USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1011 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 MET CE :methyl 174:sc= -4.86 (180deg=-3.36) USER MOD Set 1.2: A 91 GLN : amide:sc= -2.7 K(o=-8,f=-8.9!) USER MOD Set 1.3: A 106 MET CE :methyl -160:sc= -0.461 (180deg=-0.655) USER MOD Set 2.1: A 25 LYS NZ :NH3+ -108:sc= 0.0986 (180deg=0) USER MOD Set 2.2: A 111 HIS : no HD1:sc= 0.0697 X(o=0.17,f=-0.27) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.011) USER MOD Single : A 15 MET CE :methyl -168:sc= -0.102 (180deg=-0.407) USER MOD Single : A 26 ASN : amide:sc= -0.371 X(o=-0.37,f=-0.25) USER MOD Single : A 29 SER OG : rot -43:sc= 1.12 USER MOD Single : A 30 GLN : amide:sc= -0.729 X(o=-0.73,f=-0.57) USER MOD Single : A 36 TYR OH : rot -23:sc= -0.387 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.117 X(o=-0.12,f=-0.38) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -178:sc= 0.0739 (180deg=0.072) USER MOD Single : A 53 SER OG : rot 76:sc= 0.931 USER MOD Single : A 60 SER OG : rot -110:sc= -1.28 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -127:sc= 0.323 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.00867 USER MOD Single : A 72 THR OG1 : rot 67:sc= 1.35 USER MOD Single : A 73 GLN : amide:sc= -3.44 K(o=-3.4,f=-6.9!) USER MOD Single : A 74 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0272) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0259 F(o=-1.1,f=-0.026) USER MOD Single : A 86 LYS NZ :NH3+ -153:sc= -0.347 (180deg=-1.43) USER MOD Single : A 92 GLN : amide:sc= -1.6! C(o=-1.6!,f=-8.8!) USER MOD Single : A 93 ASN : amide:sc= -0.55 X(o=-0.55,f=-0.86) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.75 X(o=-0.75,f=-0.31) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -64:sc= -0.0376 USER MOD Single : A 112 THR OG1 : rot -170:sc= -0.112 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -0.386 K(o=-0.39,f=-1.3) USER MOD Single : A 126 GLN : amide:sc= -1.64 K(o=-1.6,f=-3.3!) USER MOD Single : A 128 LYS NZ :NH3+ 163:sc= -0.166 (180deg=-0.166) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.626 -8.711 -8.786 1.00 23.35 N ATOM 107 CA ASP A 8 18.402 -9.839 -9.289 1.00 2.05 C ATOM 108 C ASP A 8 17.701 -10.495 -10.474 1.00 22.43 C ATOM 109 O ASP A 8 16.518 -10.257 -10.719 1.00 12.22 O ATOM 110 CB ASP A 8 18.626 -10.867 -8.179 1.00 34.43 C ATOM 111 CG ASP A 8 19.918 -10.631 -7.422 1.00 61.43 C ATOM 112 OD1 ASP A 8 20.245 -9.455 -7.159 1.00 25.23 O ATOM 113 OD2 ASP A 8 20.602 -11.623 -7.093 1.00 52.11 O ATOM 0 HA ASP A 8 19.368 -9.463 -9.625 1.00 2.05 H new ATOM 0 HB2 ASP A 8 17.789 -10.833 -7.482 1.00 34.43 H new ATOM 0 HB3 ASP A 8 18.640 -11.867 -8.612 1.00 34.43 H new ATOM 118 N LEU A 9 18.439 -11.322 -11.207 1.00 34.22 N ATOM 119 CA LEU A 9 17.888 -12.013 -12.368 1.00 3.11 C ATOM 120 C LEU A 9 18.060 -13.523 -12.235 1.00 52.21 C ATOM 121 O LEU A 9 17.601 -14.287 -13.084 1.00 65.32 O ATOM 122 CB LEU A 9 18.567 -11.522 -13.647 1.00 43.45 C ATOM 123 CG LEU A 9 19.994 -12.019 -13.884 1.00 32.11 C ATOM 124 CD1 LEU A 9 20.399 -11.808 -15.334 1.00 42.13 C ATOM 125 CD2 LEU A 9 20.966 -11.315 -12.949 1.00 30.15 C ATOM 0 H LEU A 9 19.420 -11.530 -11.018 1.00 34.22 H new ATOM 0 HA LEU A 9 16.822 -11.790 -12.421 1.00 3.11 H new ATOM 0 HB2 LEU A 9 17.954 -11.821 -14.497 1.00 43.45 H new ATOM 0 HB3 LEU A 9 18.581 -10.432 -13.631 1.00 43.45 H new ATOM 0 HG LEU A 9 20.026 -13.088 -13.671 1.00 32.11 H new ATOM 0 HD11 LEU A 9 21.417 -12.168 -15.483 1.00 42.13 H new ATOM 0 HD12 LEU A 9 19.720 -12.359 -15.985 1.00 42.13 H new ATOM 0 HD13 LEU A 9 20.350 -10.746 -15.575 1.00 42.13 H new ATOM 0 HD21 LEU A 9 21.976 -11.681 -13.132 1.00 30.15 H new ATOM 0 HD22 LEU A 9 20.931 -10.241 -13.130 1.00 30.15 H new ATOM 0 HD23 LEU A 9 20.688 -11.518 -11.915 1.00 30.15 H new ATOM 137 N VAL A 10 18.721 -13.946 -11.163 1.00 24.04 N ATOM 138 CA VAL A 10 18.951 -15.365 -10.916 1.00 54.33 C ATOM 139 C VAL A 10 17.853 -15.954 -10.037 1.00 64.12 C ATOM 140 O VAL A 10 17.609 -17.161 -10.057 1.00 54.41 O ATOM 141 CB VAL A 10 20.316 -15.604 -10.244 1.00 73.35 C ATOM 142 CG1 VAL A 10 21.428 -14.941 -11.043 1.00 33.21 C ATOM 143 CG2 VAL A 10 20.300 -15.095 -8.811 1.00 45.42 C ATOM 0 H VAL A 10 19.107 -13.326 -10.451 1.00 24.04 H new ATOM 0 HA VAL A 10 18.941 -15.861 -11.886 1.00 54.33 H new ATOM 0 HB VAL A 10 20.508 -16.677 -10.222 1.00 73.35 H new ATOM 0 HG11 VAL A 10 22.385 -15.121 -10.553 1.00 33.21 H new ATOM 0 HG12 VAL A 10 21.452 -15.359 -12.049 1.00 33.21 H new ATOM 0 HG13 VAL A 10 21.245 -13.868 -11.100 1.00 33.21 H new ATOM 0 HG21 VAL A 10 21.272 -15.272 -8.351 1.00 45.42 H new ATOM 0 HG22 VAL A 10 20.086 -14.026 -8.807 1.00 45.42 H new ATOM 0 HG23 VAL A 10 19.531 -15.622 -8.246 1.00 45.42 H new ATOM 153 N TYR A 11 17.195 -15.095 -9.267 1.00 21.32 N ATOM 154 CA TYR A 11 16.124 -15.531 -8.378 1.00 43.13 C ATOM 155 C TYR A 11 14.789 -15.574 -9.115 1.00 30.32 C ATOM 156 O TYR A 11 13.758 -15.921 -8.537 1.00 22.35 O ATOM 157 CB TYR A 11 16.023 -14.597 -7.171 1.00 24.21 C ATOM 158 CG TYR A 11 15.108 -13.415 -7.395 1.00 35.14 C ATOM 159 CD1 TYR A 11 15.309 -12.547 -8.460 1.00 74.05 C ATOM 160 CD2 TYR A 11 14.040 -13.167 -6.540 1.00 62.11 C ATOM 161 CE1 TYR A 11 14.475 -11.465 -8.668 1.00 33.41 C ATOM 162 CE2 TYR A 11 13.200 -12.089 -6.741 1.00 2.23 C ATOM 163 CZ TYR A 11 13.422 -11.241 -7.806 1.00 11.44 C ATOM 164 OH TYR A 11 12.588 -10.165 -8.010 1.00 21.13 O ATOM 0 H TYR A 11 17.384 -14.093 -9.240 1.00 21.32 H new ATOM 0 HA TYR A 11 16.360 -16.537 -8.032 1.00 43.13 H new ATOM 0 HB2 TYR A 11 15.666 -15.165 -6.312 1.00 24.21 H new ATOM 0 HB3 TYR A 11 17.019 -14.232 -6.920 1.00 24.21 H new ATOM 0 HD1 TYR A 11 16.132 -12.721 -9.138 1.00 74.05 H new ATOM 0 HD2 TYR A 11 13.864 -13.828 -5.705 1.00 62.11 H new ATOM 0 HE1 TYR A 11 14.647 -10.799 -9.501 1.00 33.41 H new ATOM 0 HE2 TYR A 11 12.374 -11.911 -6.068 1.00 2.23 H new ATOM 0 HH TYR A 11 11.897 -10.151 -7.315 1.00 21.13 H new ATOM 174 N LEU A 12 14.815 -15.220 -10.395 1.00 23.21 N ATOM 175 CA LEU A 12 13.608 -15.219 -11.213 1.00 53.24 C ATOM 176 C LEU A 12 13.442 -16.549 -11.942 1.00 11.33 C ATOM 177 O LEU A 12 12.377 -17.162 -11.899 1.00 35.20 O ATOM 178 CB LEU A 12 13.655 -14.073 -12.225 1.00 41.42 C ATOM 179 CG LEU A 12 13.003 -12.761 -11.785 1.00 62.31 C ATOM 180 CD1 LEU A 12 13.171 -11.696 -12.857 1.00 52.31 C ATOM 181 CD2 LEU A 12 11.530 -12.977 -11.471 1.00 21.32 C ATOM 0 H LEU A 12 15.659 -14.930 -10.889 1.00 23.21 H new ATOM 0 HA LEU A 12 12.752 -15.078 -10.553 1.00 53.24 H new ATOM 0 HB2 LEU A 12 14.698 -13.873 -12.469 1.00 41.42 H new ATOM 0 HB3 LEU A 12 13.171 -14.406 -13.143 1.00 41.42 H new ATOM 0 HG LEU A 12 13.500 -12.416 -10.878 1.00 62.31 H new ATOM 0 HD11 LEU A 12 12.701 -10.770 -12.526 1.00 52.31 H new ATOM 0 HD12 LEU A 12 14.232 -11.522 -13.033 1.00 52.31 H new ATOM 0 HD13 LEU A 12 12.700 -12.032 -13.781 1.00 52.31 H new ATOM 0 HD21 LEU A 12 11.082 -12.033 -11.160 1.00 21.32 H new ATOM 0 HD22 LEU A 12 11.019 -13.345 -12.360 1.00 21.32 H new ATOM 0 HD23 LEU A 12 11.433 -13.707 -10.668 1.00 21.32 H new ATOM 193 N ASN A 13 14.504 -16.989 -12.608 1.00 42.01 N ATOM 194 CA ASN A 13 14.477 -18.248 -13.345 1.00 11.54 C ATOM 195 C ASN A 13 14.395 -19.435 -12.390 1.00 2.21 C ATOM 196 O ASN A 13 13.989 -20.530 -12.778 1.00 20.34 O ATOM 197 CB ASN A 13 15.720 -18.373 -14.227 1.00 63.12 C ATOM 198 CG ASN A 13 15.848 -17.227 -15.212 1.00 4.11 C ATOM 199 OD1 ASN A 13 15.306 -17.278 -16.316 1.00 33.53 O ATOM 200 ND2 ASN A 13 16.569 -16.184 -14.816 1.00 24.54 N ATOM 0 H ASN A 13 15.394 -16.493 -12.653 1.00 42.01 H new ATOM 0 HA ASN A 13 13.589 -18.252 -13.978 1.00 11.54 H new ATOM 0 HB2 ASN A 13 16.608 -18.407 -13.596 1.00 63.12 H new ATOM 0 HB3 ASN A 13 15.681 -19.315 -14.773 1.00 63.12 H new ATOM 0 HD21 ASN A 13 16.691 -15.383 -15.436 1.00 24.54 H new ATOM 0 HD22 ASN A 13 17.001 -16.184 -13.892 1.00 24.54 H new ATOM 207 N VAL A 14 14.784 -19.209 -11.139 1.00 33.02 N ATOM 208 CA VAL A 14 14.753 -20.259 -10.128 1.00 1.14 C ATOM 209 C VAL A 14 13.342 -20.459 -9.585 1.00 43.34 C ATOM 210 O VAL A 14 12.999 -21.537 -9.103 1.00 21.44 O ATOM 211 CB VAL A 14 15.701 -19.938 -8.956 1.00 53.15 C ATOM 212 CG1 VAL A 14 15.134 -18.813 -8.104 1.00 43.41 C ATOM 213 CG2 VAL A 14 15.948 -21.181 -8.116 1.00 65.50 C ATOM 0 H VAL A 14 15.124 -18.308 -10.802 1.00 33.02 H new ATOM 0 HA VAL A 14 15.085 -21.176 -10.615 1.00 1.14 H new ATOM 0 HB VAL A 14 16.656 -19.607 -9.364 1.00 53.15 H new ATOM 0 HG11 VAL A 14 15.817 -18.600 -7.281 1.00 43.41 H new ATOM 0 HG12 VAL A 14 15.013 -17.919 -8.716 1.00 43.41 H new ATOM 0 HG13 VAL A 14 14.166 -19.113 -7.703 1.00 43.41 H new ATOM 0 HG21 VAL A 14 16.619 -20.936 -7.293 1.00 65.50 H new ATOM 0 HG22 VAL A 14 15.001 -21.544 -7.716 1.00 65.50 H new ATOM 0 HG23 VAL A 14 16.401 -21.955 -8.736 1.00 65.50 H new ATOM 223 N MET A 15 12.528 -19.411 -9.669 1.00 63.51 N ATOM 224 CA MET A 15 11.153 -19.473 -9.188 1.00 50.31 C ATOM 225 C MET A 15 10.363 -20.542 -9.936 1.00 14.30 C ATOM 226 O MET A 15 9.842 -21.478 -9.331 1.00 11.25 O ATOM 227 CB MET A 15 10.472 -18.112 -9.350 1.00 25.12 C ATOM 228 CG MET A 15 9.379 -17.854 -8.326 1.00 75.34 C ATOM 229 SD MET A 15 8.313 -16.473 -8.782 1.00 74.21 S ATOM 230 CE MET A 15 9.523 -15.173 -9.014 1.00 31.45 C ATOM 0 H MET A 15 12.797 -18.510 -10.065 1.00 63.51 H new ATOM 0 HA MET A 15 11.176 -19.737 -8.131 1.00 50.31 H new ATOM 0 HB2 MET A 15 11.224 -17.327 -9.272 1.00 25.12 H new ATOM 0 HB3 MET A 15 10.044 -18.046 -10.350 1.00 25.12 H new ATOM 0 HG2 MET A 15 8.774 -18.753 -8.212 1.00 75.34 H new ATOM 0 HG3 MET A 15 9.835 -17.652 -7.357 1.00 75.34 H new ATOM 0 HE1 MET A 15 9.015 -14.212 -9.089 1.00 31.45 H new ATOM 0 HE2 MET A 15 10.207 -15.157 -8.165 1.00 31.45 H new ATOM 0 HE3 MET A 15 10.085 -15.358 -9.929 1.00 31.45 H new ATOM 240 N GLU A 16 10.277 -20.395 -11.254 1.00 45.35 N ATOM 241 CA GLU A 16 9.549 -21.348 -12.083 1.00 41.03 C ATOM 242 C GLU A 16 10.029 -22.773 -11.823 1.00 71.01 C ATOM 243 O GLU A 16 9.252 -23.726 -11.898 1.00 55.52 O ATOM 244 CB GLU A 16 9.718 -21.004 -13.564 1.00 44.45 C ATOM 245 CG GLU A 16 11.097 -21.332 -14.112 1.00 4.31 C ATOM 246 CD GLU A 16 11.426 -20.552 -15.370 1.00 3.20 C ATOM 247 OE1 GLU A 16 10.894 -20.903 -16.443 1.00 75.41 O ATOM 248 OE2 GLU A 16 12.217 -19.589 -15.281 1.00 31.03 O ATOM 0 H GLU A 16 10.702 -19.625 -11.771 1.00 45.35 H new ATOM 0 HA GLU A 16 8.493 -21.285 -11.821 1.00 41.03 H new ATOM 0 HB2 GLU A 16 8.969 -21.545 -14.142 1.00 44.45 H new ATOM 0 HB3 GLU A 16 9.523 -19.941 -13.706 1.00 44.45 H new ATOM 0 HG2 GLU A 16 11.847 -21.118 -13.350 1.00 4.31 H new ATOM 0 HG3 GLU A 16 11.155 -22.399 -14.325 1.00 4.31 H new ATOM 255 N LEU A 17 11.314 -22.911 -11.518 1.00 23.45 N ATOM 256 CA LEU A 17 11.900 -24.220 -11.246 1.00 54.14 C ATOM 257 C LEU A 17 11.309 -24.829 -9.979 1.00 11.44 C ATOM 258 O LEU A 17 10.825 -25.961 -9.988 1.00 5.21 O ATOM 259 CB LEU A 17 13.419 -24.102 -11.109 1.00 74.54 C ATOM 260 CG LEU A 17 14.133 -25.311 -10.503 1.00 43.32 C ATOM 261 CD1 LEU A 17 14.088 -26.493 -11.459 1.00 42.41 C ATOM 262 CD2 LEU A 17 15.572 -24.959 -10.154 1.00 21.30 C ATOM 0 H LEU A 17 11.971 -22.133 -11.453 1.00 23.45 H new ATOM 0 HA LEU A 17 11.667 -24.876 -12.085 1.00 54.14 H new ATOM 0 HB2 LEU A 17 13.840 -23.914 -12.097 1.00 74.54 H new ATOM 0 HB3 LEU A 17 13.642 -23.229 -10.496 1.00 74.54 H new ATOM 0 HG LEU A 17 13.615 -25.593 -9.586 1.00 43.32 H new ATOM 0 HD11 LEU A 17 14.601 -27.344 -11.010 1.00 42.41 H new ATOM 0 HD12 LEU A 17 13.050 -26.760 -11.659 1.00 42.41 H new ATOM 0 HD13 LEU A 17 14.580 -26.224 -12.394 1.00 42.41 H new ATOM 0 HD21 LEU A 17 16.066 -25.830 -9.724 1.00 21.30 H new ATOM 0 HD22 LEU A 17 16.100 -24.651 -11.056 1.00 21.30 H new ATOM 0 HD23 LEU A 17 15.582 -24.143 -9.431 1.00 21.30 H new ATOM 274 N VAL A 18 11.349 -24.068 -8.889 1.00 24.51 N ATOM 275 CA VAL A 18 10.815 -24.531 -7.614 1.00 22.34 C ATOM 276 C VAL A 18 9.323 -24.824 -7.717 1.00 34.31 C ATOM 277 O VAL A 18 8.761 -25.539 -6.887 1.00 21.14 O ATOM 278 CB VAL A 18 11.048 -23.495 -6.498 1.00 52.23 C ATOM 279 CG1 VAL A 18 10.493 -24.000 -5.175 1.00 61.33 C ATOM 280 CG2 VAL A 18 12.528 -23.168 -6.375 1.00 65.52 C ATOM 0 H VAL A 18 11.746 -23.129 -8.864 1.00 24.51 H new ATOM 0 HA VAL A 18 11.346 -25.449 -7.363 1.00 22.34 H new ATOM 0 HB VAL A 18 10.518 -22.579 -6.760 1.00 52.23 H new ATOM 0 HG11 VAL A 18 10.667 -23.255 -4.399 1.00 61.33 H new ATOM 0 HG12 VAL A 18 9.422 -24.178 -5.274 1.00 61.33 H new ATOM 0 HG13 VAL A 18 10.992 -24.930 -4.903 1.00 61.33 H new ATOM 0 HG21 VAL A 18 12.674 -22.435 -5.582 1.00 65.52 H new ATOM 0 HG22 VAL A 18 13.083 -24.076 -6.136 1.00 65.52 H new ATOM 0 HG23 VAL A 18 12.890 -22.759 -7.318 1.00 65.52 H new ATOM 290 N ARG A 19 8.685 -24.268 -8.742 1.00 5.52 N ATOM 291 CA ARG A 19 7.257 -24.468 -8.954 1.00 21.54 C ATOM 292 C ARG A 19 7.003 -25.714 -9.797 1.00 75.32 C ATOM 293 O ARG A 19 6.237 -26.595 -9.406 1.00 42.01 O ATOM 294 CB ARG A 19 6.644 -23.244 -9.635 1.00 53.12 C ATOM 295 CG ARG A 19 6.042 -22.243 -8.662 1.00 73.24 C ATOM 296 CD ARG A 19 4.595 -21.930 -9.010 1.00 34.25 C ATOM 297 NE ARG A 19 3.658 -22.707 -8.202 1.00 52.02 N ATOM 298 CZ ARG A 19 2.354 -22.460 -8.148 1.00 73.05 C ATOM 299 NH1 ARG A 19 1.835 -21.463 -8.852 1.00 11.02 N ATOM 300 NH2 ARG A 19 1.566 -23.212 -7.390 1.00 54.43 N ATOM 0 H ARG A 19 9.135 -23.675 -9.439 1.00 5.52 H new ATOM 0 HA ARG A 19 6.786 -24.606 -7.981 1.00 21.54 H new ATOM 0 HB2 ARG A 19 7.412 -22.746 -10.227 1.00 53.12 H new ATOM 0 HB3 ARG A 19 5.871 -23.574 -10.329 1.00 53.12 H new ATOM 0 HG2 ARG A 19 6.096 -22.641 -7.649 1.00 73.24 H new ATOM 0 HG3 ARG A 19 6.628 -21.324 -8.675 1.00 73.24 H new ATOM 0 HD2 ARG A 19 4.408 -20.867 -8.860 1.00 34.25 H new ATOM 0 HD3 ARG A 19 4.423 -22.138 -10.066 1.00 34.25 H new ATOM 0 HE ARG A 19 4.025 -23.481 -7.649 1.00 52.02 H new ATOM 0 HH11 ARG A 19 2.438 -20.884 -9.437 1.00 11.02 H new ATOM 0 HH12 ARG A 19 0.833 -21.275 -8.809 1.00 11.02 H new ATOM 0 HH21 ARG A 19 1.962 -23.980 -6.848 1.00 54.43 H new ATOM 0 HH22 ARG A 19 0.565 -23.022 -7.349 1.00 54.43 H new ATOM 314 N ALA A 20 7.649 -25.780 -10.956 1.00 42.14 N ATOM 315 CA ALA A 20 7.494 -26.918 -11.854 1.00 41.32 C ATOM 316 C ALA A 20 7.819 -28.227 -11.143 1.00 5.32 C ATOM 317 O ALA A 20 7.329 -29.290 -11.523 1.00 64.11 O ATOM 318 CB ALA A 20 8.379 -26.747 -13.080 1.00 51.12 C ATOM 0 H ALA A 20 8.285 -25.059 -11.296 1.00 42.14 H new ATOM 0 HA ALA A 20 6.453 -26.958 -12.174 1.00 41.32 H new ATOM 0 HB1 ALA A 20 8.253 -27.604 -13.742 1.00 51.12 H