USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1316 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 105 HIS : no HE2:sc= 0.881 K(o=2,f=-3.4!) USER MOD Set 1.2: A 118 TYR OH : rot -43:sc= 1.08 USER MOD Set 2.1: A 90 GLN : amide:sc= 2.2 K(o=4.5,f=1.2) USER MOD Set 2.2: A 124 TYR OH : rot -3:sc= 0.656 USER MOD Set 2.3: A 149 GLN : amide:sc= 1.59 K(o=4.5,f=0.85) USER MOD Set 3.1: A 7 TYR OH : rot 57:sc= 0.107 USER MOD Set 3.2: A 85 TYR OH : rot 99:sc= 1.05 USER MOD Set 4.1: A 33 HIS : no HE2:sc= -0.656 K(o=-0.19,f=-1.8) USER MOD Set 4.2: A 45 GLN : amide:sc= 0.467 X(o=-0.19,f=-0.66) USER MOD Set 4.3: A 46 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 2 ASN : amide:sc= 0.799 X(o=1.5,f=1) USER MOD Set 5.2: A 31 THR OG1 : rot -170:sc= 0.714 USER MOD Set 6.1: A 10 SER OG : rot 164:sc= 0.215 USER MOD Set 6.2: A 14 THR OG1 : rot 180:sc= 0.205 USER MOD Set 7.1: A 1 MET CE :methyl -173:sc= -0.0389 (180deg=-0.0428) USER MOD Set 7.2: A 3 MET CE :methyl -166:sc= -1.71 (180deg=-2.56) USER MOD Single : A 1 MET N :NH3+ -110:sc= 0.0502 (180deg=0) USER MOD Single : A 9 SER OG : rot -144:sc= 0.558 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00281 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 171:sc= 0 (180deg=-0.023) USER MOD Single : A 20 LYS NZ :NH3+ 161:sc= 1.24 (180deg=1.22) USER MOD Single : A 34 ASN : amide:sc= 0.00807 K(o=0.0081,f=-6.5!) USER MOD Single : A 36 LYS NZ :NH3+ 161:sc= 1.19 (180deg=0.818) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 MET CE :methyl -178:sc= -1.31 (180deg=-1.37) USER MOD Single : A 55 THR OG1 : rot 50:sc= -0.331 USER MOD Single : A 62 GLN : amide:sc= -2.06! C(o=-2.1!,f=-2.5!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -159:sc= 2.21 (180deg=1.74) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl -164:sc= -1.47 (180deg=-1.99) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0485 USER MOD Single : A 111 LYS NZ :NH3+ 179:sc= 2.02 (180deg=2.02) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot 166:sc= 0.386 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0.233 USER MOD Single : A 128 SER OG : rot 171:sc= 1.29 USER MOD Single : A 130 LYS NZ :NH3+ -174:sc= 1.28 (180deg=1.16) USER MOD Single : A 137 GLN : amide:sc= 0.878 K(o=0.88,f=-0.0015) USER MOD Single : A 147 THR OG1 : rot -160:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 0.684 K(o=0.68,f=-5.7!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -136:sc= 0.636 USER MOD Single : A 158 GLN : amide:sc= -0.155 X(o=-0.15,f=-0.33) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 84:sc= -0.534 USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 ASN : amide:sc= 0.427 X(o=0.43,f=-0.068) USER MOD Single : A 168 MET CE :methyl -159:sc= -0.972 (180deg=-2.3) USER MOD Single : A 171 HIS : no HD1:sc= -0.202 X(o=-0.2,f=0) USER MOD Single : A 172 TYR OH : rot -179:sc= 0.697 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.705 1.880 0.940 1.00 0.00 N ATOM 2 CA MET A 1 0.962 0.971 -0.222 1.00 0.00 C ATOM 3 C MET A 1 -0.372 0.411 -0.765 1.00 0.00 C ATOM 4 O MET A 1 -1.312 0.250 0.013 1.00 0.00 O ATOM 5 CB MET A 1 2.038 -0.109 0.109 1.00 0.00 C ATOM 6 CG MET A 1 1.553 -1.463 0.651 1.00 0.00 C ATOM 7 SD MET A 1 0.768 -1.398 2.285 1.00 0.00 S ATOM 8 CE MET A 1 0.173 -3.101 2.406 1.00 0.00 C ATOM 0 H1 MET A 1 0.908 2.862 0.664 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.291 1.801 1.229 1.00 0.00 H new ATOM 0 H3 MET A 1 1.319 1.610 1.735 1.00 0.00 H new ATOM 0 HA MET A 1 1.404 1.544 -1.037 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.613 -0.298 -0.798 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.726 0.317 0.839 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.844 -1.889 -0.059 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.403 -2.143 0.700 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.445 -3.208 3.297 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.418 -3.343 1.523 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.023 -3.780 2.471 1.00 0.00 H new ATOM 20 N ASN A 2 -0.496 0.139 -2.072 1.00 0.00 N ATOM 21 CA ASN A 2 -1.775 -0.223 -2.708 1.00 0.00 C ATOM 22 C ASN A 2 -1.779 -1.681 -3.159 1.00 0.00 C ATOM 23 O ASN A 2 -0.739 -2.199 -3.570 1.00 0.00 O ATOM 24 CB ASN A 2 -2.072 0.722 -3.884 1.00 0.00 C ATOM 25 CG ASN A 2 -3.526 0.618 -4.345 1.00 0.00 C ATOM 26 OD1 ASN A 2 -4.389 1.330 -3.844 1.00 0.00 O ATOM 27 ND2 ASN A 2 -3.840 -0.265 -5.279 1.00 0.00 N ATOM 0 H ASN A 2 0.290 0.163 -2.722 1.00 0.00 H new ATOM 0 HA ASN A 2 -2.567 -0.111 -1.967 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -1.858 1.749 -3.588 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -1.409 0.485 -4.716 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -4.808 -0.358 -5.588 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -3.115 -0.853 -5.690 1.00 0.00 H new ATOM 34 N MET A 3 -2.941 -2.332 -3.123 1.00 0.00 N ATOM 35 CA MET A 3 -3.109 -3.743 -3.469 1.00 0.00 C ATOM 36 C MET A 3 -3.938 -3.878 -4.741 1.00 0.00 C ATOM 37 O MET A 3 -5.025 -3.313 -4.808 1.00 0.00 O ATOM 38 CB MET A 3 -3.800 -4.516 -2.330 1.00 0.00 C ATOM 39 CG MET A 3 -3.367 -4.111 -0.922 1.00 0.00 C ATOM 40 SD MET A 3 -4.048 -5.211 0.335 1.00 0.00 S ATOM 41 CE MET A 3 -3.720 -4.164 1.766 1.00 0.00 C ATOM 0 H MET A 3 -3.813 -1.882 -2.846 1.00 0.00 H new ATOM 0 HA MET A 3 -2.117 -4.166 -3.629 1.00 0.00 H new ATOM 0 HB2 MET A 3 -4.877 -4.376 -2.417 1.00 0.00 H new ATOM 0 HB3 MET A 3 -3.605 -5.580 -2.462 1.00 0.00 H new ATOM 0 HG2 MET A 3 -2.279 -4.120 -0.861 1.00 0.00 H new ATOM 0 HG3 MET A 3 -3.690 -3.089 -0.723 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.834 -4.749 2.679 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.703 -3.777 1.708 1.00 0.00 H new ATOM 0 HE3 MET A 3 -4.424 -3.332 1.777 1.00 0.00 H new ATOM 51 N GLY A 4 -3.474 -4.655 -5.719 1.00 0.00 N ATOM 52 CA GLY A 4 -4.281 -5.053 -6.870 1.00 0.00 C ATOM 53 C GLY A 4 -4.800 -6.457 -6.594 1.00 0.00 C ATOM 54 O GLY A 4 -4.013 -7.312 -6.202 1.00 0.00 O ATOM 0 H GLY A 4 -2.524 -5.027 -5.735 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.109 -4.359 -7.018 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.684 -5.036 -7.782 1.00 0.00 H new ATOM 58 N LEU A 5 -6.094 -6.716 -6.766 1.00 0.00 N ATOM 59 CA LEU A 5 -6.698 -8.049 -6.658 1.00 0.00 C ATOM 60 C LEU A 5 -6.992 -8.467 -8.091 1.00 0.00 C ATOM 61 O LEU A 5 -7.910 -7.889 -8.673 1.00 0.00 O ATOM 62 CB LEU A 5 -7.988 -7.976 -5.810 1.00 0.00 C ATOM 63 CG LEU A 5 -8.688 -9.323 -5.497 1.00 0.00 C ATOM 64 CD1 LEU A 5 -10.135 -9.040 -5.118 1.00 0.00 C ATOM 65 CD2 LEU A 5 -8.632 -10.409 -6.586 1.00 0.00 C ATOM 0 H LEU A 5 -6.772 -5.988 -6.990 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.046 -8.769 -6.164 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.748 -7.489 -4.865 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.700 -7.334 -6.328 1.00 0.00 H new ATOM 0 HG LEU A 5 -8.114 -9.756 -4.678 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -10.643 -9.978 -4.894 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -10.162 -8.395 -4.240 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -10.638 -8.544 -5.948 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.159 -11.299 -6.240 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.105 -10.038 -7.495 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -7.592 -10.661 -6.795 1.00 0.00 H new ATOM 77 N PHE A 6 -6.251 -9.422 -8.661 1.00 0.00 N ATOM 78 CA PHE A 6 -6.495 -9.875 -10.028 1.00 0.00 C ATOM 79 C PHE A 6 -7.290 -11.171 -10.083 1.00 0.00 C ATOM 80 O PHE A 6 -7.117 -12.067 -9.252 1.00 0.00 O ATOM 81 CB PHE A 6 -5.220 -9.883 -10.887 1.00 0.00 C ATOM 82 CG PHE A 6 -4.451 -11.191 -10.975 1.00 0.00 C ATOM 83 CD1 PHE A 6 -4.889 -12.202 -11.852 1.00 0.00 C ATOM 84 CD2 PHE A 6 -3.237 -11.358 -10.287 1.00 0.00 C ATOM 85 CE1 PHE A 6 -4.124 -13.366 -12.046 1.00 0.00 C ATOM 86 CE2 PHE A 6 -2.466 -12.516 -10.489 1.00 0.00 C ATOM 87 CZ PHE A 6 -2.915 -13.530 -11.351 1.00 0.00 C ATOM 0 H PHE A 6 -5.477 -9.895 -8.194 1.00 0.00 H new ATOM 0 HA PHE A 6 -7.141 -9.130 -10.493 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.492 -9.582 -11.899 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.546 -9.120 -10.498 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -5.823 -12.082 -12.381 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -2.896 -10.596 -9.602 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -4.465 -14.131 -12.727 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.521 -12.627 -9.978 1.00 0.00 H new ATOM 0 HZ PHE A 6 -2.333 -14.431 -11.479 1.00 0.00 H new ATOM 97 N TYR A 7 -8.119 -11.259 -11.122 1.00 0.00 N ATOM 98 CA TYR A 7 -9.023 -12.354 -11.419 1.00 0.00 C ATOM 99 C TYR A 7 -9.116 -12.516 -12.937 1.00 0.00 C ATOM 100 O TYR A 7 -8.677 -11.644 -13.693 1.00 0.00 O ATOM 101 CB TYR A 7 -10.436 -11.964 -10.967 1.00 0.00 C ATOM 102 CG TYR A 7 -10.720 -11.804 -9.513 1.00 0.00 C ATOM 103 CD1 TYR A 7 -10.815 -12.943 -8.700 1.00 0.00 C ATOM 104 CD2 TYR A 7 -11.129 -10.545 -9.051 1.00 0.00 C ATOM 105 CE1 TYR A 7 -11.378 -12.830 -7.424 1.00 0.00 C ATOM 106 CE2 TYR A 7 -11.706 -10.428 -7.784 1.00 0.00 C ATOM 107 CZ TYR A 7 -11.876 -11.587 -6.984 1.00 0.00 C ATOM 108 OH TYR A 7 -12.543 -11.536 -5.803 1.00 0.00 O ATOM 0 H TYR A 7 -8.176 -10.517 -11.819 1.00 0.00 H new ATOM 0 HA TYR A 7 -8.664 -13.257 -10.926 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -10.688 -11.022 -11.455 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -11.123 -12.717 -11.354 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -10.457 -13.898 -9.055 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -10.999 -9.670 -9.671 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -11.431 -13.694 -6.778 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -12.020 -9.462 -7.416 1.00 0.00 H new ATOM 0 HH TYR A 7 -11.972 -11.890 -5.089 1.00 0.00 H new ATOM 118 N GLY A 8 -9.735 -13.610 -13.384 1.00 0.00 N ATOM 119 CA GLY A 8 -10.150 -13.783 -14.772 1.00 0.00 C ATOM 120 C GLY A 8 -11.544 -13.176 -14.979 1.00 0.00 C ATOM 121 O GLY A 8 -12.079 -12.495 -14.102 1.00 0.00 O ATOM 0 H GLY A 8 -9.963 -14.405 -12.787 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -9.432 -13.304 -15.438 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -10.163 -14.843 -15.027 1.00 0.00 H new ATOM 125 N SER A 9 -12.146 -13.466 -16.134 1.00 0.00 N ATOM 126 CA SER A 9 -13.544 -13.164 -16.431 1.00 0.00 C ATOM 127 C SER A 9 -14.452 -13.984 -15.505 1.00 0.00 C ATOM 128 O SER A 9 -15.258 -13.418 -14.762 1.00 0.00 O ATOM 129 CB SER A 9 -13.794 -13.498 -17.906 1.00 0.00 C ATOM 130 OG SER A 9 -13.106 -14.696 -18.250 1.00 0.00 O ATOM 0 H SER A 9 -11.663 -13.928 -16.905 1.00 0.00 H new ATOM 0 HA SER A 9 -13.766 -12.111 -16.260 1.00 0.00 H new ATOM 0 HB2 SER A 9 -14.862 -13.616 -18.086 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.453 -12.677 -18.537 1.00 0.00 H new ATOM 0 HG SER A 9 -12.775 -14.630 -19.170 1.00 0.00 H new ATOM 136 N SER A 10 -14.233 -15.306 -15.523 1.00 0.00 N ATOM 137 CA SER A 10 -14.907 -16.348 -14.750 1.00 0.00 C ATOM 138 C SER A 10 -16.380 -16.540 -15.139 1.00 0.00 C ATOM 139 O SER A 10 -17.079 -15.600 -15.522 1.00 0.00 O ATOM 140 CB SER A 10 -14.692 -16.140 -13.243 1.00 0.00 C ATOM 141 OG SER A 10 -13.322 -15.895 -12.950 1.00 0.00 O ATOM 0 H SER A 10 -13.518 -15.703 -16.132 1.00 0.00 H new ATOM 0 HA SER A 10 -14.437 -17.296 -15.011 1.00 0.00 H new ATOM 0 HB2 SER A 10 -15.296 -15.301 -12.899 1.00 0.00 H new ATOM 0 HB3 SER A 10 -15.031 -17.021 -12.699 1.00 0.00 H new ATOM 0 HG SER A 10 -13.243 -15.511 -12.052 1.00 0.00 H new ATOM 147 N THR A 11 -16.859 -17.784 -15.053 1.00 0.00 N ATOM 148 CA THR A 11 -18.225 -18.149 -15.414 1.00 0.00 C ATOM 149 C THR A 11 -19.187 -17.415 -14.469 1.00 0.00 C ATOM 150 O THR A 11 -19.068 -17.543 -13.246 1.00 0.00 O ATOM 151 CB THR A 11 -18.380 -19.682 -15.345 1.00 0.00 C ATOM 152 OG1 THR A 11 -17.249 -20.306 -15.941 1.00 0.00 O ATOM 153 CG2 THR A 11 -19.648 -20.152 -16.066 1.00 0.00 C ATOM 0 H THR A 11 -16.300 -18.572 -14.727 1.00 0.00 H new ATOM 0 HA THR A 11 -18.460 -17.850 -16.435 1.00 0.00 H new ATOM 0 HB THR A 11 -18.457 -19.962 -14.294 1.00 0.00 H new ATOM 0 HG1 THR A 11 -17.350 -21.280 -15.894 1.00 0.00 H new ATOM 0 HG21 THR A 11 -19.725 -21.237 -15.997 1.00 0.00 H new ATOM 0 HG22 THR A 11 -20.522 -19.696 -15.600 1.00 0.00 H new ATOM 0 HG23 THR A 11 -19.601 -19.857 -17.114 1.00 0.00 H new ATOM 161 N CYS A 12 -20.102 -16.613 -15.034 1.00 0.00 N ATOM 162 CA CYS A 12 -21.016 -15.731 -14.299 1.00 0.00 C ATOM 163 C CYS A 12 -20.290 -14.793 -13.307 1.00 0.00 C ATOM 164 O CYS A 12 -20.902 -14.366 -12.324 1.00 0.00 O ATOM 165 CB CYS A 12 -22.144 -16.549 -13.647 1.00 0.00 C ATOM 166 SG CYS A 12 -22.952 -17.650 -14.849 1.00 0.00 S ATOM 0 H CYS A 12 -20.229 -16.560 -16.045 1.00 0.00 H new ATOM 0 HA CYS A 12 -21.476 -15.057 -15.022 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -21.738 -17.140 -12.826 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -22.883 -15.873 -13.217 1.00 0.00 H new ATOM 0 HG CYS A 12 -23.894 -18.322 -14.257 1.00 0.00 H new ATOM 172 N TYR A 13 -19.015 -14.482 -13.595 1.00 0.00 N ATOM 173 CA TYR A 13 -18.035 -13.763 -12.776 1.00 0.00 C ATOM 174 C TYR A 13 -17.815 -14.323 -11.356 1.00 0.00 C ATOM 175 O TYR A 13 -18.624 -15.075 -10.807 1.00 0.00 O ATOM 176 CB TYR A 13 -18.178 -12.229 -12.868 1.00 0.00 C ATOM 177 CG TYR A 13 -19.536 -11.627 -12.552 1.00 0.00 C ATOM 178 CD1 TYR A 13 -19.882 -11.300 -11.226 1.00 0.00 C ATOM 179 CD2 TYR A 13 -20.444 -11.356 -13.597 1.00 0.00 C ATOM 180 CE1 TYR A 13 -21.133 -10.720 -10.943 1.00 0.00 C ATOM 181 CE2 TYR A 13 -21.696 -10.777 -13.320 1.00 0.00 C ATOM 182 CZ TYR A 13 -22.048 -10.459 -11.988 1.00 0.00 C ATOM 183 OH TYR A 13 -23.260 -9.897 -11.699 1.00 0.00 O ATOM 0 H TYR A 13 -18.611 -14.755 -14.491 1.00 0.00 H new ATOM 0 HA TYR A 13 -17.075 -13.981 -13.245 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -17.448 -11.783 -12.193 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -17.904 -11.926 -13.879 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -19.185 -11.495 -10.424 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -20.176 -11.594 -14.616 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -21.394 -10.474 -9.924 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -22.388 -10.576 -14.124 1.00 0.00 H new ATOM 0 HH TYR A 13 -23.772 -9.781 -12.526 1.00 0.00 H new ATOM 193 N THR A 14 -16.648 -14.013 -10.776 1.00 0.00 N ATOM 194 CA THR A 14 -16.283 -14.452 -9.431 1.00 0.00 C ATOM 195 C THR A 14 -17.243 -13.818 -8.404 1.00 0.00 C ATOM 196 O THR A 14 -17.810 -12.743 -8.638 1.00 0.00 O ATOM 197 CB THR A 14 -14.789 -14.163 -9.190 1.00 0.00 C ATOM 198 OG1 THR A 14 -14.041 -14.859 -10.173 1.00 0.00 O ATOM 199 CG2 THR A 14 -14.272 -14.585 -7.813 1.00 0.00 C ATOM 0 H THR A 14 -15.931 -13.449 -11.232 1.00 0.00 H new ATOM 0 HA THR A 14 -16.400 -15.529 -9.313 1.00 0.00 H new ATOM 0 HB THR A 14 -14.671 -13.081 -9.247 1.00 0.00 H new ATOM 0 HG1 THR A 14 -13.085 -14.687 -10.039 1.00 0.00 H new ATOM 0 HG21 THR A 14 -13.212 -14.343 -7.733 1.00 0.00 H new ATOM 0 HG22 THR A 14 -14.825 -14.054 -7.038 1.00 0.00 H new ATOM 0 HG23 THR A 14 -14.410 -15.659 -7.686 1.00 0.00 H new ATOM 207 N GLU A 15 -17.459 -14.510 -7.277 1.00 0.00 N ATOM 208 CA GLU A 15 -18.393 -14.109 -6.228 1.00 0.00 C ATOM 209 C GLU A 15 -17.947 -12.799 -5.555 1.00 0.00 C ATOM 210 O GLU A 15 -16.837 -12.306 -5.780 1.00 0.00 O ATOM 211 CB GLU A 15 -18.520 -15.248 -5.197 1.00 0.00 C ATOM 212 CG GLU A 15 -19.147 -16.536 -5.759 1.00 0.00 C ATOM 213 CD GLU A 15 -20.565 -16.332 -6.334 1.00 0.00 C ATOM 214 OE1 GLU A 15 -21.377 -15.581 -5.742 1.00 0.00 O ATOM 215 OE2 GLU A 15 -20.884 -16.940 -7.385 1.00 0.00 O ATOM 0 H GLU A 15 -16.976 -15.384 -7.069 1.00 0.00 H new ATOM 0 HA GLU A 15 -19.369 -13.922 -6.675 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.530 -15.480 -4.804 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.122 -14.899 -4.358 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.500 -16.934 -6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.189 -17.285 -4.968 1.00 0.00 H new ATOM 222 N MET A 16 -18.795 -12.257 -4.669 1.00 0.00 N ATOM 223 CA MET A 16 -18.628 -10.954 -4.011 1.00 0.00 C ATOM 224 C MET A 16 -17.413 -10.884 -3.070 1.00 0.00 C ATOM 225 O MET A 16 -17.183 -9.841 -2.459 1.00 0.00 O ATOM 226 CB MET A 16 -19.933 -10.547 -3.293 1.00 0.00 C ATOM 227 CG MET A 16 -21.063 -10.086 -4.231 1.00 0.00 C ATOM 228 SD MET A 16 -21.746 -11.312 -5.391 1.00 0.00 S ATOM 229 CE MET A 16 -20.878 -10.849 -6.917 1.00 0.00 C ATOM 0 H MET A 16 -19.649 -12.733 -4.380 1.00 0.00 H new ATOM 0 HA MET A 16 -18.416 -10.231 -4.798 1.00 0.00 H new ATOM 0 HB2 MET A 16 -20.289 -11.394 -2.706 1.00 0.00 H new ATOM 0 HB3 MET A 16 -19.711 -9.743 -2.591 1.00 0.00 H new ATOM 0 HG2 MET A 16 -21.881 -9.714 -3.614 1.00 0.00 H new ATOM 0 HG3 MET A 16 -20.693 -9.242 -4.813 1.00 0.00 H new ATOM 0 HE1 MET A 16 -21.063 -11.601 -7.684 1.00 0.00 H new ATOM 0 HE2 MET A 16 -21.241 -9.881 -7.263 1.00 0.00 H new ATOM 0 HE3 MET A 16 -19.807 -10.786 -6.722 1.00 0.00 H new ATOM 239 N ALA A 