205 C 0.0065 -0.0152 0.0203 2003 GLU 205 O 0.0088 -0.0146 0.0185 2004 GLU 205 CB 0.0040 -0.0155 0.0217 2005 GLU 205 CG 0.0011 -0.0152 0.0226 2006 GLU 205 CD 0.0014 -0.0165 0.0239 2007 GLU 205 OE1 0.0036 -0.0182 0.0249 2008 GLU 205 OE2 -0.0004 -0.0157 0.0239 2009 ASP 206 N 0.0064 -0.0168 0.0221 2010 ASP 206 HN 0.0044 -0.0172 0.0235 2011 ASP 206 CA 0.0089 -0.0179 0.0222 2012 ASP 206 C 0.0111 -0.0198 0.0233 2013 ASP 206 O 0.0106 -0.0216 0.0255 2014 ASP 206 CB 0.0078 -0.0188 0.0237 2015 ASP 206 CG 0.0102 -0.0195 0.0233 2016 ASP 206 OD1 0.0129 -0.0198 0.0224 2017 ASP 206 OD2 0.0094 -0.0198 0.0240 2018 ARG 207 N 0.0160 -0.0211 0.0226 2019 ARG 207 HN 0.0170 -0.0182 0.0209 2020 ARG 207 CA 0.0182 -0.0239 0.0233 2021 ARG 207 C 0.0210 -0.0278 0.0243 2022 ARG 207 O 0.0208 -0.0312 0.0261 2023 ARG 207 CB 0.0211 -0.0215 0.0211 2024 ARG 207 CG 0.0185 -0.0183 0.0204 2025 ARG 207 CD 0.0215 -0.0158 0.0180 2026 ARG 207 NE 0.0191 -0.0130 0.0174 2027 ARG 207 HE 0.0158 -0.0132 0.0187 2028 ARG 207 CZ 0.0208 -0.0102 0.0154 2029 ARG 207 NH1 0.0251 -0.0098 0.0137 2030 ARG 207 1HH1 0.0270 -0.0117 0.0140 2031 ARG 207 2HH1 0.0264 -0.0077 0.0122 2032 ARG 207 NH2 0.0183 -0.0078 0.0151 2033 ARG 207 1HH2 0.0150 -0.0081 0.0164 2034 ARG 207 2HH2 0.0196 -0.0057 0.0135 2035 PRO 208 N 0.0236 -0.0272 0.0231 2036 PRO 208 HN 0.0236 -0.0243 0.0216 2037 PRO 208 CA 0.0264 -0.0307 0.0239 2038 PRO 208 C 0.0237 -0.0339 0.0264 2039 PRO 208 O 0.0252 -0.0376 0.0278 2040 PRO 208 CB 0.0292 -0.0291 0.0221 2041 SER 209 N 0.0188 -0.0303 0.0288 2042 SER 209 HN 0.0173 -0.0265 0.0266 2043 SER 209 CA 0.0150 -0.0323 0.0337 2044 SER 209 C 0.0139 -0.0360 0.0380 2045 SER 209 O 0.0135 -0.0400 0.0419 2046 SER 209 CB 0.0096 -0.0276 0.0339 2047 LYS 210 N 0.0133 -0.0347 0.0372 2048 LYS 210 HN 0.0136 -0.0313 0.0339 2049 LYS 210 CA 0.0123 -0.0380 0.0410 2050 LYS 210 C 0.0174 -0.0432 0.0416 2051 LYS 210 O 0.0169 -0.0474 0.0457 2052 LYS 210 CB 0.0108 -0.0350 0.0395 2053 GLU 211 N 0.0220 -0.0441 0.0379 2054 GLU 211 HN 0.0221 -0.0404 0.0347 2055 GLU 211 CA 0.0273 -0.0490 0.0377 2056 GLU 211 C 0.0281 -0.0527 0.0403 2057 GLU 211 O 0.0294 -0.0577 0.0435 2058 GLU 211 CB 0.0323 -0.0473 0.0322 2059 GLU 211 CG 0.0327 -0.0444 0.0294 2060 GLU 211 CD 0.0371 -0.0420 0.0238 2061 GLU 211 OE1 0.0401 -0.0429 0.0220 2062 GLU 211 OE2 0.0375 -0.0393 0.0211 2063 PRO 212 N 0.0274 -0.0503 0.0388 2064 PRO 212 HN 0.0264 -0.0462 0.0361 2065 PRO 212 CA 0.0280 -0.0534 0.0409 2066 PRO 212 C 0.0237 -0.0558 0.0466 2067 PRO 212 O 0.0246 -0.0599 0.0493 2068 PRO 212 CB 0.0277 -0.0497 0.0381 2069 SER 213 N 0.0190 -0.0535 0.0496 2070 SER 213 HN 0.0184 -0.0497 0.0468 2071 SER 213 CA 0.0140 -0.0556 0.0559 2072 SER 213 C 0.0156 -0.0612 0.0594 2073 SER 213 O 0.0142 -0.0655 0.0645 2074 SER 213 CB 0.0077 -0.0501 0.0567 2075 PHE 214 N 0.0185 -0.0612 0.0568 2076 PHE 214 HN 0.0195 -0.0574 0.0526 2077 PHE 214 CA 0.0204 -0.0663 0.0596 2078 PHE 214 C 0.0259 -0.0722 0.0599 2079 PHE 214 O 0.0264 -0.0775 0.0642 2080 PHE 214 CB 0.0222 -0.0644 0.0562 2081 TRP 215 N 0.0299 -0.0712 0.0556 2082 TRP 215 HN 0.0291 -0.0665 0.0522 2083 TRP 215 CA 0.0358 -0.0764 0.0555 2084 TRP 215 C 0.0340 -0.0799 0.0599 2085 TRP 215 O 0.0369 -0.0859 0.0628 2086 TRP 215 CB 0.0409 -0.0738 0.0492 2087 TRP 215 OXT 0.0296 -0.0765 0.0604