new ATOM 0 HB2 ALA A 20 8.097 -25.836 -13.608 1.00 51.12 H new ATOM 0 HB3 ALA A 20 9.422 -26.678 -12.769 1.00 51.12 H new ATOM 324 N VAL A 21 8.650 -28.142 -10.108 1.00 60.24 N ATOM 325 CA VAL A 21 9.041 -29.320 -9.343 1.00 73.34 C ATOM 326 C VAL A 21 8.050 -29.598 -8.218 1.00 63.11 C ATOM 327 O VAL A 21 7.963 -30.719 -7.716 1.00 32.51 O ATOM 328 CB VAL A 21 10.450 -29.158 -8.744 1.00 20.24 C ATOM 329 CG1 VAL A 21 10.471 -28.028 -7.726 1.00 34.02 C ATOM 330 CG2 VAL A 21 10.914 -30.463 -8.113 1.00 52.35 C ATOM 0 H VAL A 21 9.065 -27.270 -9.781 1.00 60.24 H new ATOM 0 HA VAL A 21 9.044 -30.161 -10.036 1.00 73.34 H new ATOM 0 HB VAL A 21 11.140 -28.904 -9.548 1.00 20.24 H new ATOM 0 HG11 VAL A 21 11.475 -27.929 -7.313 1.00 34.02 H new ATOM 0 HG12 VAL A 21 10.184 -27.095 -8.212 1.00 34.02 H new ATOM 0 HG13 VAL A 21 9.769 -28.249 -6.922 1.00 34.02 H new ATOM 0 HG21 VAL A 21 11.912 -30.330 -7.695 1.00 52.35 H new ATOM 0 HG22 VAL A 21 10.223 -30.750 -7.320 1.00 52.35 H new ATOM 0 HG23 VAL A 21 10.940 -31.245 -8.872 1.00 52.35 H new ATOM 340 N LEU A 22 7.305 -28.571 -7.826 1.00 41.44 N ATOM 341 CA LEU A 22 6.319 -28.703 -6.760 1.00 31.43 C ATOM 342 C LEU A 22 5.024 -29.313 -7.288 1.00 23.22 C ATOM 343 O LEU A 22 4.310 -30.001 -6.560 1.00 73.40 O ATOM 344 CB LEU A 22 6.033 -27.339 -6.130 1.00 24.15 C ATOM 345 CG LEU A 22 5.634 -27.352 -4.654 1.00 14.13 C ATOM 346 CD1 LEU A 22 5.647 -25.942 -4.085 1.00 2.43 C ATOM 347 CD2 LEU A 22 4.262 -27.987 -4.478 1.00 53.52 C ATOM 0 H LEU A 22 7.365 -27.637 -8.231 1.00 41.44 H new ATOM 0 HA LEU A 22 6.730 -29.368 -6.000 1.00 31.43 H new ATOM 0 HB2 LEU A 22 6.921 -26.717 -6.240 1.00 24.15 H new ATOM 0 HB3 LEU A 22 5.235 -26.859 -6.697 1.00 24.15 H new ATOM 0 HG LEU A 22 6.362 -27.950 -4.106 1.00 14.13 H new ATOM 0 HD11 LEU A 22 5.360 -25.971 -3.034 1.00 2.43 H new ATOM 0 HD12 LEU A 22 6.649 -25.522 -4.177 1.00 2.43 H new ATOM 0 HD13 LEU A 22 4.941 -25.321 -4.636 1.00 2.43 H new ATOM 0 HD21 LEU A 22 3.994 -27.988 -3.421 1.00 53.52 H new ATOM 0 HD22 LEU A 22 3.522 -27.416 -5.039 1.00 53.52 H new ATOM 0 HD23 LEU A 22 4.286 -29.012 -4.847 1.00 53.52 H new ATOM 359 N GLU A 23 4.731 -29.057 -8.559 1.00 12.02 N ATOM 360 CA GLU A 23 3.523 -29.582 -9.184 1.00 72.50 C ATOM 361 C GLU A 23 3.588 -31.103 -9.301 1.00 13.43 C ATOM 362 O GLU A 23 2.583 -31.793 -9.128 1.00 75.42 O ATOM 363 CB GLU A 23 3.327 -28.962 -10.569 1.00 1.42 C ATOM 364 CG GLU A 23 3.579 -27.464 -10.605 1.00 42.34 C ATOM 365 CD GLU A 23 2.478 -26.704 -11.319 1.00 62.05 C ATOM 366 OE1 GLU A 23 1.343 -26.677 -10.801 1.00 13.11 O ATOM 367 OE2 GLU A 23 2.753 -26.136 -12.397 1.00 70.25 O ATOM 0 H GLU A 23 5.313 -28.490 -9.175 1.00 12.02 H new ATOM 0 HA GLU A 23 2.675 -29.318 -8.552 1.00 72.50 H new ATOM 0 HB2 GLU A 23 3.997 -29.452 -11.276 1.00 1.42 H new ATOM 0 HB3 GLU A 23 2.309 -29.159 -10.906 1.00 1.42 H new ATOM 0 HG2 GLU A 23 3.671 -27.090 -9.585 1.00 42.34 H new ATOM 0 HG3 GLU A 23 4.530 -27.271 -11.102 1.00 42.34 H new ATOM 374 N LEU A 24 4.776 -31.617 -9.595 1.00 65.11 N ATOM 375 CA LEU A 24 4.974 -33.056 -9.736 1.00 0.42 C ATOM 376 C LEU A 24 4.819 -33.761 -8.392 1.00 53.51 C ATOM 377 O LEU A 24 4.658 -34.980 -8.333 1.00 1.20 O ATOM 378 CB LEU A 24 6.358 -33.346 -10.320 1.00 12.42 C ATOM 379 CG LEU A 24 7.513 -33.391 -9.319 1.00 12.42 C ATOM 380 CD1 LEU A 24 7.737 -34.812 -8.826 1.00 12.33 C ATOM 381 CD2 LEU A 24 8.783 -32.835 -9.945 1.00 45.03 C ATOM 0 H LEU A 24 5.618 -31.059 -9.741 1.00 65.11 H new ATOM 0 HA LEU A 24 4.212 -33.438 -10.416 1.00 0.42 H new ATOM 0 HB2 LEU A 24 6.317 -34.303 -10.841 1.00 12.42 H new ATOM 0 HB3 LEU A 24 6.581 -32.585 -11.068 1.00 12.42 H new ATOM 0 HG LEU A 24 7.251 -32.769 -8.463 1.00 12.42 H new ATOM 0 HD11 LEU A 24 8.563 -34.824 -8.115 1.00 12.33 H new ATOM 0 HD12 LEU A 24 6.832 -35.175 -8.338 1.00 12.33 H new ATOM 0 HD13 LEU A 24 7.977 -35.457 -9.671 1.00 12.33 H new ATOM 0 HD21 LEU A 24 9.594 -32.875 -9.218 1.00 45.03 H new ATOM 0 HD22 LEU A 24 9.049 -33.430 -10.819 1.00 45.03 H new ATOM 0 HD23 LEU A 24 8.617 -31.801 -10.247 1.00 45.03 H new ATOM 393 N LYS A 25 4.866 -32.985 -7.314 1.00 74.12 N ATOM 394 CA LYS A 25 4.727 -33.533 -5.970 1.00 73.12 C ATOM 395 C LYS A 25 3.304 -34.027 -5.728 1.00 52.51 C ATOM 396 O LYS A 25 3.058 -35.230 -5.656 1.00 41.23 O ATOM 397 CB LYS A 25 5.096 -32.477 -4.926 1.00 22.31 C ATOM 398 CG LYS A 25 6.489 -31.900 -5.111 1.00 30.11 C ATOM 399 CD LYS A 25 6.862 -30.968 -3.970 1.00 65.24 C ATOM 400 CE LYS A 25 7.291 -31.744 -2.734 1.00 44.04 C ATOM 401 NZ LYS A 25 7.148 -30.933 -1.493 1.00 65.34 N ATOM 0 H LYS A 25 4.999 -31.974 -7.345 1.00 74.12 H new ATOM 0 HA LYS A 25 5.407 -34.380 -5.878 1.00 73.12 H new ATOM 0 HB2 LYS A 25 4.368 -31.667 -4.968 1.00 22.31 H new ATOM 0 HB3 LYS A 25 5.024 -32.920 -3.933 1.00 22.31 H new ATOM 0 HG2 LYS A 25 7.215 -32.711 -5.172 1.00 30.11 H new ATOM 0 HG3 LYS A 25 6.537 -31.358 -6.055 1.00 30.11 H new ATOM 0 HD2 LYS A 25 7.671 -30.309 -4.286 1.00 65.24 H new ATOM 0 HD3 LYS A 25 6.011 -30.333 -3.725 1.00 65.24 H new ATOM 0 HE2 LYS A 25 6.691 -32.650 -2.647 1.00 44.04 H new ATOM 0 HE3 LYS A 25 8.329 -32.059 -2.845 1.00 44.04 H new ATOM 0 HZ1 LYS A 25 8.090 -30.662 -1.145 1.00 65.34 H new ATOM 0 HZ2 LYS A 25 6.596 -30.076 -1.700 1.00 65.34 H new ATOM 0 HZ3 LYS A 25 6.658 -31.493 -0.767 1.00 65.34 H new ATOM 415 N ASN A 26 2.370 -33.089 -5.605 1.00 1.24 N ATOM 416 CA ASN A 26 0.971 -33.429 -5.372 1.00 22.03 C ATOM 417 C ASN A 26 0.404 -34.229 -6.540 1.00 60.05 C ATOM 418 O ASN A 26 -0.590 -34.939 -6.394 1.00 55.34 O ATOM 419 CB ASN A 26 0.144 -32.159 -5.159 1.00 64.33 C ATOM 420 CG ASN A 26 0.869 -31.133 -4.310 1.00 51.10 C ATOM 421 OD1 ASN A 26 0.875 -29.943 -4.625 1.00 54.20 O ATOM 422 ND2 ASN A 26 1.485 -31.591 -3.226 1.00 41.44 N ATOM 0 H ASN A 26 2.557 -32.088 -5.663 1.00 1.24 H new ATOM 0 HA ASN A 26 0.917 -34.044 -4.474 1.00 22.03 H new ATOM 0 HB2 ASN A 26 -0.098 -31.720 -6.127 1.00 64.33 H new ATOM 0 HB3 ASN A 26 -0.801 -32.420 -4.682 1.00 64.33 H new ATOM 0 HD21 ASN A 26 1.989 -30.948 -2.616 1.00 41.44 H new ATOM 0 HD22 ASN A 26 1.454 -32.586 -3.004 1.00 41.44 H new ATOM 429 N GLU A 27 1.045 -34.109 -7.699 1.00 54.31 N ATOM 430 CA GLU A 27 0.603 -34.821 -8.893 1.00 3.33 C ATOM 431 C GLU A 27 1.359 -36.137 -9.052 1.00 12.05 C ATOM 432 O GLU A 27 1.428 -36.698 -10.146 1.00 4.10 O ATOM 433 CB GLU A 27 0.804 -33.951 -10.136 1.00 24.43 C ATOM 434 CG GLU A 27 -0.017 -32.673 -10.124 1.00 5.24 C ATOM 435 CD GLU A 27 -1.426 -32.879 -10.644 1.00 22.31 C ATOM 436 OE1 GLU A 27 -2.314 -33.218 -9.834 1.00 70.14 O ATOM 437 OE2 GLU A 27 -1.640 -32.702 -11.861 1.00 41.45 O ATOM 0 H GLU A 27 1.871 -33.526 -7.836 1.00 54.31 H new ATOM 0 HA GLU A 27 -0.458 -35.043 -8.781 1.00 3.33 H new ATOM 0 HB2 GLU A 27 1.860 -33.694 -10.222 1.00 24.43 H new ATOM 0 HB3 GLU A 27 0.544 -34.531 -11.021 1.00 24.43 H new ATOM 0 HG2 GLU A 27 -0.063 -32.285 -9.107 1.00 5.24 H new ATOM 0 HG3 GLU A 27 0.483 -31.919 -10.731 1.00 5.24 H new ATOM 444 N LEU A 28 1.924 -36.624 -7.952 1.00 72.14 N ATOM 445 CA LEU A 28 2.675 -37.874 -7.968 1.00 63.42 C ATOM 446 C LEU A 28 1.738 -39.074 -7.877 1.00 60.34 C ATOM 447 O LEU A 28 2.076 -40.173 -8.317 1.00 21.42 O ATOM 448 CB LEU A 28 3.676 -37.906 -6.811 1.00 52.44 C ATOM 449 CG LEU A 28 4.583 -39.135 -6.742 1.00 11.54 C ATOM 450 CD1 LEU A 28 3.866 -40.289 -6.059 1.00 72.24 C ATOM 451 CD2 LEU A 28 5.042 -39.538 -8.135 1.00 24.20 C ATOM 0 H LEU A 28 1.876 -36.172 -7.039 1.00 72.14 H new ATOM 0 HA LEU A 28 3.217 -37.930 -8.912 1.00 63.42 H new ATOM 0 HB2 LEU A 28 4.305 -37.018 -6.877 1.00 52.44 H new ATOM 0 HB3 LEU A 28 3.122 -37.835 -5.875 1.00 52.44 H new ATOM 0 HG LEU A 28 5.463 -38.881 -6.151 1.00 11.54 H new ATOM 0 HD11 LEU A 28 4.527 -41.155 -6.019 1.00 72.24 H new ATOM 0 HD12 LEU A 28 3.589 -39.997 -5.046 1.00 72.24 H new ATOM 0 HD13 LEU A 28 2.968 -40.544 -6.622 1.00 72.24 H new ATOM 0 HD21 LEU A 28 5.687 -40.414 -8.066 1.00 24.20 H new ATOM 0 HD22 LEU A 28 4.174 -39.774 -8.750 1.00 24.20 H new ATOM 0 HD23 LEU A 28 5.595 -38.715 -8.588 1.00 24.20 H new ATOM 463 N SER A 29 0.558 -38.855 -7.306 1.00 60.11 N ATOM 464 CA SER A 29 -0.428 -39.919 -7.156 1.00 51.23 C ATOM 465 C SER A 29 -1.688 -39.609 -7.959 1.00 42.22 C ATOM 466 O SER A 29 -2.778 -40.071 -7.625 1.00 72.53 O ATOM 467 CB SER A 29 -0.784 -40.109 -5.681 1.00 11.04 C ATOM 468 OG SER A 29 -1.713 -41.165 -5.512 1.00 75.42 O ATOM 0 H SER A 29 0.261 -37.950 -6.940 1.00 60.11 H new ATOM 0 HA SER A 29 0.008 -40.842 -7.539 1.00 51.23 H new ATOM 0 HB2 SER A 29 0.120 -40.321 -5.110 1.00 11.04 H new ATOM 0 HB3 SER A 29 -1.203 -39.185 -5.283 1.00 11.04 H new ATOM 0 HG SER A 29 -2.405 -41.106 -6.203 1.00 75.42 H new ATOM 474 N GLN A 30 -1.528 -38.823 -9.019 1.00 0.41 N ATOM 475 CA GLN A 30 -2.652 -38.450 -9.869 1.00 52.33 C ATOM 476 C GLN A 30 -2.288 -38.587 -11.344 1.00 51.20 C ATOM 477 O GLN A 30 -3.021 -38.128 -12.221 1.00 14.53 O ATOM 478 CB GLN A 30 -3.090 -37.015 -9.571 1.00 55.13 C ATOM 479 CG GLN A 30 -3.156 -36.695 -8.087 1.00 2.43 C ATOM 480 CD GLN A 30 -4.214 -37.503 -7.361 1.00 41.54 C ATOM 481 OE1 GLN A 30 -5.330 -37.670 -7.855 1.00 23.45 O ATOM 482 NE2 GLN A 30 -3.869 -38.008 -6.183 1.00 64.52 N ATOM 0 H GLN A 30 -0.631 -38.433 -9.309 1.00 0.41 H new ATOM 0 HA GLN A 30 -3.479 -39.127 -9.653 1.00 52.33 H new ATOM 0 HB2 GLN A 30 -2.397 -36.325 -10.052 1.00 55.13 H new ATOM 0 HB3 GLN A 30 -4.071 -36.844 -10.015 1.00 55.13 H new ATOM 0 HG2 GLN A 30 -2.183 -36.888 -7.634 1.00 2.43 H new ATOM 0 HG3 GLN A 30 -3.363 -35.633 -7.957 1.00 2.43 H new ATOM 0 HE21 GLN A 30 -2.933 -37.844 -5.812 1.00 64.52 H new ATOM 0 HE22 GLN A 30 -4.540 -38.560 -5.648 1.00 64.52 H new ATOM 491 N LEU A 31 -1.152 -39.221 -11.611 1.00 43.21 N ATOM 492 CA LEU A 31 -0.690 -39.418 -12.981 1.00 25.44 C ATOM 493 C LEU A 31 0.169 -40.674 -13.090 1.00 25.25 C ATOM 494 O LEU A 31 0.765 -41.135 -12.116 1.00 21.05 O ATOM 495 CB LEU A 31 0.106 -38.200 -13.452 1.00 62.00 C ATOM 496 CG LEU A 31 -0.691 -36.908 -13.637 1.00 70.30 C ATOM 497 CD1 LEU A 31 0.246 -35.726 -13.831 1.00 73.12 C ATOM 498 CD2 LEU A 31 -1.645 -37.035 -14.816 1.00 1.51 C ATOM 0 H LEU A 31 -0.534 -39.607 -10.898 1.00 43.21 H new ATOM 0 HA LEU A 31 -1.565 -39.541 -13.619 1.00 25.44 H new ATOM 0 HB2 LEU A 31 0.903 -38.012 -12.733 1.00 62.00 H new ATOM 0 HB3 LEU A 31 0.584 -38.448 -14.400 1.00 62.00 H new ATOM 0 HG LEU A 31 -1.280 -36.734 -12.736 1.00 70.30 H new ATOM 0 HD11 LEU A 31 -0.339 -34.816 -13.961 1.00 73.12 H new ATOM 0 HD12 LEU A 31 0.888 -35.623 -12.956 1.00 73.12 H new ATOM 0 HD13 LEU A 31 0.862 -35.891 -14.715 1.00 73.12 H new ATOM 0 HD21 LEU A 31 -2.204 -36.107 -14.933 1.00 1.51 H new ATOM 0 HD22 LEU A 31 -1.076 -37.233 -15.724 1.00 1.51 H new ATOM 0 HD23 LEU A 31 -2.339 -37.856 -14.636 1.00 1.51 H new ATOM 510 N PRO A 32 0.238 -41.241 -14.303 1.00 70.12 N ATOM 511 CA PRO A 32 1.024 -42.450 -14.569 1.00 50.42 C ATOM 512 C PRO A 32 2.525 -42.192 -14.497 1.00 22.33 C ATOM 513 O PRO A 32 2.982 -41.050 -14.444 1.00 32.23 O ATOM 514 CB PRO A 32 0.615 -42.832 -15.994 1.00 21.22 C ATOM 515 CG PRO A 32 0.172 -41.554 -16.617 1.00 13.31 C ATOM 516 CD PRO A 32 -0.446 -40.746 -15.509 1.00 51.34 C ATOM 0 HA PRO A 32 0.834 -43.231 -13.832 1.00 50.42 H new ATOM 0 HB2 PRO A 32 1.450 -43.271 -16.541 1.00 21.22 H new ATOM 0 HB3 PRO A 32 -0.187 -43.570 -15.991 1.00 21.22 H new ATOM 0 HG2 PRO A 32 1.014 -41.025 -17.063 1.00 13.31 H new ATOM 0 HG3 PRO A 32 -0.548 -41.738 -17.415 1.00 13.31 H new ATOM 0 HD2 PRO A 32 -0.284 -39.678 -15.653 1.00 51.34 H new ATOM 0 HD3 PRO A 32 -1.523 -40.901 -15.452 1.00 51.34 H new ATOM 524 N PRO A 33 3.313 -43.278 -14.495 1.00 0.13 N ATOM 525 CA PRO A 33 4.775 -43.195 -14.430 1.00 41.21 C ATOM 526 C PRO A 33 5.381 -42.637 -15.713 1.00 43.32 C ATOM 527 O PRO A 33 6.297 -41.816 -15.671 1.00 51.33 O ATOM 528 CB PRO A 33 5.204 -44.650 -14.225 1.00 4.44 C ATOM 529 CG PRO A 33 4.094 -45.457 -14.803 1.00 22.43 C ATOM 530 CD PRO A 33 2.837 -44.670 -14.556 1.00 21.12 C ATOM 0 HA PRO A 33 5.111 -42.522 -13.641 1.00 41.21 H new ATOM 0 HB2 PRO A 33 6.149 -44.859 -14.727 1.00 4.44 H new ATOM 0 HB3 PRO A 33 5.348 -44.875 -13.168 1.00 4.44 H new ATOM 0 HG2 PRO A 33 4.247 -45.623 -15.869 1.00 22.43 H new ATOM 0 HG3 PRO A 33 4.039 -46.438 -14.332 1.00 22.43 H new ATOM 0 HD2 PRO A 33 2.110 -44.812 -15.356 1.00 21.12 H new ATOM 0 HD3 PRO A 33 2.351 -44.970 -13.627 1.00 21.12 H new ATOM 538 N GLU A 34 4.864 -43.088 -16.852 1.00 11.33 N ATOM 539 CA GLU A 34 5.356 -42.632 -18.147 1.00 32.43 C ATOM 540 C GLU A 34 5.182 -41.124 -18.295 1.00 10.41 C ATOM 541 O GLU A 34 5.846 -40.489 -19.113 1.00 5.44 O ATOM 542 CB GLU A 34 4.622 -43.355 -19.279 1.00 2.14 C ATOM 543 CG GLU A 34 5.073 -42.929 -20.666 1.00 10.24 C ATOM 544 CD GLU A 34 3.981 -42.218 -21.441 1.00 71.33 C ATOM 545 OE1 GLU A 34 2.846 -42.739 -21.480 1.00 24.23 O ATOM 546 OE2 GLU A 34 4.260 -41.142 -22.010 1.00 22.31 O ATOM 0 H GLU A 34 4.105 -43.768 -16.904 1.00 11.33 H new ATOM 0 HA GLU A 34 6.419 -42.865 -18.206 1.00 32.43 H new ATOM 0 HB2 GLU A 34 4.773 -44.429 -19.171 1.00 2.14 H new ATOM 0 HB3 GLU A 34 3.552 -43.172 -19.182 1.00 2.14 H new ATOM 0 HG2 GLU A 34 5.937 -42.271 -20.577 1.00 10.24 H new ATOM 0 HG3 GLU A 34 5.397 -43.807 -21.224 1.00 10.24 H new ATOM 553 N GLY A 35 4.282 -40.556 -17.497 1.00 62.11 N ATOM 554 CA GLY A 35 4.036 -39.127 -17.555 1.00 70.11 C ATOM 555 C GLY A 35 4.967 -38.341 -16.653 1.00 62.25 C ATOM 556 O GLY A 35 5.044 -37.116 -16.745 1.00 54.21 O ATOM 0 H GLY A 35 3.719 -41.060 -16.812 1.00 62.11 H new ATOM 0 HA2 GLY A 35 4.154 -38.783 -18.582 1.00 70.11 H new ATOM 0 HA3 GLY A 35 3.003 -38.927 -17.269 1.00 70.11 H new ATOM 560 N TYR A 36 5.676 -39.047 -15.779 1.00 50.41 N ATOM 561 CA TYR A 36 6.604 -38.407 -14.854 1.00 12.20 C ATOM 562 C TYR A 36 8.000 -38.310 -15.462 1.00 55.32 C ATOM 563 O TYR A 36 8.708 -37.322 -15.266 1.00 21.45 O ATOM 564 CB TYR A 36 6.662 -39.184 -13.538 1.00 32.02 C ATOM 565 CG TYR A 36 5.353 -39.191 -12.780 1.00 42.43 C ATOM 566 CD1 TYR A 36 4.568 -38.047 -12.702 1.00 11.13 C ATOM 567 CD2 TYR A 36 4.903 -40.340 -12.142 1.00 54.44 C ATOM 568 CE1 TYR A 36 3.372 -38.048 -12.010 1.00 51.12 C ATOM 569 CE2 TYR A 36 3.707 -40.350 -11.450 1.00 24.20 C ATOM 570 CZ TYR A 36 2.946 -39.202 -11.387 1.00 12.15 C ATOM 571 OH TYR A 36 1.755 -39.208 -10.696 1.00 42.05 O ATOM 0 H TYR A 36 5.626 -40.062 -15.692 1.00 50.41 H new ATOM 0 HA TYR A 36 6.242 -37.398 -14.657 1.00 12.20 H new ATOM 0 HB2 TYR A 36 6.957 -40.212 -13.746 1.00 32.02 H new ATOM 0 HB3 TYR A 36 7.437 -38.752 -12.905 1.00 32.02 H new ATOM 0 HD1 TYR A 36 4.898 -37.142 -13.190 1.00 11.13 H new ATOM 0 HD2 TYR A 36 5.498 -41.240 -12.188 1.00 54.44 H new ATOM 0 HE1 TYR A 36 2.774 -37.150 -11.957 1.00 51.12 H new ATOM 0 HE2 TYR A 36 3.370 -41.252 -10.961 1.00 24.20 H new ATOM 0 HH TYR A 36 1.526 -38.293 -10.431 1.00 42.05 H new ATOM 581 N VAL A 37 8.388 -39.343 -16.203 1.00 40.44 N ATOM 582 CA VAL A 37 9.698 -39.375 -16.843 1.00 51.20 C ATOM 583 C VAL A 37 9.861 -38.216 -17.820 1.00 3.44 C ATOM 584 O VAL A 37 10.976 -37.768 -18.087 1.00 43.44 O ATOM 585 CB VAL A 37 9.923 -40.700 -17.594 1.00 61.34 C ATOM 586 CG1 VAL A 37 8.795 -40.952 -18.584 1.00 3.33 C ATOM 587 CG2 VAL A 37 11.270 -40.690 -18.301 1.00 4.34 C ATOM 0 H VAL A 37 7.814 -40.169 -16.375 1.00 40.44 H new ATOM 0 HA VAL A 37 10.440 -39.285 -16.050 1.00 51.20 H new ATOM 0 HB VAL A 37 9.925 -41.512 -16.867 1.00 61.34 H new ATOM 0 HG11 VAL A 37 8.972 -41.893 -19.105 1.00 3.33 H new ATOM 0 HG12 VAL A 37 7.847 -41.006 -18.049 1.00 3.33 H new ATOM 0 HG13 VAL A 37 8.758 -40.138 -19.308 1.00 3.33 H new ATOM 0 HG21 VAL A 37 11.412 -41.634 -18.827 1.00 4.34 H new ATOM 0 HG22 VAL A 37 11.299 -39.868 -19.017 1.00 4.34 H new ATOM 0 HG23 VAL A 37 12.065 -40.560 -17.567 1.00 4.34 H new ATOM 597 N VAL A 38 8.742 -37.733 -18.349 1.00 53.13 N ATOM 598 CA VAL A 38 8.760 -36.624 -19.296 1.00 11.24 C ATOM 599 C VAL A 38 8.781 -35.283 -18.570 1.00 51.05 C ATOM 600 O VAL A 38 9.169 -34.263 -19.140 1.00 3.11 O ATOM 601 CB VAL A 38 7.540 -36.668 -20.235 1.00 43.23 C ATOM 602 CG1 VAL A 38 6.250 -36.521 -19.443 1.00 41.42 C ATOM 603 CG2 VAL A 38 7.649 -35.586 -21.299 1.00 53.02 C ATOM 0 H VAL A 38 7.811 -38.092 -18.138 1.00 53.13 H new ATOM 0 HA VAL A 38 9.669 -36.728 -19.889 1.00 11.24 H new ATOM 0 HB VAL A 38 7.522 -37.637 -20.734 1.00 43.23 H new ATOM 0 HG11 VAL A 38 5.399 -36.554 -20.124 1.00 41.42 H new ATOM 0 HG12 VAL A 38 6.171 -37.335 -18.723 1.00 41.42 H new ATOM 0 HG13 VAL A 38 6.254 -35.568 -18.914 1.00 41.42 H new ATOM 0 HG21 VAL A 38 6.779 -35.631 -21.954 1.00 53.02 H new ATOM 0 HG22 VAL A 38 7.692 -34.608 -20.820 1.00 53.02 H new ATOM 0 HG23 VAL A 38 8.554 -35.743 -21.886 1.00 53.02 H new ATOM 613 N VAL A 39 8.361 -35.292 -17.309 1.00 52.33 N ATOM 614 CA VAL A 39 8.333 -34.076 -16.504 1.00 73.35 C ATOM 615 C VAL A 39 9.681 -33.826 -15.839 1.00 65.42 C ATOM 616 O VAL A 39 10.113 -32.682 -15.697 1.00 65.43 O ATOM 617 CB VAL A 39 7.242 -34.147 -15.419 1.00 25.22 C ATOM 618 CG1 VAL A 39 7.246 -32.882 -14.575 1.00 52.40 C ATOM 619 CG2 VAL A 39 5.877 -34.374 -16.050 1.00 11.34 C ATOM 0 H VAL A 39 8.036 -36.127 -16.823 1.00 52.33 H new ATOM 0 HA VAL A 39 8.108 -33.252 -17.182 1.00 73.35 H new ATOM 0 HB VAL A 39 7.458 -34.992 -14.765 1.00 25.22 H new ATOM 0 HG11 VAL A 39 6.469 -32.950 -13.814 1.00 52.40 H new ATOM 0 HG12 VAL A 39 8.217 -32.769 -14.093 1.00 52.40 H new ATOM 0 HG13 VAL A 39 7.055 -32.019 -15.212 1.00 52.40 H new ATOM 0 HG21 VAL A 39 5.118 -34.422 -15.269 1.00 11.34 H new ATOM 0 HG22 VAL A 39 5.648 -33.552 -16.728 1.00 11.34 H new ATOM 0 HG23 VAL A 39 5.885 -35.312 -16.606 1.00 11.34 H new ATOM 629 N VAL A 40 10.344 -34.905 -15.433 1.00 33.01 N ATOM 630 CA VAL A 40 11.645 -34.804 -14.784 1.00 2.44 C ATOM 631 C VAL A 40 12.611 -33.967 -15.616 1.00 32.32 C ATOM 632 O VAL A 40 13.515 -33.325 -15.080 1.00 75.31 O ATOM 633 CB VAL A 40 12.263 -36.194 -14.544 1.00 33.11 C ATOM 634 CG1 VAL A 40 13.551 -36.076 -13.744 1.00 12.34 C ATOM 635 CG2 VAL A 40 11.268 -37.104 -13.838 1.00 45.31 C ATOM 0 H VAL A 40 10.001 -35.859 -15.543 1.00 33.01 H new ATOM 0 HA VAL A 40 11.482 -34.317 -13.823 1.00 2.44 H new ATOM 0 HB VAL A 40 12.504 -36.637 -15.510 1.00 33.11 H new ATOM 0 HG11 VAL A 40 13.973 -37.068 -13.585 1.00 12.34 H new ATOM 0 HG12 VAL A 40 14.265 -35.462 -14.293 1.00 12.34 H new ATOM 0 HG13 VAL A 40 13.340 -35.613 -12.780 1.00 12.34 H new ATOM 0 HG21 VAL A 40 11.721 -38.082 -13.676 1.00 45.31 H new ATOM 0 HG22 VAL A 40 10.994 -36.668 -12.878 1.00 45.31 H new ATOM 0 HG23 VAL A 40 10.376 -37.215 -14.454 1.00 45.31 H new ATOM 645 N LYS A 41 12.414 -33.979 -16.930 1.00 15.43 N ATOM 646 CA LYS A 41 13.265 -33.220 -17.838 1.00 40.02 C ATOM 647 C LYS A 41 13.000 -31.723 -17.710 1.00 71.33 C ATOM 648 O LYS A 41 13.931 -30.925 -17.614 1.00 14.25 O ATOM 649 CB LYS A 41 13.032 -33.668 -19.283 1.00 33.43 C ATOM 650 CG LYS A 41 14.306 -34.053 -20.014 1.00 3.13 C ATOM 651 CD LYS A 41 14.575 -35.545 -19.919 1.00 22.44 C ATOM 652 CE LYS A 41 14.734 -35.992 -18.473 1.00 70.14 C ATOM 653 NZ LYS A 41 15.611 -37.190 -18.356 1.00 50.13 N ATOM 0 H LYS A 41 11.672 -34.506 -17.390 1.00 15.43 H new ATOM 0 HA LYS A 41 14.303 -33.412 -17.567 1.00 40.02 H new ATOM 0 HB2 LYS A 41 12.351 -34.519 -19.285 1.00 33.43 H new ATOM 0 HB3 LYS A 41 12.539 -32.864 -19.829 1.00 33.43 H new ATOM 0 HG2 LYS A 41 14.227 -33.763 -21.062 1.00 3.13 H new ATOM 0 HG3 LYS A 41 15.148 -33.503 -19.593 1.00 3.13 H new ATOM 0 HD2 LYS A 41 13.755 -36.094 -20.383 1.00 22.44 H new ATOM 0 HD3 LYS A 41 15.478 -35.789 -20.478 1.00 22.44 H new ATOM 0 HE2 LYS A 41 15.154 -35.176 -17.885 1.00 70.14 H new ATOM 0 HE3 LYS A 41 13.754 -36.217 -18.053 1.00 70.14 H new ATOM 0 HZ1 LYS A 41 15.694 -37.463 -17.356 1.00 50.13 H new ATOM 0 HZ2 LYS A 41 15.198 -37.977 -18.897 1.00 50.13 H new ATOM 0 HZ3 LYS A 41 16.554 -36.968 -18.734 1.00 50.13 H new ATOM 667 N ASN A 42 11.724 -31.351 -17.709 1.00 50.01 N ATOM 668 CA ASN A 42 11.337 -29.950 -17.592 1.00 11.22 C ATOM 669 C ASN A 42 11.625 -29.421 -16.190 1.00 35.42 C ATOM 670 O ASN A 42 11.818 -28.222 -15.994 1.00 45.54 O ATOM 671 CB ASN A 42 9.852 -29.780 -17.918 1.00 74.40 C ATOM 672 CG ASN A 42 9.414 -30.643 -19.086 1.00 43.23 C ATOM 673 OD1 ASN A 42 10.147 -30.802 -20.063 1.00 33.31 O ATOM 674 ND2 ASN A 42 8.214 -31.204 -18.991 1.00 4.41 N ATOM 0 H ASN A 42 10.941 -32.000 -17.788 1.00 50.01 H new ATOM 0 HA ASN A 42 11.927 -29.376 -18.306 1.00 11.22 H new ATOM 0 HB2 ASN A 42 9.259 -30.034 -17.040 1.00 74.40 H new ATOM 0 HB3 ASN A 42 9.651 -28.734 -18.147 1.00 74.40 H new ATOM 0 HD21 ASN A 42 7.866 -31.794 -19.746 1.00 4.41 H new ATOM 0 HD22 ASN A 42 7.641 -31.045 -18.163 1.00 4.41 H new ATOM 681 N VAL A 43 11.651 -30.326 -15.216 1.00 62.22 N ATOM 682 CA VAL A 43 11.917 -29.952 -13.832 1.00 71.42 C ATOM 683 C VAL A 43 13.413 -29.810 -13.579 1.00 25.30 C ATOM 684 O VAL A 43 13.835 -29.105 -12.663 1.00 54.13 O ATOM 685 CB VAL A 43 11.337 -30.988 -12.850 1.00 41.41 C ATOM 686 CG1 VAL A 43 11.676 -30.611 -11.416 1.00 22.32 C ATOM 687 CG2 VAL A 43 9.833 -31.113 -13.036 1.00 35.04 C ATOM 0 H VAL A 43 11.491 -31.323 -15.360 1.00 62.22 H new ATOM 0 HA VAL A 43 11.431 -28.991 -13.664 1.00 71.42 H new ATOM 0 HB VAL A 43 11.788 -31.957 -13.062 1.00 41.41 H new ATOM 0 HG11 VAL A 43 11.258 -31.354 -10.736 1.00 22.32 H new ATOM 0 HG12 VAL A 43 12.759 -30.576 -11.295 1.00 22.32 H new ATOM 0 HG13 VAL A 43 11.254 -29.632 -11.188 1.00 22.32 H new ATOM 0 HG21 VAL A 43 9.440 -31.849 -12.335 1.00 35.04 H new ATOM 0 HG22 VAL A 43 9.362 -30.148 -12.851 1.00 35.04 H new ATOM 0 HG23 VAL A 43 9.618 -31.432 -14.056 1.00 35.04 H new ATOM 697 N GLY A 44 14.214 -30.486 -14.398 1.00 53.02 N ATOM 698 CA GLY A 44 15.656 -30.422 -14.247 1.00 14.41 C ATOM 699 C GLY A 44 16.315 -29.582 -15.324 1.00 34.45 C ATOM 700 O GLY A 44 17.522 -29.344 -15.283 1.00 4.30 O ATOM 0 H GLY A 44 13.889 -31.077 -15.163 1.00 53.02 H new ATOM 0 HA2 GLY A 44 15.898 -30.007 -13.268 1.00 14.41 H new ATOM 0 HA3 GLY A 44 16.066 -31.431 -14.276 1.00 14.41 H new ATOM 704 N LEU A 45 15.521 -29.134 -16.290 1.00 64.34 N ATOM 705 CA LEU A 45 16.035 -28.318 -17.385 1.00 2.23 C ATOM 706 C LEU A 45 16.048 -26.841 -17.003 1.00 33.12 C ATOM 707 O LEU A 45 16.686 -26.022 -17.665 1.00 23.21 O ATOM 708 CB LEU A 45 15.189 -28.524 -18.642 1.00 73.00 C ATOM 709 CG LEU A 45 15.649 -29.635 -19.586 1.00 61.22 C ATOM 710 CD1 LEU A 45 14.470 -30.194 -20.367 1.00 61.35 C ATOM 711 CD2 LEU A 45 16.723 -29.119 -20.534 1.00 35.45 C ATOM 0 H LEU A 45 14.520 -29.322 -16.338 1.00 64.34 H new ATOM 0 HA LEU A 45 17.059 -28.631 -17.589 1.00 2.23 H new ATOM 0 HB2 LEU A 45 14.165 -28.736 -18.336 1.00 73.00 H new ATOM 0 HB3 LEU A 45 15.168 -27.587 -19.199 1.00 73.00 H new ATOM 0 HG LEU A 45 16.077 -30.440 -18.988 1.00 61.22 H new ATOM 0 HD11 LEU A 45 14.817 -30.984 -21.034 1.00 61.35 H new ATOM 0 HD12 LEU A 45 13.735 -30.602 -19.673 1.00 61.35 H new ATOM 0 HD13 LEU A 45 14.013 -29.398 -20.955 1.00 61.35 H new ATOM 0 HD21 LEU A 45 17.039 -29.923 -21.199 1.00 35.45 H new ATOM 0 HD22 LEU A 45 16.321 -28.296 -21.125 1.00 35.45 H new ATOM 0 HD23 LEU A 45 17.579 -28.768 -19.958 1.00 35.45 H new ATOM 723 N THR A 46 15.339 -26.507 -15.929 1.00 1.33 N ATOM 724 CA THR A 46 15.269 -25.129 -15.458 1.00 23.45 C ATOM 725 C THR A 46 16.440 -24.803 -14.537 1.00 70.04 C ATOM 726 O THR A 46 16.900 -23.662 -14.482 1.00 41.30 O ATOM 727 CB THR A 46 13.951 -24.858 -14.708 1.00 60.13 C ATOM 728 OG1 THR A 46 12.895 -25.640 -15.277 1.00 55.40 O ATOM 729 CG2 THR A 46 13.587 -23.382 -14.770 1.00 61.44 C ATOM 0 H THR A 46 14.805 -27.172 -15.369 1.00 1.33 H new ATOM 0 HA THR A 46 15.315 -24.491 -16.340 1.00 23.45 H new ATOM 0 HB THR A 46 14.088 -25.138 -13.664 1.00 60.13 H new ATOM 0 HG1 THR A 46 12.061 -25.464 -14.794 1.00 55.40 H new ATOM 0 HG21 THR A 46 12.653 -23.215 -14.234 1.00 61.44 H new ATOM 0 HG22 THR A 46 14.380 -22.792 -14.310 1.00 61.44 H new ATOM 0 HG23 THR A 46 13.467 -23.080 -15.811 1.00 61.44 H new ATOM 737 N LEU A 47 16.919 -25.811 -13.817 1.00 33.12 N ATOM 738 CA LEU A 47 18.038 -25.631 -12.898 1.00 71.34 C ATOM 739 C LEU A 47 19.367 -25.664 -13.647 1.00 12.25 C ATOM 740 O LEU A 47 20.376 -25.150 -13.163 1.00 35.03 O ATOM 741 CB LEU A 47 18.019 -26.718 -11.822 1.00 1.54 C ATOM 742 CG LEU A 47 18.310 -28.141 -12.299 1.00 5.34 C ATOM 743 CD1 LEU A 47 19.809 -28.398 -12.327 1.00 41.22 C ATOM 744 CD2 LEU A 47 17.610 -29.156 -11.407 1.00 43.11 C ATOM 0 H LEU A 47 16.550 -26.761 -13.851 1.00 33.12 H new ATOM 0 HA LEU A 47 17.934 -24.656 -12.422 1.00 71.34 H new ATOM 0 HB2 LEU A 47 18.750 -26.456 -11.057 1.00 1.54 H new ATOM 0 HB3 LEU A 47 17.040 -26.710 -11.343 1.00 1.54 H new ATOM 0 HG LEU A 47 17.924 -28.250 -13.312 1.00 5.34 H new ATOM 0 HD11 LEU A 47 19.997 -29.416 -12.669 1.00 41.22 H new ATOM 0 HD12 LEU A 47 20.286 -27.693 -13.007 1.00 41.22 H new ATOM 0 HD13 LEU A 47 20.219 -28.270 -11.325 1.00 41.22 H new ATOM 0 HD21 LEU A 47 17.828 -30.163 -11.761 1.00 43.11 H new ATOM 0 HD22 LEU A 47 17.966 -29.047 -10.383 1.00 43.11 H new ATOM 0 HD23 LEU A 47 16.534 -28.986 -11.437 1.00 43.11 H new ATOM 756 N ARG A 48 19.359 -26.269 -14.830 1.00 22.24 N ATOM 757 CA ARG A 48 20.564 -26.368 -15.645 1.00 53.31 C ATOM 758 C ARG A 48 20.711 -25.146 -16.547 1.00 52.22 C ATOM 759 O ARG A 48 21.788 -24.881 -17.082 1.00 72.21 O ATOM 760 CB ARG A 48 20.528 -27.640 -16.494 1.00 22.03 C ATOM 761 CG ARG A 48 19.565 -27.563 -17.667 1.00 0.10 C ATOM 762 CD ARG A 48 19.528 -28.869 -18.444 1.00 63.44 C ATOM 763 NE ARG A 48 20.869 -29.378 -18.724 1.00 15.21 N ATOM 764 CZ ARG A 48 21.116 -30.624 -19.112 1.00 34.02 C ATOM 765 NH1 ARG A 48 20.118 -31.484 -19.266 1.00 24.04 N ATOM 766 NH2 ARG A 48 22.363 -31.012 -19.347 1.00 54.01 N ATOM 0 H ARG A 48 18.532 -26.698 -15.245 1.00 22.24 H new ATOM 0 HA ARG A 48 21.423 -26.410 -14.976 1.00 53.31 H new ATOM 0 HB2 ARG A 48 21.530 -27.844 -16.871 1.00 22.03 H new ATOM 0 HB3 ARG A 48 20.249 -28.482 -15.860 1.00 22.03 H new ATOM 0 HG2 ARG A 48 18.565 -27.326 -17.303 1.00 0.10 H new ATOM 0 HG3 ARG A 48 19.863 -26.752 -18.331 1.00 0.10 H new ATOM 0 HD2 ARG A 48 18.969 -29.613 -17.876 1.00 63.44 H new ATOM 0 HD3 ARG A 48 18.995 -28.718 -19.382 1.00 63.44 H new ATOM 0 HE ARG A 48 21.659 -28.741 -18.616 1.00 15.21 H new ATOM 0 HH11 ARG A 48 19.158 -31.189 -19.086 1.00 24.04 H new ATOM 0 HH12 ARG A 48 20.310 -32.440 -19.564 1.00 24.04 H new ATOM 0 HH21 ARG A 48 23.133 -30.353 -19.230 1.00 54.01 H new ATOM 0 HH22 ARG A 48 22.552 -31.969 -19.645 1.00 54.01 H new ATOM 780 N LYS A 49 19.621 -24.404 -16.712 1.00 72.14 N ATOM 781 CA LYS A 49 19.627 -23.210 -17.549 1.00 0.33 C ATOM 782 C LYS A 49 19.812 -21.954 -16.703 1.00 24.14 C ATOM 783 O LYS A 49 20.395 -20.968 -17.156 1.00 23.21 O ATOM 784 CB LYS A 49 18.324 -23.113 -18.345 1.00 71.02 C ATOM 785 CG LYS A 49 17.171 -22.519 -17.555 1.00 34.41 C ATOM 786 CD LYS A 49 15.928 -22.360 -18.415 1.00 65.05 C ATOM 787 CE LYS A 49 14.668 -22.294 -17.567 1.00 75.55 C ATOM 788 NZ LYS A 49 13.653 -21.374 -18.152 1.00 3.01 N ATOM 0 H LYS A 49 18.722 -24.609 -16.277 1.00 72.14 H new ATOM 0 HA LYS A 49 20.464 -23.287 -18.242 1.00 0.33 H new ATOM 0 HB2 LYS A 49 18.495 -22.506 -19.234 1.00 71.02 H new ATOM 0 HB3 LYS A 49 18.043 -24.109 -18.689 1.00 71.02 H new ATOM 0 HG2 LYS A 49 16.945 -23.159 -16.702 1.00 34.41 H new ATOM 0 HG3 LYS A 49 17.465 -21.548 -17.155 1.00 34.41 H new ATOM 0 HD2 LYS A 49 16.012 -21.453 -19.014 1.00 65.05 H new ATOM 0 HD3 LYS A 49 15.856 -23.196 -19.111 1.00 65.05 H new ATOM 0 HE2 LYS A 49 14.241 -23.293 -17.472 1.00 75.55 H new ATOM 0 HE3 LYS A 49 14.924 -21.960 -16.561 1.00 75.55 H new ATOM 0 HZ1 LYS A 49 12.823 -21.331 -17.527 1.00 3.01 H new ATOM 0 HZ2 LYS A 49 14.062 -20.423 -18.251 1.00 3.01 H new ATOM 0 HZ3 LYS A 49 13.364 -21.725 -19.087 1.00 3.01 H new ATOM 802 N LEU A 50 19.315 -21.997 -15.472 1.00 33.03 N ATOM 803 CA LEU A 50 19.427 -20.863 -14.561 1.00 51.11 C ATOM 804 C LEU A 50 20.823 -20.790 -13.951 1.00 62.33 C ATOM 805 O LEU A 50 21.285 -19.718 -13.559 1.00 72.13 O ATOM 806 CB LEU A 50 18.379 -20.968 -13.452 1.00 75.22 C ATOM 807 CG LEU A 50 18.850 -21.598 -12.141 1.00 13.53 C ATOM 808 CD1 LEU A 50 19.460 -20.542 -11.231 1.00 63.44 C ATOM 809 CD2 LEU A 50 17.696 -22.303 -11.443 1.00 12.43 C ATOM 0 H LEU A 50 18.830 -22.805 -15.081 1.00 33.03 H new ATOM 0 HA LEU A 50 19.252 -19.952 -15.133 1.00 51.11 H new ATOM 0 HB2 LEU A 50 18.005 -19.967 -13.237 1.00 75.22 H new ATOM 0 HB3 LEU A 50 17.537 -21.549 -13.829 1.00 75.22 H new ATOM 0 HG LEU A 50 19.616 -22.338 -12.370 1.00 13.53 H new ATOM 0 HD11 LEU A 50 19.790 -21.008 -10.303 1.00 63.44 H new ATOM 0 HD12 LEU A 50 20.313 -20.082 -11.729 1.00 63.44 H new ATOM 0 HD13 LEU A 50 18.714 -19.779 -11.009 1.00 63.44 H new ATOM 0 HD21 LEU A 50 18.050 -22.745 -10.512 1.00 12.43 H new ATOM 0 HD22 LEU A 50 16.907 -21.583 -11.226 1.00 12.43 H new ATOM 0 HD23 LEU A 50 17.303 -23.087 -12.091 1.00 12.43 H new ATOM 821 N ILE A 51 21.491 -21.937 -13.877 1.00 12.45 N ATOM 822 CA ILE A 51 22.835 -22.002 -13.318 1.00 5.12 C ATOM 823 C ILE A 