17 -16.599 -11.946 -2.989 1.00 0.00 N ATOM 240 CA ALA A 17 -15.286 -11.952 -2.349 1.00 0.00 C ATOM 241 C ALA A 17 -14.485 -10.710 -2.768 1.00 0.00 C ATOM 242 O ALA A 17 -13.855 -10.096 -1.918 1.00 0.00 O ATOM 243 CB ALA A 17 -14.542 -13.231 -2.766 1.00 0.00 C ATOM 0 H ALA A 17 -16.850 -12.853 -3.382 1.00 0.00 H new ATOM 0 HA ALA A 17 -15.403 -11.931 -1.266 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -13.559 -13.250 -2.296 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -15.113 -14.104 -2.449 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -14.426 -13.248 -3.850 1.00 0.00 H new ATOM 249 N ALA A 18 -14.575 -10.295 -4.039 1.00 0.00 N ATOM 250 CA ALA A 18 -13.878 -9.116 -4.560 1.00 0.00 C ATOM 251 C ALA A 18 -14.229 -7.846 -3.788 1.00 0.00 C ATOM 252 O ALA A 18 -13.341 -7.165 -3.275 1.00 0.00 O ATOM 253 CB ALA A 18 -14.277 -8.926 -6.035 1.00 0.00 C ATOM 0 H ALA A 18 -15.140 -10.775 -4.740 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.806 -9.283 -4.452 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.767 -8.052 -6.440 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.992 -9.810 -6.606 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -15.355 -8.782 -6.105 1.00 0.00 H new ATOM 259 N GLU A 19 -15.527 -7.537 -3.695 1.00 0.00 N ATOM 260 CA GLU A 19 -16.012 -6.353 -2.988 1.00 0.00 C ATOM 261 C GLU A 19 -15.596 -6.468 -1.534 1.00 0.00 C ATOM 262 O GLU A 19 -15.065 -5.521 -0.964 1.00 0.00 O ATOM 263 CB GLU A 19 -17.548 -6.286 -3.041 1.00 0.00 C ATOM 264 CG GLU A 19 -18.104 -5.859 -4.397 1.00 0.00 C ATOM 265 CD GLU A 19 -17.741 -4.411 -4.774 1.00 0.00 C ATOM 266 OE1 GLU A 19 -17.780 -3.511 -3.899 1.00 0.00 O ATOM 267 OE2 GLU A 19 -17.429 -4.157 -5.960 1.00 0.00 O ATOM 0 H GLU A 19 -16.268 -8.102 -4.109 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.596 -5.460 -3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -17.953 -7.265 -2.786 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -17.898 -5.588 -2.280 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.726 -6.533 -5.166 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -19.189 -5.964 -4.387 1.00 0.00 H new ATOM 274 N LYS A 20 -15.798 -7.650 -0.947 1.00 0.00 N ATOM 275 CA LYS A 20 -15.603 -7.835 0.478 1.00 0.00 C ATOM 276 C LYS A 20 -14.124 -7.671 0.832 1.00 0.00 C ATOM 277 O LYS A 20 -13.830 -7.010 1.817 1.00 0.00 O ATOM 278 CB LYS A 20 -16.202 -9.182 0.918 1.00 0.00 C ATOM 279 CG LYS A 20 -17.738 -9.162 0.780 1.00 0.00 C ATOM 280 CD LYS A 20 -18.404 -10.523 1.043 1.00 0.00 C ATOM 281 CE LYS A 20 -18.379 -10.972 2.517 1.00 0.00 C ATOM 282 NZ LYS A 20 -19.266 -10.155 3.393 1.00 0.00 N ATOM 0 H LYS A 20 -16.097 -8.489 -1.444 1.00 0.00 H new ATOM 0 HA LYS A 20 -16.135 -7.065 1.037 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.787 -9.987 0.311 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.927 -9.388 1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -18.146 -8.428 1.475 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -17.999 -8.829 -0.225 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -19.440 -10.477 0.708 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.906 -11.280 0.437 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.682 -12.017 2.577 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.357 -10.914 2.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -19.462 -10.676 4.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -18.796 -9.256 3.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -20.160 -9.962 2.898 1.00 0.00 H new ATOM 296 N ILE A 21 -13.198 -8.170 0.012 1.00 0.00 N ATOM 297 CA ILE A 21 -11.757 -8.019 0.197 1.00 0.00 C ATOM 298 C ILE A 21 -11.429 -6.533 0.327 1.00 0.00 C ATOM 299 O ILE A 21 -10.887 -6.110 1.350 1.00 0.00 O ATOM 300 CB ILE A 21 -11.008 -8.738 -0.962 1.00 0.00 C ATOM 301 CG1 ILE A 21 -10.918 -10.246 -0.646 1.00 0.00 C ATOM 302 CG2 ILE A 21 -9.589 -8.184 -1.186 1.00 0.00 C ATOM 303 CD1 ILE A 21 -10.537 -11.092 -1.859 1.00 0.00 C ATOM 0 H ILE A 21 -13.438 -8.705 -0.822 1.00 0.00 H new ATOM 0 HA ILE A 21 -11.417 -8.496 1.117 1.00 0.00 H new ATOM 0 HB ILE A 21 -11.575 -8.562 -1.876 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -10.183 -10.402 0.143 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -11.878 -10.588 -0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -9.113 -8.722 -2.006 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -9.647 -7.124 -1.433 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -9.000 -8.313 -0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.491 -12.142 -1.570 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -11.285 -10.964 -2.642 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -9.563 -10.775 -2.232 1.00 0.00 H new ATOM 315 N ARG A 22 -11.770 -5.727 -0.687 1.00 0.00 N ATOM 316 CA ARG A 22 -11.428 -4.305 -0.645 1.00 0.00 C ATOM 317 C ARG A 22 -12.168 -3.614 0.489 1.00 0.00 C ATOM 318 O ARG A 22 -11.577 -2.774 1.151 1.00 0.00 O ATOM 319 CB ARG A 22 -11.649 -3.597 -1.999 1.00 0.00 C ATOM 320 CG ARG A 22 -13.097 -3.562 -2.491 1.00 0.00 C ATOM 321 CD ARG A 22 -13.322 -2.541 -3.607 1.00 0.00 C ATOM 322 NE ARG A 22 -14.743 -2.159 -3.685 1.00 0.00 N ATOM 323 CZ ARG A 22 -15.269 -1.243 -4.513 1.00 0.00 C ATOM 324 NH1 ARG A 22 -14.491 -0.444 -5.244 1.00 0.00 N ATOM 325 NH2 ARG A 22 -16.585 -1.132 -4.602 1.00 0.00 N ATOM 0 H ARG A 22 -12.269 -6.027 -1.524 1.00 0.00 H new ATOM 0 HA ARG A 22 -10.359 -4.232 -0.447 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.286 -2.573 -1.918 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.038 -4.093 -2.753 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -13.378 -4.552 -2.850 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -13.754 -3.328 -1.654 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.712 -1.656 -3.426 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.000 -2.960 -4.560 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.386 -2.634 -3.052 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.476 -0.523 -5.180 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.911 0.246 -5.867 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -17.187 -1.739 -4.045 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.997 -0.440 -5.228 1.00 0.00 H new ATOM 339 N ASP A 23 -13.427 -3.964 0.721 1.00 0.00 N ATOM 340 CA ASP A 23 -14.276 -3.256 1.675 1.00 0.00 C ATOM 341 C ASP A 23 -13.732 -3.436 3.095 1.00 0.00 C ATOM 342 O ASP A 23 -13.689 -2.491 3.886 1.00 0.00 O ATOM 343 CB ASP A 23 -15.717 -3.759 1.608 1.00 0.00 C ATOM 344 CG ASP A 23 -16.575 -3.066 2.681 1.00 0.00 C ATOM 345 OD1 ASP A 23 -16.920 -1.871 2.499 1.00 0.00 O ATOM 346 OD2 ASP A 23 -16.927 -3.715 3.695 1.00 0.00 O ATOM 0 H ASP A 23 -13.889 -4.745 0.255 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.269 -2.198 1.414 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -16.132 -3.564 0.619 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -15.740 -4.839 1.756 1.00 0.00 H new ATOM 351 N ILE A 24 -13.267 -4.653 3.392 1.00 0.00 N ATOM 352 CA ILE A 24 -12.796 -5.072 4.695 1.00 0.00 C ATOM 353 C ILE A 24 -11.412 -4.485 4.960 1.00 0.00 C ATOM 354 O ILE A 24 -11.206 -3.839 5.989 1.00 0.00 O ATOM 355 CB ILE A 24 -12.862 -6.618 4.773 1.00 0.00 C ATOM 356 CG1 ILE A 24 -14.336 -7.080 4.870 1.00 0.00 C ATOM 357 CG2 ILE A 24 -12.018 -7.145 5.938 1.00 0.00 C ATOM 358 CD1 ILE A 24 -14.536 -8.582 4.634 1.00 0.00 C ATOM 0 H ILE A 24 -13.210 -5.396 2.696 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.432 -4.690 5.493 1.00 0.00 H new ATOM 0 HB ILE A 24 -12.438 -7.038 3.861 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -14.722 -6.823 5.856 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -14.928 -6.526 4.142 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -12.082 -8.233 5.970 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.979 -6.846 5.799 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -12.392 -6.732 6.875 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -15.595 -8.826 4.719 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -14.182 -8.844 3.637 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.973 -9.145 5.378 1.00 0.00 H new ATOM 370 N ILE A 25 -10.471 -4.711 4.042 1.00 0.00 N ATOM 371 CA ILE A 25 -9.106 -4.218 4.187 1.00 0.00 C ATOM 372 C ILE A 25 -9.123 -2.682 4.221 1.00 0.00 C ATOM 373 O ILE A 25 -8.490 -2.066 5.081 1.00 0.00 O ATOM 374 CB ILE A 25 -8.249 -4.765 3.026 1.00 0.00 C ATOM 375 CG1 ILE A 25 -8.082 -6.293 3.170 1.00 0.00 C ATOM 376 CG2 ILE A 25 -6.887 -4.067 2.925 1.00 0.00 C ATOM 377 CD1 ILE A 25 -7.302 -6.943 2.024 1.00 0.00 C ATOM 0 H ILE A 25 -10.635 -5.237 3.184 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.665 -4.564 5.122 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.775 -4.550 2.096 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.572 -6.506 4.110 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.069 -6.752 3.231 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.323 -4.488 2.093 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.036 -3.000 2.759 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.332 -4.216 3.851 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -7.227 -8.016 2.198 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.821 -6.763 1.083 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.302 -6.513 1.975 1.00 0.00 H new ATOM 389 N GLY A 26 -9.859 -2.086 3.284 1.00 0.00 N ATOM 390 CA GLY A 26 -10.039 -0.651 3.127 1.00 0.00 C ATOM 391 C GLY A 26 -10.037 -0.299 1.640 1.00 0.00 C ATOM 392 O GLY A 26 -9.013 -0.480 0.979 1.00 0.00 O ATOM 0 H GLY A 26 -10.369 -2.621 2.581 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.978 -0.339 3.585 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.241 -0.115 3.640 1.00 0.00 H new ATOM 396 N PRO A 27 -11.143 0.224 1.087 1.00 0.00 N ATOM 397 CA PRO A 27 -11.300 0.395 -0.355 1.00 0.00 C ATOM 398 C PRO A 27 -10.445 1.538 -0.930 1.00 0.00 C ATOM 399 O PRO A 27 -10.352 1.666 -2.151 1.00 0.00 O ATOM 400 CB PRO A 27 -12.806 0.614 -0.558 1.00 0.00 C ATOM 401 CG PRO A 27 -13.255 1.252 0.755 1.00 0.00 C ATOM 402 CD PRO A 27 -12.388 0.532 1.777 1.00 0.00 C ATOM 0 HA PRO A 27 -10.939 -0.477 -0.901 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -13.006 1.265 -1.409 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -13.326 -0.325 -0.746 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -13.085 2.329 0.763 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -14.318 1.096 0.941 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -12.208 1.160 2.650 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.874 -0.376 2.133 1.00 0.00 H new ATOM 410 N GLU A 28 -9.797 2.349 -0.081 1.00 0.00 N ATOM 411 CA GLU A 28 -8.928 3.435 -0.523 1.00 0.00 C ATOM 412 C GLU A 28 -7.540 2.924 -0.939 1.00 0.00 C ATOM 413 O GLU A 28 -6.807 3.636 -1.630 1.00 0.00 O ATOM 414 CB GLU A 28 -8.863 4.550 0.539 1.00 0.00 C ATOM 415 CG GLU A 28 -8.184 4.139 1.854 1.00 0.00 C ATOM 416 CD GLU A 28 -8.137 5.311 2.853 1.00 0.00 C ATOM 417 OE1 GLU A 28 -7.162 6.102 2.825 1.00 0.00 O ATOM 418 OE2 GLU A 28 -9.065 5.440 3.687 1.00 0.00 O1- ATOM 0 H GLU A 28 -9.865 2.265 0.933 1.00 0.00 H new ATOM 0 HA GLU A 28 -9.364 3.875 -1.420 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.329 5.403 0.120 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -9.877 4.885 0.758 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.723 3.302 2.298 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.171 3.793 1.649 1.00 0.00 H new ATOM 425 N LEU A 29 -7.173 1.700 -0.524 1.00 0.00 N ATOM 426 CA LEU A 29 -5.858 1.099 -0.733 1.00 0.00 C ATOM 427 C LEU A 29 -5.918 -0.271 -1.425 1.00 0.00 C ATOM 428 O LEU A 29 -4.898 -0.956 -1.515 1.00 0.00 O ATOM 429 CB LEU A 29 -5.090 1.069 0.596 1.00 0.00 C ATOM 430 CG LEU A 29 -5.658 0.120 1.675 1.00 0.00 C ATOM 431 CD1 LEU A 29 -4.515 -0.559 2.439 1.00 0.00 C ATOM 432 CD2 LEU A 29 -6.528 0.862 2.692 1.00 0.00 C ATOM 0 H LEU A 29 -7.810 1.086 -0.017 1.00 0.00 H new ATOM 0 HA LEU A 29 -5.307 1.727 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -4.058 0.782 0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.065 2.080 1.003 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.269 -0.617 1.154 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.929 -1.225 3.196 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.904 -1.135 1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.898 0.200 2.921 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.906 0.156 3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.932 1.626 3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -7.366 1.333 2.179 1.00 0.00 H new ATOM 444 N VAL A 30 -7.091 -0.690 -1.903 1.00 0.00 N ATOM 445 CA VAL A 30 -7.278 -1.909 -2.688 1.00 0.00 C ATOM 446 C VAL A 30 -7.958 -1.522 -4.005 1.00 0.00 C ATOM 447 O VAL A 30 -8.763 -0.591 -4.052 1.00 0.00 O ATOM 448 CB VAL A 30 -8.087 -2.946 -1.885 1.00 0.00 C ATOM 449 CG1 VAL A 30 -8.298 -4.273 -2.635 1.00 0.00 C ATOM 450 CG2 VAL A 30 -7.461 -3.260 -0.520 1.00 0.00 C ATOM 0 H VAL A 30 -7.959 -0.177 -1.750 1.00 0.00 H new ATOM 0 HA VAL A 30 -6.321 -2.380 -2.914 1.00 0.00 H new ATOM 0 HB VAL A 30 -9.055 -2.467 -1.741 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.875 -4.956 -2.011 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -8.839 -4.085 -3.563 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.330 -4.720 -2.863 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -8.074 -3.996 0.001 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.457 -3.660 -0.663 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.407 -2.348 0.074 1.00 0.00 H new ATOM 460 N THR A 31 -7.661 -2.274 -5.059 1.00 0.00 N ATOM 461 CA THR A 31 -8.130 -2.062 -6.424 1.00 0.00 C ATOM 462 C THR A 31 -8.483 -3.437 -6.995 1.00 0.00 C ATOM 463 O THR A 31 -7.736 -4.394 -6.784 1.00 0.00 O ATOM 464 CB THR A 31 -7.009 -1.356 -7.220 1.00 0.00 C ATOM 465 OG1 THR A 31 -6.481 -0.254 -6.492 1.00 0.00 O ATOM 466 CG2 THR A 31 -7.453 -0.853 -8.596 1.00 0.00 C ATOM 0 H THR A 31 -7.055 -3.091 -4.980 1.00 0.00 H new ATOM 0 HA THR A 31 -9.014 -1.426 -6.475 1.00 0.00 H new ATOM 0 HB THR A 31 -6.247 -2.121 -7.371 1.00 0.00 H new ATOM 0 HG1 THR A 31 -5.890 0.269 -7.073 1.00 0.00 H new ATOM 0 HG21 THR A 31 -6.613 -0.369 -9.095 1.00 0.00 H new ATOM 0 HG22 THR A 31 -7.797 -1.695 -9.198 1.00 0.00 H new ATOM 0 HG23 THR A 31 -8.266 -0.137 -8.477 1.00 0.00 H new ATOM 474 N LEU A 32 -9.614 -3.562 -7.692 1.00 0.00 N ATOM 475 CA LEU A 32 -9.993 -4.811 -8.359 1.00 0.00 C ATOM 476 C LEU A 32 -9.433 -4.767 -9.780 1.00 0.00 C ATOM 477 O LEU A 32 -9.357 -3.694 -10.383 1.00 0.00 O ATOM 478 CB LEU A 32 -11.518 -5.043 -8.349 1.00 0.00 C ATOM 479 CG LEU A 32 -12.214 -4.812 -6.994 1.00 0.00 C ATOM 480 CD1 LEU A 32 -13.716 -5.075 -7.123 1.00 0.00 C ATOM 481 CD2 LEU A 32 -11.628 -5.697 -5.889 1.00 0.00 C ATOM 0 H LEU A 32 -10.289 -2.807 -7.810 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.572 -5.657 -7.816 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.973 -4.384 -9.089 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.715 -6.066 -8.669 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.044 -3.773 -6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.198 -4.909 -6.160 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.142 -4.398 -7.864 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -13.879 -6.106 -7.438 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -12.148 -5.501 -4.952 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.750 -6.746 -6.160 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.568 -5.475 -5.769 1.00 0.00 H new ATOM 493 N HIS A 33 -9.044 -5.922 -10.312 1.00 0.00 N ATOM 494 CA HIS A 33 -8.287 -6.044 -11.552 1.00 0.00 C ATOM 495 C HIS A 33 -8.844 -7.243 -12.312 1.00 0.00 C ATOM 496 O HIS A 33 -9.015 -8.318 -11.732 1.00 0.00 O ATOM 497 CB HIS A 33 -6.809 -6.203 -11.174 1.00 0.00 C ATOM 498 CG HIS A 33 -5.838 -6.025 -12.298 1.00 0.00 C ATOM 499 ND1 HIS A 33 -5.255 -7.044 -13.056 1.00 0.00 N ATOM 500 CD2 HIS A 33 -5.257 -4.836 -12.606 1.00 0.00 C ATOM 501 CE1 HIS A 33 -4.337 -6.429 -13.824 1.00 0.00 C ATOM 502 NE2 HIS A 33 -4.330 -5.105 -13.582 1.00 0.00 N ATOM 0 H HIS A 33 -9.253 -6.822 -9.880 1.00 0.00 H new ATOM 0 HA HIS A 33 -8.373 -5.172 -12.200 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -6.571 -5.481 -10.393 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -6.665 -7.195 -10.746 1.00 0.00 H new ATOM 0 HD1 HIS A 33 -5.477 -8.039 -13.032 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -5.480 -3.873 -12.171 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -3.695 -6.928 -14.535 1.00 0.00 H new ATOM 510 N ASN A 34 -9.198 -7.064 -13.583 1.00 0.00 N ATOM 511 CA ASN A 34 -9.934 -8.060 -14.353 1.00 0.00 C ATOM 512 C ASN A 34 -9.193 -8.298 -15.654 1.00 0.00 C ATOM 513 O ASN A 34 -9.169 -7.435 -16.536 1.00 0.00 O ATOM 514 CB ASN A 34 -11.379 -7.601 -14.609 1.00 0.00 C ATOM 515 CG ASN A 34 -12.181 -8.603 -15.444 1.00 0.00 C ATOM 516 OD1 ASN A 34 -11.676 -9.628 -15.888 1.00 0.00 O ATOM 517 ND2 ASN A 34 -13.452 -8.320 -15.681 1.00 0.00 N ATOM 0 H ASN A 34 -8.980 -6.218 -14.109 1.00 0.00 H new ATOM 0 HA ASN A 34 -9.995 -8.992 -13.791 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -11.881 -7.447 -13.654 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.364 -6.638 -15.120 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -14.021 -8.957 -16.238 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -13.862 -7.464 -15.307 1.00 0.00 H new ATOM 524 N LEU A 35 -8.613 -9.491 -15.793 1.00 0.00 N ATOM 525 CA LEU A 35 -7.762 -9.837 -16.925 1.00 0.00 C ATOM 526 C LEU A 35 -8.520 -9.904 -18.258 1.00 0.00 C ATOM 527 O LEU A 35 -7.884 -9.947 -19.313 1.00 0.00 O ATOM 528 CB LEU A 35 -7.012 -11.137 -16.608 1.00 0.00 C ATOM 529 CG LEU A 35 -5.949 -10.978 -15.505 1.00 0.00 C ATOM 530 CD1 LEU A 35 -5.386 -12.368 -15.192 1.00 0.00 C ATOM 531 CD2 LEU A 35 -4.835 -9.993 -15.885 1.00 0.00 C ATOM 0 H LEU A 35 -8.723 -10.247 -15.117 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.039 -9.034 -17.066 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.731 -11.897 -16.302 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.531 -11.501 -17.516 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.419 -10.548 -14.620 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -4.629 -12.287 -14.412 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.191 -13.018 -14.850 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.937 -12.790 -16.091 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.117 -9.923 -15.068 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.329 -10.345 -16.784 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.267 -9.010 -16.073 1.00 0.00 H new ATOM 543 N LYS A 36 -9.862 -9.867 -18.242 1.00 0.00 N ATOM 544 CA LYS A 36 -10.667 -9.672 -19.446 1.00 0.00 C ATOM 545 C LYS A 36 -10.304 -8.356 -20.151 1.00 0.00 C ATOM 546 O LYS A 36 -10.455 -8.269 -21.371 1.00 0.00 O ATOM 547 CB LYS A 36 -12.162 -9.671 -19.059 1.00 0.00 C ATOM 548 CG LYS A 36 -13.159 -9.748 -20.233 1.00 0.00 C ATOM 549 CD LYS A 36 -12.869 -10.965 -21.118 1.00 0.00 C ATOM 550 CE LYS A 36 -14.048 -11.414 -21.988 1.00 0.00 C ATOM 551 NZ LYS A 36 -13.696 -12.643 -22.751 1.00 0.00 N ATOM 0 H LYS A 36 -10.414 -9.972 -17.391 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.463 -10.488 -20.140 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.346 -10.515 -18.394 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.370 -8.765 -18.489 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -14.177 -9.808 -19.848 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -13.097 -8.837 -20.829 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.023 -10.734 -21.766 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -12.566 -11.797 -20.482 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.918 -11.606 -21.360 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -14.322 -10.616 -22.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -14.566 -13.113 -23.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.116 -12.386 -23.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -13.159 -13.290 -22.139 1.00 0.00 H new ATOM 565 N ASP A 37 -9.848 -7.343 -19.405 1.00 0.00 N ATOM 566 CA ASP A 37 -9.605 -5.994 -19.922 1.00 0.00 C ATOM 567 C ASP A 37 -8.214 -5.467 -19.564 1.00 0.00 C ATOM 568 O ASP A 37 -7.569 -4.822 -20.393 1.00 0.00 O ATOM 569 CB ASP A 37 -10.677 -5.040 -19.395 1.00 0.00 C ATOM 570 CG ASP A 37 -10.439 -3.615 -19.923 1.00 0.00 C ATOM 571 OD1 ASP A 37 -10.677 -3.371 -21.133 1.00 0.00 O ATOM 572 OD2 ASP A 37 -10.056 -2.722 -19.129 1.00 0.00 O ATOM 0 H ASP A 37 -9.635 -7.440 -18.412 1.00 0.00 H new ATOM 0 HA ASP A 37 -9.654 -6.050 -21.009 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -11.664 -5.387 -19.702 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -10.665 -5.037 -18.305 1.00 0.00 H new ATOM 577 N ASP A 38 -7.724 -5.762 -18.357 1.00 0.00 N ATOM 578 CA ASP A 38 -6.413 -5.326 -17.897 1.00 0.00 C ATOM 579 C ASP A 38 -5.350 -6.245 -18.496 1.00 0.00 C ATOM 580 O ASP A 38 -5.447 -7.472 -18.382 1.00 0.00 O ATOM 581 CB ASP A 38 -6.290 -5.344 -16.368 1.00 0.00 C ATOM 582 CG ASP A 38 -7.177 -4.307 -15.659 1.00 0.00 C ATOM 583 OD1 ASP A 38 -6.922 -3.089 -15.822 1.00 0.00 O1- ATOM 584 OD2 ASP A 38 -8.111 -4.707 -14.919 1.00 0.00 O ATOM 0 H ASP A 38 -8.235 -6.315 -17.669 1.00 0.00 H new ATOM 0 HA ASP A 38 -6.273 -4.295 -18.223 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -6.549 -6.338 -16.004 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.250 -5.165 -16.095 1.00 0.00 H new ATOM 589 N SER A 39 -4.313 -5.661 -19.095 1.00 0.00 N ATOM 590 CA SER A 39 -3.152 -6.401 -19.589 1.00 0.00 C ATOM 591 C SER A 39 -2.290 -6.863 -18.397 1.00 0.00 C ATOM 592 O SER A 39 -2.279 -6.199 -17.359 1.00 0.00 O ATOM 593 CB SER A 39 -2.380 -5.536 -20.601 1.00 0.00 C ATOM 594 OG SER A 39 -3.258 -5.011 -21.593 1.00 0.00 O ATOM 0 H SER A 39 -4.254 -4.655 -19.252 1.00 0.00 H new ATOM 0 HA SER A 39 -3.465 -7.300 -20.120 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.881 -4.718 -20.081 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.602 -6.133 -21.077 1.00 0.00 H new ATOM 0 HG SER A 39 -2.747 -4.463 -22.225 1.00 0.00 H new ATOM 600 N PRO A 40 -1.523 -7.965 -18.498 1.00 0.00 N ATOM 601 CA PRO A 40 -0.867 -8.564 -17.334 1.00 0.00 C ATOM 602 C PRO A 40 0.325 -7.763 -16.812 1.00 0.00 C ATOM 603 O PRO A 40 0.617 -7.827 -15.623 1.00 0.00 O ATOM 604 CB PRO A 40 -0.474 -9.973 -17.780 1.00 0.00 C ATOM 605 CG PRO A 40 -0.301 -9.834 -19.294 1.00 0.00 C ATOM 606 CD PRO A 40 -1.369 -8.812 -19.671 1.00 0.00 C ATOM 0 HA PRO A 40 -1.543 -8.578 -16.479 1.00 0.00 H new ATOM 0 HB2 PRO A 40 0.447 -10.304 -17.300 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -1.244 -10.703 -17.529 1.00 0.00 H new ATOM 0 HG2 PRO A 40 0.699 -9.488 -19.555 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -0.453 -10.784 -19.806 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -1.065 -8.228 -20.540 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -2.308 -9.302 -19.928 1.00 0.00 H new ATOM 614 N LYS A 41 0.983 -6.949 -17.647 1.00 0.00 N ATOM 615 CA LYS A 41 2.112 -6.123 -17.196 1.00 0.00 C ATOM 616 C LYS A 41 1.678 -5.094 -16.140 1.00 0.00 C ATOM 617 O LYS A 41 2.509 -4.637 -15.360 1.00 0.00 O ATOM 618 CB LYS A 41 2.811 -5.466 -18.405 1.00 0.00 C ATOM 619 CG LYS A 41 3.829 -6.368 -19.137 1.00 0.00 C ATOM 620 CD LYS A 41 3.272 -7.613 -19.861 1.00 0.00 C ATOM 621 CE LYS A 41 4.369 -8.386 -20.623 1.00 0.00 C ATOM 622 NZ LYS A 41 4.874 -7.680 -21.836 1.00 0.00 N1+ ATOM 0 H LYS A 41 0.755 -6.844 -18.636 1.00 0.00 H new ATOM 0 HA LYS A 41 2.838 -6.771 -16.706 1.00 0.00 H new ATOM 0 HB2 LYS A 41 2.050 -5.149 -19.118 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.324 -4.566 -18.065 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.356 -5.758 -19.870 1.00 0.00 H new ATOM 0 HG3 LYS A 41 4.569 -6.702 -18.410 1.00 0.00 H new ATOM 0 HD2 LYS A 41 2.803 -8.275 -19.133 1.00 0.00 H new ATOM 0 HD3 LYS A 41 2.494 -7.306 -20.560 1.00 0.00 H new ATOM 0 HE2 LYS A 41 5.205 -8.571 -19.948 1.00 0.00 H new ATOM 0 HE3 LYS A 41 3.976 -9.359 -20.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 5.607 -8.258 -22.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.089 -7.526 -22.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.279 -6.763 -21.560 1.00 0.00 H new ATOM 636 N LEU A 42 0.376 -4.801 -16.026 1.00 0.00 N ATOM 637 CA LEU A 42 -0.200 -3.935 -14.994 1.00 0.00 C ATOM 638 C LEU A 42 0.011 -4.535 -13.604 1.00 0.00 C ATOM 639 O LEU A 42 0.066 -3.780 -12.636 1.00 0.00 O ATOM 640 CB LEU A 42 -1.715 -3.732 -15.236 1.00 0.00 C ATOM 641 CG LEU A 42 -2.206 -2.805 -16.377 1.00 0.00 C ATOM 642 CD1 LEU A 42 -2.217 -1.340 -15.933 1.00 0.00 C ATOM 643 CD2 LEU A 42 -1.399 -2.888 -17.678 1.00 0.00 C ATOM 0 H LEU A 42 -0.324 -5.172 -16.669 1.00 0.00 H new ATOM 0 HA LEU A 42 0.306 -2.971 -15.049 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.149 -4.717 -15.410 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.143 -3.355 -14.307 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.210 -3.171 -16.590 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.566 -0.714 -16.754 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.884 -1.224 -15.079 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.209 -1.038 -15.649 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.822 -2.202 -18.413 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.362 -2.615 -17.481 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.439 -3.906 -18.066 1.00 0.00 H new ATOM 655 N MET A 43 0.166 -5.859 -13.477 1.00 0.00 N ATOM 656 CA MET A 43 0.429 -6.502 -12.186 1.00 0.00 C ATOM 657 C MET A 43 1.747 -6.020 -11.578 1.00 0.00 C ATOM 658 O MET A 43 1.921 -6.091 -10.365 1.00 0.00 O ATOM 659 CB MET A 43 0.514 -8.027 -12.334 1.00 0.00 C ATOM 660 CG MET A 43 -0.786 -8.699 -12.767 1.00 0.00 C ATOM 661 SD MET A 43 -0.635 -10.496 -12.648 1.00 0.00 S ATOM 662 CE MET A 43 -2.103 -10.972 -13.579 1.00 0.00 C ATOM 0 H MET A 43 0.113 -6.509 -14.261 1.00 0.00 H new ATOM 0 HA MET A 43 -0.401 -6.232 -11.534 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.290 -8.265 -13.061 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.828 -8.454 -11.382 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.608 -8.354 -12.139 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.026 -8.415 -13.791 1.00 0.00 H new ATOM 0 HE1 MET A 43 -2.196 -12.058 -13.582 1.00 0.00 H new ATOM 0 HE2 MET A 43 -2.986 -10.534 -13.115 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.016 -10.613 -14.604 1.00 0.00 H new ATOM 672 N GLU A 44 2.685 -5.532 -12.397 1.00 0.00 N ATOM 673 CA GLU A 44 3.994 -5.094 -11.925 1.00 0.00 C ATOM 674 C GLU A 44 3.853 -3.887 -10.988 1.00 0.00 C ATOM 675 O GLU A 44 4.614 -3.768 -10.028 1.00 0.00 O ATOM 676 CB GLU A 44 4.918 -4.768 -13.114 1.00 0.00 C ATOM 677 CG GLU A 44 5.240 -5.995 -13.989 1.00 0.00 C ATOM 678 CD GLU A 44 6.120 -5.682 -15.216 1.00 0.00 C ATOM 679 OE1 GLU A 44 6.503 -4.510 -15.454 1.00 0.00 O ATOM 680 OE2 GLU A 44 6.442 -6.643 -15.955 1.00 0.00 O1- ATOM 0 H GLU A 44 2.554 -5.431 -13.404 1.00 0.00 H new ATOM 0 HA GLU A 44 4.448 -5.908 -11.360 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.448 -4.003 -13.732 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.849 -4.345 -12.737 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.743 -6.743 -13.376 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.305 -6.440 -14.330 1.00 0.00 H new ATOM 687 N GLN A 45 2.846 -3.033 -11.223 1.00 0.00 N ATOM 688 CA GLN A 45 2.715 -1.731 -10.565 1.00 0.00 C ATOM 689 C GLN A 45 2.432 -1.829 -9.062 1.00 0.00 C ATOM 690 O GLN A 45 2.955 -1.046 -8.269 1.00 0.00 O ATOM 691 CB GLN A 45 1.517 -0.966 -11.157 1.00 0.00 C ATOM 692 CG GLN A 45 1.446 -0.810 -12.684 1.00 0.00 C ATOM 693 CD GLN A 45 0.056 -0.300 -13.073 1.00 0.00 C ATOM 694 OE1 GLN A 45 -0.104 0.809 -13.574 1.00 0.00 O ATOM 695 NE2 GLN A 45 -0.982 -1.090 -12.819 1.00 0.00 N ATOM 0 H GLN A 45 2.094 -3.232 -11.882 1.00 0.00 H new ATOM 0 HA GLN A 45 3.671 -1.232 -10.726 1.00 0.00 H new ATOM 0 HB2 GLN A 45 0.606 -1.467 -10.829 1.00 0.00 H new ATOM 0 HB3 GLN A 45 1.508 0.032 -10.718 1.00 0.00 H new ATOM 0 HG2 GLN A 45 2.211 -0.113 -13.026 1.00 0.00 H new ATOM 0 HG3 GLN A 45 1.645 -1.766 -13.169 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.833 -2.009 -12.402 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -1.927 -0.777 -13.041 1.00 0.00 H new ATOM 704 N TYR A 46 1.546 -2.758 -8.693 1.00 0.00 N ATOM 705 CA TYR A 46 0.929 -2.788 -7.371 1.00 0.00 C ATOM 706 C TYR A 46 1.908 -3.262 -6.305 1.00 0.00 C ATOM 707 O TYR A 46 2.725 -4.147 -6.560 1.00 0.00 O ATOM 708 CB TYR A 46 -0.360 -3.624 -7.412 1.00 0.00 C ATOM 709 CG TYR A 46 -1.345 -3.164 -8.477 1.00 0.00 C ATOM 710 CD1 TYR A 46 -2.064 -1.968 -8.300 1.00 0.00 C ATOM 711 CD2 TYR A 46 -1.514 -3.902 -9.664 1.00 0.00 C ATOM 712 CE1 TYR A 46 -2.967 -1.523 -9.283 1.00 0.00 C ATOM 713 CE2 TYR A 46 -2.412 -3.464 -10.653 1.00 0.00 C ATOM 714 CZ TYR A 46 -3.142 -2.269 -10.471 1.00 0.00 C ATOM 715 OH TYR A 46 -3.973 -1.827 -11.461 1.00 0.00 O ATOM 0 H TYR A 46 1.238 -3.512 -9.307 1.00 0.00 H new ATOM 0 HA TYR A 46 0.653 -1.772 -7.088 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -0.102 -4.667 -7.593 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -0.844 -3.580 -6.436 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -1.922 -1.386 -7.401 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -0.950 -4.811 -9.816 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -3.526 -0.612 -9.130 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -2.544 -4.043 -11.555 1.00 0.00 H new ATOM 0 HH TYR A 46 -3.968 -2.468 -12.203 1.00 0.00 H new ATOM 725 N ASP A 47 1.818 -2.697 -5.101 1.00 0.00 N ATOM 726 CA ASP A 47 2.747 -3.005 -4.007 1.00 0.00 C ATOM 727 C ASP A 47 2.391 -4.349 -3.386 1.00 0.00 C ATOM 728 O ASP A 47 3.258 -5.056 -2.873 1.00 0.00 O ATOM 729 CB ASP A 47 2.679 -1.920 -2.928 1.00 0.00 C ATOM 730 CG ASP A 47 2.991 -0.508 -3.446 1.00 0.00 C ATOM 731 OD1 ASP A 47 4.146 -0.242 -3.853 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 2.068 0.340 -3.403 1.00 0.00 O ATOM 0 H ASP A 47 1.102 -2.014 -4.854 1.00 0.00 H new ATOM 0 HA ASP A 47 3.757 -3.044 -4.414 1.00 0.00 H new ATOM 0 HB2 ASP A 47 1.683 -1.923 -2.486 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.381 -2.168 -2.132 1.00 0.00 H new ATOM 737 N VAL A 48 1.106 -4.710 -3.438 1.00 0.00 N ATOM 738 CA VAL A 48 0.626 -6.041 -3.111 1.00 0.00 C ATOM 739 C VAL A 48 -0.151 -6.530 -4.320 1.00 0.00 C ATOM 740 O VAL A 48 -0.862 -5.751 -4.959 1.00 0.00 O ATOM 741 CB VAL A 48 -0.252 -6.059 -1.850 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.496 -7.510 -1.403 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.336 -5.224 -0.705 1.00 0.00 C ATOM 0 H VAL A 48 0.363 -4.069 -3.714 1.00 0.00 H new ATOM 0 HA VAL A 48 1.469 -6.694 -2.886 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.204 -5.595 -2.109 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.119 -7.515 -0.509 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.001 -8.056 -2.200 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.458 -7.988 -1.183 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.327 -5.274 0.159 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.316 -5.617 -0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.437 -4.187 -1.025 1.00 0.00 H new ATOM 753 N LEU A 49 -0.068 -7.822 -4.590 1.00 0.00 N ATOM 754 CA LEU A 49 -0.818 -8.464 -5.646 1.00 0.00 C ATOM 755 C LEU A 49 -1.589 -9.615 -5.018 1.00 0.00 C ATOM 756 O LEU A 49 -1.010 -10.622 -4.632 1.00 0.00 O ATOM 757 CB LEU A 49 0.210 -8.913 -6.679 1.00 0.00 C ATOM 758 CG LEU A 49 -0.394 -9.406 -8.001 1.00 0.00 C ATOM 759 CD1 LEU A 49 -1.033 -8.263 -8.797 1.00 0.00 C ATOM 760 CD2 LEU A 49 0.705 -10.060 -8.846 1.00 0.00 C ATOM 0 H LEU A 49 0.534 -8.461 -4.070 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.546 -7.820 -6.140 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.883 -8.082 -6.889 1.00 0.00 H new ATOM 0 HB3 LEU A 49 0.814 -9.712 -6.249 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.176 -10.128 -7.765 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.449 -8.654 -9.726 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.829 -7.809 -8.206 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.277 -7.512 -9.026 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.280 -10.412 -9.786 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.488 -9.330 -9.052 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.129 -10.904 -8.301 1.00 0.00 H new ATOM 772 N ILE A 50 -2.891 -9.457 -4.858 1.00 0.00 N ATOM 773 CA ILE A 50 -3.779 -10.495 -4.386 1.00 0.00 C ATOM 774 C ILE A 50 -4.180 -11.307 -5.631 1.00 0.00 C ATOM 775 O ILE A 50 -4.611 -10.732 -6.631 1.00 0.00 O ATOM 776 CB ILE A 50 -4.954 -9.835 -3.628 1.00 0.00 C ATOM 777 CG1 ILE A 50 -4.544 -9.167 -2.295 1.00 0.00 C ATOM 778 CG2 ILE A 50 -6.070 -10.850 -3.394 1.00 0.00 C ATOM 779 CD1 ILE A 50 -5.563 -8.092 -1.889 1.00 0.00 C ATOM 0 H ILE A 50 -3.369 -8.579 -5.059 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.328 -11.181 -3.669 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.313 -9.030 -4.269 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.473 -9.921 -1.512 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.556 -8.718 -2.396 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.891 -10.372 -2.859 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.430 -11.223 -4.353 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.687 -11.682 -2.802 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.255 -7.635 -0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.614 -7.328 -2.664 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -6.545 -8.549 -1.766 1.00 0.00 H new ATOM 791 N LEU A 51 -4.034 -12.632 -5.579 1.00 0.00 N ATOM 792 CA LEU A 51 -4.364 -13.554 -6.667 1.00 0.00 C ATOM 793 C LEU A 51 -5.688 -14.193 -6.300 1.00 0.00 C ATOM 794 O LEU A 51 -5.766 -14.798 -5.227 1.00 0.00 O ATOM 795 CB LEU A 51 -3.286 -14.653 -6.782 1.00 0.00 C ATOM 796 CG LEU A 51 -1.979 -14.240 -7.468 1.00 0.00 C ATOM 797 CD1 LEU A 51 -1.508 -12.809 -7.219 1.00 0.00 C ATOM 798 CD2 LEU A 51 -0.861 -15.154 -6.977 1.00 0.00 C ATOM 0 H LEU A 51 -3.672 -13.108 -4.753 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.416 -13.027 -7.620 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.050 -15.010 -5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.710 -15.495 -7.329 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.195 -14.318 -8.534 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.575 -12.635 -7.755 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.266 -12.110 -7.572 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.346 -12.660 -6.151 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.076 -14.872 -7.457 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.759 -15.056 -5.896 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.100 -16.188 -7.227 1.00 0.00 H new ATOM 810 N GLY A 52 -6.696 -14.095 -7.167 1.00 0.00 N ATOM 811 CA GLY A 52 -7.985 -14.714 -6.931 1.00 0.00 C ATOM 812 C GLY A 52 -8.250 -15.640 -8.098 1.00 0.00 C ATOM 813 O GLY A 52 -8.282 -15.186 -9.243 1.00 0.00 O ATOM 0 H GLY A 52 -6.635 -13.584 -8.048 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.981 -15.268 -5.992 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.767 -13.959 -6.852 1.00 0.00 H new ATOM 817 N ILE A 53 -8.426 -16.935 -7.842 1.00 0.00 N ATOM 818 CA ILE A 53 -8.899 -17.855 -8.868 1.00 0.00 C ATOM 819 C ILE A 53 -9.699 -18.982 -8.213 1.00 0.00 C ATOM 820 O ILE A 53 -9.137 -19.750 -7.432 1.00 0.00 O ATOM 821 CB ILE A 53 -7.733 -18.352 -9.768 1.00 0.00 C ATOM 822 CG1 ILE A 53 -8.297 -19.380 -10.775 1.00 0.00 C ATOM 823 CG2 ILE A 53 -6.506 -18.911 -9.004 1.00 0.00 C ATOM 824 CD1 ILE A 53 -7.530 -19.487 -12.084 1.00 0.00 C ATOM 0 H ILE A 53 -8.248 -17.367 -6.935 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.575 -17.334 -9.546 1.00 0.00 H new ATOM 0 HB ILE A 53 -7.334 -17.480 -10.287 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -8.312 -20.361 -10.299 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.331 -19.118 -10.998 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -5.748 -19.232 -9.718 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -6.093 -18.134 -8.361 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -6.813 -19.761 -8.395 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -8.003 -20.233 -12.723 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -7.536 -18.521 -12.589 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -6.501 -19.784 -11.880 1.00 0.00 H new ATOM 836 N PRO A 54 -11.006 -19.112 -8.505 1.00 0.00 N ATOM 837 CA PRO A 54 -11.730 -20.325 -8.151 1.00 0.00 C ATOM 838 C PRO A 54 -11.179 -21.523 -8.932 1.00 0.00 C ATOM 839 O PRO A 54 -10.786 -21.368 -10.089 1.00 0.00 O ATOM 840 CB PRO A 54 -13.194 -20.052 -8.506 1.00 0.00 C ATOM 841 CG PRO A 54 -13.293 -18.532 -8.415 1.00 0.00 C ATOM 842 CD PRO A 54 -11.941 -18.080 -8.964 1.00 0.00 C ATOM 0 HA PRO A 54 -11.623 -20.571 -7.095 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -13.441 -20.413 -9.504 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -13.876 -20.543 -7.812 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.122 -18.143 -9.006 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -13.448 -18.196 -7.390 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.955 -18.010 -10.052 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.666 -17.096 -8.585 1.00 0.00 H new ATOM 850 N THR A 55 -11.175 -22.717 -8.331 1.00 0.00 N ATOM 851 CA THR A 55 -10.904 -23.956 -9.068 1.00 0.00 C ATOM 852 C THR A 55 -11.997 -24.987 -8.775 1.00 0.00 C ATOM 853 O THR A 55 -12.328 -25.224 -7.611 1.00 0.00 O ATOM 854 CB THR A 55 -9.529 -24.571 -8.767 1.00 0.00 C ATOM 855 OG1 THR A 55 -8.569 -23.649 -8.294 1.00 0.00 O ATOM 856 CG2 THR A 55 -8.942 -25.226 -10.015 1.00 0.00 C ATOM 0 H THR A 55 -11.356 -22.852 -7.336 1.00 0.00 H new ATOM 0 HA THR A 55 -10.900 -23.684 -10.124 1.00 0.00 H new ATOM 0 HB THR A 55 -9.725 -25.297 -7.978 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.952 -23.127 -7.558 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.968 -25.654 -9.777 1.00 0.00 H new ATOM 0 HG22 THR A 55 -9.611 -26.014 -10.361 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.827 -24.478 -10.799 1.00 0.00 H new ATOM 864 N TRP A 56 -12.481 -25.636 -9.832 1.00 0.00 N ATOM 865 CA TRP A 56 -13.339 -26.815 -9.819 1.00 0.00 C ATOM 866 C TRP A 56 -12.863 -27.702 -10.981 1.00 0.00 C ATOM 867 O TRP A 56 -12.101 -27.235 -11.836 1.00 0.00 O ATOM 868 CB TRP A 56 -14.808 -26.410 -10.009 1.00 0.00 C ATOM 869 CG TRP A 56 -15.430 -25.591 -8.918 1.00 0.00 C ATOM 870 CD1 TRP A 56 -15.926 -26.082 -7.763 1.00 0.00 C ATOM 871 CD2 TRP A 56 -15.715 -24.157 -8.895 1.00 0.00 C ATOM 872 NE1 TRP A 56 -16.500 -25.062 -7.031 1.00 0.00 N ATOM 873 CE2 TRP A 56 -16.399 -23.851 -7.681 1.00 0.00 C ATOM 874 CE3 TRP A 56 -15.499 -23.089 -9.793 1.00 0.00 C ATOM 875 CZ2 TRP A 56 -16.835 -22.555 -7.368 1.00 0.00 C ATOM 876 CZ3 TRP A 56 -15.948 -21.786 -9.497 1.00 0.00 C ATOM 877 CH2 TRP A 56 -16.610 -21.516 -8.286 1.00 0.00 C ATOM 0 H TRP A 56 -12.269 -25.331 -10.782 1.00 0.00 H new ATOM 0 HA TRP A 56 -13.276 -27.345 -8.869 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -14.888 -25.851 -10.941 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -15.398 -27.319 -10.130 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -15.881 -27.117 -7.457 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -16.944 -25.189 -6.122 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -14.981 -23.274 -10.722 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -17.338 -22.358 -6.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -15.782 -20.988 -10.206 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -16.944 -20.514 -8.063 1.00 0.00 H new ATOM 888 N ASP A 57 -13.308 -28.963 -11.034 1.00 0.00 N ATOM 889 CA ASP A 57 -13.013 -29.841 -12.178 1.00 0.00 C ATOM 890 C ASP A 57 -13.685 -29.313 -13.450 1.00 0.00 C ATOM 891 O ASP A 57 -13.079 -29.312 -14.526 1.00 0.00 O ATOM 892 CB ASP A 57 -13.481 -31.270 -11.900 1.00 0.00 C ATOM 893 CG ASP A 57 -13.320 -32.146 -13.156 1.00 0.00 C ATOM 894 OD1 ASP A 57 -12.172 -32.536 -13.481 1.00 0.00 O ATOM 895 OD2 ASP A 57 -14.340 -32.466 -13.813 1.00 0.00 O ATOM 0 H ASP A 57 -13.871 -29.399 -10.303 1.00 0.00 H new ATOM 0 HA ASP A 57 -11.933 -29.848 -12.325 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -12.904 -31.694 -11.078 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.525 -31.262 -11.587 1.00 0.00 H new ATOM 900 N PHE A 58 -14.920 -28.813 -13.317 1.00 0.00 N ATOM 901 CA PHE A 58 -15.596 -28.083 -14.378 1.00 0.00 C ATOM 902 C PHE A 58 -14.965 -26.692 -14.496 1.00 0.00 C ATOM 903 O PHE A 58 -14.689 -26.044 -13.483 1.00 0.00 O ATOM 904 CB PHE A 58 -17.105 -28.004 -14.091 1.00 0.00 C ATOM 905 CG PHE A 58 -17.886 -27.258 -15.157 1.00 0.00 C ATOM 906 CD1 PHE A 58 -18.245 -27.906 -16.355 1.00 0.00 C ATOM 907 CD2 PHE A 58 -18.225 -25.904 -14.968 1.00 0.00 C ATOM 908 CE1 PHE A 58 -18.947 -27.207 -17.353 1.00 0.00 C ATOM 909 CE2 PHE A 58 -18.924 -25.203 -15.967 1.00 0.00 C ATOM 910 CZ PHE A 58 -19.284 -25.855 -17.160 1.00 0.00 C ATOM 0 H PHE A 58 -15.473 -28.908 -12.465 1.00 0.00 H new ATOM 0 HA PHE A 58 -15.478 -28.602 -15.329 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -17.503 -29.015 -14.001 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.259 -27.514 -13.130 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -17.981 -28.942 -16.507 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -17.947 -25.402 -14.053 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -19.227 -27.708 -18.268 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -19.184 -24.165 -15.818 1.00 0.00 H new ATOM 0 HZ PHE A 58 -19.820 -25.317 -17.928 1.00 0.00 H new ATOM 920 N GLY A 59 -14.775 -26.212 -15.727 1.00 0.00 N ATOM 921 CA GLY A 59 -14.265 -24.877 -16.009 1.00 0.00 C ATOM 922 C GLY A 59 -12.750 -24.784 -15.815 1.00 0.00 C ATOM 923 O GLY A 59 -12.033 -24.521 -16.785 1.00 0.00 O ATOM 0 H GLY A 59 -14.976 -26.753 -16.568 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.516 -24.603 -17.034 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -14.758 -24.156 -15.357 1.00 0.00 H new ATOM 927 N GLU A 60 -12.259 -25.031 -14.591 1.00 0.00 N ATOM 928 CA GLU A 60 -10.871 -24.775 -14.184 1.00 0.00 C ATOM 929 C GLU A 60 -10.500 -23.313 -14.510 1.00 0.00 C ATOM 930 O GLU A 60 -11.374 -22.440 -14.558 1.00 0.00 O ATOM 931 CB GLU A 60 -9.954 -25.861 -14.793 1.00 0.00 C ATOM 932 CG GLU A 60 -8.704 -26.144 -13.946 1.00 0.00 C ATOM 933 CD GLU A 60 -7.808 -27.192 -14.633 1.00 0.00 C ATOM 934 OE1 GLU A 60 -6.964 -26.804 -15.476 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 -7.929 -28.403 -14.323 1.00 0.00 O ATOM 0 H GLU A 60 -12.829 -25.423 -13.841 1.00 0.00 H new ATOM 0 HA GLU A 60 -10.735 -24.862 -13.106 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.523 -26.784 -14.909 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.646 -25.549 -15.791 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.144 -25.221 -13.796 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.000 -26.501 -12.960 1.00 0.00 H new ATOM 942 N ILE A 61 -9.208 -23.026 -14.678 1.00 0.00 N ATOM 943 CA ILE A 61 -8.708 -21.766 -15.212 1.00 0.00 C ATOM 944 C ILE A 61 -9.508 -21.418 -16.479 1.00 0.00 C ATOM 945 O ILE A 61 -9.521 -22.171 -17.457 1.00 0.00 O ATOM 946 CB ILE A 61 -7.190 -21.881 -15.493 1.00 0.00 C ATOM 947 CG1 ILE A 61 -6.367 -21.933 -14.190 1.00 0.00 C ATOM 948 CG2 ILE A 61 -6.697 -20.689 -16.325 1.00 0.00 C ATOM 949 CD1 ILE A 61 -4.976 -22.544 -14.334 1.00 0.00 C ATOM 0 H ILE A 61 -8.465 -23.683 -14.439 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.841 -20.960 -14.490 1.00 0.00 H new ATOM 0 HB ILE A 61 -7.047 -22.810 -16.044 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.265 -20.920 -13.801 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.924 -22.505 -13.448 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.628 -20.792 -16.510 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.229 -20.664 -17.276 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -6.884 -19.763 -15.781 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.474 -22.537 -13.367 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.065 -23.570 -14.690 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.395 -21.961 -15.049 1.00 0.00 H new ATOM 961 N GLN A 62 -10.147 -20.246 -16.444 1.00 0.00 N ATOM 962 CA GLN A 62 -10.854 -19.652 -17.572 1.00 0.00 C ATOM 963 C GLN A 62 -9.849 -19.068 -18.564 1.00 0.00 C ATOM 964 O GLN A 62 -8.750 -18.660 -18.181 1.00 0.00 O ATOM 965 CB GLN A 62 -11.895 -18.608 -17.108 1.00 0.00 C ATOM 966 CG GLN A 62 -11.423 -17.657 -15.990 1.00 0.00 C ATOM 967 CD GLN A 62 -11.510 -18.281 -14.592 1.00 0.00 C ATOM 968 OE1 GLN A 62 -12.515 -18.873 -14.214 1.00 0.00 O ATOM 969 NE2 GLN A 62 -10.430 -18.228 -13.822 1.00 0.00 N ATOM 0 H GLN A 62 -10.185 -19.670 -15.603 1.00 0.00 H new ATOM 0 HA GLN A 62 -11.418 -20.433 -18.082 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -12.193 -18.010 -17.969 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -12.784 -19.135 -16.762 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -10.393 -17.360 -16.185 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.026 -16.750 -16.014 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -9.598 -17.733 -14.144 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -10.432 -18.682 -12.909 1.00 0.00 H new ATOM 978 N GLU A 63 -10.258 -18.980 -19.831 1.00 0.00 N ATOM 979 CA GLU A 63 -9.388 -18.622 -20.948 1.00 0.00 C ATOM 980 C GLU A 63 -8.728 -17.265 -20.713 1.00 0.00 C ATOM 981 O GLU A 63 -7.531 -17.136 -20.931 1.00 0.00 O ATOM 982 CB GLU A 63 -10.218 -18.640 -22.243 1.00 0.00 C ATOM 983 CG GLU A 63 -9.396 -18.238 -23.474 1.00 0.00 C ATOM 984 CD GLU A 63 -10.201 -18.429 -24.774 1.00 0.00 C ATOM 985 OE1 GLU A 63 -10.915 -17.487 -25.198 1.00 0.00 O ATOM 986 OE2 GLU A 63 -10.113 -19.518 -25.394 1.00 0.00 O ATOM 0 H GLU A 63 -11.222 -19.159 -20.113 1.00 0.00 H new ATOM 0 HA GLU A 63 -8.580 -19.348 -21.036 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.628 -19.639 -22.394 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.064 -17.961 -22.138 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.089 -17.196 -23.384 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -8.486 -18.836 -23.517 1.00 0.00 H new ATOM 993 N ASP A 64 -9.456 -16.268 -20.203 1.00 0.00 N ATOM 994 CA ASP A 64 -8.924 -14.902 -20.073 1.00 0.00 C ATOM 995 C ASP A 64 -7.834 -14.799 -18.998 1.00 0.00 C ATOM 996 O ASP A 64 -7.087 -13.822 -18.968 1.00 0.00 O ATOM 997 CB ASP A 64 -10.061 -13.909 -19.803 1.00 0.00 C ATOM 998 CG ASP A 64 -10.943 -13.752 -21.051 1.00 0.00 C ATOM 999 OD1 ASP A 64 -10.494 -13.134 -22.044 1.00 0.00 O ATOM 1000 OD2 ASP A 64 -12.106 -14.225 -21.033 1.00 0.00 O ATOM 0 H ASP A 64 -10.415 -16.377 -19.873 1.00 0.00 H new ATOM 0 HA ASP A 64 -8.452 -14.645 -21.021 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -10.665 -14.257 -18.965 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -9.647 -12.942 -19.518 1.00 0.00 H new ATOM 1005 N TRP A 65 -7.723 -15.804 -18.122 1.00 0.00 N ATOM 1006 CA TRP A 65 -6.656 -15.925 -17.132 1.00 0.00 C ATOM 1007 C TRP A 65 -5.524 -16.757 -17.749 1.00 0.00 C ATOM 1008 O TRP A 65 -4.371 -16.338 -17.721 1.00 0.00 O ATOM 1009 CB TRP A 65 -7.273 -16.541 -15.871 1.00 0.00 C ATOM 1010 CG TRP A 65 -6.518 -16.512 -14.570 1.00 0.00 C ATOM 1011 CD1 TRP A 65 -6.797 -15.715 -13.507 1.00 0.00 C ATOM 1012 CD2 TRP A 65 -5.461 -17.405 -14.100 1.00 0.00 C ATOM 1013 NE1 TRP A 65 -6.035 -16.083 -12.420 1.00 0.00 N ATOM 1014 CE2 TRP A 65 -5.214 -17.145 -12.719 1.00 0.00 C ATOM 1015 CE3 TRP A 65 -4.727 -18.454 -14.684 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 -4.333 -17.917 -11.952 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 -3.844 -19.244 -13.926 1.00 0.00 C ATOM 1018 CH2 TRP A 65 -3.659 -18.988 -12.559 1.00 0.00 C ATOM 0 H TRP A 65 -8.392 -16.573 -18.084 1.00 0.00 H new ATOM 0 HA TRP A 65 -6.217 -14.969 -16.846 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -8.228 -16.044 -15.702 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -7.492 -17.585 -16.095 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -7.514 -14.908 -13.513 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -6.075 -15.626 -11.509 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -4.844 -18.657 -15.738 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -4.174 -17.691 -10.908 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -3.306 -20.052 -14.399 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -3.000 -19.613 -11.975 1.00 0.00 H new ATOM 1029 N GLU A 66 -5.825 -17.899 -18.388 1.00 0.00 N ATOM 1030 CA GLU A 66 -4.823 -18.778 -18.988 1.00 0.00 C ATOM 1031 C GLU A 66 -4.071 -18.051 -20.113 1.00 0.00 C ATOM 1032 O GLU A 66 -2.866 -18.242 -20.282 1.00 0.00 O ATOM 1033 CB GLU A 66 -5.510 -20.081 -19.449 1.00 0.00 C ATOM 1034 CG GLU A 66 -4.992 -20.600 -20.783 1.00 0.00 C ATOM 1035 CD GLU A 66 -5.608 -21.964 -21.148 1.00 0.00 C ATOM 1036 OE1 GLU A 66 -6.719 -21.993 -21.733 1.00 0.00 O1- ATOM 1037 OE2 GLU A 66 -4.976 -23.012 -20.872 1.00 0.00 O ATOM 0 H GLU A 66 -6.781 -18.236 -18.501 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.065 -19.051 -18.254 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -5.365 -20.848 -18.688 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.583 -19.909 -19.527 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.220 -19.878 -21.567 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.907 -20.692 -20.740 1.00 0.00 H new ATOM 1044 N ALA A 67 -4.769 -17.190 -20.855 1.00 0.00 N ATOM 1045 CA ALA A 67 -4.237 -16.499 -22.025 1.00 0.00 C ATOM 1046 C ALA A 67 -3.052 -15.609 -21.642 1.00 0.00 C ATOM 1047 O ALA A 67 -2.191 -15.327 -22.477 1.00 0.00 O ATOM 1048 CB ALA A 67 -5.336 -15.641 -22.661 1.00 0.00 C ATOM 0 H ALA A 67 -5.740 -16.950 -20.653 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.892 -17.247 -22.739 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.936 -15.126 -23.534 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.166 -16.279 -22.964 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.689 -14.907 -21.937 1.00 0.00 H new ATOM 1054 N VAL A 68 -3.015 -15.171 -20.380 1.00 0.00 N ATOM 1055 CA VAL A 68 -1.939 -14.361 -19.829 1.00 0.00 C ATOM 1056 C VAL A 68 -1.116 -15.121 -18.802 1.00 0.00 C ATOM 1057 O VAL A 68 -0.013 -14.673 -18.523 1.00 0.00 O ATOM 1058 CB VAL A 68 -2.490 -13.039 -19.278 1.00 0.00 C ATOM 1059 CG1 VAL A 68 -3.079 -12.185 -20.409 1.00 0.00 C ATOM 1060 CG2 VAL A 68 -3.528 -13.238 -18.176 1.00 0.00 C ATOM 0 H VAL A 68 -3.750 -15.377 -19.704 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.251 -14.120 -20.639 1.00 0.00 H new ATOM 0 HB VAL A 68 -1.645 -12.517 -18.829 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.464 -11.252 -19.998 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.302 -11.965 -21.141 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.889 -12.730 -20.892 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.879 -12.267 -17.828 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.370 -13.809 -18.568 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.077 -13.780 -17.345 1.00 0.00 H new ATOM 1070 N TRP A 69 -1.580 -16.263 -18.280 1.00 0.00 N ATOM 1071 CA TRP A 69 -0.850 -17.104 -17.328 1.00 0.00 C ATOM 1072 C TRP A 69 0.553 -17.415 -17.853 1.00 0.00 C ATOM 1073 O TRP A 69 1.531 -17.338 -17.114 1.00 0.00 O ATOM 1074 CB TRP A 69 -1.677 -18.369 -17.059 1.00 0.00 C ATOM 1075 CG TRP A 69 -1.120 -19.368 -16.094 1.00 0.00 C ATOM 1076 CD1 TRP A 69 -0.757 -19.124 -14.816 1.00 0.00 C ATOM 1077 CD2 TRP A 69 -0.926 -20.802 -16.291 1.00 0.00 C ATOM 1078 NE1 TRP A 69 -0.331 -20.298 -14.219 1.00 0.00 N ATOM 1079 CE2 TRP A 69 -0.389 -21.357 -15.095 1.00 0.00 C ATOM 1080 CE3 TRP A 69 -1.168 -21.695 -17.356 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 -0.060 -22.711 -14.972 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 -0.855 -23.064 -17.243 1.00 0.00 C ATOM 1083 CH2 TRP A 69 -0.295 -23.573 -16.056 1.00 0.00 C ATOM 0 H TRP A 69 -2.499 -16.636 -18.516 1.00 0.00 H new ATOM 0 HA TRP A 69 -0.711 -16.580 -16.382 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -2.656 -18.059 -16.694 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -1.837 -18.875 -18.011 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -0.794 -18.159 -14.333 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.014 -20.369 -13.252 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -1.600 -21.323 -18.273 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 0.369 -23.089 -14.