51 23.782 -21.058 -14.052 1.00 21.22 C ATOM 824 O ILE A 51 24.714 -20.514 -13.461 1.00 62.04 O ATOM 825 CB ILE A 51 23.403 -23.432 -13.382 1.00 31.32 C ATOM 826 CG1 ILE A 51 22.953 -24.238 -12.161 1.00 52.23 C ATOM 827 CG2 ILE A 51 24.921 -23.396 -13.469 1.00 23.31 C ATOM 828 CD1 ILE A 51 23.073 -25.734 -12.347 1.00 70.21 C ATOM 0 H ILE A 51 21.123 -22.833 -14.197 1.00 12.45 H new ATOM 0 HA ILE A 51 22.758 -21.697 -12.274 1.00 5.12 H new ATOM 0 HB ILE A 51 23.019 -23.920 -14.278 1.00 31.32 H new ATOM 0 HG12 ILE A 51 23.548 -23.938 -11.298 1.00 52.23 H new ATOM 0 HG13 ILE A 51 21.916 -23.990 -11.934 1.00 52.23 H new ATOM 0 HG21 ILE A 51 25.307 -24.414 -13.513 1.00 23.31 H new ATOM 0 HG22 ILE A 51 25.221 -22.855 -14.366 1.00 23.31 H new ATOM 0 HG23 ILE A 51 25.324 -22.893 -12.590 1.00 23.31 H new ATOM 0 HD11 ILE A 51 22.737 -26.241 -11.443 1.00 70.21 H new ATOM 0 HD12 ILE A 51 22.456 -26.047 -13.189 1.00 70.21 H new ATOM 0 HD13 ILE A 51 24.113 -25.994 -12.543 1.00 70.21 H new ATOM 840 N GLY A 52 23.535 -20.867 -15.344 1.00 73.53 N ATOM 841 CA GLY A 52 24.373 -19.988 -16.138 1.00 15.40 C ATOM 842 C GLY A 52 24.195 -18.528 -15.768 1.00 23.55 C ATOM 843 O GLY A 52 24.946 -17.668 -16.228 1.00 72.53 O ATOM 0 H GLY A 52 22.769 -21.306 -15.855 1.00 73.53 H new ATOM 0 HA2 GLY A 52 25.418 -20.269 -16.005 1.00 15.40 H new ATOM 0 HA3 GLY A 52 24.139 -20.123 -17.194 1.00 15.40 H new ATOM 847 N SER A 53 23.199 -18.248 -14.934 1.00 12.01 N ATOM 848 CA SER A 53 22.922 -16.882 -14.506 1.00 53.31 C ATOM 849 C SER A 53 23.768 -16.510 -13.292 1.00 71.32 C ATOM 850 O SER A 53 24.227 -15.375 -13.165 1.00 21.23 O ATOM 851 CB SER A 53 21.437 -16.720 -14.176 1.00 13.43 C ATOM 852 OG SER A 53 20.640 -17.579 -14.972 1.00 62.51 O ATOM 0 H SER A 53 22.570 -18.949 -14.541 1.00 12.01 H new ATOM 0 HA SER A 53 23.180 -16.212 -15.326 1.00 53.31 H new ATOM 0 HB2 SER A 53 21.270 -16.938 -13.121 1.00 13.43 H new ATOM 0 HB3 SER A 53 21.136 -15.685 -14.339 1.00 13.43 H new ATOM 0 HG SER A 53 20.711 -18.496 -14.635 1.00 62.51 H new ATOM 858 N VAL A 54 23.970 -17.476 -12.402 1.00 21.43 N ATOM 859 CA VAL A 54 24.762 -17.253 -11.198 1.00 13.02 C ATOM 860 C VAL A 54 26.237 -17.547 -11.447 1.00 74.05 C ATOM 861 O VAL A 54 27.113 -16.832 -10.963 1.00 5.34 O ATOM 862 CB VAL A 54 24.266 -18.126 -10.030 1.00 71.30 C ATOM 863 CG1 VAL A 54 24.871 -17.655 -8.716 1.00 71.34 C ATOM 864 CG2 VAL A 54 22.746 -18.112 -9.962 1.00 42.22 C ATOM 0 H VAL A 54 23.596 -18.421 -12.492 1.00 21.43 H new ATOM 0 HA VAL A 54 24.644 -16.202 -10.932 1.00 13.02 H new ATOM 0 HB VAL A 54 24.590 -19.152 -10.204 1.00 71.30 H new ATOM 0 HG11 VAL A 54 24.509 -18.284 -7.903 1.00 71.34 H new ATOM 0 HG12 VAL A 54 25.958 -17.723 -8.771 1.00 71.34 H new ATOM 0 HG13 VAL A 54 24.581 -16.621 -8.532 1.00 71.34 H new ATOM 0 HG21 VAL A 54 22.413 -18.734 -9.131 1.00 42.22 H new ATOM 0 HG22 VAL A 54 22.398 -17.090 -9.812 1.00 42.22 H new ATOM 0 HG23 VAL A 54 22.336 -18.502 -10.894 1.00 42.22 H new ATOM 874 N ASP A 55 26.503 -18.604 -12.207 1.00 50.32 N ATOM 875 CA ASP A 55 27.873 -18.992 -12.523 1.00 74.33 C ATOM 876 C ASP A 55 28.622 -17.845 -13.195 1.00 33.44 C ATOM 877 O ASP A 55 29.836 -17.711 -13.043 1.00 10.23 O ATOM 878 CB ASP A 55 27.879 -20.223 -13.431 1.00 44.04 C ATOM 879 CG ASP A 55 29.141 -21.050 -13.276 1.00 53.25 C ATOM 880 OD1 ASP A 55 30.242 -20.464 -13.318 1.00 45.14 O ATOM 881 OD2 ASP A 55 29.026 -22.283 -13.114 1.00 50.11 O ATOM 0 H ASP A 55 25.789 -19.207 -12.615 1.00 50.32 H new ATOM 0 HA ASP A 55 28.381 -19.235 -11.590 1.00 74.33 H new ATOM 0 HB2 ASP A 55 27.012 -20.843 -13.204 1.00 44.04 H new ATOM 0 HB3 ASP A 55 27.781 -19.906 -14.469 1.00 44.04 H new ATOM 886 N ASP A 56 27.890 -17.022 -13.937 1.00 60.35 N ATOM 887 CA ASP A 56 28.485 -15.887 -14.632 1.00 50.44 C ATOM 888 C ASP A 56 28.774 -14.746 -13.661 1.00 62.23 C ATOM 889 O ASP A 56 29.688 -13.949 -13.878 1.00 30.04 O ATOM 890 CB ASP A 56 27.558 -15.401 -15.747 1.00 55.23 C ATOM 891 CG ASP A 56 28.220 -14.375 -16.645 1.00 51.53 C ATOM 892 OD1 ASP A 56 29.065 -14.770 -17.475 1.00 73.22 O ATOM 893 OD2 ASP A 56 27.894 -13.175 -16.518 1.00 21.54 O ATOM 0 H ASP A 56 26.884 -17.120 -14.073 1.00 60.35 H new ATOM 0 HA ASP A 56 29.427 -16.215 -15.071 1.00 50.44 H new ATOM 0 HB2 ASP A 56 27.239 -16.253 -16.347 1.00 55.23 H new ATOM 0 HB3 ASP A 56 26.660 -14.968 -15.306 1.00 55.23 H new ATOM 898 N LEU A 57 27.990 -14.674 -12.592 1.00 13.43 N ATOM 899 CA LEU A 57 28.161 -13.630 -11.587 1.00 54.30 C ATOM 900 C LEU A 57 28.959 -14.147 -10.395 1.00 4.21 C ATOM 901 O LEU A 57 29.062 -13.478 -9.365 1.00 73.34 O ATOM 902 CB LEU A 57 26.798 -13.117 -11.119 1.00 35.45 C ATOM 903 CG LEU A 57 26.143 -12.051 -11.997 1.00 41.14 C ATOM 904 CD1 LEU A 57 26.989 -10.787 -12.023 1.00 20.42 C ATOM 905 CD2 LEU A 57 25.929 -12.580 -13.408 1.00 60.10 C ATOM 0 H LEU A 57 27.230 -15.326 -12.398 1.00 13.43 H new ATOM 0 HA LEU A 57 28.715 -12.809 -12.042 1.00 54.30 H new ATOM 0 HB2 LEU A 57 26.119 -13.966 -11.046 1.00 35.45 H new ATOM 0 HB3 LEU A 57 26.911 -12.711 -10.114 1.00 35.45 H new ATOM 0 HG LEU A 57 25.170 -11.804 -11.571 1.00 41.14 H new ATOM 0 HD11 LEU A 57 26.507 -10.039 -12.653 1.00 20.42 H new ATOM 0 HD12 LEU A 57 27.091 -10.397 -11.010 1.00 20.42 H new ATOM 0 HD13 LEU A 57 27.976 -11.018 -12.424 1.00 20.42 H new ATOM 0 HD21 LEU A 57 25.462 -11.808 -14.019 1.00 60.10 H new ATOM 0 HD22 LEU A 57 26.890 -12.855 -13.843 1.00 60.10 H new ATOM 0 HD23 LEU A 57 25.282 -13.456 -13.374 1.00 60.10 H new ATOM 917 N LEU A 58 29.526 -15.340 -10.542 1.00 14.55 N ATOM 918 CA LEU A 58 30.318 -15.946 -9.478 1.00 22.24 C ATOM 919 C LEU A 58 31.380 -14.976 -8.968 1.00 74.15 C ATOM 920 O LEU A 58 31.414 -14.617 -7.791 1.00 63.42 O ATOM 921 CB LEU A 58 30.982 -17.230 -9.978 1.00 44.02 C ATOM 922 CG LEU A 58 30.405 -18.539 -9.439 1.00 55.00 C ATOM 923 CD1 LEU A 58 31.140 -19.731 -10.031 1.00 22.11 C ATOM 924 CD2 LEU A 58 30.475 -18.567 -7.919 1.00 63.22 C ATOM 0 H LEU A 58 29.452 -15.906 -11.387 1.00 14.55 H new ATOM 0 HA LEU A 58 29.648 -16.188 -8.653 1.00 22.24 H new ATOM 0 HB2 LEU A 58 30.917 -17.249 -11.066 1.00 44.02 H new ATOM 0 HB3 LEU A 58 32.041 -17.191 -9.722 1.00 44.02 H new ATOM 0 HG LEU A 58 29.358 -18.601 -9.736 1.00 55.00 H new ATOM 0 HD11 LEU A 58 30.715 -20.654 -9.635 1.00 22.11 H new ATOM 0 HD12 LEU A 58 31.037 -19.720 -11.116 1.00 22.11 H new ATOM 0 HD13 LEU A 58 32.196 -19.675 -9.767 1.00 22.11 H new ATOM 0 HD21 LEU A 58 30.060 -19.506 -7.553 1.00 63.22 H new ATOM 0 HD22 LEU A 58 31.514 -18.481 -7.601 1.00 63.22 H new ATOM 0 HD23 LEU A 58 29.901 -17.734 -7.513 1.00 63.22 H new ATOM 936 N PRO A 59 32.266 -14.539 -9.875 1.00 54.35 N ATOM 937 CA PRO A 59 33.343 -13.602 -9.542 1.00 53.11 C ATOM 938 C PRO A 59 32.820 -12.203 -9.234 1.00 73.12 C ATOM 939 O PRO A 59 33.572 -11.330 -8.800 1.00 73.43 O ATOM 940 CB PRO A 59 34.202 -13.585 -10.808 1.00 44.45 C ATOM 941 CG PRO A 59 33.269 -13.965 -11.905 1.00 72.33 C ATOM 942 CD PRO A 59 32.284 -14.925 -11.296 1.00 51.44 C ATOM 0 HA PRO A 59 33.885 -13.906 -8.647 1.00 53.11 H new ATOM 0 HB2 PRO A 59 34.634 -12.599 -10.980 1.00 44.45 H new ATOM 0 HB3 PRO A 59 35.032 -14.288 -10.733 1.00 44.45 H new ATOM 0 HG2 PRO A 59 32.762 -13.088 -12.307 1.00 72.33 H new ATOM 0 HG3 PRO A 59 33.807 -14.429 -12.732 1.00 72.33 H new ATOM 0 HD2 PRO A 59 31.298 -14.831 -11.750 1.00 51.44 H new ATOM 0 HD3 PRO A 59 32.598 -15.960 -11.427 1.00 51.44 H new ATOM 950 N SER A 60 31.526 -11.997 -9.461 1.00 3.41 N ATOM 951 CA SER A 60 30.903 -10.702 -9.211 1.00 25.14 C ATOM 952 C SER A 60 30.505 -10.565 -7.744 1.00 62.32 C ATOM 953 O SER A 60 30.069 -9.501 -7.304 1.00 4.24 O ATOM 954 CB SER A 60 29.674 -10.523 -10.103 1.00 42.35 C ATOM 955 OG SER A 60 29.972 -10.843 -11.451 1.00 51.35 O ATOM 0 H SER A 60 30.889 -12.710 -9.817 1.00 3.41 H new ATOM 0 HA SER A 60 31.630 -9.925 -9.447 1.00 25.14 H new ATOM 0 HB2 SER A 60 28.865 -11.160 -9.745 1.00 42.35 H new ATOM 0 HB3 SER A 60 29.321 -9.494 -10.040 1.00 42.35 H new ATOM 0 HG SER A 60 29.967 -10.025 -11.990 1.00 51.35 H new ATOM 961 N LEU A 61 30.658 -11.650 -6.993 1.00 31.12 N ATOM 962 CA LEU A 61 30.315 -11.653 -5.575 1.00 33.21 C ATOM 963 C LEU A 61 31.485 -12.149 -4.732 1.00 64.43 C ATOM 964 O LEU A 61 32.394 -12.820 -5.222 1.00 45.22 O ATOM 965 CB LEU A 61 29.086 -12.531 -5.329 1.00 64.22 C ATOM 966 CG LEU A 61 28.985 -13.797 -6.181 1.00 53.22 C ATOM 967 CD1 LEU A 61 29.691 -14.958 -5.498 1.00 75.15 C ATOM 968 CD2 LEU A 61 27.528 -14.141 -6.453 1.00 34.32 C ATOM 0 H LEU A 61 31.017 -12.539 -7.342 1.00 31.12 H new ATOM 0 HA LEU A 61 30.087 -10.629 -5.280 1.00 33.21 H new ATOM 0 HB2 LEU A 61 29.076 -12.822 -4.279 1.00 64.22 H new ATOM 0 HB3 LEU A 61 28.194 -11.929 -5.501 1.00 64.22 H new ATOM 0 HG LEU A 61 29.478 -13.611 -7.135 1.00 53.22 H new ATOM 0 HD11 LEU A 61 29.609 -15.850 -6.119 1.00 75.15 H new ATOM 0 HD12 LEU A 61 30.743 -14.711 -5.355 1.00 75.15 H new ATOM 0 HD13 LEU A 61 29.228 -15.146 -4.529 1.00 75.15 H new ATOM 0 HD21 LEU A 61 27.475 -15.044 -7.061 1.00 34.32 H new ATOM 0 HD22 LEU A 61 27.011 -14.308 -5.508 1.00 34.32 H new ATOM 0 HD23 LEU A 61 27.053 -13.317 -6.986 1.00 34.32 H new ATOM 980 N PRO A 62 31.464 -11.815 -3.433 1.00 74.35 N ATOM 981 CA PRO A 62 32.514 -12.219 -2.495 1.00 4.05 C ATOM 982 C PRO A 62 32.494 -13.717 -2.210 1.00 53.13 C ATOM 983 O PRO A 62 31.523 -14.405 -2.526 1.00 41.11 O ATOM 984 CB PRO A 62 32.180 -11.429 -1.227 1.00 34.44 C ATOM 985 CG PRO A 62 30.715 -11.171 -1.317 1.00 21.32 C ATOM 986 CD PRO A 62 30.411 -11.018 -2.781 1.00 60.24 C ATOM 0 HA PRO A 62 33.510 -12.019 -2.889 1.00 4.05 H new ATOM 0 HB2 PRO A 62 32.428 -11.997 -0.330 1.00 34.44 H new ATOM 0 HB3 PRO A 62 32.744 -10.497 -1.181 1.00 34.44 H new ATOM 0 HG2 PRO A 62 30.146 -11.994 -0.884 1.00 21.32 H new ATOM 0 HG3 PRO A 62 30.443 -10.271 -0.766 1.00 21.32 H new ATOM 0 HD2 PRO A 62 29.416 -11.390 -3.026 1.00 60.24 H new ATOM 0 HD3 PRO A 62 30.447 -9.974 -3.092 1.00 60.24 H new ATOM 994 N SER A 63 33.571 -14.216 -1.612 1.00 34.01 N ATOM 995 CA SER A 63 33.677 -15.634 -1.288 1.00 40.11 C ATOM 996 C SER A 63 32.528 -16.073 -0.385 1.00 42.41 C ATOM 997 O SER A 63 32.152 -17.244 -0.366 1.00 33.40 O ATOM 998 CB SER A 63 35.016 -15.924 -0.607 1.00 13.13 C ATOM 999 OG SER A 63 35.000 -15.506 0.747 1.00 0.32 O ATOM 0 H SER A 63 34.382 -13.660 -1.342 1.00 34.01 H new ATOM 0 HA SER A 63 33.620 -16.199 -2.218 1.00 40.11 H new ATOM 0 HB2 SER A 63 35.230 -16.991 -0.659 1.00 13.13 H new ATOM 0 HB3 SER A 63 35.817 -15.412 -1.140 1.00 13.13 H new ATOM 0 HG SER A 63 35.866 -15.704 1.161 1.00 0.32 H new ATOM 1005 N SER A 64 31.975 -15.123 0.362 1.00 4.43 N ATOM 1006 CA SER A 64 30.872 -15.410 1.271 1.00 31.22 C ATOM 1007 C SER A 64 29.752 -16.153 0.548 1.00 1.32 C ATOM 1008 O SER A 64 29.082 -17.006 1.130 1.00 54.44 O ATOM 1009 CB SER A 64 30.331 -14.114 1.877 1.00 2.32 C ATOM 1010 OG SER A 64 30.669 -14.013 3.250 1.00 41.53 O ATOM 0 H SER A 64 32.273 -14.148 0.356 1.00 4.43 H new ATOM 0 HA SER A 64 31.250 -16.046 2.071 1.00 31.22 H new ATOM 0 HB2 SER A 64 30.736 -13.259 1.336 1.00 2.32 H new ATOM 0 HB3 SER A 64 29.248 -14.080 1.762 1.00 2.32 H new ATOM 0 HG SER A 64 30.313 -13.175 3.614 1.00 41.53 H new ATOM 1016 N SER A 65 29.556 -15.821 -0.724 1.00 61.30 N ATOM 1017 CA SER A 65 28.515 -16.453 -1.527 1.00 5.02 C ATOM 1018 C SER A 65 29.127 -17.319 -2.624 1.00 34.41 C ATOM 1019 O SER A 65 28.520 -18.292 -3.072 1.00 33.41 O ATOM 1020 CB SER A 65 27.605 -15.391 -2.147 1.00 65.24 C ATOM 1021 OG SER A 65 26.708 -14.863 -1.186 1.00 22.42 O ATOM 0 H SER A 65 30.104 -15.118 -1.221 1.00 61.30 H new ATOM 0 HA SER A 65 27.922 -17.092 -0.872 1.00 5.02 H new ATOM 0 HB2 SER A 65 28.211 -14.587 -2.564 1.00 65.24 H new ATOM 0 HB3 SER A 65 27.043 -15.827 -2.973 1.00 65.24 H new ATOM 0 HG SER A 65 25.790 -14.930 -1.523 1.00 22.42 H new ATOM 1027 N ARG A 66 30.332 -16.958 -3.052 1.00 32.32 N ATOM 1028 CA ARG A 66 31.026 -17.701 -4.097 1.00 74.01 C ATOM 1029 C ARG A 66 31.127 -19.180 -3.737 1.00 74.42 C ATOM 1030 O ARG A 66 30.617 -20.042 -4.455 1.00 10.12 O ATOM 1031 CB ARG A 66 32.424 -17.123 -4.320 1.00 43.14 C ATOM 1032 CG ARG A 66 33.000 -17.435 -5.692 1.00 3.30 C ATOM 1033 CD ARG A 66 34.508 -17.623 -5.633 1.00 61.42 C ATOM 1034 NE ARG A 66 34.971 -18.630 -6.585 1.00 2.22 N ATOM 1035 CZ ARG A 66 36.128 -19.273 -6.470 1.00 33.15 C ATOM 1036 NH1 ARG A 66 36.934 -19.016 -5.449 1.00 31.43 N ATOM 1037 NH2 ARG A 66 36.479 -20.176 -7.376 1.00 45.33 N ATOM 0 H ARG A 66 30.848 -16.156 -2.691 1.00 32.32 H new ATOM 0 HA ARG A 66 30.450 -17.608 -5.018 1.00 74.01 H new ATOM 0 HB2 ARG A 66 32.386 -16.042 -4.188 1.00 43.14 H new ATOM 0 HB3 ARG A 66 33.096 -17.514 -3.556 1.00 43.14 H new ATOM 0 HG2 ARG A 66 32.535 -18.338 -6.086 1.00 3.30 H new ATOM 0 HG3 ARG A 66 32.760 -16.626 -6.381 1.00 3.30 H new ATOM 0 HD2 ARG A 66 35.000 -16.673 -5.842 1.00 61.42 H new ATOM 0 HD3 ARG A 66 34.798 -17.917 -4.624 1.00 61.42 H new ATOM 0 HE ARG A 66 34.373 -18.851 -7.381 1.00 2.22 H new ATOM 0 HH11 ARG A 66 36.666 -18.323 -4.750 1.00 31.43 H new ATOM 0 HH12 ARG A 66 37.822 -19.511 -5.363 1.00 31.43 H new ATOM 0 HH21 ARG A 66 35.861 -20.377 -8.162 1.00 45.33 H new ATOM 0 HH22 ARG A 66 37.367 -20.669 -7.287 1.00 45.33 H new ATOM 1051 N THR A 67 31.788 -19.469 -2.621 1.00 3.02 N ATOM 1052 CA THR A 67 31.958 -20.843 -2.166 1.00 71.23 C ATOM 1053 C THR A 67 30.620 -21.570 -2.102 1.00 34.21 C ATOM 1054 O THR A 67 30.556 -22.787 -2.271 1.00 31.31 O ATOM 1055 CB THR A 67 32.626 -20.898 -0.780 1.00 2.14 C ATOM 1056 OG1 THR A 67 33.731 -19.988 -0.732 1.00 30.11 O ATOM 1057 CG2 THR A 67 33.109 -22.306 -0.467 1.00 34.35 C ATOM 0 H THR A 67 32.215 -18.769 -2.015 1.00 3.02 H new ATOM 0 HA THR A 67 32.604 -21.338 -2.891 1.00 71.23 H new ATOM 0 HB THR A 67 31.886 -20.610 -0.033 1.00 2.14 H new ATOM 0 HG1 THR A 67 34.149 -20.028 0.153 1.00 30.11 H new ATOM 0 HG21 THR A 67 33.577 -22.320 0.517 1.00 34.35 H new ATOM 0 HG22 THR A 67 32.262 -22.992 -0.475 1.00 34.35 H new ATOM 0 HG23 THR A 67 33.835 -22.617 -1.218 1.00 34.35 H new ATOM 1065 N GLU A 68 29.553 -20.816 -1.857 1.00 53.21 N ATOM 1066 CA GLU A 68 28.215 -21.390 -1.771 1.00 23.34 C ATOM 1067 C GLU A 68 27.663 -21.694 -3.160 1.00 72.42 C ATOM 1068 O GLU A 68 27.096 -22.762 -3.394 1.00 71.21 O ATOM 1069 CB GLU A 68 27.273 -20.437 -1.033 1.00 2.23 C ATOM 1070 CG GLU A 68 25.810 -20.839 -1.118 1.00 44.04 C ATOM 1071 CD GLU A 68 25.532 -22.173 -0.453 1.00 63.03 C ATOM 1072 OE1 GLU A 68 26.037 -23.201 -0.953 1.00 14.32 O ATOM 1073 OE2 GLU A 68 24.811 -22.190 0.566 1.00 53.35 O ATOM 0 H GLU A 68 29.589 -19.807 -1.715 1.00 53.21 H new ATOM 0 HA GLU A 68 28.284 -22.324 -1.214 1.00 23.34 H new ATOM 0 HB2 GLU A 68 27.567 -20.389 0.015 1.00 2.23 H new ATOM 0 HB3 GLU A 68 27.390 -19.434 -1.444 1.00 2.23 H new ATOM 0 HG2 GLU A 68 25.198 -20.069 -0.649 1.00 44.04 H new ATOM 0 HG3 GLU A 68 25.511 -20.890 -2.165 1.00 44.04 H new ATOM 1080 N ILE A 69 27.832 -20.748 -4.078 1.00 20.33 N ATOM 1081 CA ILE A 69 27.351 -20.915 -5.444 1.00 2.24 C ATOM 1082 C ILE A 69 28.118 -22.017 -6.166 1.00 22.32 C ATOM 1083 O ILE A 69 27.522 -22.900 -6.782 1.00 11.03 O ATOM 1084 CB ILE A 69 27.476 -19.607 -6.248 1.00 34.05 C ATOM 1085 CG1 ILE A 69 26.671 -18.492 -5.577 1.00 34.02 C ATOM 1086 CG2 ILE A 69 27.007 -19.819 -7.679 1.00 55.22 C ATOM 1087 CD1 ILE A 69 27.408 -17.173 -5.507 1.00 13.04 C ATOM 0 H ILE A 69 28.298 -19.858 -3.901 1.00 20.33 H new ATOM 0 HA ILE A 69 26.299 -21.192 -5.377 1.00 2.24 H new ATOM 0 HB ILE A 69 28.524 -19.309 -6.270 1.00 34.05 H new ATOM 0 HG12 ILE A 69 25.738 -18.349 -6.123 1.00 34.02 H new ATOM 0 HG13 ILE A 69 26.405 -18.804 -4.567 1.00 34.02 H new ATOM 0 HG21 ILE A 69 27.101 -18.886 -8.235 1.00 55.22 H new ATOM 0 HG22 ILE A 69 27.619 -20.587 -8.152 1.00 55.22 H new ATOM 0 HG23 ILE A 69 25.964 -20.136 -7.677 1.00 55.22 H new ATOM 0 HD11 ILE A 69 26.778 -16.429 -5.019 1.00 13.04 H new ATOM 0 HD12 ILE A 69 28.328 -17.300 -4.936 1.00 13.04 H new ATOM 0 HD13 ILE A 69 27.651 -16.838 -6.515 1.00 13.04 H new ATOM 1099 N GLU A 70 29.444 -21.960 -6.084 1.00 12.13 N ATOM 1100 CA GLU A 70 30.292 -22.955 -6.729 1.00 42.12 C ATOM 1101 C GLU A 70 29.865 -24.368 -6.342 1.00 53.33 C ATOM 1102 O GLU A 70 29.932 -25.292 -7.151 1.00 42.14 O ATOM 1103 CB GLU A 70 31.758 -22.732 -6.349 1.00 54.45 C ATOM 1104 CG GLU A 70 32.709 -22.789 -7.533 1.00 55.42 C ATOM 1105 CD GLU A 70 32.969 -21.423 -8.139 1.00 10.14 C ATOM 1106 OE1 GLU A 70 32.738 -20.411 -7.444 1.00 32.51 O ATOM 1107 OE2 GLU A 70 33.405 -21.366 -9.308 1.00 35.32 O ATOM 0 H GLU A 70 29.953 -21.236 -5.578 1.00 12.13 H new ATOM 0 HA GLU A 70 30.182 -22.843 -7.808 1.00 42.12 H new ATOM 0 HB2 GLU A 70 31.855 -21.762 -5.862 1.00 54.45 H new ATOM 0 HB3 GLU A 70 32.054 -23.486 -5.619 1.00 54.45 H new ATOM 0 HG2 GLU A 70 33.655 -23.227 -7.214 1.00 55.42 H new ATOM 0 HG3 GLU A 70 32.294 -23.448 -8.296 1.00 55.42 H new ATOM 1114 N GLY A 71 29.425 -24.527 -5.098 1.00 12.24 N ATOM 1115 CA GLY A 71 28.994 -25.829 -4.624 1.00 35.00 C ATOM 1116 C GLY A 71 27.535 -26.104 -4.931 1.00 52.23 C ATOM 1117 O GLY A 71 27.166 -27.226 -5.281 1.00 1.33 O ATOM 0 H GLY A 71 29.359 -23.777 -4.410 1.00 12.24 H new ATOM 0 HA2 GLY A 71 29.611 -26.602 -5.083 1.00 35.00 H new ATOM 0 HA3 GLY A 71 29.154 -25.891 -3.548 1.00 35.00 H new ATOM 1121 N THR A 72 26.700 -25.077 -4.800 1.00 23.31 N ATOM 1122 CA THR A 72 25.273 -25.214 -5.063 1.00 44.21 C ATOM 1123 C THR A 72 25.016 -25.580 -6.520 1.00 74.31 C ATOM 1124 O THR A 72 24.304 -26.542 -6.811 1.00 5.24 O ATOM 1125 CB THR A 72 24.514 -23.916 -4.730 1.00 50.41 C ATOM 1126 OG1 THR A 72 24.650 -23.612 -3.337 1.00 40.04 O ATOM 1127 CG2 THR A 72 23.040 -24.045 -5.085 1.00 2.35 C ATOM 0 H THR A 72 26.988 -24.141 -4.513 1.00 23.31 H new ATOM 0 HA THR A 72 24.908 -26.015 -4.420 1.00 44.21 H new ATOM 0 HB THR A 72 24.944 -23.108 -5.321 1.00 50.41 H new ATOM 0 HG1 THR A 72 25.584 -23.388 -3.141 1.00 40.04 H new ATOM 0 HG21 THR A 72 22.524 -23.116 -4.841 1.00 2.35 H new ATOM 0 HG22 THR A 72 22.939 -24.247 -6.151 1.00 2.35 H new ATOM 0 HG23 THR A 72 22.599 -24.865 -4.517 1.00 2.35 H new ATOM 1135 N GLN A 73 25.599 -24.809 -7.432 1.00 13.43 N ATOM 1136 CA GLN A 73 25.431 -25.054 -8.859 1.00 41.43 C ATOM 1137 C GLN A 73 25.933 -26.444 -9.236 1.00 14.14 C ATOM 1138 O GLN A 73 25.570 -26.985 -10.280 1.00 52.14 O ATOM 1139 CB GLN A 73 26.176 -23.993 -9.671 1.00 43.31 C ATOM 1140 CG GLN A 73 25.830 -22.567 -9.272 1.00 64.21 C ATOM 1141 CD GLN A 73 24.504 -22.107 -9.843 1.00 53.11 C ATOM 1142 OE1 GLN A 73 24.461 -21.344 -10.809 1.00 5.24 O ATOM 1143 NE2 GLN A 73 23.410 -22.570 -9.248 1.00 43.52 N ATOM 0 H GLN A 73 26.192 -24.010 -7.208 1.00 13.43 H new ATOM 0 HA GLN A 73 24.367 -24.997 -9.089 1.00 41.43 H new ATOM 0 HB2 GLN A 73 27.249 -24.144 -9.553 1.00 43.31 H new ATOM 0 HB3 GLN A 73 25.949 -24.131 -10.728 1.00 43.31 H new ATOM 0 HG2 GLN A 73 25.797 -22.496 -8.185 1.00 64.21 H new ATOM 0 HG3 GLN A 73 26.620 -21.897 -9.612 1.00 64.21 H new ATOM 0 HE21 GLN A 73 23.491 -23.200 -8.450 1.00 43.52 H new ATOM 0 HE22 GLN A 73 22.489 -22.295 -9.589 1.00 43.52 H new ATOM 1152 N LYS A 74 26.769 -27.018 -8.378 1.00 3.23 N ATOM 1153 CA LYS A 74 27.321 -28.346 -8.618 1.00 51.15 C ATOM 1154 C LYS A 74 26.345 -29.430 -8.171 1.00 4.44 C ATOM 1155 O LYS A 74 26.040 -30.355 -8.925 1.00 4.25 O ATOM 1156 CB LYS A 74 28.653 -28.508 -7.883 1.00 20.40 C ATOM 1157 CG LYS A 74 29.095 -29.954 -7.736 1.00 75.34 C ATOM 1158 CD LYS A 74 28.637 -30.546 -6.413 1.00 43.45 C ATOM 1159 CE LYS A 74 27.856 -31.834 -6.619 1.00 55.13 C ATOM 1160 NZ LYS A 74 28.754 -32.991 -6.885 1.00 30.51 N ATOM 0 H LYS A 74 27.080 -26.584 -7.509 1.00 3.23 H new ATOM 0 HA LYS A 74 27.490 -28.454 -9.689 1.00 51.15 H new ATOM 0 HB2 LYS A 74 29.424 -27.954 -8.419 1.00 20.40 H new ATOM 0 HB3 LYS A 74 28.569 -28.060 -6.893 1.00 20.40 H new ATOM 0 HG2 LYS A 74 28.691 -30.544 -8.559 1.00 75.34 H new ATOM 0 HG3 LYS A 74 30.181 -30.012 -7.805 1.00 75.34 H new ATOM 0 HD2 LYS A 74 29.504 -30.742 -5.782 1.00 43.45 H new ATOM 0 HD3 LYS A 74 28.015 -29.823 -5.885 1.00 43.45 H new ATOM 0 HE2 LYS A 74 27.253 -32.038 -5.734 1.00 55.13 H new ATOM 0 HE3 LYS A 74 27.166 -31.711 -7.454 1.00 55.13 H new ATOM 0 HZ1 LYS A 74 28.194 -33.788 -7.250 1.00 30.51 H new ATOM 0 HZ2 LYS A 74 29.471 -32.720 -7.588 1.00 30.51 H new ATOM 0 HZ3 LYS A 74 29.225 -33.275 -6.002 1.00 30.51 H new ATOM 1174 N LEU A 75 25.858 -29.309 -6.941 1.00 11.32 N ATOM 1175 CA LEU A 75 24.915 -30.278 -6.393 1.00 11.40 C ATOM 1176 C LEU A 75 23.566 -30.184 -7.099 1.00 0.20 C ATOM 1177 O LEU A 75 22.741 -31.094 -7.008 1.00 12.23 O ATOM 1178 CB LEU A 75 24.734 -30.050 -4.891 1.00 42.11 C ATOM 1179 CG LEU A 75 23.693 -29.004 -4.491 1.00 74.33 C ATOM 1180 CD1 LEU A 75 22.351 -29.666 -4.214 1.00 44.43 C ATOM 1181 CD2 LEU A 75 24.164 -28.220 -3.275 1.00 52.14 C ATOM 0 H LEU A 75 26.100 -28.550 -6.304 1.00 11.32 H new ATOM 0 HA LEU A 75 25.321 -31.276 -6.557 1.00 11.40 H new ATOM 0 HB2 LEU A 75 24.461 -30.999 -4.430 1.00 42.11 H new ATOM 0 HB3 LEU A 75 25.695 -29.756 -4.470 1.00 42.11 H new ATOM 0 HG LEU A 75 23.568 -28.308 -5.320 1.00 74.33 H new ATOM 0 HD11 LEU A 75 21.622 -28.907 -3.931 1.00 44.43 H new ATOM 0 HD12 LEU A 75 22.008 -30.182 -5.111 1.00 44.43 H new ATOM 0 HD13 LEU A 75 22.461 -30.385 -3.402 1.00 44.43 H new ATOM 0 HD21 LEU A 75 23.410 -27.480 -3.005 1.00 52.14 H new ATOM 0 HD22 LEU A 75 24.318 -28.903 -2.439 1.00 52.14 H new ATOM 0 HD23 LEU A 75 25.101 -27.715 -3.509 1.00 52.14 H new ATOM 1193 N LEU A 76 23.349 -29.079 -7.804 1.00 70.34 N ATOM 1194 CA LEU A 76 22.101 -28.867 -8.529 1.00 33.12 C ATOM 1195 C LEU A 76 21.861 -29.984 -9.540 1.00 2.12 C ATOM 1196 O LEU A 76 20.719 -30.328 -9.840 1.00 31.20 O ATOM 1197 CB LEU A 76 22.126 -27.514 -9.243 1.00 31.44 C ATOM 1198 CG LEU A 76 21.034 -26.523 -8.840 1.00 51.40 C ATOM 1199 CD1 LEU A 76 21.051 -26.291 -7.337 1.00 75.40 C ATOM 1200 CD2 LEU A 76 21.207 -25.207 -9.586 1.00 34.52 C ATOM 0 H LEU A 76 24.021 -28.316 -7.889 1.00 70.34 H new ATOM 0 HA LEU A 76 21.285 -28.875 -7.807 1.00 33.12 H new ATOM 0 HB2 LEU A 76 23.095 -27.049 -9.064 1.00 31.44 H new ATOM 0 HB3 LEU A 76 22.051 -27.690 -10.316 1.00 31.44 H new ATOM 0 HG LEU A 76 20.067 -26.948 -9.110 1.00 51.40 H new ATOM 0 HD11 LEU A 76 20.267 -25.583 -7.069 1.00 75.40 H new ATOM 0 HD12 LEU A 76 20.879 -27.236 -6.821 1.00 75.40 H new ATOM 0 HD13 LEU A 76 22.020 -25.888 -7.042 1.00 75.40 H new ATOM 0 HD21 LEU A 76 20.421 -24.513 -9.287 1.00 34.52 H new ATOM 0 HD22 LEU A 76 22.180 -24.778 -9.346 1.00 34.52 H new ATOM 0 HD23 LEU A 76 21.144 -25.386 -10.659 1.00 34.52 H new ATOM 1212 N ASN A 77 22.947 -30.547 -10.060 1.00 31.22 N ATOM 1213 CA ASN A 77 22.855 -31.627 -11.036 1.00 12.10 C ATOM 1214 C ASN A 77 22.815 -32.985 -10.343 1.00 25.34 C ATOM 1215 O ASN A 77 22.823 -34.029 -10.996 1.00 11.13 O ATOM 1216 CB ASN A 77 24.039 -31.570 -12.004 1.00 14.24 C ATOM 1217 CG ASN A 77 23.812 -30.588 -13.137 1.00 72.33 C ATOM 1218 OD1 ASN A 77 23.335 -30.961 -14.209 1.00 53.44 O ATOM 1219 ND2 ASN A 77 24.154 -29.327 -12.905 1.00 2.44 N ATOM 0 H ASN A 77 23.900 -30.273 -9.822 1.00 31.22 H new ATOM 0 HA ASN A 77 21.929 -31.498 -11.597 1.00 12.10 H new ATOM 0 HB2 ASN A 77 24.939 -31.288 -11.457 1.00 14.24 H new ATOM 0 HB3 ASN A 77 24.215 -32.563 -12.417 1.00 14.24 H new ATOM 0 HD21 ASN A 77 24.025 -28.622 -13.631 1.00 2.44 H new ATOM 0 HD22 ASN A 77 24.546 -29.063 -12.001 1.00 2.44 H new ATOM 1226 N LYS A 78 22.773 -32.965 -9.015 1.00 10.53 N ATOM 1227 CA LYS A 78 22.730 -34.193 -8.231 1.00 24.22 C ATOM 1228 C LYS A 78 21.357 -34.386 -7.596 1.00 31.11 C ATOM 1229 O LYS A 78 20.980 -35.502 -7.237 1.00 12.21 O ATOM 1230 CB LYS A 78 23.807 -34.167 -7.144 1.00 3.42 C ATOM 1231 CG LYS A 78 25.186 -33.794 -7.662 1.00 74.41 C ATOM 1232 CD LYS A 78 25.760 -34.885 -8.551 1.00 2.40 C ATOM 1233 CE LYS A 78 26.311 -36.040 -7.730 1.00 64.30 C ATOM 1234 NZ LYS A 78 26.687 -37.200 -8.586 1.00 54.42 N ATOM 0 H LYS A 78 22.768 -32.110 -8.459 1.00 10.53 H new ATOM 0 HA LYS A 78 22.921 -35.030 -8.903 1.00 24.22 H new ATOM 0 HB2 LYS A 78 23.514 -33.456 -6.371 1.00 3.42 H new ATOM 0 HB3 LYS A 78 23.859 -35.148 -6.672 1.00 3.42 H new ATOM 0 HG2 LYS A 78 25.125 -32.861 -8.222 1.00 74.41 H new ATOM 0 HG3 LYS A 78 25.857 -33.618 -6.821 1.00 74.41 H new ATOM 0 HD2 LYS A 78 24.985 -35.253 -9.224 1.00 2.40 H new ATOM 0 HD3 LYS A 78 26.552 -34.469 -9.174 1.00 2.40 H new ATOM 0 HE2 LYS A 78 27.184 -35.704 -7.170 1.00 64.30 H new ATOM 0 HE3 LYS A 78 25.566 -36.354 -6.999 1.00 64.30 H new ATOM 0 HZ1 LYS A 78 27.058 -37.966 -7.989 1.00 54.42 H new ATOM 0 HZ2 LYS A 78 25.849 -37.537 -9.101 1.00 54.42 H new ATOM 0 HZ3 LYS A 78 27.417 -36.907 -9.267 1.00 54.42 H new ATOM 1248 N ASP A 79 20.614 -33.293 -7.462 1.00 34.43 N ATOM 1249 CA ASP A 79 19.281 -33.343 -6.872 1.00 75.15 C ATOM 1250 C ASP A 79 18.313 -34.097 -7.780 1.00 0.51 C ATOM 1251 O ASP A 79 17.254 -34.546 -7.339 1.00 41.25 O ATOM 1252 CB ASP A 79 18.760 -31.928 -6.615 1.00 5.02 C ATOM 1253 CG ASP A 79 19.629 -31.161 -5.638 1.00 3.14 C ATOM 1254 OD1 ASP A 79 20.461 -31.797 -4.957 1.00 75.52 O ATOM 1255 OD2 ASP A 79 19.477 -29.924 -5.552 1.00 65.04 O ATOM 0 H ASP A 79 20.912 -32.362 -7.754 1.00 34.43 H new ATOM 0 HA ASP A 79 19.350 -33.874 -5.923 1.00 75.15 H new ATOM 0 HB2 ASP A 79 18.712 -31.384 -7.559 1.00 5.02 H new ATOM 0 HB3 ASP A 79 17.743 -31.983 -6.227 1.00 5.02 H new ATOM 1260 N LEU A 80 18.683 -34.230 -9.049 1.00 33.42 N ATOM 1261 CA LEU A 80 17.847 -34.929 -10.020 1.00 2.34 C ATOM 1262 C LEU A 80 18.457 -36.276 -10.394 1.00 10.15 C ATOM 1263 O LEU A 80 17.771 -37.157 -10.911 1.00 13.14 O ATOM 1264 CB LEU A 80 17.665 -34.073 -11.274 1.00 52.32 C ATOM 1265 CG LEU A 80 18.822 -33.135 -11.621 1.00 14.22 C ATOM 1266 CD1 LEU A 80 20.087 -33.930 -11.903 1.00 41.41 C ATOM 1267 CD2 LEU A 80 18.461 -32.261 -12.814 1.00 31.44 C ATOM 0 H LEU A 80 19.555 -33.864 -9.430 1.00 33.42 H new ATOM 0 HA LEU A 80 16.873 -35.106 -9.564 1.00 2.34 H new ATOM 0 HB2 LEU A 80 17.496 -34.737 -12.121 1.00 52.32 H new ATOM 0 HB3 LEU A 80 16.762 -33.474 -11.153 1.00 52.32 H new ATOM 0 HG LEU A 80 19.008 -32.487 -10.765 1.00 14.22 H new ATOM 0 HD11 LEU A 80 20.900 -33.246 -12.148 1.00 41.41 H new ATOM 0 HD12 LEU A 80 20.356 -34.511 -11.021 1.00 41.41 H new ATOM 0 HD13 LEU A 80 19.914 -34.603 -12.742 1.00 41.41 H new ATOM 0 HD21 LEU A 80 19.296 -31.600 -13.047 1.00 31.44 H new ATOM 0 HD22 LEU A 80 18.247 -32.893 -13.676 1.00 31.44 H new ATOM 0 HD23 LEU A 80 17.581 -31.664 -12.574 1.00 31.44 H new ATOM 1279 N ALA A 81 19.750 -36.429 -10.126 1.00 72.14 N ATOM 1280 CA ALA A 81 20.451 -37.670 -10.431 1.00 30.22 C ATOM 1281 C ALA A 81 19.790 -38.858 -9.739 1.00 4.20 C ATOM 1282 O ALA A 81 19.831 -39.981 -10.241 1.00 3.45 O ATOM 1283 CB ALA A 81 21.913 -37.565 -10.022 1.00 14.45 C ATOM 0 H ALA A 81 20.333 -35.709 -9.699 1.00 72.14 H new ATOM 0 HA ALA A 81 20.397 -37.834 -11.507 1.00 30.22 H new ATOM 0 HB1 ALA A 81 22.424 -38.499 -10.256 1.00 14.45 H new ATOM 0 HB2 ALA A 81 22.385 -36.747 -10.566 1.00 14.45 H new ATOM 0 HB3 ALA A 81 21.978 -37.374 -8.951 1.00 14.45 H new ATOM 1289 N GLU A 82 19.183 -38.602 -8.585 1.00 0.55 N ATOM 1290 CA GLU A 82 18.515 -39.651 -7.824 1.00 23.31 C ATOM 1291 C GLU A 82 17.040 -39.743 -8.203 1.00 30.21 C ATOM 1292 O GLU A 82 16.441 -40.819 -8.157 1.00 1.41 O ATOM 1293 CB GLU A 82 18.652 -39.390 -6.323 1.00 1.34 C ATOM 1294 CG GLU A 82 20.080 -39.119 -5.880 1.00 21.04 C ATOM 1295 CD GLU A 82 20.990 -40.316 -6.079 1.00 14.02 C ATOM 1296 OE1 GLU A 82 20.855 -41.297 -5.318 1.00 43.02 O ATOM 1297 OE2 GLU A 82 21.836 -40.271 -6.996 1.00 73.14 O ATOM 0 H GLU A 82 19.140 -37.677 -8.156 1.00 0.55 H new ATOM 0 HA GLU A 82 18.994 -40.600 -8.065 1.00 23.31 H new ATOM 0 HB2 GLU A 82 18.029 -38.538 -6.053 1.00 1.34 H new ATOM 0 HB3 GLU A 82 18.268 -40.252 -5.776 1.00 1.34 H new ATOM 0 HG2 GLU A 82 20.475 -38.270 -6.439 1.00 21.04 H new ATOM 0 HG3 GLU A 82 20.082 -38.837 -4.827 1.00 21.04 H new ATOM 1304 N LEU A 83 16.460 -38.608 -8.577 1.00 33.21 N ATOM 1305 CA LEU A 83 15.054 -38.559 -8.964 1.00 11.13 C ATOM 1306 C LEU A 83 14.814 -39.348 -10.247 1.00 23.12 C ATOM 1307 O LEU A 83 13.845 -40.101 -10.352 1.00 43.33 O ATOM 1308 CB LEU A 83 14.607 -37.108 -9.153 1.00 22.22 C ATOM 1309 CG LEU A 83 13.335 -36.899 -9.975 1.00 31.42 C ATOM 1310 CD1 LEU A 83 12.202 -37.757 -9.432 1.00 41.41 C ATOM 1311 CD2 LEU A 83 12.939 -35.430 -9.981 1.00 32.14 C ATOM 0 H LEU A 83 16.941 -37.710 -8.621 1.00 33.21 H new ATOM 0 HA LEU A 83 14.467 -39.013 -8.165 1.00 11.13 H new ATOM 0 HB2 LEU A 83 14.457 -36.664 -8.169 1.00 22.22 H new ATOM 0 HB3 LEU A 83 15.418 -36.558 -9.630 1.00 22.22 H new ATOM 0 HG LEU A 83 13.534 -37.204 -11.002 1.00 31.42 H new ATOM 0 HD11 LEU A 83 11.305 -37.595 -10.029 1.00 41.41 H new ATOM 0 HD12 LEU A 83 12.486 -38.808 -9.481 1.00 41.41 H new ATOM 0 HD13 LEU A 83 12.002 -37.483 -8.396 1.00 41.41 H new ATOM 0 HD21 LEU A 83 12.032 -35.300 -10.571 1.00 32.14 H new ATOM 0 HD22 LEU A 83 12.758 -35.098 -8.959 1.00 32.14 H new ATOM 0 HD23 LEU A 83 13.743 -34.838 -10.418 1.00 32.14 H new ATOM 1323 N ILE A 84 15.704 -39.173 -11.218 1.00 53.41 N ATOM 1324 CA ILE A 84 15.590 -39.871 -12.493 1.00 4.15 C ATOM 1325 C ILE A 84 15.872 -41.361 -12.330 1.00 1.31 C ATOM 1326 O ILE A 84 15.169 -42.200 -12.891 1.00 23.43 O ATOM 1327 CB ILE A 84 16.556 -39.289 -13.541 1.00 42.24 C ATOM 1328 CG1 ILE A 84 16.274 -37.800 -13.756 1.00 21.32 C ATOM 1329 CG2 ILE A 84 16.436 -40.051 -14.853 1.00 12.42 C ATOM 1330 CD1 ILE A 84 17.456 -37.035 -14.310 1.00 35.14 C ATOM 0 H ILE A 84 16.512 -38.554 -11.146 1.00 53.41 H new ATOM 0 HA ILE A 84 14.566 -39.733 -12.839 1.00 4.15 H new ATOM 0 HB ILE A 84 17.576 -39.397 -13.172 1.00 42.24 H new ATOM 0 HG12 ILE A 84 15.430 -37.693 -14.438 1.00 21.32 H new ATOM 0 HG13 ILE A 84 15.975 -37.354 -12.807 1.00 21.32 H new ATOM 0 HG21 ILE A 84 17.125 -39.628 -15.584 1.00 12.42 H new ATOM 0 HG22 ILE A 84 16.681 -41.100 -14.688 1.00 12.42 H new ATOM 0 HG23 ILE A 84 15.416 -39.971 -15.228 1.00 12.42 H new ATOM 0 HD11 ILE A 84 17.184 -35.987 -14.437 1.00 35.14 H new ATOM 0 HD12 ILE A 84 18.295 -37.111 -13.618 1.00 35.14 H new ATOM 0 HD13 ILE A 84 17.742 -37.455 -15.274 1.00 35.14 H new ATOM 1342 N ASN A 85 16.905 -41.681 -11.557 1.00 34.23 N ATOM 1343 CA ASN A 85 17.279 -43.071 -11.319 1.00 11.54 C ATOM 1344 C ASN A 85 16.115 -43.852 -10.716 1.00 42.12 C ATOM 1345 O ASN A 85 16.052 -45.077 -10.825 1.00 41.44 O ATOM 1346 CB ASN A 85 18.491 -43.141 -10.388 1.00 65.52 C ATOM 1347 CG ASN A 85 19.803 -43.006 -11.137 1.00 3.22 C ATOM 1348 OD1 ASN A 85 19.865 -42.047 -12.053 1.00 70.34 O flip ATOM 1349 ND2 ASN A 85 20.750 -43.754 -10.893 1.00 51.14 N flip ATOM 0 H ASN A 85 17.497 -40.998 -11.085 1.00 34.23 H new ATOM 0 HA ASN A 85 17.538 -43.521 -12.277 1.00 11.54 H new ATOM 0 HB2 ASN A 85 18.419 -42.350 -9.642 1.00 65.52 H new ATOM 0 HB3 ASN A 85 18.479 -44.089 -9.850 1.00 65.52 H new ATOM 0 HD21 ASN A 85 20.658 -44.478 -10.180 1.00 51.14 H new ATOM 0 HD22 ASN A 85 21.627 -43.650 -11.404 1.00 51.14 H new ATOM 1356 N LYS A 86 15.195 -43.135 -10.080 1.00 72.11 N ATOM 1357 CA LYS A 86 14.031 -43.759 -9.461 1.00 63.03 C ATOM 1358 C LYS A 86 12.907 -43.941 -10.476 1.00 42.02 C ATOM 1359 O LYS A 86 12.025 -44.780 -10.296 1.00 2.15 O ATOM 1360 CB LYS A 86 13.539 -42.913 -8.285 1.00 34.31 C ATOM 1361 CG LYS A 86 12.587 -43.653 -7.360 1.00 64.02 C ATOM 1362 CD LYS A 86 13.292 -44.777 -6.619 1.00 12.12 C ATOM 1363 CE LYS A 86 14.391 -44.244 -5.713 1.00 1.12 C ATOM 1364 NZ LYS A 86 14.622 -45.131 -4.539 1.00 73.34 N ATOM 0 H LYS A 86 15.233 -42.121 -9.979 1.00 72.11 H new ATOM 0 HA LYS A 86 14.328 -44.742 -9.095 1.00 63.03 H new ATOM 0 HB2 LYS A 86 14.399 -42.571 -7.709 1.00 34.31 H new ATOM 0 HB3 LYS A 86 13.040 -42.024 -8.671 1.00 34.31 H new ATOM 0 HG2 LYS A 86 12.159 -42.954 -6.641 1.00 64.02 H new ATOM 0 HG3 LYS A 86 11.759 -44.061 -7.939 1.00 64.02 H new ATOM 0 HD2 LYS A 86 12.567 -45.333 -6.025 1.00 12.12 H new ATOM 0 HD3 LYS A 86 13.719 -45.476 -7.338 1.00 12.12 H new ATOM 0 HE2 LYS A 86 15.316 -44.147 -6.282 1.00 1.12 H new ATOM 0 HE3 LYS A 86 14.124 -43.246 -5.367 1.00 1.12 H new ATOM 0 HZ1 LYS A 86 14.999 -44.570 -3.749 1.00 73.34 H new ATOM 0 HZ2 LYS A 86 13.724 -45.571 -4.254 1.00 73.34 H new ATOM 0 HZ3 LYS A 86 15.305 -45.873 -4.793 1.00 73.34 H new ATOM 1378 N MET A 87 12.946 -43.151 -11.544 1.00 5.40 N ATOM 1379 CA MET A 87 11.932 -43.227 -12.589 1.00 30.32 C ATOM 1380 C MET A 87 12.059 -44.528 -13.376 1.00 5.31 C ATOM 1381 O MET A 87 11.127 -45.331 -13.421 1.00 43.41 O ATOM 1382 CB MET A 87 12.052 -42.031 -13.535 1.00 21.02 C ATOM 1383 CG MET A 87 11.530 -40.732 -12.942 1.00 23.44 C ATOM 1384 SD MET A 87 9.859 -40.340 -13.492 1.00 12.32 S ATOM 1385 CE MET A 87 9.070 -41.942 -13.350 1.00 5.31 C ATOM 0 H MET A 87 13.669 -42.451 -11.708 1.00 5.40 H new ATOM 0 HA MET A 87 10.952 -43.206 -12.112 1.00 30.32 H new ATOM 0 HB2 MET A 87 13.098 -41.900 -13.811 1.00 21.02 H new ATOM 0 HB3 MET A 87 11.505 -42.248 -14.453 1.00 21.02 H new ATOM 0 HG2 MET A 87 11.543 -40.802 -11.854 1.00 23.44 H new ATOM 0 HG3 MET A 87 12.199 -39.917 -13.217 1.00 23.44 H new ATOM 0 HE1 MET A 87 8.004 -41.842 -13.553 1.00 5.31 H new ATOM 0 HE2 MET A 87 9.513 -42.631 -14.069 1.00 5.31 H new ATOM 0 HE3 MET A 87 9.212 -42.329 -12.341 1.00 5.31 H new ATOM 1395 N ARG A 88 13.218 -44.729 -13.995 1.00 4.54 N ATOM 1396 CA ARG A 88 13.466 -45.931 -14.781 1.00 43.20 C ATOM 1397 C ARG A 88 13.374 -47.180 -13.909 1.00 54.40 C ATOM 1398 O ARG A 88 13.202 -48.290 -14.413 1.00 22.51 O ATOM 1399 CB ARG A 88 14.844 -45.859 -15.442 1.00 41.50 C ATOM 1400 CG ARG A 88 15.981 -45.639 -14.458 1.00 1.24 C ATOM 1401 CD ARG A 88 17.330 -45.620 -15.160 1.00 30.54 C ATOM 1402 NE ARG A 88 17.523 -46.795 -16.006 1.00 33.13 N ATOM 1403 CZ ARG A 88 17.766 -48.011 -15.530 1.00 61.32 C ATOM 1404 NH1 ARG A 88 17.846 -48.212 -14.222 1.00 13.40 N ATOM 1405 NH2 ARG A 88 17.930 -49.030 -16.364 1.00 61.50 N ATOM 0 H ARG A 88 14.000 -44.075 -13.967 1.00 4.54 H new ATOM 0 HA ARG A 88 12.701 -45.992 -15.555 1.00 43.20 H new ATOM 0 HB2 ARG A 88 15.023 -46.784 -15.990 1.00 41.50 H new ATOM 0 HB3 ARG A 88 14.845 -45.050 -16.172 1.00 41.50 H new ATOM 0 HG2 ARG A 88 15.830 -44.697 -13.931 1.00 1.24 H new ATOM 0 HG3 ARG A 88 15.972 -46.429 -13.707 1.00 1.24 H new ATOM 0 HD2 ARG A 88 17.410 -44.719 -15.768 1.00 30.54 H new ATOM 0 HD3 ARG A 88 18.125 -45.574 -14.416 1.00 30.54 H new ATOM 0 HE ARG A 88 17.468 -46.675 -17.017 1.00 33.13 H new ATOM 0 HH11 ARG A 88 17.721 -47.431 -13.577 1.00 13.40 H new ATOM 0 HH12 ARG A 88 18.033 -49.147 -13.860 1.00 13.40 H new ATOM 0 HH21 ARG A 88 17.869 -48.880 -17.371 1.00 61.50 H new ATOM 0 HH22 ARG A 88 18.117 -49.964 -15.998 1.00 61.50 H new ATOM 1419 N LEU A 89 13.489 -46.990 -12.599 1.00 54.13 N ATOM 1420 CA LEU A 89 13.418 -48.101 -11.656 1.00 43.23 C ATOM 1421 C LEU A 89 12.016 -48.228 -11.069 1.00 24.42 C ATOM 1422 O LEU A 89 11.683 -49.236 -10.446 1.00 3.14 O ATOM 1423 CB LEU A 89 14.439 -47.907 -10.533 1.00 73.51 C ATOM 1424 CG LEU A 89 14.288 -48.831 -9.323 1.00 43.35 C ATOM 1425 CD1 LEU A 89 14.457 -50.284 -9.737 1.00 61.32 C ATOM 1426 CD2 LEU A 89 15.294 -48.462 -8.243 1.00 0.43 C ATOM 0 H LEU A 89 13.632 -46.078 -12.166 1.00 54.13 H new ATOM 0 HA LEU A 89 13.650 -49.020 -12.195 1.00 43.23 H new ATOM 0 HB2 LEU A 89 15.437 -48.045 -10.948 1.00 73.51 H new ATOM 0 HB3 LEU A 89 14.378 -46.875 -10.187 1.00 73.51 H new ATOM 0 HG LEU A 89 13.285 -48.705 -8.916 1.00 43.35 H new ATOM 0 HD11 LEU A 89 14.346 -50.926 -8.863 1.00 61.32 H new ATOM 0 HD12 LEU A 89 13.698 -50.542 -10.476 1.00 61.32 H new ATOM 0 HD13 LEU A 89 15.448 -50.426 -10.169 1.00 61.32 H new ATOM 0 HD21 LEU A 89 15.173 -49.129 -7.390 1.00 0.43 H new ATOM 0 HD22 LEU A 89 16.305 -48.559 -8.639 1.00 0.43 H new ATOM 0 HD23 LEU A 89 15.126 -47.433 -7.926 1.00 0.43 H new ATOM 1438 N ALA A 90 11.199 -47.201 -11.274 1.00 33.12 N ATOM 1439 CA ALA A 90 9.832 -47.200 -10.768 1.00 74.23 C ATOM 1440 C ALA A 90 8.911 -48.012 -11.673 1.00 62.51 C ATOM 1441 O ALA A 90 8.215 -48.917 -11.213 1.00 62.11 O ATOM 1442 CB ALA A 90 9.319 -45.774 -10.635 1.00 1.21 C ATOM 0 H ALA A 90 11.460 -46.359 -11.787 1.00 33.12 H new ATOM 0 HA ALA A 90 9.836 -47.667 -9.783 1.00 74.23 H new ATOM 0 HB1 ALA A 90 8.297 -45.789 -10.256 1.00 1.21 H new ATOM 0 HB2 ALA A 90 9.955 -45.222 -9.943 1.00 1.21 H new ATOM 0 HB3 ALA A 90 9.337 -45.288 -11.611 1.00 1.21 H new ATOM 1448 N GLN A 91 8.913 -47.683 -12.961 1.00 10.34 N ATOM 1449 CA GLN A 91 8.076 -48.382 -13.929 1.00 3.32 C ATOM 1450 C GLN A 91 8.886 -49.419 -14.700 1.00 4.40 C ATOM 1451 O GLN A 91 8.672 -49.623 -15.894 1.00 60.44 O ATOM 1452 CB GLN A 91 7.444 -47.385 -14.902 1.00 12.14 C ATOM 1453 CG GLN A 91 8.439 -46.762 -15.867 1.00 71.45 C ATOM 1454 CD GLN A 91 8.118 -45.315 -16.184 1.00 0.14 C ATOM 1455 OE1 GLN A 91 7.544 -45.008 -17.229 1.00 63.21 O ATOM 1456 NE2 GLN A 91 8.487 -44.415 -15.279 1.00 62.24 N ATOM 0 H GLN A 91 9.485 -46.937 -13.358 1.00 10.34 H new ATOM 0 HA GLN A 91 7.286 -48.897 -13.383 1.00 3.32 H new ATOM 0 HB2 GLN A 91 6.665 -47.891 -15.473 1.00 12.14 H new ATOM 0 HB3 GLN A 91 6.958 -46.593 -14.333 1.00 12.14 H new ATOM 0 HG2 GLN A 91 9.440 -46.823 -15.440 1.00 71.45 H new ATOM 0 HG3 GLN A 91 8.452 -47.338 -16.792 1.00 71.45 H new ATOM 0 HE21 GLN A 91 8.961 -44.714 -14.426 1.00 62.24 H new ATOM 0 HE22 GLN A 91 8.297 -43.425 -15.437 1.00 62.24 H new ATOM 1465 N GLN A 92 9.817 -50.069 -14.009 1.00 11.22 N ATOM 1466 CA GLN A 92 10.660 -51.084 -14.630 1.00 54.31 C ATOM 1467 C GLN A 92 9.813 -52.206 -15.222 1.00 43.12 C ATOM 1468 O GLN A 92 10.264 -52.937 -16.103 1.00 74.01 O ATOM 1469 CB GLN A 92 11.643 -51.656 -13.608 1.00 2.32 C ATOM 1470 CG GLN A 92 11.032 -52.712 -12.701 1.00 5.55 C ATOM 1471 CD GLN A 92 9.785 -52.222 -11.992 1.00 51.53 C ATOM 1472 OE1 GLN A 92 8.732 -52.856 -12.055 1.00 33.42 O ATOM 1473 NE2 GLN A 92 9.897 -51.086 -11.313 1.00 30.22 N ATOM 0 H GLN A 92 10.007 -49.911 -13.019 1.00 11.22 H new ATOM 0 HA GLN A 92 11.220 -50.611 -15.437 1.00 54.31 H new ATOM 0 HB2 GLN A 92 12.492 -52.090 -14.136 1.00 2.32 H new ATOM 0 HB3 GLN A 92 12.031 -50.843 -12.995 1.00 2.32 H new ATOM 0 HG2 GLN A 92 10.786 -53.595 -13.292 1.00 5.55 H new ATOM 0 HG3 GLN A 92 11.770 -53.020 -11.960 1.00 5.55 H new ATOM 0 HE21 GLN A 92 10.790 -50.593 -11.287 1.00 30.22 H new ATOM 0 HE22 GLN A 92 9.090 -50.707 -10.817 1.00 30.22 H new ATOM 1482 N ASN A 93 8.585 -52.336 -14.732 1.00 20.15 N ATOM 1483 CA ASN A 93 7.676 -53.370 -15.212 1.00 32.32 C ATOM 1484 C ASN A 93 8.265 -54.760 -14.987 1.00 13.41 C ATOM 1485 O ASN A 93 8.314 -55.580 -15.903 1.00 52.31 O ATOM 1486 CB ASN A 93 7.377 -53.165 -16.698 1.00 74.42 C ATOM 1487 CG ASN A 93 7.050 -51.722 -17.029 1.00 2.33 C ATOM 1488 OD1 ASN A 93 7.632 -51.135 -17.942 1.00 30.54 O ATOM 1489 ND2 ASN A 93 6.115 -51.142 -16.285 1.00 4.40 N ATOM 0 H ASN A 93 8.196 -51.738 -14.003 1.00 20.15 H new ATOM 0 HA ASN A 93 6.747 -53.293 -14.647 1.00 32.32 H new ATOM 0 HB2 ASN A 93 8.238 -53.484 -17.286 1.00 74.42 H new ATOM 0 HB3 ASN A 93 6.540 -53.800 -16.988 1.00 74.42 H new ATOM 0 HD21 ASN A 93 5.853 -50.172 -16.460 1.00 4.40 H new ATOM 0 HD22 ASN A 93 5.659 -51.667 -15.539 1.00 4.40 H new ATOM 1496 N ALA A 94 8.710 -55.016 -13.761 1.00 71.33 N ATOM 1497 CA ALA A 94 9.293 -56.307 -13.415 1.00 11.50 C ATOM 1498 C ALA A 94 8.364 -57.102 -12.504 1.00 72.13 C ATOM 1499 O ALA A 94 8.663 -58.238 -12.135 1.00 1.55 O ATOM 1500 CB ALA A 94 10.648 -56.112 -12.750 1.00 74.21 C ATOM 0 H ALA A 94 8.678 -54.347 -12.991 1.00 71.33 H new ATOM 0 HA ALA A 94 9.430 -56.875 -14.335 1.00 11.50 H new ATOM 0 HB1 ALA A 94 11.072 -57.084 -12.497 1.00 74.21 H new ATOM 0 HB2 ALA A 94 11.318 -55.591 -13.434 1.00 74.21 H new ATOM 0 HB3 ALA A 94 10.526 -55.522 -11.842 1.00 74.21 H new ATOM 1506 N VAL A 95 7.235 -56.499 -12.145 1.00 42.52 N ATOM 1507 CA VAL A 95 6.262 -57.151 -11.278 1.00 32.13 C ATOM 1508 C VAL A 95 6.848 -57.415 -9.895 1.00 72.23 C ATOM 1509 O VAL A 95 7.211 -58.545 -9.568 1.00 30.54 O ATOM 1510 CB VAL A 95 5.777 -58.483 -11.881 1.00 14.24 C ATOM 1511 CG1 VAL A 95 4.622 -59.048 -11.068 1.00 12.22 C ATOM 1512 CG2 VAL A 95 5.373 -58.293 -13.335 1.00 61.10 C ATOM 0 H VAL A 95 6.972 -55.559 -12.442 1.00 42.52 H new ATOM 0 HA VAL A 95 5.414 -56.472 -11.187 1.00 32.13 H new ATOM 0 HB VAL A 95 6.599 -59.198 -11.846 1.00 14.24 H new ATOM 0 HG11 VAL A 95 4.293 -59.989 -11.509 1.00 12.22 H new ATOM 0 HG12 VAL A 95 4.950 -59.223 -10.043 1.00 12.22 H new ATOM 0 HG13 VAL A 95 3.795 -58.338 -11.069 1.00 12.22 H new ATOM 0 HG21 VAL A 95 5.033 -59.244 -13.745 1.00 61.10 H new ATOM 0 HG22 VAL A 95 4.567 -57.562 -13.396 1.00 61.10 H new ATOM 0 HG23 VAL A 95 6.230 -57.937 -13.907 1.00 61.10 H new ATOM 1522 N THR A 96 6.937 -56.364 -9.086 1.00 22.53 N ATOM 1523 CA THR A 96 7.480 -56.482 -7.738 1.00 54.11 C ATOM 1524 C THR A 96 6.915 -55.402 -6.822 1.00 42.12 C ATOM 1525 O THR A 96 6.472 -54.351 -7.286 1.00 21.15 O ATOM 1526 CB THR A 96 9.017 -56.385 -7.741 1.00 11.12 C ATOM 1527 OG1 THR A 96 9.531 -56.724 -6.448 1.00 65.54 O ATOM 1528 CG2 THR A 96 9.470 -54.983 -8.120 1.00 71.25 C ATOM 0 H THR A 96 6.640 -55.422 -9.340 1.00 22.53 H new ATOM 0 HA THR A 96 7.187 -57.463 -7.363 1.00 54.11 H new ATOM 0 HB THR A 96 9.402 -57.087 -8.481 1.00 11.12 H new ATOM 0 HG1 THR A 96 10.509 -56.662 -6.458 1.00 65.54 H new ATOM 0 HG21 THR A 96 10.559 -54.939 -8.115 1.00 71.25 H new ATOM 0 HG22 THR A 96 9.101 -54.738 -9.116 1.00 71.25 H new ATOM 0 HG23 THR A 96 9.075 -54.266 -7.400 1.00 71.25 H new ATOM 1536 N SER A 97 6.935 -55.667 -5.520 1.00 21.11 N ATOM 1537 CA SER A 97 6.422 -54.718 -4.539 1.00 21.23 C ATOM 1538 C SER A 97 7.319 -53.487 -4.452 1.00 65.45 C ATOM 1539 O SER A 97 6.863 -52.394 -4.118 1.00 15.51 O ATOM 1540 CB SER A 97 6.314 -55.382 -3.164 1.00 51.34 C ATOM 1541 OG SER A 97 7.574 -55.863 -2.730 1.00 10.33 O ATOM 0 H SER A 97 7.301 -56.531 -5.120 1.00 21.11 H new ATOM 0 HA SER A 97 5.430 -54.401 -4.861 1.00 21.23 H new ATOM 0 HB2 SER A 97 5.926 -54.666 -2.440 1.00 51.34 H new ATOM 0 HB3 SER A 97 5.602 -56.206 -3.210 1.00 51.34 H new ATOM 0 HG SER A 97 7.479 -56.281 -1.849 1.00 10.33 H new ATOM 1547 N LEU A 98 8.599 -53.674 -4.757 1.00 1.24 N ATOM 1548 CA LEU A 98 9.563 -52.579 -4.714 1.00 72.41 C ATOM 1549 C LEU A 98 9.084 -51.399 -5.553 1.00 14.12 C ATOM 1550 O LEU A 98 9.334 -50.242 -5.215 1.00 22.12 O ATOM 1551 CB LEU A 98 10.927 -53.056 -5.216 1.00 3.53 C ATOM 1552 CG LEU A 98 12.146 -52.361 -4.607 1.00 31.34 C ATOM 1553 CD1 LEU A 98 12.148 -50.882 -4.958 1.00 3.42 C ATOM 1554 CD2 LEU A 98 12.170 -52.553 -3.097 1.00 51.01 C ATOM 0 H LEU A 98 8.993 -54.572 -5.036 1.00 1.24 H new ATOM 0 HA LEU A 98 9.658 -52.250 -3.679 1.00 72.41 H new ATOM 0 HB2 LEU A 98 11.009 -54.126 -5.023 1.00 3.53 H new ATOM 0 HB3 LEU A 98 10.961 -52.924 -6.297 1.00 3.53 H new ATOM 0 HG LEU A 98 13.045 -52.814 -5.025 1.00 31.34 H new ATOM 0 HD11 LEU A 98 13.022 -50.404 -4.516 1.00 3.42 H new ATOM 0 HD12 LEU A 98 12.179 -50.765 -6.041 1.00 3.42 H new ATOM 0 HD13 LEU A 98 11.244 -50.414 -4.569 1.00 3.42 H new ATOM 0 HD21 LEU A 98 13.044 -52.052 -2.680 1.00 51.01 H new ATOM 0 HD22 LEU A 98 11.266 -52.127 -2.662 1.00 51.01 H new ATOM 0 HD23 LEU A 98 12.218 -53.617 -2.866 1.00 51.01 H new ATOM 1566 N SER A 99 8.391 -51.699 -6.647 1.00 22.31 N ATOM 1567 CA SER A 99 7.878 -50.663 -7.535 1.00 72.11 C ATOM 1568 C SER A 99 6.978 -49.693 -6.775 1.00 60.23 C ATOM 1569 O SER A 99 6.804 -48.545 -7.181 1.00 51.41 O ATOM 1570 CB SER A 99 7.103 -51.293 -8.694 1.00 64.15 C ATOM 1571 OG SER A 99 5.865 -50.635 -8.898 1.00 41.11 O ATOM 0 H SER A 99 8.172 -52.651 -6.939 1.00 22.31 H new ATOM 0 HA SER A 99 8.727 -50.108 -7.934 1.00 72.11 H new ATOM 0 HB2 SER A 99 7.700 -51.242 -9.605 1.00 64.15 H new ATOM 0 HB3 SER A 99 6.927 -52.349 -8.487 1.00 64.15 H new ATOM 0 HG SER A 99 5.390 -51.056 -9.645 1.00 41.11 H new ATOM 1577 N GLU A 100 6.409 -50.165 -5.670 1.00 61.45 N ATOM 1578 CA GLU A 100 5.526 -49.340 -4.854 1.00 64.41 C ATOM 1579 C GLU A 100 6.325 -48.316 -4.054 1.00 5.04 C ATOM 1580 O GLU A 100 5.881 -47.186 -3.855 1.00 45.33 O ATOM 1581 CB GLU A 100 4.705 -50.217 -3.906 1.00 2.31 C ATOM 1582 CG GLU A 100 3.727 -51.135 -4.619 1.00 52.53 C ATOM 1583 CD GLU A 100 2.522 -50.392 -5.164 1.00 61.34 C ATOM 1584 OE1 GLU A 100 1.754 -49.833 -4.354 1.00 33.53 O ATOM 1585 OE2 GLU A 100 2.347 -50.370 -6.401 1.00 23.55 O ATOM 0 H GLU A 100 6.544 -51.113 -5.320 1.00 61.45 H new ATOM 0 HA GLU A 100 4.849 -48.806 -5.521 1.00 64.41 H new ATOM 0 HB2 GLU A 100 5.384 -50.821 -3.304 1.00 2.31 H new ATOM 0 HB3 GLU A 100 4.153 -49.576 -3.218 1.00 2.31 H new ATOM 0 HG2 GLU A 100 4.239 -51.640 -5.438 1.00 52.53 H new ATOM 0 HG3 GLU A 100 3.391 -51.908 -3.928 1.00 52.53 H new ATOM 1592 N GLU A 101 7.506 -48.721 -3.596 1.00 61.33 N ATOM 1593 CA GLU A 101 8.366 -47.839 -2.816 1.00 62.24 C ATOM 1594 C GLU A 101 8.986 -46.762 -3.701 1.00 43.25 C ATOM 1595 O GLU A 101 9.267 -45.654 -3.245 1.00 21.23 O ATOM 1596 CB GLU A 101 9.469 -48.645 -2.126 1.00 51.14 C ATOM 1597 CG GLU A 101 10.315 -47.823 -1.169 1.00 45.43 C ATOM 1598 CD GLU A 101 9.939 -48.047 0.282 1.00 11.54 C ATOM 1599 OE1 GLU A 101 9.605 -49.196 0.639 1.00 52.42 O ATOM 1600 OE2 GLU A 101 9.979 -47.072 1.062 1.00 11.31 O ATOM 0 H GLU A 101 7.888 -49.654 -3.752 1.00 61.33 H new ATOM 0 HA GLU A 101 7.752 -47.353 -2.057 1.00 62.24 H new ATOM 0 HB2 GLU A 101 9.015 -49.471 -1.579 1.00 51.14 H new ATOM 0 HB3 GLU A 101 10.117 -49.083 -2.886 1.00 51.14 H new ATOM 0 HG2 GLU A 101 11.366 -48.075 -1.311 1.00 45.43 H new ATOM 0 HG3 GLU A 101 10.205 -46.766 -1.410 1.00 45.43 H new ATOM 1607 N ALA A 102 9.198 -47.096 -4.970 1.00 75.13 N ATOM 1608 CA ALA A 102 9.783 -46.158 -5.920 1.00 53.01 C ATOM 1609 C ALA A 102 8.843 -44.987 -6.185 1.00 10.43 C ATOM 1610 O ALA A 102 9.275 -43.914 -6.608 1.00 14.13 O ATOM 1611 CB ALA A 102 10.123 -46.868 -7.222 1.00 22.32 C ATOM 0 H ALA A 102 8.973 -48.010 -5.364 1.00 75.13 H new ATOM 0 HA ALA A 102 10.700 -45.763 -5.484 1.00 53.01 H new ATOM 0 HB1 ALA A 102 10.559 -46.155 -7.922 1.00 22.32 H new ATOM 0 HB2 ALA A 102 10.838 -47.667 -7.025 1.00 22.32 H new ATOM 0 HB3 ALA A 102 9.216 -47.291 -7.653 1.00 22.32 H new ATOM 1617 N LYS A 103 7.556 -45.199 -5.934 1.00 15.43 N ATOM 1618 CA LYS A 103 6.553 -44.161 -6.144 1.00 4.41 C ATOM 1619 C LYS A 103 6.770 -42.993 -5.186 1.00 71.40 C ATOM 1620 O LYS A 103 6.607 -41.832 -5.561 1.00 31.10 O ATOM 1621 CB LYS A 103 5.147 -44.735 -5.956 1.00 4.43 C ATOM 1622 CG LYS A 103 4.377 -44.895 -7.255 1.00 31.02 C ATOM 1623 CD LYS A 103 2.941 -45.323 -7.002 1.00 60.33 C ATOM 1624 CE LYS A 103 1.973 -44.164 -7.186 1.00 23.31 C ATOM 1625 NZ LYS A 103 0.602 -44.635 -7.524 1.00 74.30 N ATOM 0 H LYS A 103 7.182 -46.081 -5.584 1.00 15.43 H new ATOM 0 HA LYS A 103 6.655 -43.794 -7.165 1.00 4.41 H new ATOM 0 HB2 LYS A 103 5.222 -45.706 -5.466 1.00 4.43 H new ATOM 0 HB3 LYS A 103 4.584 -44.084 -5.288 1.00 4.43 H new ATOM 0 HG2 LYS A 103 4.386 -43.953 -7.803 1.00 31.02 H new ATOM 0 HG3 LYS A 103 4.873 -45.634 -7.884 1.00 31.02 H new ATOM 0 HD2 LYS A 103 2.676 -46.131 -7.683 1.00 60.33 H new ATOM 0 HD3 LYS A 103 2.851 -45.717 -5.990 1.00 60.33 H new ATOM 0 HE2 LYS A 103 1.938 -43.571 -6.272 1.00 23.31 H new ATOM 0 HE3 LYS A 103 2.337 -43.509 -7.977 1.00 23.31 H new ATOM 0 HZ1 LYS A 103 -0.028 -43.816 -7.641 1.00 74.30 H new ATOM 0 HZ2 LYS A 103 0.630 -45.179 -8.410 1.00 74.30 H new ATOM 0 HZ3 LYS A 103 0.244 -45.240 -6.757 1.00 74.30 H new ATOM 1639 N ARG A 104 7.139 -43.310 -3.949 1.00 40.41 N ATOM 1640 CA ARG A 104 7.378 -42.287 -2.938 1.00 41.31 C ATOM 1641 C ARG A 104 8.822 -41.797 -2.991 1.00 24.22 C ATOM 1642 O ARG A 104 9.092 -40.610 -2.808 1.00 70.43 O ATOM 1643 CB ARG A 104 7.064 -42.834 -1.544 1.00 42.34 C ATOM 1644 CG ARG A 104 7.841 -44.092 -1.195 1.00 25.31 C ATOM 1645 CD ARG A 104 7.524 -44.570 0.213 1.00 33.23 C ATOM 1646 NE ARG A 104 8.046 -43.661 1.231 1.00 75.54 N ATOM 1647 CZ ARG A 104 7.857 -43.831 2.534 1.00 33.54 C ATOM 1648 NH1 ARG A 104 7.163 -44.871 2.977 1.00 14.31 N ATOM 1649 NH2 ARG A 104 8.363 -42.961 3.398 1.00 23.14 N ATOM 0 H ARG A 104 7.279 -44.266 -3.623 1.00 40.41 H new ATOM 0 HA ARG A 104 6.719 -41.444 -3.147 1.00 41.31 H new ATOM 0 HB2 ARG A 104 7.283 -42.065 -0.803 1.00 42.34 H new ATOM 0 HB3 ARG A 104 5.997 -43.046 -1.478 1.00 42.34 H new ATOM 0 HG2 ARG A 104 7.601 -44.879 -1.910 1.00 25.31 H new ATOM 0 HG3 ARG A 104 8.910 -43.897 -1.282 1.00 25.31 H new ATOM 0 HD2 ARG A 104 6.444 -44.663 0.330 1.00 33.23 H new ATOM 0 HD3 ARG A 104 7.948 -45.563 0.362 1.00 33.23 H new ATOM 0 HE ARG A 104 8.585 -42.852 0.924 1.00 75.54 H new ATOM 0 HH11 ARG A 104 6.773 -45.543 2.316 1.00 14.31 H new ATOM 0 HH12 ARG A 104 7.019 -44.999 3.979 1.00 14.31 H new ATOM 0 HH21 ARG A 104 8.898 -42.160 3.061 1.00 23.14 H new ATOM 0 HH22 ARG A 104 8.217 -43.093 4.399 1.00 23.14 H new ATOM 1663 N GLN A 105 9.746 -42.720 -3.241 1.00 13.02 N ATOM 1664 CA GLN A 105 11.162 -42.382 -3.316 1.00 1.10 C ATOM 1665 C GLN A 105 11.442 -41.471 -4.507 1.00 71.30 C ATOM 1666 O GLN A 105 12.494 -40.837 -4.582 1.00 61.41 O ATOM 1667 CB GLN A 105 12.007 -43.653 -3.421 1.00 74.02 C ATOM 1668 CG GLN A 105 12.057 -44.458 -2.133 1.00 24.04 C ATOM 1669 CD GLN A 105 12.451 -43.617 -0.934 1.00 61.13 C ATOM 1670 OE1 GLN A 105 13.618 -43.261 -0.767 1.00 61.54 O ATOM 1671 NE2 GLN A 105 11.477 -43.294 -0.092 1.00 10.12 N ATOM 0 H GLN A 105 9.539 -43.707 -3.395 1.00 13.02 H new ATOM 0 HA GLN A 105 11.431 -41.850 -2.404 1.00 1.10 H new ATOM 0 HB2 GLN A 105 11.606 -44.281 -4.217 1.00 74.02 H new ATOM 0 HB3 GLN A 105 13.022 -43.381 -3.710 1.00 74.02 H new ATOM 0 HG2 GLN A 105 11.081 -44.907 -1.952 1.00 24.04 H new ATOM 0 HG3 GLN A 105 12.768 -45.276 -2.248 1.00 24.04 H new ATOM 0 HE21 GLN A 105 10.524 -43.611 -0.269 1.00 10.12 H new ATOM 0 HE22 GLN A 105 11.682 -42.729 0.732 1.00 10.12 H new ATOM 1680 N MET A 106 10.493 -41.412 -5.436 1.00 23.01 N ATOM 1681 CA MET A 106 10.638 -40.578 -6.623 1.00 42.14 C ATOM 1682 C MET A 106 10.245 -39.135 -6.325 1.00 41.51 C ATOM 1683 O MET A 106 10.725 -38.203 -6.973 1.00 74.22 O ATOM 1684 CB MET A 106 9.781 -41.126 -7.766 1.00 22.52 C ATOM 1685 CG MET A 106 9.995 -40.405 -9.086 1.00 52.34 C ATOM 1686 SD MET A 106 8.537 -40.450 -10.147 1.00 20.34 S ATOM 1687 CE MET A 106 8.042 -42.163 -9.968 1.00 43.54 C ATOM 0 H MET A 106 9.616 -41.931 -5.389 1.00 23.01 H new ATOM 0 HA MET A 106 11.686 -40.596 -6.923 1.00 42.14 H new ATOM 0 HB2 MET A 106 10.003 -42.185 -7.900 1.00 22.52 H new ATOM 0 HB3 MET A 106 8.730 -41.053 -7.488 1.00 22.52 H new ATOM 0 HG2 MET A 106 10.264 -39.367 -8.889 1.00 52.34 H new ATOM 0 HG3 MET A 106 10.836 -40.858 -9.611 1.00 52.34 H new ATOM 0 HE1 MET A 106 7.400 -42.445 -10.803 1.00 43.54 H new ATOM 0 HE2 MET A 106 8.927 -42.799 -9.960 1.00 43.54 H new ATOM 0 HE3 MET A 106 7.497 -42.288 -9.032 1.00 43.54 H new ATOM 1697 N LEU A 107 9.370 -38.956 -5.341 1.00 44.45 N ATOM 1698 CA LEU A 107 8.912 -37.625 -4.957 1.00 45.25 C ATOM 1699 C LEU A 107 9.876 -36.983 -3.964 1.00 71.02 C ATOM 1700 O LEU A 107 10.124 -35.778 -4.012 1.00 53.45 O ATOM 1701 CB LEU A 107 7.511 -37.702 -4.349 1.00 41.10 C ATOM 1702 CG LEU A 107 7.082 -36.506 -3.498 1.00 23.44 C ATOM 1703 CD1 LEU A 107 7.247 -35.210 -4.276 1.00 21.30 C ATOM 1704 CD2 LEU A 107 5.643 -36.672 -3.032 1.00 50.13 C ATOM 0 H LEU A 107 8.964 -39.716 -4.795 1.00 44.45 H new ATOM 0 HA LEU A 107 8.878 -37.006 -5.854 1.00 45.25 H new ATOM 0 HB2 LEU A 107 6.791 -37.823 -5.159 1.00 41.10 H new ATOM 0 HB3 LEU A 107 7.453 -38.600 -3.734 1.00 41.10 H new ATOM 0 HG LEU A 107 7.724 -36.461 -2.619 1.00 23.44 H new ATOM 0 HD11 LEU A 107 6.937 -34.370 -3.654 1.00 21.30 H new ATOM 0 HD12 LEU A 107 8.292 -35.086 -4.558 1.00 21.30 H new ATOM 0 HD13 LEU A 107 6.630 -35.244 -5.174 1.00 21.30 H new ATOM 0 HD21 LEU A 107 5.355 -35.812 -2.428 1.00 50.13 H new ATOM 0 HD22 LEU A 107 4.986 -36.743 -3.899 1.00 50.13 H new ATOM 0 HD23 LEU A 107 5.556 -37.580 -2.435 1.00 50.13 H new ATOM 1716 N THR A 108 10.419 -37.797 -3.064 1.00 42.12 N ATOM 1717 CA THR A 108 11.356 -37.310 -2.060 1.00 44.51 C ATOM 1718 C THR A 108 12.628 -36.775 -2.709 1.00 23.24 C ATOM 1719 O THR A 108 13.395 -36.044 -2.083 1.00 23.22 O ATOM 1720 CB THR A 108 11.731 -38.417 -1.057 1.00 42.21 C ATOM 1721 OG1 THR A 108 12.463 -37.857 0.040 1.00 74.35 O ATOM 1722 CG2 THR A 108 12.564 -39.497 -1.730 1.00 61.31 C ATOM 0 H THR A 108 10.226 -38.797 -3.010 1.00 42.12 H new ATOM 0 HA THR A 108 10.856 -36.502 -1.527 1.00 44.51 H new ATOM 0 HB THR A 108 10.811 -38.868 -0.687 1.00 42.21 H new ATOM 0 HG1 THR A 108 12.696 -38.567 0.674 1.00 74.35 H new ATOM 0 HG21 THR A 108 12.817 -40.268 -1.002 1.00 61.31 H new ATOM 0 HG22 THR A 108 11.993 -39.941 -2.546 1.00 61.31 H new ATOM 0 HG23 THR A 108 13.480 -39.057 -2.125 1.00 61.31 H new ATOM 1730 N ALA A 109 12.845 -37.144 -3.967 1.00 25.33 N ATOM 1731 CA ALA A 109 14.024 -36.699 -4.701 1.00 34.43 C ATOM 1732 C ALA A 109 13.735 -35.420 -5.478 1.00 40.25 C ATOM 1733 O ALA A 109 14.609 -34.568 -5.637 1.00 64.12 O ATOM 1734 CB ALA A 109 14.504 -37.794 -5.642 1.00 32.33 C ATOM 0 H ALA A 109 12.220 -37.750 -4.499 1.00 25.33 H new ATOM 0 HA ALA A 109 14.812 -36.485 -3.979 1.00 34.43 H new ATOM 0 HB1 ALA A 109 15.385 -37.448 -6.183 1.00 32.33 H new ATOM 0 HB2 ALA A 109 14.759 -38.683 -5.066 1.00 32.33 H new ATOM 0 HB3 ALA A 109 13.713 -38.036 -6.352 1.00 32.33 H new ATOM 1740 N SER A 110 12.504 -35.292 -5.962 1.00 55.30 N ATOM 1741 CA SER A 110 12.101 -34.118 -6.728 1.00 2.45 C ATOM 1742 C SER A 110 12.292 -32.844 -5.909 1.00 64.05 C ATOM 1743 O SER A 110 12.929 -31.891 -6.362 1.00 33.54 O ATOM 1744 CB SER A 110 10.640 -34.243 -7.163 1.00 41.24 C ATOM 1745 OG SER A 110 9.769 -34.197 -6.047 1.00 21.45 O ATOM 0 H SER A 110 11.768 -35.987 -5.837 1.00 55.30 H new ATOM 0 HA SER A 110 12.733 -34.059 -7.614 1.00 2.45 H new ATOM 0 HB2 SER A 110 10.393 -33.437 -7.854 1.00 41.24 H new ATOM 0 HB3 SER A 110 10.497 -35.180 -7.701 1.00 41.24 H new ATOM 0 HG SER A 110 9.930 -34.976 -5.474 1.00 21.45 H new ATOM 1751 N HIS A 111 11.737 -32.835 -4.702 1.00 14.20 N ATOM 1752 CA HIS A 111 11.846 -31.679 -3.819 1.00 54.10 C ATOM 1753 C HIS A 111 13.307 -31.299 -3.600 1.00 12.42 C ATOM 1754 O HIS A 111 13.623 -30.143 -3.314 1.00 60.15 O ATOM 1755 CB HIS A 111 11.176 -31.971 -2.476 1.00 74.51 C ATOM 1756 CG HIS A 111 10.847 -30.740 -1.690 1.00 4.14 C ATOM 1757 ND1 HIS A 111 10.001 -29.754 -2.153 1.00 24.43 N ATOM 1758 CD2 HIS A 111 11.256 -30.338 -0.463 1.00 54.43 C ATOM 1759 CE1 HIS A 111 9.905 -28.798 -1.246 1.00 72.41 C ATOM 1760 NE2 HIS A 111 10.656 -29.128 -0.211 1.00 30.30 N ATOM 0 H HIS A 111 11.207 -33.615 -4.313 1.00 14.20 H new ATOM 0 HA HIS A 111 11.338 -30.840 -4.295 1.00 54.10 H new ATOM 0 HB2 HIS A 111 10.260 -32.535 -2.651 1.00 74.51 H new ATOM 0 HB3 HIS A 111 11.833 -32.606 -1.882 1.00 74.51 H new ATOM 0 HD2 HIS A 111 11.928 -30.869 0.194 1.00 54.43 H new ATOM 0 HE1 HIS A 111 9.313 -27.899 -1.336 1.00 72.41 H new ATOM 0 HE2 HIS A 111 10.772 -28.574 0.638 1.00 30.30 H new ATOM 1768 N THR A 112 14.195 -32.279 -3.734 1.00 41.42 N ATOM 1769 CA THR A 112 15.622 -32.047 -3.549 1.00 61.41 C ATOM 1770 C THR A 112 16.153 -31.042 -4.565 1.00 35.21 C ATOM 1771 O THR A 112 17.222 -30.460 -4.377 1.00 53.14 O ATOM 1772 CB THR A 112 16.424 -33.357 -3.673 1.00 10.25 C ATOM 1773 OG1 THR A 112 15.726 -34.422 -3.019 1.00 75.52 O ATOM 1774 CG2 THR A 112 17.809 -33.203 -3.063 1.00 1.52 C ATOM 0 H THR A 112 13.951 -33.241 -3.970 1.00 41.42 H new ATOM 0 HA THR A 112 15.749 -31.644 -2.544 1.00 61.41 H new ATOM 0 HB THR A 112 16.534 -33.591 -4.732 1.00 10.25 H new ATOM 0 HG1 THR A 112 16.308 -35.209 -2.963 1.00 75.52 H new ATOM 0 HG21 THR A 112 18.357 -34.140 -3.162 1.00 1.52 H new ATOM 0 HG22 THR A 112 18.349 -32.411 -3.581 1.00 1.52 H new ATOM 0 HG23 THR A 112 17.715 -32.948 -2.007 1.00 1.52 H new ATOM 1782 N LEU A 113 15.399 -30.842 -5.641 1.00 4.03 N ATOM 1783 CA LEU A 113 15.794 -29.905 -6.687 1.00 73.22 C ATOM 1784 C LEU A 113 15.408 -28.477 -6.314 1.00 23.55 C ATOM 1785 O LEU A 113 16.022 -27.517 -6.777 1.00 52.14 O ATOM 1786 CB LEU A 113 15.142 -30.290 -8.016 1.00 75.51 C ATOM 1787 CG LEU A 113 15.756 -31.487 -8.743 1.00 51.04 C ATOM 1788 CD1 LEU A 113 15.141 -32.786 -8.248 1.00 33.44 C ATOM 1789 CD2 LEU A 113 15.573 -31.348 -10.248 1.00 22.03 C ATOM 0 H LEU A 113 14.512 -31.316 -5.812 1.00 4.03 H new ATOM 0 HA LEU A 113 16.878 -29.953 -6.793 1.00 73.22 H new ATOM 0 HB2 LEU A 113 14.089 -30.503 -7.833 1.00 75.51 H new ATOM 0 HB3 LEU A 113 15.182 -29.427 -8.681 1.00 75.51 H new ATOM 0 HG LEU A 113 16.824 -31.510 -8.527 1.00 51.04 H new ATOM 0 HD11 LEU A 113 15.591 -33.626 -8.777 1.00 33.44 H new ATOM 0 HD12 LEU A 113 15.324 -32.891 -7.179 1.00 33.44 H new ATOM 0 HD13 LEU A 113 14.067 -32.774 -8.433 1.00 33.44 H new ATOM 0 HD21 LEU A 113 16.016 -32.209 -10.749 1.00 22.03 H new ATOM 0 HD22 LEU A 113 14.510 -31.299 -10.482 1.00 22.03 H new ATOM 0 HD23 LEU A 113 16.062 -30.437 -10.591 1.00 22.03 H new ATOM 1801 N ALA A 114 14.389 -28.347 -5.470 1.00 44.54 N ATOM 1802 CA ALA A 114 13.925 -27.037 -5.031 1.00 0.41 C ATOM 1803 C ALA A 114 14.539 -26.659 -3.687 1.00 43.23 C ATOM 1804 O ALA A 114 14.859 -25.495 -3.445 1.00 13.14 O ATOM 1805 CB ALA A 114 12.406 -27.017 -4.943 1.00 62.21 C ATOM 0 H ALA A 114 13.870 -29.132 -5.077 1.00 44.54 H new ATOM 0 HA ALA A 114 14.245 -26.300 -5.768 1.00 0.41 H new ATOM 0 HB1 ALA A 114 12.074 -26.032 -4.614 1.00 62.21 H new ATOM 0 HB2 ALA A 114 11.982 -27.234 -5.923 1.00 62.21 H new ATOM 0 HB3 ALA A 114 12.073 -27.770 -4.229 1.00 62.21 H new ATOM 1811 N VAL A 115 14.702 -27.650 -2.816 1.00 53.23 N ATOM 1812 CA VAL A 115 15.278 -27.421 -1.497 1.00 22.22 C ATOM 1813 C VAL A 115 16.605 -26.677 -1.598 1.00 53.32 C ATOM 1814 O VAL A 115 16.987 -25.941 -0.688 1.00 32.43 O ATOM 1815 CB VAL A 115 15.502 -28.747 -0.745 1.00 2.41 C ATOM 1816 CG1 VAL A 115 16.667 -29.515 -1.351 1.00 52.52 C ATOM 1817 CG2 VAL A 115 15.738 -28.486 0.735 1.00 14.22 C ATOM 0 H VAL A 115 14.443 -28.619 -3.001 1.00 53.23 H new ATOM 0 HA VAL A 115 14.565 -26.812 -0.942 