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -1.046 -23.728 -18.073 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -0.047 -24.621 -15.979 1.00 0.00 H new ATOM 1094 N ASP A 70 0.667 -17.623 -19.164 1.00 0.00 N ATOM 1095 CA ASP A 70 1.920 -17.859 -19.875 1.00 0.00 C ATOM 1096 C ASP A 70 2.890 -16.662 -19.810 1.00 0.00 C ATOM 1097 O ASP A 70 4.107 -16.849 -19.831 1.00 0.00 O ATOM 1098 CB ASP A 70 1.562 -18.203 -21.325 1.00 0.00 C ATOM 1099 CG ASP A 70 2.823 -18.472 -22.164 1.00 0.00 C ATOM 1100 OD1 ASP A 70 3.441 -19.551 -22.000 1.00 0.00 O ATOM 1101 OD2 ASP A 70 3.176 -17.622 -23.016 1.00 0.00 O1- ATOM 0 H ASP A 70 -0.144 -17.632 -19.783 1.00 0.00 H new ATOM 0 HA ASP A 70 2.453 -18.680 -19.395 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.916 -19.081 -21.344 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.997 -17.382 -21.767 1.00 0.00 H new ATOM 1106 N GLN A 71 2.369 -15.437 -19.664 1.00 0.00 N ATOM 1107 CA GLN A 71 3.126 -14.195 -19.542 1.00 0.00 C ATOM 1108 C GLN A 71 3.407 -13.822 -18.093 1.00 0.00 C ATOM 1109 O GLN A 71 4.314 -13.038 -17.837 1.00 0.00 O ATOM 1110 CB GLN A 71 2.379 -13.035 -20.219 1.00 0.00 C ATOM 1111 CG GLN A 71 2.320 -13.220 -21.743 1.00 0.00 C ATOM 1112 CD GLN A 71 2.047 -11.888 -22.435 1.00 0.00 C ATOM 1113 OE1 GLN A 71 2.947 -11.230 -22.956 1.00 0.00 O ATOM 1114 NE2 GLN A 71 0.806 -11.431 -22.406 1.00 0.00 N ATOM 0 H GLN A 71 1.361 -15.283 -19.627 1.00 0.00 H new ATOM 0 HA GLN A 71 4.080 -14.368 -20.040 1.00 0.00 H new ATOM 0 HB2 GLN A 71 1.367 -12.969 -19.819 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.876 -12.094 -19.984 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.262 -13.636 -22.101 1.00 0.00 H new ATOM 0 HG3 GLN A 71 1.538 -13.936 -21.998 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.068 -11.985 -21.971 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.587 -10.524 -22.818 1.00 0.00 H new ATOM 1123 N LEU A 72 2.650 -14.354 -17.132 1.00 0.00 N ATOM 1124 CA LEU A 72 2.806 -13.978 -15.721 1.00 0.00 C ATOM 1125 C LEU A 72 4.187 -14.365 -15.188 1.00 0.00 C ATOM 1126 O LEU A 72 4.676 -13.741 -14.252 1.00 0.00 O ATOM 1127 CB LEU A 72 1.679 -14.559 -14.846 1.00 0.00 C ATOM 1128 CG LEU A 72 0.257 -14.161 -15.282 1.00 0.00 C ATOM 1129 CD1 LEU A 72 -0.785 -14.612 -14.260 1.00 0.00 C ATOM 1130 CD2 LEU A 72 0.096 -12.672 -15.567 1.00 0.00 C ATOM 0 H LEU A 72 1.922 -15.047 -17.303 1.00 0.00 H new ATOM 0 HA LEU A 72 2.727 -12.892 -15.666 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.756 -15.646 -14.853 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.833 -14.235 -13.817 1.00 0.00 H new ATOM 0 HG LEU A 72 0.090 -14.682 -16.225 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.778 -14.316 -14.598 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.746 -15.696 -14.155 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.575 -14.146 -13.297 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.931 -12.468 -15.868 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.330 -12.102 -14.668 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.774 -12.380 -16.369 1.00 0.00 H new ATOM 1142 N ASP A 73 4.841 -15.360 -15.804 1.00 0.00 N ATOM 1143 CA ASP A 73 6.212 -15.732 -15.452 1.00 0.00 C ATOM 1144 C ASP A 73 7.229 -14.721 -16.012 1.00 0.00 C ATOM 1145 O ASP A 73 8.289 -14.517 -15.421 1.00 0.00 O ATOM 1146 CB ASP A 73 6.532 -17.161 -15.911 1.00 0.00 C ATOM 1147 CG ASP A 73 8.038 -17.474 -15.808 1.00 0.00 C ATOM 1148 OD1 ASP A 73 8.521 -17.749 -14.685 1.00 0.00 O ATOM 1149 OD2 ASP A 73 8.724 -17.496 -16.859 1.00 0.00 O1- ATOM 0 H ASP A 73 4.436 -15.923 -16.553 1.00 0.00 H new ATOM 0 HA ASP A 73 6.293 -15.708 -14.365 1.00 0.00 H new ATOM 0 HB2 ASP A 73 5.971 -17.872 -15.304 1.00 0.00 H new ATOM 0 HB3 ASP A 73 6.203 -17.293 -16.942 1.00 0.00 H new ATOM 1154 N ASP A 74 6.903 -14.037 -17.116 1.00 0.00 N ATOM 1155 CA ASP A 74 7.816 -13.130 -17.816 1.00 0.00 C ATOM 1156 C ASP A 74 7.924 -11.757 -17.133 1.00 0.00 C ATOM 1157 O ASP A 74 8.866 -11.003 -17.385 1.00 0.00 O ATOM 1158 CB ASP A 74 7.360 -12.968 -19.272 1.00 0.00 C ATOM 1159 CG ASP A 74 8.332 -12.093 -20.085 1.00 0.00 C ATOM 1160 OD1 ASP A 74 9.491 -12.523 -20.308 1.00 0.00 O ATOM 1161 OD2 ASP A 74 7.923 -11.002 -20.556 1.00 0.00 O1- ATOM 0 H ASP A 74 5.984 -14.100 -17.553 1.00 0.00 H new ATOM 0 HA ASP A 74 8.811 -13.574 -17.785 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.279 -13.950 -19.738 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.366 -12.522 -19.293 1.00 0.00 H new ATOM 1166 N LEU A 75 6.968 -11.427 -16.252 1.00 0.00 N ATOM 1167 CA LEU A 75 6.816 -10.102 -15.664 1.00 0.00 C ATOM 1168 C LEU A 75 8.034 -9.719 -14.832 1.00 0.00 C ATOM 1169 O LEU A 75 8.653 -10.556 -14.169 1.00 0.00 O ATOM 1170 CB LEU A 75 5.556 -10.016 -14.785 1.00 0.00 C ATOM 1171 CG LEU A 75 4.226 -10.316 -15.494 1.00 0.00 C ATOM 1172 CD1 LEU A 75 3.062 -9.971 -14.561 1.00 0.00 C ATOM 1173 CD2 LEU A 75 4.054 -9.566 -16.815 1.00 0.00 C ATOM 0 H LEU A 75 6.268 -12.093 -15.926 1.00 0.00 H new ATOM 0 HA LEU A 75 6.718 -9.402 -16.494 1.00 0.00 H new ATOM 0 HB2 LEU A 75 5.668 -10.711 -13.953 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.501 -9.015 -14.358 1.00 0.00 H new ATOM 0 HG LEU A 75 4.234 -11.379 -15.735 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.118 -10.183 -15.063 1.00 0.00 H new ATOM 0 HD12 LEU A 75 3.133 -10.570 -13.653 1.00 0.00 H new ATOM 0 HD13 LEU A 75 3.105 -8.913 -14.302 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.093 -9.827 -17.259 1.00 0.00 H new ATOM 0 HD22 LEU A 75 4.089 -8.492 -16.631 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.857 -9.844 -17.498 1.00 0.00 H new ATOM 1185 N ASN A 76 8.328 -8.425 -14.813 1.00 0.00 N ATOM 1186 CA ASN A 76 9.370 -7.821 -13.997 1.00 0.00 C ATOM 1187 C ASN A 76 8.794 -7.576 -12.605 1.00 0.00 C ATOM 1188 O ASN A 76 8.306 -6.487 -12.298 1.00 0.00 O ATOM 1189 CB ASN A 76 9.896 -6.537 -14.663 1.00 0.00 C ATOM 1190 CG ASN A 76 11.039 -5.930 -13.851 1.00 0.00 C ATOM 1191 OD1 ASN A 76 10.891 -4.903 -13.192 1.00 0.00 O ATOM 1192 ND2 ASN A 76 12.203 -6.562 -13.877 1.00 0.00 N ATOM 0 H ASN A 76 7.829 -7.745 -15.386 1.00 0.00 H new ATOM 0 HA ASN A 76 10.230 -8.484 -13.904 1.00 0.00 H new ATOM 0 HB2 ASN A 76 10.241 -6.761 -15.672 1.00 0.00 H new ATOM 0 HB3 ASN A 76 9.086 -5.813 -14.756 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.993 -6.197 -13.345 1.00 0.00 H new ATOM 0 HD22 ASN A 76 12.309 -7.413 -14.429 1.00 0.00 H new ATOM 1199 N LEU A 77 8.799 -8.623 -11.779 1.00 0.00 N ATOM 1200 CA LEU A 77 8.473 -8.542 -10.365 1.00 0.00 C ATOM 1201 C LEU A 77 9.414 -9.461 -9.596 1.00 0.00 C ATOM 1202 O LEU A 77 9.586 -10.620 -9.961 1.00 0.00 O ATOM 1203 CB LEU A 77 6.975 -8.817 -10.102 1.00 0.00 C ATOM 1204 CG LEU A 77 6.432 -10.231 -10.403 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.462 -11.133 -9.159 1.00 0.00 C ATOM 1206 CD2 LEU A 77 4.969 -10.147 -10.857 1.00 0.00 C ATOM 0 H LEU A 77 9.035 -9.567 -12.085 1.00 0.00 H new ATOM 0 HA LEU A 77 8.628 -7.526 -10.003 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.775 -8.599 -9.053 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.397 -8.105 -10.691 1.00 0.00 H new ATOM 0 HG LEU A 77 7.071 -10.651 -11.180 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.072 -12.118 -9.414 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.488 -11.230 -8.805 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.847 -10.691 -8.375 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.595 -11.149 -11.067 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.369 -9.694 -10.068 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.902 -9.539 -11.759 1.00 0.00 H new ATOM 1218 N GLU A 78 9.992 -8.916 -8.531 1.00 0.00 N ATOM 1219 CA GLU A 78 10.739 -9.585 -7.485 1.00 0.00 C ATOM 1220 C GLU A 78 10.376 -8.918 -6.160 1.00 0.00 C ATOM 1221 O GLU A 78 10.114 -7.715 -6.124 1.00 0.00 O ATOM 1222 CB GLU A 78 12.256 -9.502 -7.725 1.00 0.00 C ATOM 1223 CG GLU A 78 12.730 -10.624 -8.641 1.00 0.00 C ATOM 1224 CD GLU A 78 14.248 -10.550 -8.892 1.00 0.00 C ATOM 1225 OE1 GLU A 78 15.027 -11.156 -8.118 1.00 0.00 O1- ATOM 1226 OE2 GLU A 78 14.677 -9.897 -9.875 1.00 0.00 O ATOM 0 H GLU A 78 9.943 -7.910 -8.369 1.00 0.00 H new ATOM 0 HA GLU A 78 10.480 -10.644 -7.474 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.505 -8.538 -8.168 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.782 -9.560 -6.772 1.00 0.00 H new ATOM 0 HG2 GLU A 78 12.481 -11.587 -8.196 1.00 0.00 H new ATOM 0 HG3 GLU A 78 12.200 -10.566 -9.592 1.00 0.00 H new ATOM 1233 N GLY A 79 10.353 -9.700 -5.079 1.00 0.00 N ATOM 1234 CA GLY A 79 10.242 -9.201 -3.709 1.00 0.00 C ATOM 1235 C GLY A 79 8.890 -8.593 -3.315 1.00 0.00 C ATOM 1236 O GLY A 79 8.736 -8.226 -2.148 1.00 0.00 O ATOM 0 H GLY A 79 10.412 -10.717 -5.133 1.00 0.00 H new ATOM 0 HA2 GLY A 79 10.459 -10.023 -3.027 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.014 -8.447 -3.556 1.00 0.00 H new ATOM 1240 N LYS A 80 7.909 -8.476 -4.225 1.00 0.00 N ATOM 1241 CA LYS A 80 6.629 -7.851 -3.903 1.00 0.00 C ATOM 1242 C LYS A 80 5.814 -8.780 -3.016 1.00 0.00 C ATOM 1243 O LYS A 80 6.056 -9.987 -2.980 1.00 0.00 O ATOM 1244 CB LYS A 80 5.893 -7.326 -5.159 1.00 0.00 C ATOM 1245 CG LYS A 80 5.029 -8.339 -5.928 1.00 0.00 C ATOM 1246 CD LYS A 80 3.978 -7.696 -6.856 1.00 0.00 C ATOM 1247 CE LYS A 80 4.486 -6.845 -8.051 1.00 0.00 C ATOM 1248 NZ LYS A 80 4.878 -5.441 -7.706 1.00 0.00 N1+ ATOM 0 H LYS A 80 7.984 -8.808 -5.187 1.00 0.00 H new ATOM 0 HA LYS A 80 6.804 -6.946 -3.322 1.00 0.00 H new ATOM 0 HB2 LYS A 80 5.255 -6.495 -4.857 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.637 -6.923 -5.846 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.681 -8.978 -6.524 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.519 -8.983 -5.211 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.353 -8.494 -7.256 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.335 -7.063 -6.245 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.345 -7.347 -8.496 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.706 -6.812 -8.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 4.859 -4.854 -8.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.210 -5.055 -7.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.838 -5.437 -7.305 1.00 0.00 H new ATOM 1262 N ILE A 81 4.812 -8.229 -2.343 1.00 0.00 N ATOM 1263 CA ILE A 81 3.933 -9.023 -1.500 1.00 0.00 C ATOM 1264 C ILE A 81 2.843 -9.597 -2.395 1.00 0.00 C ATOM 1265 O ILE A 81 2.276 -8.893 -3.228 1.00 0.00 O ATOM 1266 CB ILE A 81 3.403 -8.235 -0.281 1.00 0.00 C ATOM 1267 CG1 ILE A 81 4.533 -7.414 0.385 1.00 0.00 C ATOM 1268 CG2 ILE A 81 2.767 -9.245 0.694 1.00 0.00 C ATOM 1269 CD1 ILE A 81 4.283 -7.015 1.841 1.00 0.00 C ATOM 0 H ILE A 81 4.589 -7.234 -2.366 1.00 0.00 H new ATOM 0 HA ILE A 81 4.483 -9.845 -1.042 1.00 0.00 H new ATOM 0 HB ILE A 81 2.650 -7.511 -0.594 1.00 0.00 H new ATOM 0 HG12 ILE A 81 5.456 -7.992 0.338 1.00 0.00 H new ATOM 0 HG13 ILE A 81 4.694 -6.508 -0.200 1.00 0.00 H new ATOM 0 HG21 ILE A 81 2.383 -8.716 1.566 1.00 0.00 H new ATOM 0 HG22 ILE A 81 1.949 -9.766 0.196 1.00 0.00 H new ATOM 0 HG23 ILE A 81 3.519 -9.969 1.010 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.134 -6.444 2.213 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.382 -6.405 1.901 1.00 0.00 H new ATOM 0 HD13 ILE A 81 4.155 -7.912 2.447 1.00 0.00 H new ATOM 1281 N VAL A 82 2.546 -10.873 -2.216 1.00 0.00 N ATOM 1282 CA VAL A 82 1.545 -11.599 -2.970 1.00 0.00 C ATOM 1283 C VAL A 82 0.619 -12.289 -1.970 1.00 0.00 C ATOM 1284 O VAL A 82 1.098 -12.851 -0.986 1.00 0.00 O ATOM 1285 CB VAL A 82 2.253 -12.565 -3.943 1.00 0.00 C ATOM 1286 CG1 VAL A 82 1.264 -13.496 -4.649 1.00 0.00 C ATOM 1287 CG2 VAL A 82 3.041 -11.769 -5.006 1.00 0.00 C ATOM 0 H VAL A 82 3.013 -11.450 -1.516 1.00 0.00 H new ATOM 0 HA VAL A 82 0.929 -10.946 -3.587 1.00 0.00 H new ATOM 0 HB VAL A 82 2.933 -13.175 -3.349 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.806 -14.158 -5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.731 -14.091 -3.907 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.549 -12.903 -5.219 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.536 -12.462 -5.686 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.355 -11.136 -5.569 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.789 -11.147 -4.514 1.00 0.00 H new ATOM 1297 N ALA A 83 -0.693 -12.272 -2.222 1.00 0.00 N ATOM 1298 CA ALA A 83 -1.670 -13.073 -1.487 1.00 0.00 C ATOM 1299 C ALA A 83 -2.262 -14.099 -2.441 1.00 0.00 C ATOM 1300 O ALA A 83 -2.287 -13.865 -3.647 1.00 0.00 O ATOM 1301 CB ALA A 83 -2.782 -12.199 -0.898 1.00 0.00 C ATOM 0 H ALA A 83 -1.109 -11.694 -2.952 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.171 -13.569 -0.654 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -3.491 -12.827 -0.358 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.348 -11.470 -0.213 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.299 -11.677 -1.703 1.00 0.00 H new ATOM 1307 N LEU A 84 -2.789 -15.195 -1.908 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.370 -16.290 -2.676 1.00 0.00 C ATOM 1309 C LEU A 84 -4.627 -16.723 -1.949 1.00 0.00 C ATOM 1310 O LEU A 84 -4.586 -16.889 -0.730 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.357 -17.447 -2.718 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.396 -17.375 -3.912 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -0.033 -17.952 -3.533 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -1.963 -18.151 -5.107 1.00 0.00 C ATOM 0 H LEU A 84 -2.825 -15.351 -0.901 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.607 -15.991 -3.697 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.778 -17.446 -1.795 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.898 -18.392 -2.754 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.279 -16.328 -4.190 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.638 -17.894 -4.390 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.386 -17.381 -2.705 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.149 -18.993 -3.233 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.268 -18.089 -5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.103 -19.196 -4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.921 -17.721 -5.398 1.00 0.00 H new ATOM 1326 N TYR A 85 -5.730 -16.933 -2.659 1.00 0.00 N ATOM 1327 CA TYR A 85 -6.932 -17.533 -2.110 1.00 0.00 C ATOM 1328 C TYR A 85 -7.832 -17.951 -3.272 1.00 0.00 C ATOM 1329 O TYR A 85 -7.581 -17.600 -4.429 1.00 0.00 O ATOM 1330 CB TYR A 85 -7.679 -16.538 -1.204 1.00 0.00 C ATOM 1331 CG TYR A 85 -8.377 -15.439 -1.965 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -7.617 -14.432 -2.590 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -9.774 -15.500 -2.148 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -8.246 -13.561 -3.483 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -10.410 -14.594 -3.009 1.00 0.00 C ATOM 1336 CZ TYR A 85 -9.632 -13.636 -3.691 1.00 0.00 C ATOM 1337 OH TYR A 85 -10.199 -12.743 -4.531 1.00 0.00 O ATOM 0 H TYR A 85 -5.811 -16.686 -3.645 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.661 -18.398 -1.505 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -8.414 -17.081 -0.610 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -6.971 -16.092 -0.506 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.562 -14.334 -2.382 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -10.355 -16.245 -1.625 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -7.662 -12.826 -4.017 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.480 -14.630 -3.148 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.335 -13.159 -5.408 1.00 0.00 H new ATOM 1347 N GLY A 86 -8.896 -18.680 -2.963 1.00 0.00 N ATOM 1348 CA GLY A 86 -9.967 -18.934 -3.906 1.00 0.00 C ATOM 1349 C GLY A 86 -11.055 -19.754 -3.244 1.00 0.00 C ATOM 1350 O GLY A 86 -10.926 -20.160 -2.090 1.00 0.00 O ATOM 0 H GLY A 86 -9.037 -19.111 -2.049 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -10.378 -17.991 -4.265 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.579 -19.464 -4.776 1.00 0.00 H new ATOM 1354 N LEU A 87 -12.125 -19.992 -3.995 1.00 0.00 N ATOM 1355 CA LEU A 87 -13.213 -20.893 -3.629 1.00 0.00 C ATOM 1356 C LEU A 87 -13.151 -22.155 -4.482 1.00 0.00 C ATOM 1357 O LEU A 87 -12.633 -22.140 -5.600 1.00 0.00 O ATOM 1358 CB LEU A 87 -14.625 -20.253 -3.635 1.00 0.00 C ATOM 1359 CG LEU A 87 -14.922 -19.261 -4.769 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -16.416 -19.231 -5.093 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -14.482 -17.852 -4.342 1.00 0.00 C ATOM 0 H LEU A 87 -12.264 -19.550 -4.904 1.00 0.00 H new ATOM 0 HA LEU A 87 -13.053 -21.153 -2.583 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.363 -21.054 -3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -14.771 -19.739 -2.685 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.374 -19.581 -5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -16.599 -18.521 -5.899 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.741 -20.224 -5.403 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -16.974 -18.927 -4.208 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -14.692 -17.146 -5.146 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -15.029 -17.556 -3.447 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -13.413 -17.853 -4.130 1.00 0.00 H new ATOM 1373 N GLY A 88 -13.705 -23.235 -3.944 1.00 0.00 N ATOM 1374 CA GLY A 88 -13.957 -24.485 -4.639 1.00 0.00 C ATOM 1375 C GLY A 88 -15.172 -25.143 -3.994 1.00 0.00 C ATOM 1376 O GLY A 88 -16.023 -24.451 -3.429 1.00 0.00 O ATOM 0 H GLY A 88 -14.003 -23.261 -2.969 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -14.139 -24.303 -5.698 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.088 -25.140 -4.573 1.00 0.00 H new ATOM 1380 N ASP A 89 -15.269 -26.470 -4.073 1.00 0.00 N ATOM 1381 CA ASP A 89 -16.372 -27.235 -3.498 1.00 0.00 C ATOM 1382 C ASP A 89 -15.851 -28.582 -2.994 1.00 0.00 C ATOM 1383 O ASP A 89 -15.269 -29.350 -3.763 1.00 0.00 O ATOM 1384 CB ASP A 89 -17.460 -27.435 -4.559 1.00 0.00 C ATOM 1385 CG ASP A 89 -18.345 -28.638 -4.247 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -18.752 -28.777 -3.068 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -18.604 -29.427 -5.185 1.00 0.00 O ATOM 0 H ASP A 89 -14.575 -27.050 -4.544 1.00 0.00 H new ATOM 0 HA ASP A 89 -16.802 -26.693 -2.656 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -18.076 -26.538 -4.621 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -16.994 -27.570 -5.535 1.00 0.00 H new ATOM 1392 N GLN A 90 -16.065 -28.883 -1.712 1.00 0.00 N ATOM 1393 CA GLN A 90 -15.630 -30.138 -1.097 1.00 0.00 C ATOM 1394 C GLN A 90 -16.494 -31.348 -1.508 1.00 0.00 C ATOM 1395 O GLN A 90 -16.064 -32.483 -1.303 1.00 0.00 O ATOM 1396 CB GLN A 90 -15.528 -29.958 0.431 1.00 0.00 C ATOM 1397 CG GLN A 90 -16.887 -29.850 1.141 1.00 0.00 C ATOM 1398 CD GLN A 90 -16.780 -29.056 2.445 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -16.728 -29.614 3.539 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -16.753 -27.735 2.344 1.00 0.00 N ATOM 0 H GLN A 90 -16.549 -28.258 -1.067 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.637 -30.376 -1.479 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -14.977 -30.800 0.850 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -14.947 -29.060 0.643 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -17.607 -29.368 0.479 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -17.268 -30.849 1.353 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.797 -27.293 1.426 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -16.688 -27.160 3.184 1.00 0.00 H new ATOM 1409 N LEU A 91 -17.666 -31.144 -2.124 1.00 0.00 N ATOM 1410 CA LEU A 91 -18.454 -32.217 -2.744 1.00 0.00 C ATOM 1411 C LEU A 91 -17.740 -32.746 -3.993 1.00 0.00 C ATOM 1412 O LEU A 91 -17.981 -33.890 -4.383 1.00 0.00 O ATOM 1413 CB LEU A 91 -19.905 -31.784 -3.064 1.00 0.00 C ATOM 1414 CG LEU A 91 -20.721 -31.298 -1.862 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -22.153 -30.985 -2.318 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -20.749 -32.255 -0.660 1.00 0.00 C ATOM 0 H LEU A 91 -18.097 -30.223 -2.207 1.00 0.00 H new ATOM 0 HA LEU A 91 -18.533 -33.025 -2.016 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -19.874 -30.988 -3.808 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -20.426 -32.626 -3.520 1.00 0.00 H new ATOM 0 HG LEU A 91 -20.213 -30.405 -1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -22.739 -30.639 -1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -22.130 -30.208 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -22.609 -31.886 -2.729 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -21.352 -31.820 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -21.182 -33.208 -0.964 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -19.733 -32.417 -0.300 1.00 0.00 H new ATOM 1428 N GLY A 92 -16.799 -31.985 -4.573 1.00 0.00 N ATOM 1429 CA GLY A 92 -15.865 -32.452 -5.595 1.00 0.00 C ATOM 1430 C GLY A 92 -14.735 -33.278 -4.965 1.00 0.00 C ATOM 1431 O GLY A 92 -13.578 -33.160 -5.371 1.00 0.00 O ATOM 0 H GLY A 92 -16.668 -31.002 -4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.396 -33.056 -6.331 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.445 -31.599 -6.127 1.00 0.00 H new ATOM 1435 N TYR A 93 -15.042 -34.006 -3.886 1.00 0.00 N ATOM 1436 CA TYR A 93 -14.155 -34.760 -3.000 1.00 0.00 C ATOM 1437 C TYR A 93 -13.019 -33.944 -2.361 1.00 0.00 C ATOM 1438 O TYR A 93 -12.275 -34.478 -1.538 1.00 0.00 O ATOM 1439 CB TYR A 93 -13.641 -36.015 -3.722 1.00 0.00 C ATOM 1440 CG TYR A 93 -14.736 -36.875 -4.333 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -15.516 -37.713 -3.512 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -14.993 -36.814 -5.719 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -16.545 -38.492 -4.071 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -16.022 -37.588 -6.285 1.00 0.00 C ATOM 1445 CZ TYR A 93 -16.804 -38.432 -5.460 1.00 0.00 C ATOM 1446 OH TYR A 93 -17.806 -39.194 -5.991 1.00 0.00 O ATOM 0 H TYR A 93 -16.013 -34.088 -3.584 1.00 0.00 H new ATOM 0 HA TYR A 93 -14.761 -35.057 -2.144 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -12.952 -35.711 -4.510 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -13.072 -36.619 -3.016 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -15.323 -37.757 -2.450 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -14.397 -36.170 -6.348 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -17.138 -39.137 -3.439 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -16.215 -37.539 -7.346 1.00 0.00 H new ATOM 0 HH TYR A 93 -17.858 -39.039 -6.957 1.00 0.00 H new ATOM 1456 N GLY A 94 -12.850 -32.666 -2.723 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.674 -31.890 -2.359 1.00 0.00 C ATOM 1458 C GLY A 94 -10.432 -32.396 -3.102 1.00 0.00 C ATOM 1459 O GLY A 94 -9.331 -31.958 -2.788 1.00 0.00 O ATOM 0 H GLY A 94 -13.530 -32.147 -3.278 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.840 -30.839 -2.594 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.510 -31.954 -1.283 1.00 0.00 H new ATOM 1463 N GLU A 95 -10.588 -33.287 -4.093 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.522 -33.682 -5.013 1.00 0.00 C ATOM 1465 C GLU A 95 -9.295 -32.583 -6.054 1.00 0.00 C ATOM 1466 O GLU A 95 -8.202 -32.478 -6.612 1.00 0.00 O ATOM 1467 CB GLU A 95 -9.920 -34.979 -5.751 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.792 -36.248 -4.900 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.190 -37.512 -5.689 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -9.503 -37.854 -6.685 1.00 0.00 O1- ATOM 1471 OE2 GLU A 95 -11.157 -38.205 -5.293 1.00 0.00 O ATOM 0 H GLU A 95 -11.474 -33.758 -4.277 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.610 -33.843 -4.438 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.950 -34.887 -6.095 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.296 -35.085 -6.639 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.765 -36.348 -4.549 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.424 -36.158 -4.016 1.00 0.00 H new ATOM 1478 N TRP A 96 -10.319 -31.770 -6.328 1.00 0.00 N ATOM 1479 CA TRP A 96 -10.320 -30.863 -7.469 1.00 0.00 C ATOM 1480 C TRP A 96 -10.281 -29.386 -7.073 1.00 0.00 C ATOM 1481 O TRP A 96 -10.210 -28.536 -7.965 1.00 0.00 O ATOM 1482 CB TRP A 96 -11.572 -31.183 -8.306 1.00 0.00 C ATOM 1483 CG TRP A 96 -11.805 -32.627 -8.660 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -10.852 -33.558 -8.906 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -13.082 -33.324 -8.815 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -11.446 -34.778 -9.168 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -12.819 -34.691 -9.130 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -14.439 -32.939 -8.734 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -13.840 -35.624 -9.344 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -15.476 -33.868 -8.952 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -15.179 -35.207 -9.255 1.00 0.00 C ATOM 0 H TRP A 96 -11.167 -31.725 -5.763 1.00 0.00 H new ATOM 0 HA TRP A 96 -9.409 -31.020 -8.046 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -12.445 -30.822 -7.762 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -11.515 -30.612 -9.233 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -9.788 -33.374 -8.898 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -10.931 -35.636 -9.365 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -14.686 -31.914 -8.501 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -13.602 -36.652 -9.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -16.506 -33.548 -8.886 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -15.978 -35.915 -9.419 1.00 0.00 H new ATOM 1502 N PHE A 97 -10.367 -29.046 -5.776 1.00 0.00 N ATOM 1503 CA PHE A 97 -10.445 -27.641 -5.397 1.00 0.00 C ATOM 1504 C PHE A 97 -9.075 -26.992 -5.355 1.00 0.00 C ATOM 1505 O PHE A 97 -8.065 -27.649 -5.113 1.00 0.00 O ATOM 1506 CB PHE A 97 -11.286 -27.341 -4.145 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.954 -27.860 -2.760 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.728 -27.542 -2.145 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -12.000 -28.379 -1.971 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -9.582 -27.657 -0.754 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.829 -28.563 -0.590 1.00 0.00 C ATOM 1512 CZ PHE A 97 -10.633 -28.170 0.022 1.00 0.00 C ATOM 0 H PHE A 97 -10.383 -29.708 -5.000 1.00 0.00 H new ATOM 0 HA PHE A 97 -11.011 -27.170 -6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -11.331 -26.255 -4.061 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -12.296 -27.686 -4.366 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -8.896 -27.208 -2.747 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -12.941 -28.637 -2.433 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -8.661 -27.351 -0.281 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.618 -29.007 -0.001 1.00 0.00 H new ATOM 0 HZ PHE A 97 -10.519 -28.262 1.092 1.00 0.00 H new ATOM 1522 N LEU A 98 -9.082 -25.666 -5.535 1.00 0.00 N ATOM 1523 CA LEU A 98 -7.957 -24.758 -5.332 1.00 0.00 C ATOM 1524 C LEU A 98 -6.689 -25.090 -6.128 1.00 0.00 C ATOM 1525 O LEU A 98 -5.668 -24.450 -5.903 1.00 0.00 O ATOM 1526 CB LEU A 98 -7.648 -24.628 -3.831 1.00 0.00 C ATOM 1527 CG LEU A 98 -8.777 -24.188 -2.889 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -8.236 -24.129 -1.462 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -9.403 -22.841 -3.259 1.00 0.00 C ATOM 0 H LEU A 98 -9.921 -25.175 -5.843 1.00 0.00 H new ATOM 0 HA LEU A 98 -8.284 -23.800 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.282 -25.594 -3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.828 -23.918 -3.721 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.573 -24.927 -2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.031 -23.817 -0.784 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.875 -25.115 -1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.416 -23.413 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -10.192 -22.599 -2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.639 -22.065 -3.231 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.825 -22.899 -4.263 1.00 0.00 H new ATOM 1541 N ASP A 99 -6.713 -26.029 -7.074 1.00 0.00 N ATOM 1542 CA ASP A 99 -5.512 -26.459 -7.799 1.00 0.00 C ATOM 1543 C ASP A 99 -4.878 -25.285 -8.556 1.00 0.00 C ATOM 1544 O ASP A 99 -3.656 -25.197 -8.681 1.00 0.00 O ATOM 1545 CB ASP A 99 -5.885 -27.615 -8.737 1.00 0.00 C ATOM 1546 CG ASP A 99 -4.647 -28.303 -9.318 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -4.070 -29.175 -8.631 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -4.267 -28.006 -10.473 1.00 0.00 O ATOM 0 H ASP A 99 -7.563 -26.514 -7.361 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.761 -26.812 -7.092 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.484 -28.345 -8.193 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -6.505 -27.237 -9.550 1.00 0.00 H new ATOM 1553 N ALA A 100 -5.699 -24.305 -8.960 1.00 0.00 N ATOM 1554 CA ALA A 100 -5.253 -23.099 -9.626 1.00 0.00 C ATOM 1555 C ALA A 100 -4.505 -22.150 -8.682 1.00 0.00 C ATOM 1556 O ALA A 100 -3.617 -21.436 -9.151 1.00 0.00 O ATOM 1557 CB ALA A 100 -6.459 -22.439 -10.305 1.00 0.00 C ATOM 0 H ALA A 100 -6.709 -24.341 -8.825 1.00 0.00 H new ATOM 0 HA ALA A 100 -4.521 -23.360 -10.390 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.138 -21.529 -10.811 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.888 -23.127 -11.033 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.209 -22.191 -9.554 1.00 0.00 H new ATOM 1563 N LEU A 101 -4.767 -22.174 -7.363 1.00 0.00 N ATOM 1564 CA LEU A 101 -3.931 -21.425 -6.417 1.00 0.00 C ATOM 1565 C LEU A 101 -2.524 -22.014 -6.468 1.00 0.00 C ATOM 1566 O LEU A 101 -1.548 -21.272 -6.478 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.391 -21.547 -4.944 1.00 0.00 C ATOM 1568 CG LEU A 101 -5.568 -20.687 -4.470 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -6.834 -20.973 -5.272 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -5.802 -20.971 -2.980 1.00 0.00 C ATOM 0 H LEU A 101 -5.535 -22.693 -6.938 1.00 0.00 H new ATOM 0 HA LEU A 101 -3.990 -20.377 -6.711 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.649 -22.590 -4.763 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -3.535 -21.316 -4.310 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.326 -19.635 -4.623 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -7.646 -20.344 -4.907 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.654 -20.758 -6.325 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.108 -22.022 -5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.637 -20.368 -2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.032 -22.028 -2.843 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.904 -20.719 -2.416 1.00 0.00 H new ATOM 1582 N GLY A 102 -2.417 -23.349 -6.489 1.00 0.00 N ATOM 1583 CA GLY A 102 -1.135 -24.038 -6.428 1.00 0.00 C ATOM 1584 C GLY A 102 -0.306 -23.747 -7.669 1.00 0.00 C ATOM 1585 O GLY A 102 0.889 -23.489 -7.564 1.00 0.00 O ATOM 0 H GLY A 102 -3.220 -23.975 -6.549 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -0.590 -23.723 -5.539 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -1.298 -25.112 -6.338 1.00 0.00 H new ATOM 1589 N MET A 103 -0.949 -23.705 -8.839 1.00 0.00 N ATOM 1590 CA MET A 103 -0.265 -23.399 -10.090 1.00 0.00 C ATOM 1591 C MET A 103 0.307 -21.976 -10.092 1.00 0.00 C ATOM 1592 O MET A 103 1.462 -21.798 -10.474 1.00 0.00 O ATOM 1593 CB MET A 103 -1.214 -23.656 -11.272 1.00 0.00 C ATOM 1594 CG MET A 103 -1.326 -25.152 -11.571 1.00 0.00 C ATOM 1595 SD MET A 103 -2.328 -25.607 -13.010 1.00 0.00 S ATOM 1596 CE MET A 103 -3.977 -25.265 -12.343 1.00 0.00 C ATOM 0 H MET A 103 -1.948 -23.881 -8.942 1.00 0.00 H new ATOM 0 HA MET A 103 0.594 -24.062 -10.196 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.201 -23.252 -11.045 1.00 0.00 H new ATOM 0 HB3 MET A 103 -0.850 -23.131 -12.155 1.00 0.00 H new ATOM 0 HG2 MET A 103 -0.321 -25.549 -11.714 1.00 0.00 H new ATOM 0 HG3 MET A 103 -1.742 -25.647 -10.693 1.00 0.00 H new ATOM 0 HE1 MET A 103 -4.729 -25.745 -12.969 1.00 0.00 H new ATOM 0 HE2 MET A 103 -4.047 -25.655 -11.328 1.00 0.00 H new