1.00 22.22 H new ATOM 0 HB VAL A 115 14.604 -29.357 -0.845 1.00 2.41 H new ATOM 0 HG11 VAL A 115 16.810 -30.448 -0.807 1.00 52.52 H new ATOM 0 HG12 VAL A 115 16.454 -29.734 -2.397 1.00 52.52 H new ATOM 0 HG13 VAL A 115 17.574 -28.914 -1.284 1.00 52.52 H new ATOM 0 HG21 VAL A 115 15.894 -29.433 1.251 1.00 14.22 H new ATOM 0 HG22 VAL A 115 16.619 -27.856 0.857 1.00 14.22 H new ATOM 0 HG23 VAL A 115 14.870 -27.981 1.158 1.00 14.22 H new ATOM 1827 N ASP A 116 17.303 -26.872 -2.712 1.00 14.25 N ATOM 1828 CA ASP A 116 18.587 -26.217 -2.934 1.00 32.45 C ATOM 1829 C ASP A 116 18.391 -24.812 -3.492 1.00 51.53 C ATOM 1830 O ASP A 116 19.121 -23.886 -3.140 1.00 12.43 O ATOM 1831 CB ASP A 116 19.446 -27.045 -3.891 1.00 3.14 C ATOM 1832 CG ASP A 116 20.917 -27.010 -3.525 1.00 42.43 C ATOM 1833 OD1 ASP A 116 21.235 -27.154 -2.326 1.00 13.41 O ATOM 1834 OD2 ASP A 116 21.751 -26.839 -4.439 1.00 0.01 O ATOM 0 H ASP A 116 17.001 -27.478 -3.475 1.00 14.25 H new ATOM 0 HA ASP A 116 19.098 -26.138 -1.975 1.00 32.45 H new ATOM 0 HB2 ASP A 116 19.098 -28.078 -3.886 1.00 3.14 H new ATOM 0 HB3 ASP A 116 19.318 -26.670 -4.906 1.00 3.14 H new ATOM 1839 N ALA A 117 17.401 -24.660 -4.366 1.00 62.23 N ATOM 1840 CA ALA A 117 17.109 -23.368 -4.973 1.00 51.40 C ATOM 1841 C ALA A 117 16.857 -22.306 -3.908 1.00 53.31 C ATOM 1842 O ALA A 117 17.279 -21.158 -4.048 1.00 45.14 O ATOM 1843 CB ALA A 117 15.910 -23.480 -5.903 1.00 60.21 C ATOM 0 H ALA A 117 16.788 -25.416 -4.669 1.00 62.23 H new ATOM 0 HA ALA A 117 17.979 -23.063 -5.555 1.00 51.40 H new ATOM 0 HB1 ALA A 117 15.704 -22.507 -6.349 1.00 60.21 H new ATOM 0 HB2 ALA A 117 16.127 -24.202 -6.690 1.00 60.21 H new ATOM 0 HB3 ALA A 117 15.040 -23.811 -5.336 1.00 60.21 H new ATOM 1849 N LYS A 118 16.165 -22.695 -2.843 1.00 35.30 N ATOM 1850 CA LYS A 118 15.856 -21.778 -1.753 1.00 12.42 C ATOM 1851 C LYS A 118 17.125 -21.363 -1.015 1.00 53.30 C ATOM 1852 O LYS A 118 17.269 -20.210 -0.609 1.00 70.41 O ATOM 1853 CB LYS A 118 14.874 -22.427 -0.775 1.00 13.30 C ATOM 1854 CG LYS A 118 13.463 -21.871 -0.870 1.00 44.15 C ATOM 1855 CD LYS A 118 12.820 -22.209 -2.205 1.00 42.30 C ATOM 1856 CE LYS A 118 11.481 -21.507 -2.372 1.00 31.23 C ATOM 1857 NZ LYS A 118 11.647 -20.087 -2.788 1.00 14.13 N ATOM 0 H LYS A 118 15.807 -23.641 -2.711 1.00 35.30 H new ATOM 0 HA LYS A 118 15.397 -20.887 -2.181 1.00 12.42 H new ATOM 0 HB2 LYS A 118 14.846 -23.501 -0.961 1.00 13.30 H new ATOM 0 HB3 LYS A 118 15.242 -22.289 0.242 1.00 13.30 H new ATOM 0 HG2 LYS A 118 12.856 -22.275 -0.060 1.00 44.15 H new ATOM 0 HG3 LYS A 118 13.488 -20.789 -0.740 1.00 44.15 H new ATOM 0 HD2 LYS A 118 13.488 -21.918 -3.016 1.00 42.30 H new ATOM 0 HD3 LYS A 118 12.679 -23.287 -2.279 1.00 42.30 H new ATOM 0 HE2 LYS A 118 10.884 -22.036 -3.115 1.00 31.23 H new ATOM 0 HE3 LYS A 118 10.930 -21.548 -1.433 1.00 31.23 H new ATOM 0 HZ1 LYS A 118 10.712 -19.644 -2.891 1.00 14.13 H new ATOM 0 HZ2 LYS A 118 12.195 -19.576 -2.067 1.00 14.13 H new ATOM 0 HZ3 LYS A 118 12.150 -20.048 -3.697 1.00 14.13 H new ATOM 1871 N ASN A 119 18.042 -22.309 -0.846 1.00 62.45 N ATOM 1872 CA ASN A 119 19.300 -22.041 -0.158 1.00 73.23 C ATOM 1873 C ASN A 119 20.247 -21.241 -1.047 1.00 55.25 C ATOM 1874 O ASN A 119 21.122 -20.526 -0.557 1.00 32.43 O ATOM 1875 CB ASN A 119 19.965 -23.353 0.263 1.00 74.21 C ATOM 1876 CG ASN A 119 18.983 -24.322 0.893 1.00 22.51 C ATOM 1877 OD1 ASN A 119 17.922 -23.924 1.374 1.00 4.04 O ATOM 1878 ND2 ASN A 119 19.334 -25.603 0.893 1.00 21.22 N ATOM 0 H ASN A 119 17.938 -23.269 -1.176 1.00 62.45 H new ATOM 0 HA ASN A 119 19.080 -21.451 0.732 1.00 73.23 H new ATOM 0 HB2 ASN A 119 20.424 -23.820 -0.608 1.00 74.21 H new ATOM 0 HB3 ASN A 119 20.766 -23.140 0.971 1.00 74.21 H new ATOM 0 HD21 ASN A 119 18.714 -26.302 1.303 1.00 21.22 H new ATOM 0 HD22 ASN A 119 20.223 -25.888 0.483 1.00 21.22 H new ATOM 1885 N LEU A 120 20.065 -21.365 -2.358 1.00 1.34 N ATOM 1886 CA LEU A 120 20.902 -20.652 -3.317 1.00 24.53 C ATOM 1887 C LEU A 120 20.435 -19.210 -3.482 1.00 11.01 C ATOM 1888 O LEU A 120 21.241 -18.306 -3.706 1.00 24.40 O ATOM 1889 CB LEU A 120 20.882 -21.365 -4.670 1.00 33.52 C ATOM 1890 CG LEU A 120 21.946 -20.927 -5.676 1.00 40.41 C ATOM 1891 CD1 LEU A 120 21.584 -19.580 -6.283 1.00 73.12 C ATOM 1892 CD2 LEU A 120 23.314 -20.864 -5.012 1.00 51.23 C ATOM 0 H LEU A 120 19.346 -21.952 -2.780 1.00 1.34 H new ATOM 0 HA LEU A 120 21.922 -20.642 -2.934 1.00 24.53 H new ATOM 0 HB2 LEU A 120 20.994 -22.435 -4.496 1.00 33.52 H new ATOM 0 HB3 LEU A 120 19.901 -21.217 -5.122 1.00 33.52 H new ATOM 0 HG LEU A 120 21.987 -21.665 -6.477 1.00 40.41 H new ATOM 0 HD11 LEU A 120 22.353 -19.284 -6.997 1.00 73.12 H new ATOM 0 HD12 LEU A 120 20.625 -19.657 -6.794 1.00 73.12 H new ATOM 0 HD13 LEU A 120 21.515 -18.832 -5.493 1.00 73.12 H new ATOM 0 HD21 LEU A 120 24.059 -20.550 -5.743 1.00 51.23 H new ATOM 0 HD22 LEU A 120 23.287 -20.148 -4.191 1.00 51.23 H new ATOM 0 HD23 LEU A 120 23.577 -21.849 -4.626 1.00 51.23 H new ATOM 1904 N LEU A 121 19.128 -19.000 -3.368 1.00 21.52 N ATOM 1905 CA LEU A 121 18.552 -17.667 -3.502 1.00 44.22 C ATOM 1906 C LEU A 121 19.068 -16.738 -2.407 1.00 72.42 C ATOM 1907 O LEU A 121 19.559 -15.645 -2.687 1.00 42.21 O ATOM 1908 CB LEU A 121 17.026 -17.741 -3.447 1.00 15.02 C ATOM 1909 CG LEU A 121 16.302 -16.438 -3.104 1.00 62.10 C ATOM 1910 CD1 LEU A 121 16.785 -15.308 -4.000 1.00 2.13 C ATOM 1911 CD2 LEU A 121 14.796 -16.615 -3.231 1.00 1.04 C ATOM 0 H LEU A 121 18.447 -19.737 -3.183 1.00 21.52 H new ATOM 0 HA LEU A 121 18.855 -17.263 -4.468 1.00 44.22 H new ATOM 0 HB2 LEU A 121 16.664 -18.090 -4.414 1.00 15.02 H new ATOM 0 HB3 LEU A 121 16.745 -18.494 -2.711 1.00 15.02 H new ATOM 0 HG LEU A 121 16.531 -16.178 -2.070 1.00 62.10 H new ATOM 0 HD11 LEU A 121 16.259 -14.389 -3.742 1.00 2.13 H new ATOM 0 HD12 LEU A 121 17.856 -15.165 -3.859 1.00 2.13 H new ATOM 0 HD13 LEU A 121 16.586 -15.559 -5.042 1.00 2.13 H new ATOM 0 HD21 LEU A 121 14.297 -15.678 -2.983 1.00 1.04 H new ATOM 0 HD22 LEU A 121 14.548 -16.899 -4.254 1.00 1.04 H new ATOM 0 HD23 LEU A 121 14.462 -17.395 -2.547 1.00 1.04 H new ATOM 1923 N ASP A 122 18.954 -17.182 -1.160 1.00 62.54 N ATOM 1924 CA ASP A 122 19.412 -16.393 -0.023 1.00 33.02 C ATOM 1925 C ASP A 122 20.890 -16.045 -0.163 1.00 4.15 C ATOM 1926 O ASP A 122 21.348 -15.021 0.344 1.00 14.11 O ATOM 1927 CB ASP A 122 19.176 -17.155 1.282 1.00 35.11 C ATOM 1928 CG ASP A 122 19.293 -16.263 2.503 1.00 62.54 C ATOM 1929 OD1 ASP A 122 18.627 -15.207 2.533 1.00 72.51 O ATOM 1930 OD2 ASP A 122 20.051 -16.622 3.428 1.00 71.11 O ATOM 0 H ASP A 122 18.548 -18.084 -0.911 1.00 62.54 H new ATOM 0 HA ASP A 122 18.840 -15.466 -0.002 1.00 33.02 H new ATOM 0 HB2 ASP A 122 18.185 -17.608 1.260 1.00 35.11 H new ATOM 0 HB3 ASP A 122 19.897 -17.969 1.360 1.00 35.11 H new ATOM 1935 N ALA A 123 21.633 -16.905 -0.852 1.00 51.22 N ATOM 1936 CA ALA A 123 23.059 -16.688 -1.059 1.00 43.32 C ATOM 1937 C ALA A 123 23.304 -15.565 -2.061 1.00 50.25 C ATOM 1938 O ALA A 123 24.016 -14.603 -1.770 1.00 75.34 O ATOM 1939 CB ALA A 123 23.726 -17.972 -1.529 1.00 72.15 C ATOM 0 H ALA A 123 21.270 -17.759 -1.276 1.00 51.22 H new ATOM 0 HA ALA A 123 23.498 -16.391 -0.106 1.00 43.32 H new ATOM 0 HB1 ALA A 123 24.791 -17.795 -1.680 1.00 72.15 H new ATOM 0 HB2 ALA A 123 23.590 -18.749 -0.777 1.00 72.15 H new ATOM 0 HB3 ALA A 123 23.275 -18.293 -2.468 1.00 72.15 H new ATOM 1945 N VAL A 124 22.710 -15.693 -3.244 1.00 22.31 N ATOM 1946 CA VAL A 124 22.864 -14.689 -4.290 1.00 15.15 C ATOM 1947 C VAL A 124 22.240 -13.362 -3.872 1.00 52.25 C ATOM 1948 O VAL A 124 22.753 -12.292 -4.201 1.00 65.31 O ATOM 1949 CB VAL A 124 22.222 -15.152 -5.611 1.00 62.21 C ATOM 1950 CG1 VAL A 124 22.968 -16.352 -6.175 1.00 1.10 C ATOM 1951 CG2 VAL A 124 20.751 -15.478 -5.403 1.00 70.23 C ATOM 0 H VAL A 124 22.118 -16.482 -3.501 1.00 22.31 H new ATOM 0 HA VAL A 124 23.934 -14.552 -4.444 1.00 15.15 H new ATOM 0 HB VAL A 124 22.291 -14.339 -6.333 1.00 62.21 H new ATOM 0 HG11 VAL A 124 22.500 -16.665 -7.108 1.00 1.10 H new ATOM 0 HG12 VAL A 124 24.006 -16.079 -6.363 1.00 1.10 H new ATOM 0 HG13 VAL A 124 22.932 -17.172 -5.458 1.00 1.10 H new ATOM 0 HG21 VAL A 124 20.313 -15.803 -6.347 1.00 70.23 H new ATOM 0 HG22 VAL A 124 20.656 -16.275 -4.665 1.00 70.23 H new ATOM 0 HG23 VAL A 124 20.228 -14.590 -5.048 1.00 70.23 H new ATOM 1961 N ASP A 125 21.130 -13.438 -3.147 1.00 30.45 N ATOM 1962 CA ASP A 125 20.436 -12.243 -2.682 1.00 51.23 C ATOM 1963 C ASP A 125 21.347 -11.392 -1.803 1.00 23.40 C ATOM 1964 O ASP A 125 21.254 -10.165 -1.802 1.00 25.34 O ATOM 1965 CB ASP A 125 19.174 -12.628 -1.908 1.00 41.24 C ATOM 1966 CG ASP A 125 18.148 -11.512 -1.881 1.00 45.33 C ATOM 1967 OD1 ASP A 125 18.531 -10.361 -1.580 1.00 33.44 O ATOM 1968 OD2 ASP A 125 16.964 -11.788 -2.162 1.00 72.25 O ATOM 0 H ASP A 125 20.691 -14.315 -2.868 1.00 30.45 H new ATOM 0 HA ASP A 125 20.152 -11.656 -3.555 1.00 51.23 H new ATOM 0 HB2 ASP A 125 18.730 -13.515 -2.361 1.00 41.24 H new ATOM 0 HB3 ASP A 125 19.445 -12.893 -0.886 1.00 41.24 H new ATOM 1973 N GLN A 126 22.226 -12.054 -1.056 1.00 51.54 N ATOM 1974 CA GLN A 126 23.152 -11.358 -0.171 1.00 45.54 C ATOM 1975 C GLN A 126 24.459 -11.040 -0.892 1.00 14.12 C ATOM 1976 O GLN A 126 25.174 -10.110 -0.520 1.00 33.02 O ATOM 1977 CB GLN A 126 23.435 -12.202 1.072 1.00 34.14 C ATOM 1978 CG GLN A 126 24.690 -11.783 1.820 1.00 21.32 C ATOM 1979 CD GLN A 126 24.644 -10.338 2.275 1.00 15.12 C ATOM 1980 OE1 GLN A 126 25.608 -9.591 2.109 1.00 64.33 O ATOM 1981 NE2 GLN A 126 23.518 -9.935 2.854 1.00 61.05 N ATOM 0 H GLN A 126 22.316 -13.070 -1.046 1.00 51.54 H new ATOM 0 HA GLN A 126 22.688 -10.420 0.133 1.00 45.54 H new ATOM 0 HB2 GLN A 126 22.581 -12.137 1.747 1.00 34.14 H new ATOM 0 HB3 GLN A 126 23.530 -13.247 0.777 1.00 34.14 H new ATOM 0 HG2 GLN A 126 24.824 -12.429 2.688 1.00 21.32 H new ATOM 0 HG3 GLN A 126 25.558 -11.930 1.177 1.00 21.32 H new ATOM 0 HE21 GLN A 126 22.743 -10.588 2.972 1.00 61.05 H new ATOM 0 HE22 GLN A 126 23.429 -8.973 3.181 1.00 61.05 H new ATOM 1990 N ALA A 127 24.764 -11.819 -1.924 1.00 53.14 N ATOM 1991 CA ALA A 127 25.983 -11.619 -2.698 1.00 30.41 C ATOM 1992 C ALA A 127 25.903 -10.344 -3.529 1.00 41.43 C ATOM 1993 O ALA A 127 26.833 -9.537 -3.538 1.00 50.35 O ATOM 1994 CB ALA A 127 26.241 -12.821 -3.595 1.00 4.11 C ATOM 0 H ALA A 127 24.184 -12.595 -2.244 1.00 53.14 H new ATOM 0 HA ALA A 127 26.814 -11.515 -2.000 1.00 30.41 H new ATOM 0 HB1 ALA A 127 27.154 -12.658 -4.167 1.00 4.11 H new ATOM 0 HB2 ALA A 127 26.351 -13.715 -2.982 1.00 4.11 H new ATOM 0 HB3 ALA A 127 25.402 -12.951 -4.279 1.00 4.11 H new ATOM 2000 N LYS A 128 24.787 -10.167 -4.228 1.00 34.13 N ATOM 2001 CA LYS A 128 24.584 -8.989 -5.063 1.00 1.04 C ATOM 2002 C LYS A 128 24.666 -7.713 -4.232 1.00 10.54 C ATOM 2003 O LYS A 128 24.918 -6.630 -4.761 1.00 62.21 O ATOM 2004 CB LYS A 128 23.228 -9.065 -5.767 1.00 72.15 C ATOM 2005 CG LYS A 128 23.251 -8.532 -7.189 1.00 54.24 C ATOM 2006 CD LYS A 128 23.897 -9.520 -8.145 1.00 70.25 C ATOM 2007 CE LYS A 128 22.937 -10.637 -8.525 1.00 62.33 C ATOM 2008 NZ LYS A 128 23.427 -11.415 -9.697 1.00 23.33 N ATOM 0 H LYS A 128 24.008 -10.826 -4.233 1.00 34.13 H new ATOM 0 HA LYS A 128 25.375 -8.965 -5.813 1.00 1.04 H new ATOM 0 HB2 LYS A 128 22.893 -10.102 -5.782 1.00 72.15 H new ATOM 0 HB3 LYS A 128 22.496 -8.502 -5.189 1.00 72.15 H new ATOM 0 HG2 LYS A 128 22.233 -8.321 -7.516 1.00 54.24 H new ATOM 0 HG3 LYS A 128 23.796 -7.589 -7.216 1.00 54.24 H new ATOM 0 HD2 LYS A 128 24.223 -8.998 -9.044 1.00 70.25 H new ATOM 0 HD3 LYS A 128 24.788 -9.946 -7.683 1.00 70.25 H new ATOM 0 HE2 LYS A 128 22.804 -11.306 -7.675 1.00 62.33 H new ATOM 0 HE3 LYS A 128 21.959 -10.213 -8.754 1.00 62.33 H new ATOM 0 HZ1 LYS A 128 22.918 -12.320 -9.750 1.00 23.33 H new ATOM 0 HZ2 LYS A 128 23.260 -10.872 -10.568 1.00 23.33 H new ATOM 0 HZ3 LYS A 128 24.446 -11.596 -9.592 1.00 23.33 H new ATOM 2022 N VAL A 129 24.453 -7.847 -2.926 1.00 55.34 N ATOM 2023 CA VAL A 129 24.505 -6.704 -2.022 1.00 31.52 C ATOM 2024 C VAL A 129 25.945 -6.297 -1.734 1.00 25.23 C ATOM 2025 O VAL A 129 26.278 -5.111 -1.729 1.00 61.23 O ATOM 2026 CB VAL A 129 23.793 -7.010 -0.690 1.00 42.24 C ATOM 2027 CG1 VAL A 129 23.886 -5.818 0.250 1.00 34.13 C ATOM 2028 CG2 VAL A 129 22.342 -7.393 -0.938 1.00 50.21 C ATOM 0 H VAL A 129 24.243 -8.735 -2.471 1.00 55.34 H new ATOM 0 HA VAL A 129 23.991 -5.882 -2.520 1.00 31.52 H new ATOM 0 HB VAL A 129 24.292 -7.856 -0.216 1.00 42.24 H new ATOM 0 HG11 VAL A 129 23.378 -6.052 1.186 1.00 34.13 H new ATOM 0 HG12 VAL A 129 24.934 -5.595 0.452 1.00 34.13 H new ATOM 0 HG13 VAL A 129 23.413 -4.952 -0.213 1.00 34.13 H new ATOM 0 HG21 VAL A 129 21.854 -7.606 0.013 1.00 50.21 H new ATOM 0 HG22 VAL A 129 21.828 -6.569 -1.433 1.00 50.21 H new ATOM 0 HG23 VAL A 129 22.303 -8.279 -1.572 1.00 50.21 H new ATOM 2038 N LEU A 130 26.798 -7.288 -1.494 1.00 14.34 N ATOM 2039 CA LEU A 130 28.205 -7.033 -1.205 1.00 33.33 C ATOM 2040 C LEU A 130 28.961 -6.655 -2.474 1.00 4.11 C ATOM 2041 O LEU A 130 30.045 -6.074 -2.413 1.00 33.43 O ATOM 2042 CB LEU A 130 28.845 -8.266 -0.564 1.00 0.22 C ATOM 2043 CG LEU A 130 28.460 -8.543 0.890 1.00 44.30 C ATOM 2044 CD1 LEU A 130 29.186 -9.775 1.409 1.00 52.43 C ATOM 2045 CD2 LEU A 130 28.767 -7.334 1.762 1.00 22.12 C ATOM 0 H LEU A 130 26.540 -8.275 -1.494 1.00 14.34 H new ATOM 0 HA LEU A 130 28.262 -6.197 -0.508 1.00 33.33 H new ATOM 0 HB2 LEU A 130 28.582 -9.139 -1.161 1.00 0.22 H new ATOM 0 HB3 LEU A 130 29.928 -8.158 -0.618 1.00 0.22 H new ATOM 0 HG LEU A 130 27.388 -8.734 0.932 1.00 44.30 H new ATOM 0 HD11 LEU A 130 28.900 -9.957 2.445 1.00 52.43 H new ATOM 0 HD12 LEU A 130 28.917 -10.639 0.801 1.00 52.43 H new ATOM 0 HD13 LEU A 130 30.263 -9.613 1.353 1.00 52.43 H new ATOM 0 HD21 LEU A 130 28.487 -7.549 2.793 1.00 22.12 H new ATOM 0 HD22 LEU A 130 29.833 -7.112 1.714 1.00 22.12 H new ATOM 0 HD23 LEU A 130 28.201 -6.474 1.404 1.00 22.12 H new ATOM 2057 N ALA A 131 28.382 -6.986 -3.623 1.00 72.11 N ATOM 2058 CA ALA A 131 28.999 -6.677 -4.907 1.00 22.31 C ATOM 2059 C ALA A 131 28.856 -5.197 -5.243 1.00 53.11 C ATOM 2060 O ALA A 131 29.675 -4.633 -5.968 1.00 34.14 O ATOM 2061 CB ALA A 131 28.387 -7.532 -6.006 1.00 75.14 C ATOM 0 H ALA A 131 27.486 -7.468 -3.691 1.00 72.11 H new ATOM 0 HA ALA A 131 30.063 -6.905 -4.835 1.00 22.31 H new ATOM 0 HB1 ALA A 131 28.857 -7.291 -6.959 1.00 75.14 H new ATOM 0 HB2 ALA A 131 28.547 -8.586 -5.779 1.00 75.14 H new ATOM 0 HB3 ALA A 131 27.317 -7.333 -6.069 1.00 75.14 H new