ATOM 0 HE3 MET A 103 -4.148 -24.189 -12.330 1.00 0.00 H new ATOM 1606 N LEU A 104 -0.445 -20.957 -9.643 1.00 0.00 N ATOM 1607 CA LEU A 104 0.094 -19.592 -9.614 1.00 0.00 C ATOM 1608 C LEU A 104 1.160 -19.474 -8.515 1.00 0.00 C ATOM 1609 O LEU A 104 2.204 -18.865 -8.736 1.00 0.00 O ATOM 1610 CB LEU A 104 -1.053 -18.561 -9.475 1.00 0.00 C ATOM 1611 CG LEU A 104 -0.773 -17.178 -10.094 1.00 0.00 C ATOM 1612 CD1 LEU A 104 0.554 -16.554 -9.680 1.00 0.00 C ATOM 1613 CD2 LEU A 104 -0.745 -17.172 -11.623 1.00 0.00 C ATOM 0 H LEU A 104 -1.403 -21.050 -9.304 1.00 0.00 H new ATOM 0 HA LEU A 104 0.591 -19.367 -10.558 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.949 -18.974 -9.939 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.274 -18.429 -8.416 1.00 0.00 H new ATOM 0 HG LEU A 104 -1.614 -16.603 -9.706 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.666 -15.583 -10.163 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.574 -16.425 -8.598 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.373 -17.207 -9.982 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.542 -16.162 -11.979 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.037 -17.845 -11.975 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.710 -17.505 -12.006 1.00 0.00 H new ATOM 1625 N HIS A 105 0.945 -20.096 -7.355 1.00 0.00 N ATOM 1626 CA HIS A 105 1.927 -20.107 -6.273 1.00 0.00 C ATOM 1627 C HIS A 105 3.270 -20.644 -6.773 1.00 0.00 C ATOM 1628 O HIS A 105 4.283 -19.956 -6.664 1.00 0.00 O ATOM 1629 CB HIS A 105 1.401 -20.957 -5.111 1.00 0.00 C ATOM 1630 CG HIS A 105 2.403 -21.151 -3.998 1.00 0.00 C ATOM 1631 ND1 HIS A 105 3.177 -22.298 -3.804 1.00 0.00 N ATOM 1632 CD2 HIS A 105 2.684 -20.248 -3.014 1.00 0.00 C ATOM 1633 CE1 HIS A 105 3.907 -22.056 -2.699 1.00 0.00 C ATOM 1634 NE2 HIS A 105 3.623 -20.840 -2.203 1.00 0.00 N ATOM 0 H HIS A 105 0.087 -20.605 -7.141 1.00 0.00 H new ATOM 0 HA HIS A 105 2.083 -19.087 -5.922 1.00 0.00 H new ATOM 0 HB2 HIS A 105 0.506 -20.486 -4.704 1.00 0.00 H new ATOM 0 HB3 HIS A 105 1.102 -21.933 -5.493 1.00 0.00 H new ATOM 0 HD1 HIS A 105 3.187 -23.141 -4.378 1.00 0.00 H new ATOM 0 HD2 HIS A 105 2.254 -19.264 -2.896 1.00 0.00 H new ATOM 0 HE1 HIS A 105 4.621 -22.744 -2.271 1.00 0.00 H new ATOM 1642 N ASP A 106 3.252 -21.812 -7.412 1.00 0.00 N ATOM 1643 CA ASP A 106 4.457 -22.490 -7.888 1.00 0.00 C ATOM 1644 C ASP A 106 5.214 -21.650 -8.918 1.00 0.00 C ATOM 1645 O ASP A 106 6.444 -21.553 -8.866 1.00 0.00 O ATOM 1646 CB ASP A 106 4.099 -23.851 -8.489 1.00 0.00 C ATOM 1647 CG ASP A 106 5.352 -24.521 -9.076 1.00 0.00 C ATOM 1648 OD1 ASP A 106 6.165 -25.067 -8.296 1.00 0.00 O ATOM 1649 OD2 ASP A 106 5.506 -24.526 -10.321 1.00 0.00 O1- ATOM 0 H ASP A 106 2.391 -22.320 -7.616 1.00 0.00 H new ATOM 0 HA ASP A 106 5.111 -22.633 -7.028 1.00 0.00 H new ATOM 0 HB2 ASP A 106 3.661 -24.491 -7.723 1.00 0.00 H new ATOM 0 HB3 ASP A 106 3.347 -23.726 -9.268 1.00 0.00 H new ATOM 1654 N LYS A 107 4.477 -20.980 -9.812 1.00 0.00 N ATOM 1655 CA LYS A 107 5.041 -20.032 -10.766 1.00 0.00 C ATOM 1656 C LYS A 107 5.813 -18.927 -10.036 1.00 0.00 C ATOM 1657 O LYS A 107 6.873 -18.513 -10.503 1.00 0.00 O ATOM 1658 CB LYS A 107 3.921 -19.454 -11.647 1.00 0.00 C ATOM 1659 CG LYS A 107 4.494 -18.473 -12.683 1.00 0.00 C ATOM 1660 CD LYS A 107 3.444 -17.885 -13.629 1.00 0.00 C ATOM 1661 CE LYS A 107 2.707 -18.863 -14.561 1.00 0.00 C ATOM 1662 NZ LYS A 107 3.580 -19.694 -15.452 1.00 0.00 N1+ ATOM 0 H LYS A 107 3.465 -21.085 -9.890 1.00 0.00 H new ATOM 0 HA LYS A 107 5.750 -20.550 -11.412 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.398 -20.264 -12.156 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.188 -18.944 -11.023 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.994 -17.658 -12.159 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.254 -18.986 -13.273 1.00 0.00 H new ATOM 0 HD2 LYS A 107 2.698 -17.368 -13.025 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.932 -17.132 -14.248 1.00 0.00 H new ATOM 0 HE2 LYS A 107 2.101 -19.532 -13.950 1.00 0.00 H new ATOM 0 HE3 LYS A 107 2.020 -18.293 -15.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.987 -20.316 -16.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 4.140 -19.071 -16.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 4.220 -20.272 -14.870 1.00 0.00 H new ATOM 1676 N LEU A 108 5.284 -18.411 -8.926 1.00 0.00 N ATOM 1677 CA LEU A 108 5.823 -17.219 -8.283 1.00 0.00 C ATOM 1678 C LEU A 108 6.938 -17.501 -7.289 1.00 0.00 C ATOM 1679 O LEU A 108 7.666 -16.560 -6.964 1.00 0.00 O ATOM 1680 CB LEU A 108 4.704 -16.415 -7.615 1.00 0.00 C ATOM 1681 CG LEU A 108 3.795 -15.671 -8.598 1.00 0.00 C ATOM 1682 CD1 LEU A 108 2.787 -14.882 -7.772 1.00 0.00 C ATOM 1683 CD2 LEU A 108 4.540 -14.700 -9.513 1.00 0.00 C ATOM 0 H LEU A 108 4.473 -18.808 -8.451 1.00 0.00 H new ATOM 0 HA LEU A 108 6.275 -16.631 -9.082 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.095 -17.090 -7.014 1.00 0.00 H new ATOM 0 HB3 LEU A 108 5.149 -15.693 -6.931 1.00 0.00 H new ATOM 0 HG LEU A 108 3.329 -16.412 -9.248 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.119 -14.336 -8.438 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.205 -15.568 -7.156 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.315 -14.177 -7.130 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.830 -14.211 -10.180 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.047 -13.948 -8.909 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.275 -15.247 -10.103 1.00 0.00 H new ATOM 1695 N SER A 109 7.127 -18.732 -6.820 1.00 0.00 N ATOM 1696 CA SER A 109 8.187 -19.032 -5.860 1.00 0.00 C ATOM 1697 C SER A 109 9.564 -18.641 -6.412 1.00 0.00 C ATOM 1698 O SER A 109 10.391 -18.086 -5.689 1.00 0.00 O ATOM 1699 CB SER A 109 8.162 -20.525 -5.525 1.00 0.00 C ATOM 1700 OG SER A 109 6.863 -20.925 -5.112 1.00 0.00 O ATOM 0 H SER A 109 6.561 -19.537 -7.088 1.00 0.00 H new ATOM 0 HA SER A 109 8.011 -18.448 -4.957 1.00 0.00 H new ATOM 0 HB2 SER A 109 8.466 -21.104 -6.397 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.882 -20.738 -4.735 1.00 0.00 H new ATOM 0 HG SER A 109 6.866 -21.883 -4.904 1.00 0.00 H new ATOM 1706 N THR A 110 9.789 -18.848 -7.712 1.00 0.00 N ATOM 1707 CA THR A 110 11.048 -18.542 -8.386 1.00 0.00 C ATOM 1708 C THR A 110 11.134 -17.056 -8.776 1.00 0.00 C ATOM 1709 O THR A 110 12.222 -16.559 -9.077 1.00 0.00 O ATOM 1710 CB THR A 110 11.191 -19.507 -9.579 1.00 0.00 C ATOM 1711 OG1 THR A 110 9.986 -19.517 -10.329 1.00 0.00 O ATOM 1712 CG2 THR A 110 11.434 -20.940 -9.081 1.00 0.00 C ATOM 0 H THR A 110 9.085 -19.241 -8.336 1.00 0.00 H new ATOM 0 HA THR A 110 11.893 -18.696 -7.715 1.00 0.00 H new ATOM 0 HB THR A 110 12.030 -19.171 -10.189 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.078 -20.130 -11.088 1.00 0.00 H new ATOM 0 HG21 THR A 110 11.533 -21.610 -9.935 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.349 -20.969 -8.489 1.00 0.00 H new ATOM 0 HG23 THR A 110 10.593 -21.259 -8.465 1.00 0.00 H new ATOM 1720 N LYS A 111 10.013 -16.324 -8.703 1.00 0.00 N ATOM 1721 CA LYS A 111 9.965 -14.869 -8.825 1.00 0.00 C ATOM 1722 C LYS A 111 10.310 -14.198 -7.491 1.00 0.00 C ATOM 1723 O LYS A 111 10.409 -12.977 -7.442 1.00 0.00 O ATOM 1724 CB LYS A 111 8.601 -14.398 -9.365 1.00 0.00 C ATOM 1725 CG LYS A 111 8.159 -15.015 -10.701 1.00 0.00 C ATOM 1726 CD LYS A 111 9.078 -14.764 -11.905 1.00 0.00 C ATOM 1727 CE LYS A 111 8.992 -13.306 -12.380 1.00 0.00 C ATOM 1728 NZ LYS A 111 9.821 -13.067 -13.593 1.00 0.00 N1+ ATOM 0 H LYS A 111 9.095 -16.742 -8.554 1.00 0.00 H new ATOM 0 HA LYS A 111 10.719 -14.565 -9.551 1.00 0.00 H new ATOM 0 HB2 LYS A 111 7.840 -14.618 -8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.632 -13.315 -9.480 1.00 0.00 H new ATOM 0 HG2 LYS A 111 8.061 -16.092 -10.564 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.167 -14.633 -10.942 1.00 0.00 H new ATOM 0 HD2 LYS A 111 10.107 -15.000 -11.635 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.802 -15.431 -12.721 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.953 -13.055 -12.595 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.321 -12.643 -11.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.722 -12.076 -13.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.819 -13.266 -13.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.502 -13.693 -14.360 1.00 0.00 H new ATOM 1742 N GLY A 112 10.472 -14.954 -6.401 1.00 0.00 N ATOM 1743 CA GLY A 112 11.028 -14.428 -5.162 1.00 0.00 C ATOM 1744 C GLY A 112 10.077 -13.481 -4.433 1.00 0.00 C ATOM 1745 O GLY A 112 10.537 -12.566 -3.750 1.00 0.00 O ATOM 0 H GLY A 112 10.221 -15.942 -6.358 1.00 0.00 H new ATOM 0 HA2 GLY A 112 11.280 -15.258 -4.503 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.957 -13.902 -5.382 1.00 0.00 H new ATOM 1749 N VAL A 113 8.761 -13.635 -4.613 1.00 0.00 N ATOM 1750 CA VAL A 113 7.765 -12.813 -3.942 1.00 0.00 C ATOM 1751 C VAL A 113 7.654 -13.221 -2.460 1.00 0.00 C ATOM 1752 O VAL A 113 8.182 -14.260 -2.047 1.00 0.00 O ATOM 1753 CB VAL A 113 6.428 -12.903 -4.705 1.00 0.00 C ATOM 1754 CG1 VAL A 113 6.613 -12.627 -6.202 1.00 0.00 C ATOM 1755 CG2 VAL A 113 5.706 -14.238 -4.480 1.00 0.00 C ATOM 0 H VAL A 113 8.361 -14.339 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 113 8.066 -11.765 -3.949 1.00 0.00 H new ATOM 0 HB VAL A 113 5.789 -12.123 -4.291 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.650 -12.699 -6.707 1.00 0.00 H new ATOM 0 HG12 VAL A 113 7.021 -11.626 -6.340 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.300 -13.360 -6.625 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.771 -14.245 -5.041 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.340 -15.057 -4.821 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.493 -14.362 -3.418 1.00 0.00 H new ATOM 1765 N LYS A 114 6.928 -12.427 -1.669 1.00 0.00 N ATOM 1766 CA LYS A 114 6.518 -12.817 -0.315 1.00 0.00 C ATOM 1767 C LYS A 114 5.127 -13.391 -0.470 1.00 0.00 C ATOM 1768 O LYS A 114 4.312 -12.746 -1.124 1.00 0.00 O ATOM 1769 CB LYS A 114 6.520 -11.609 0.649 1.00 0.00 C ATOM 1770 CG LYS A 114 6.020 -11.922 2.074 1.00 0.00 C ATOM 1771 CD LYS A 114 6.864 -12.969 2.819 1.00 0.00 C ATOM 1772 CE LYS A 114 6.295 -13.200 4.227 1.00 0.00 C ATOM 1773 NZ LYS A 114 7.176 -14.069 5.061 1.00 0.00 N1+ ATOM 0 H LYS A 114 6.608 -11.499 -1.946 1.00 0.00 H new ATOM 0 HA LYS A 114 7.209 -13.540 0.119 1.00 0.00 H new ATOM 0 HB2 LYS A 114 7.534 -11.214 0.713 1.00 0.00 H new ATOM 0 HB3 LYS A 114 5.897 -10.822 0.225 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.009 -11.000 2.655 1.00 0.00 H new ATOM 0 HG3 LYS A 114 4.990 -12.275 2.017 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.870 -13.906 2.262 1.00 0.00 H new ATOM 0 HD3 LYS A 114 7.898 -12.632 2.887 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.161 -12.239 4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.309 -13.657 4.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 6.750 -14.195 6.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 7.284 -14.996 4.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 8.110 -13.622 5.162 1.00 0.00 H new ATOM 1787 N PHE A 115 4.820 -14.517 0.163 1.00 0.00 N ATOM 1788 CA PHE A 115 3.457 -15.024 0.197 1.00 0.00 C ATOM 1789 C PHE A 115 2.872 -14.716 1.568 1.00 0.00 C ATOM 1790 O PHE A 115 3.428 -15.121 2.588 1.00 0.00 O ATOM 1791 CB PHE A 115 3.410 -16.520 -0.120 1.00 0.00 C ATOM 1792 CG PHE A 115 3.888 -16.885 -1.514 1.00 0.00 C ATOM 1793 CD1 PHE A 115 3.174 -16.442 -2.644 1.00 0.00 C ATOM 1794 CD2 PHE A 115 5.032 -17.689 -1.681 1.00 0.00 C ATOM 1795 CE1 PHE A 115 3.583 -16.825 -3.933 1.00 0.00 C ATOM 1796 CE2 PHE A 115 5.441 -18.071 -2.969 1.00 0.00 C ATOM 1797 CZ PHE A 115 4.714 -17.647 -4.092 1.00 0.00 C ATOM 0 H PHE A 115 5.498 -15.095 0.659 1.00 0.00 H new ATOM 0 HA PHE A 115 2.859 -14.535 -0.571 1.00 0.00 H new ATOM 0 HB2 PHE A 115 4.020 -17.052 0.610 1.00 0.00 H new ATOM 0 HB3 PHE A 115 2.386 -16.872 0.003 1.00 0.00 H new ATOM 0 HD1 PHE A 115 2.310 -15.806 -2.520 1.00 0.00 H new ATOM 0 HD2 PHE A 115 5.595 -18.012 -0.818 1.00 0.00 H new ATOM 0 HE1 PHE A 115 3.031 -16.490 -4.799 1.00 0.00 H new ATOM 0 HE2 PHE A 115 6.316 -18.692 -3.095 1.00 0.00 H new ATOM 0 HZ PHE A 115 5.023 -17.952 -5.081 1.00 0.00 H new ATOM 1807 N VAL A 116 1.761 -13.990 1.578 1.00 0.00 N ATOM 1808 CA VAL A 116 0.911 -13.796 2.748 1.00 0.00 C ATOM 1809 C VAL A 116 -0.382 -14.594 2.553 1.00 0.00 C ATOM 1810 O VAL A 116 -0.770 -14.897 1.420 1.00 0.00 O ATOM 1811 CB VAL A 116 0.689 -12.294 3.036 1.00 0.00 C ATOM 1812 CG1 VAL A 116 2.037 -11.589 3.254 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -0.080 -11.540 1.940 1.00 0.00 C ATOM 0 H VAL A 116 1.416 -13.506 0.749 1.00 0.00 H new ATOM 0 HA VAL A 116 1.400 -14.180 3.644 1.00 0.00 H new ATOM 0 HB VAL A 116 0.072 -12.267 3.934 1.00 0.00 H new ATOM 0 HG11 VAL A 116 1.866 -10.532 3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 116 2.552 -12.042 4.102 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.651 -11.693 2.359 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -0.189 -10.494 2.226 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.469 -11.604 1.001 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -1.066 -11.987 1.815 1.00 0.00 H new ATOM 1823 N GLY A 117 -1.075 -14.913 3.643 1.00 0.00 N ATOM 1824 CA GLY A 117 -2.416 -15.471 3.579 1.00 0.00 C ATOM 1825 C GLY A 117 -2.480 -16.986 3.422 1.00 0.00 C ATOM 1826 O GLY A 117 -3.492 -17.474 2.920 1.00 0.00 O ATOM 0 H GLY A 117 -0.721 -14.791 4.592 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -2.952 -15.192 4.486 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.944 -15.012 2.743 1.00 0.00 H new ATOM 1830 N TYR A 118 -1.454 -17.733 3.838 1.00 0.00 N ATOM 1831 CA TYR A 118 -1.549 -19.192 3.943 1.00 0.00 C ATOM 1832 C TYR A 118 -2.674 -19.560 4.934 1.00 0.00 C ATOM 1833 O TYR A 118 -3.034 -18.747 5.793 1.00 0.00 O ATOM 1834 CB TYR A 118 -0.192 -19.778 4.362 1.00 0.00 C ATOM 1835 CG TYR A 118 0.938 -19.799 3.338 1.00 0.00 C ATOM 1836 CD1 TYR A 118 0.809 -19.271 2.037 1.00 0.00 C ATOM 1837 CD2 TYR A 118 2.148 -20.415 3.707 1.00 0.00 C ATOM 1838 CE1 TYR A 118 1.860 -19.398 1.110 1.00 0.00 C ATOM 1839 CE2 TYR A 118 3.224 -20.500 2.805 1.00 0.00 C ATOM 1840 CZ TYR A 118 3.078 -20.000 1.493 1.00 0.00 C ATOM 1841 OH TYR A 118 4.104 -20.093 0.599 1.00 0.00 O ATOM 0 H TYR A 118 -0.547 -17.352 4.108 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.801 -19.623 2.974 1.00 0.00 H new ATOM 0 HB2 TYR A 118 0.157 -19.218 5.230 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -0.361 -20.803 4.691 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -0.102 -18.766 1.750 1.00 0.00 H new ATOM 0 HD2 TYR A 118 2.252 -20.829 4.699 1.00 0.00 H new ATOM 0 HE1 TYR A 118 1.734 -19.033 0.101 1.00 0.00 H new ATOM 0 HE2 TYR A 118 4.158 -20.946 3.115 1.00 0.00 H new ATOM 0 HH TYR A 118 3.753 -20.368 -0.274 1.00 0.00 H new ATOM 1851 N TRP A 119 -3.246 -20.769 4.823 1.00 0.00 N ATOM 1852 CA TRP A 119 -4.480 -21.140 5.534 1.00 0.00 C ATOM 1853 C TRP A 119 -4.374 -22.537 6.154 1.00 0.00 C ATOM 1854 O TRP A 119 -3.762 -23.404 5.529 1.00 0.00 O ATOM 1855 CB TRP A 119 -5.641 -21.054 4.533 1.00 0.00 C ATOM 1856 CG TRP A 119 -7.034 -21.085 5.076 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -7.882 -22.137 5.076 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -7.750 -20.013 5.745 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -9.067 -21.771 5.685 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -9.009 -20.494 6.191 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -7.411 -18.690 6.060 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -9.875 -19.710 6.963 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -8.263 -17.888 6.844 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -9.497 -18.396 7.295 1.00 0.00 C ATOM 0 H TRP A 119 -2.868 -21.515 4.240 1.00 0.00 H new ATOM 0 HA TRP A 119 -4.652 -20.454 6.364 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -5.524 -20.132 3.963 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -5.538 -21.879 3.829 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -7.667 -23.112 4.664 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.886 -22.375 5.751 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -6.481 -18.279 5.696 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -10.821 -20.109 7.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -7.969 -16.881 7.100 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -10.151 -17.779 7.894 1.00 0.00 H new ATOM 1875 N PRO A 120 -4.953 -22.791 7.345 1.00 0.00 N ATOM 1876 CA PRO A 120 -4.865 -24.082 8.021 1.00 0.00 C ATOM 1877 C PRO A 120 -5.553 -25.202 7.234 1.00 0.00 C ATOM 1878 O PRO A 120 -6.720 -25.091 6.854 1.00 0.00 O ATOM 1879 CB PRO A 120 -5.505 -23.880 9.402 1.00 0.00 C ATOM 1880 CG PRO A 120 -6.450 -22.698 9.194 1.00 0.00 C ATOM 1881 CD PRO A 120 -5.683 -21.849 8.186 1.00 0.00 C ATOM 0 HA PRO A 120 -3.826 -24.401 8.108 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -6.043 -24.770 9.728 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -4.755 -23.664 10.163 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -7.419 -23.014 8.807 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.638 -22.158 10.122 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.363 -21.239 7.591 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.000 -21.165 8.690 1.00 0.00 H new ATOM 1889 N THR A 121 -4.829 -26.304 7.041 1.00 0.00 N ATOM 1890 CA THR A 121 -5.345 -27.564 6.513 1.00 0.00 C ATOM 1891 C THR A 121 -5.973 -28.413 7.627 1.00 0.00 C ATOM 1892 O THR A 121 -6.908 -29.175 7.379 1.00 0.00 O ATOM 1893 CB THR A 121 -4.177 -28.325 5.866 1.00 0.00 C ATOM 1894 OG1 THR A 121 -3.015 -28.202 6.663 1.00 0.00 O ATOM 1895 CG2 THR A 121 -3.831 -27.787 4.478 1.00 0.00 C ATOM 0 H THR A 121 -3.833 -26.344 7.256 1.00 0.00 H new ATOM 0 HA THR A 121 -6.123 -27.359 5.777 1.00 0.00 H new ATOM 0 HB THR A 121 -4.497 -29.363 5.781 1.00 0.00 H new ATOM 0 HG1 THR A 121 -2.346 -28.856 6.370 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.000 -28.358 4.063 1.00 0.00 H new ATOM 0 HG22 THR A 121 -4.698 -27.882 3.824 1.00 0.00 H new ATOM 0 HG23 THR A 121 -3.548 -26.737 4.555 1.00 0.00 H new ATOM 1903 N GLU A 122 -5.458 -28.290 8.856 1.00 0.00 N ATOM 1904 CA GLU A 122 -5.768 -29.176 9.970 1.00 0.00 C ATOM 1905 C GLU A 122 -7.276 -29.199 10.245 1.00 0.00 C ATOM 1906 O GLU A 122 -7.912 -28.157 10.430 1.00 0.00 O ATOM 1907 CB GLU A 122 -4.981 -28.762 11.226 1.00 0.00 C ATOM 1908 CG GLU A 122 -3.462 -28.917 11.048 1.00 0.00 C ATOM 1909 CD GLU A 122 -2.716 -28.611 12.360 1.00 0.00 C ATOM 1910 OE1 GLU A 122 -2.395 -27.425 12.622 1.00 0.00 O1- ATOM 1911 OE2 GLU A 122 -2.434 -29.555 13.138 1.00 0.00 O ATOM 0 H GLU A 122 -4.799 -27.552 9.103 1.00 0.00 H new ATOM 0 HA GLU A 122 -5.464 -30.187 9.699 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -5.211 -27.725 11.469 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -5.308 -29.367 12.071 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -3.232 -29.932 10.724 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -3.114 -28.245 10.263 1.00 0.00 H new ATOM 1918 N GLY A 123 -7.838 -30.412 10.273 1.00 0.00 N ATOM 1919 CA GLY A 123 -9.240 -30.672 10.579 1.00 0.00 C ATOM 1920 C GLY A 123 -10.203 -30.371 9.426 1.00 0.00 C ATOM 1921 O GLY A 123 -11.406 -30.596 9.589 1.00 0.00 O ATOM 0 H GLY A 123 -7.310 -31.262 10.077 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.349 -31.718 10.865 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -9.528 -30.074 11.443 1.00 0.00 H new ATOM 1925 N TYR A 124 -9.721 -29.881 8.275 1.00 0.00 N ATOM 1926 CA TYR A 124 -10.552 -29.587 7.111 1.00 0.00 C ATOM 1927 C TYR A 124 -10.604 -30.796 6.168 1.00 0.00 C ATOM 1928 O TYR A 124 -9.745 -31.683 6.232 1.00 0.00 O ATOM 1929 CB TYR A 124 -10.058 -28.308 6.414 1.00 0.00 C ATOM 1930 CG TYR A 124 -11.081 -27.653 5.493 1.00 0.00 C ATOM 1931 CD1 TYR A 124 -12.397 -27.412 5.942 1.00 0.00 C ATOM 1932 CD2 TYR A 124 -10.718 -27.261 4.189 1.00 0.00 C ATOM 1933 CE1 TYR A 124 -13.350 -26.835 5.083 1.00 0.00 C ATOM 1934 CE2 TYR A 124 -11.660 -26.656 3.334 1.00 0.00 C ATOM 1935 CZ TYR A 124 -12.989 -26.459 3.770 1.00 0.00 C ATOM 1936 OH TYR A 124 -13.896 -25.866 2.947 1.00 0.00 O ATOM 0 H TYR A 124 -8.732 -29.677 8.130 1.00 0.00 H new ATOM 0 HA TYR A 124 -11.576 -29.398 7.434 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -9.759 -27.587 7.175 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -9.167 -28.547 5.834 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -12.675 -27.672 6.953 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -9.709 -27.426 3.842 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -14.361 -26.679 5.429 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -11.366 -26.342 2.343 1.00 0.00 H new ATOM 0 HH TYR A 124 -14.766 -25.822 3.396 1.00 0.00 H new ATOM 1946 N GLU A 125 -11.607 -30.835 5.284 1.00 0.00 N ATOM 1947 CA GLU A 125 -11.776 -31.896 4.300 1.00 0.00 C ATOM 1948 C GLU A 125 -11.218 -31.406 2.969 1.00 0.00 C ATOM 1949 O GLU A 125 -11.781 -30.509 2.337 1.00 0.00 O ATOM 1950 CB GLU A 125 -13.247 -32.316 4.186 1.00 0.00 C ATOM 1951 CG GLU A 125 -13.702 -33.153 5.388 1.00 0.00 C ATOM 1952 CD GLU A 125 -13.143 -34.587 5.347 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -13.733 -35.448 4.650 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -12.122 -34.870 6.020 1.00 0.00 O ATOM 0 H GLU A 125 -12.331 -30.118 5.236 1.00 0.00 H new ATOM 0 HA GLU A 125 -11.229 -32.786 4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -13.872 -31.427 4.106 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -13.390 -32.890 3.270 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -13.381 -32.667 6.309 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -14.791 -33.191 5.410 1.00 0.00 H new ATOM 1961 N PHE A 126 -10.096 -31.994 2.563 1.00 0.00 N ATOM 1962 CA PHE A 126 -9.374 -31.689 1.331 1.00 0.00 C ATOM 1963 C PHE A 126 -8.448 -32.863 0.992 1.00 0.00 C ATOM 1964 O PHE A 126 -8.193 -33.728 1.838 1.00 0.00 O ATOM 1965 CB PHE A 126 -8.523 -30.415 1.507 1.00 0.00 C ATOM 1966 CG PHE A 126 -7.283 -30.602 2.363 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -7.402 -30.615 3.763 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -6.030 -30.842 1.763 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -6.288 -30.909 4.561 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -4.913 -31.133 2.562 1.00 0.00 C ATOM 1971 CZ PHE A 126 -5.043 -31.178 3.961 1.00 0.00 C ATOM 0 H PHE A 126 -9.645 -32.729 3.108 1.00 0.00 H new ATOM 0 HA PHE A 126 -10.094 -31.527 0.529 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -8.220 -30.057 0.523 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -9.143 -29.637 1.952 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -8.354 -30.398 4.225 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -5.929 -30.802 0.688 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -6.385 -30.929 5.636 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -3.954 -31.322 2.102 1.00 0.00 H new ATOM 0 HZ PHE A 126 -4.188 -31.419 4.575 1.00 0.00 H new ATOM 1981 N THR A 127 -7.930 -32.869 -0.234 1.00 0.00 N ATOM 1982 CA THR A 127 -6.833 -33.719 -0.675 1.00 0.00 C ATOM 1983 C THR A 127 -6.198 -33.007 -1.892 1.00 0.00 C ATOM 1984 O THR A 127 -6.401 -31.800 -2.065 1.00 0.00 O ATOM 1985 CB THR A 127 -7.322 -35.178 -0.858 1.00 0.00 C ATOM 1986 OG1 THR A 127 -6.236 -36.038 -1.163 1.00 0.00 O ATOM 1987 CG2 THR A 127 -8.398 -35.344 -1.926 1.00 0.00 C ATOM 0 H THR A 127 -8.278 -32.258 -0.973 1.00 0.00 H new ATOM 0 HA THR A 127 -6.034 -33.844 0.056 1.00 0.00 H new ATOM 0 HB THR A 127 -7.772 -35.449 0.097 1.00 0.00 H new ATOM 0 HG1 THR A 127 -6.565 -36.954 -1.273 1.00 0.00 H new ATOM 0 HG21 THR A 127 -8.686 -36.393 -1.992 1.00 0.00 H new ATOM 0 HG22 THR A 127 -9.269 -34.745 -1.661 1.00 0.00 H new ATOM 0 HG23 THR A 127 -8.009 -35.013 -2.889 1.00 0.00 H new ATOM 1995 N SER A 128 -5.431 -33.736 -2.707 1.00 0.00 N ATOM 1996 CA SER A 128 -4.551 -33.255 -3.776 1.00 0.00 C ATOM 1997 C SER A 128 -3.415 -32.333 -3.258 1.00 0.00 C ATOM 1998 O SER A 128 -3.655 -31.428 -2.459 1.00 0.00 O ATOM 1999 CB SER A 128 -5.383 -32.683 -4.941 1.00 0.00 C ATOM 2000 OG SER A 128 -6.124 -33.739 -5.522 1.00 0.00 O ATOM 0 H SER A 128 -5.407 -34.753 -2.631 1.00 0.00 H new ATOM 0 HA SER A 128 -4.006 -34.105 -4.186 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.053 -31.903 -4.581 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.730 -32.224 -5.684 1.00 0.00 H new ATOM 0 HG SER A 128 -6.770 -33.372 -6.161 1.00 0.00 H new ATOM 2006 N PRO A 129 -2.147 -32.539 -3.676 1.00 0.00 N ATOM 2007 CA PRO A 129 -1.012 -31.859 -3.051 1.00 0.00 C ATOM 2008 C PRO A 129 -0.787 -30.427 -3.560 1.00 0.00 C ATOM 2009 O PRO A 129 -0.216 -29.622 -2.835 1.00 0.00 O ATOM 2010 CB PRO A 129 0.196 -32.764 -3.305 1.00 0.00 C ATOM 2011 CG PRO A 129 -0.153 -33.436 -4.632 1.00 0.00 C ATOM 2012 CD PRO A 129 -1.669 -33.613 -4.542 1.00 0.00 C ATOM 0 HA PRO A 129 -1.196 -31.716 -1.986 1.00 0.00 H new ATOM 0 HB2 PRO A 129 1.122 -32.192 -3.373 1.00 0.00 H new ATOM 0 HB3 PRO A 129 0.330 -33.493 -2.506 1.00 0.00 H new ATOM 0 HG2 PRO A 129 0.131 -32.818 -5.484 1.00 0.00 H new ATOM 0 HG3 PRO A 129 0.358 -34.392 -4.747 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -2.128 -33.553 -5.529 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.924 -34.589 -4.130 1.00 0.00 H new ATOM 2020 N LYS A 130 -1.218 -30.065 -4.777 1.00 0.00 N ATOM 2021 CA LYS A 130 -0.831 -28.778 -5.383 1.00 0.00 C ATOM 2022 C LYS A 130 -1.236 -27.539 -4.556 1.00 0.00 C ATOM 2023 O LYS A 130 -0.411 -26.633 -4.451 1.00 0.00 O ATOM 2024 CB LYS A 130 -1.327 -28.702 -6.839 1.00 0.00 C ATOM 2025 CG LYS A 130 -0.393 -27.857 -7.726 1.00 0.00 C ATOM 2026 CD LYS A 130 -0.920 -27.672 -9.161 1.00 0.00 C ATOM 2027 CE LYS A 130 -1.022 -29.014 -9.916 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.749 -28.897 -11.209 1.00 0.00 N1+ ATOM 0 H LYS A 130 -1.829 -30.638 -5.359 1.00 0.00 H new ATOM 0 HA LYS A 130 0.259 -28.751 -5.385 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -1.402 -29.709 -7.249 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -2.329 -28.274 -6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -0.256 -26.878 -7.268 1.00 0.00 H new ATOM 0 HG3 LYS A 130 0.588 -28.331 -7.765 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -1.901 -27.199 -9.129 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -0.259 -26.998 -9.706 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -0.019 -29.397 -10.102 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.530 -29.743 -9.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -1.876 -29.843 -11.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.680 -28.463 -11.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.200 -28.304 -11.863 1.00 0.00 H new ATOM 2042 N PRO A 131 -2.447 -27.433 -3.961 1.00 0.00 N ATOM 2043 CA PRO A 131 -2.818 -26.256 -3.169 1.00 0.00 C ATOM 2044 C PRO A 131 -2.187 -26.219 -1.766 1.00 0.00 C ATOM 2045 O PRO A 131 -2.455 -25.271 -1.026 1.00 0.00 O ATOM 2046 CB PRO A 131 -4.350 -26.279 -3.101 1.00 0.00 C ATOM 2047 CG PRO A 131 -4.684 -27.765 -3.174 1.00 0.00 C ATOM 2048 CD PRO A 131 -3.611 -28.302 -4.121 1.00 0.00 C ATOM 0 HA PRO A 131 -2.435 -25.352 -3.643 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -4.718 -25.829 -2.179 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -4.797 -25.725 -3.927 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -4.635 -28.240 -2.194 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -5.689 -27.936 -3.561 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.361 -29.335 -3.879 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -3.964 -28.293 -5.152 1.00 0.00 H new ATOM 2056 N VAL A 132 -1.389 -27.206 -1.357 1.00 0.00 N ATOM 2057 CA VAL A 132 -0.777 -27.252 -0.033 1.00 0.00 C ATOM 2058 C VAL A 132 0.746 -27.285 -0.156 1.00 0.00 C ATOM 2059 O VAL A 132 1.300 -27.790 -1.134 1.00 0.00 O ATOM 2060 CB VAL A 132 -1.352 -28.410 0.815 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -2.823 -28.158 1.167 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -1.270 -29.784 0.140 1.00 0.00 C ATOM 0 H VAL A 132 -1.148 -28.004 -1.944 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.030 -26.341 0.509 1.00 0.00 H new ATOM 0 HB VAL A 132 -0.725 -28.430 1.706 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.202 -28.988 1.764 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -2.907 -27.233 1.737 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -3.407 -28.074 0.251 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.694 -30.540 0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -1.830 -29.764 -0.795 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.228 -30.026 -0.067 1.00 0.00 H new ATOM 2072 N ILE A 133 1.433 -26.715 0.833 1.00 0.00 N ATOM 2073 CA ILE A 133 2.862 -26.858 0.989 1.00 0.00 C ATOM 2074 C ILE A 133 3.150 -28.093 1.813 1.00 0.00 C ATOM 2075 O ILE A 133 2.270 -28.615 2.512 1.00 0.00 O ATOM 2076 CB ILE A 133 3.501 -25.612 1.632 1.00 0.00 C ATOM 2077 CG1 ILE A 133 3.017 -25.367 3.081 1.00 0.00 C ATOM 2078 CG2 ILE A 133 3.293 -24.429 0.688 1.00 0.00 C ATOM 2079 CD1 ILE A 133 3.283 -23.937 3.547 1.00 0.00 C ATOM 0 H ILE A 133 0.999 -26.136 1.552 1.00 0.00 H new ATOM 0 HA ILE A 133 3.307 -26.963 -0.000 1.00 0.00 H new ATOM 0 HB ILE A 133 4.573 -25.766 1.755 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.949 -25.575 3.145 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.518 -26.065 3.752 1.00 0.00 H new ATOM 0 HG21 ILE A 133 3.738 -23.534 1.123 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.767 -24.641 -0.271 1.00 0.00 H new ATOM 0 HG23 ILE A 133 2.226 -24.267 0.537 1.00 0.00 H new ATOM 0 HD11 ILE A 133 2.926 -23.815 4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 133 4.354 -23.736 3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 133 2.760 -23.238 2.894 1.00 0.00 H new ATOM 2091 N ALA A 134 4.436 -28.441 1.821 1.00 0.00 N ATOM 2092 CA ALA A 134 5.006 -29.439 2.690 1.00 0.00 C ATOM 2093 C ALA A 134 4.253 -30.762 2.500 1.00 0.00 C ATOM 2094 O ALA A 134 3.648 -31.030 1.456 1.00 0.00 O ATOM 2095 CB ALA A 134 4.993 -28.830 4.106 1.00 0.00 C ATOM 0 H ALA A 134 5.122 -28.015 1.198 1.00 0.00 H new ATOM 0 HA ALA A 134 6.041 -29.700 2.468 1.00 0.00 H new ATOM 0 HB1 ALA A 134 5.415 -29.544 4.813 1.00 0.00 H new ATOM 0 HB2 ALA A 134 5.587 -27.916 4.114 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.967 -28.599 4.393 1.00 0.00 H new ATOM 2101 N ASP A 135 4.268 -31.589 3.535 1.00 0.00 N ATOM 2102 CA ASP A 135 3.457 -32.792 3.655 1.00 0.00 C ATOM 2103 C ASP A 135 2.046 -32.403 4.109 1.00 0.00 C ATOM 2104 O ASP A 135 1.609 -32.728 5.216 1.00 0.00 O ATOM 2105 CB ASP A 135 4.135 -33.824 4.570 1.00 0.00 C ATOM 2106 CG ASP A 135 3.313 -35.122 4.679 1.00 0.00 C ATOM 2107 OD1 ASP A 135 2.767 -35.594 3.651 1.00 0.00 O1- ATOM 2108 OD2 ASP A 135 3.251 -35.709 5.787 1.00 0.00 O ATOM 0 H ASP A 135 4.868 -31.435 4.345 1.00 0.00 H new ATOM 0 HA ASP A 135 3.364 -33.282 2.686 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.128 -34.054 4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.270 -33.395 5.563 1.00 0.00 H new ATOM 2113 N GLY A 136 1.370 -31.589 3.291 1.00 0.00 N ATOM 2114 CA GLY A 136 -0.004 -31.140 3.515 1.00 0.00 C ATOM 2115 C GLY A 136 -0.153 -30.290 4.777 1.00 0.00 C ATOM 2116 O GLY A 136 -1.205 -30.320 5.418 1.00 0.00 O ATOM 0 H GLY A 136 1.776 -31.216 2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -0.338 -30.563 2.653 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -0.658 -32.009 3.589 1.00 0.00 H new ATOM 2120 N GLN A 137 0.899 -29.556 5.161 1.00 0.00 N ATOM 2121 CA GLN A 137 0.954 -28.897 6.466 1.00 0.00 C ATOM 2122 C GLN A 137 0.126 -27.616 6.486 1.00 0.00 C ATOM 2123 O GLN A 137 -0.319 -27.197 7.554 1.00 0.00 O ATOM 2124 CB GLN A 137 2.394 -28.564 6.873 1.00 0.00 C ATOM 2125 CG GLN A 137 3.286 -29.806 6.945 1.00 0.00 C ATOM 2126 CD GLN A 137 2.949 -30.725 8.125 1.00 0.00 C ATOM 2127 OE1 GLN A 137 3.291 -30.437 9.271 1.00 0.00 O ATOM 2128 NE2 GLN A 137 2.263 -31.836 7.891 1.00 0.00 N ATOM 0 H GLN A 137 1.725 -29.405 4.582 1.00 0.00 H new ATOM 0 HA GLN A 137 0.535 -29.605 7.182 1.00 0.00 H new ATOM 0 HB2 GLN A 137 2.816 -27.859 6.157 1.00 0.00 H new ATOM 0 HB3 GLN A 137 2.388 -28.068 7.844 1.00 0.00 H new ATOM 0 HG2 GLN A 137 3.190 -30.368 6.016 1.00 0.00 H new ATOM 0 HG3 GLN A 137 4.327 -29.493 7.022 1.00 0.00 H new ATOM 0 HE21 GLN A 137 1.982 -32.071 6.939 1.00 0.00 H new ATOM 0 HE22 GLN A 137 2.017 -32.456 8.663 1.00 0.00 H new ATOM 2137 N LEU A 138 -0.008 -26.956 5.328 1.00 0.00 N ATOM 2138 CA LEU A 138 -0.674 -25.662 5.227 1.00 0.00 C ATOM 2139 C LEU A 138 -1.123 -25.446 3.780 1.00 0.00 C ATOM 2140 O LEU A 138 -0.452 -25.921 2.862 1.00 0.00 O ATOM 2141 CB LEU A 138 0.342 -24.590 5.684 1.00 0.00 C ATOM 2142 CG LEU A 138 -0.202 -23.279 6.261 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -1.165 -23.480 7.436 1.00 0.00 C ATOM 2144 CD2 LEU A 138 0.970 -22.444 6.786 1.00 0.00 C ATOM 0 H LEU A 138 0.344 -27.309 4.438 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.562 -25.605 5.856 1.00 0.00 H new ATOM 0 HB2 LEU A 138 0.988 -25.042 6.436 1.00 0.00 H new ATOM 0 HB3 LEU A 138 0.972 -24.342 4.830 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.745 -22.791 5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.510 -22.510 7.794 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.020 -24.071 7.109 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.651 -24.002 8.243 1.00 0.00 H new ATOM 0 HD21 LEU A 138 0.594 -21.508 7.199 1.00 0.00 H new ATOM 0 HD22 LEU A 138 1.493 -23.000 7.564 1.00 0.00 H new ATOM 0 HD23 LEU A 138 1.658 -22.229 5.969 1.00 0.00 H new ATOM 2156 N PHE A 139 -2.221 -24.728 3.541 1.00 0.00 N ATOM 2157 CA PHE A 139 -2.592 -24.302 2.194 1.00 0.00 C ATOM 2158 C PHE A 139 -1.725 -23.115 1.799 1.00 0.00 C ATOM 2159 O PHE A 139 -1.426 -22.267 2.638 1.00 0.00 O ATOM 2160 CB PHE A 139 -4.060 -23.880 2.100 1.00 0.00 C ATOM 2161 CG PHE A 139 -5.086 -24.984 2.229 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -5.275 -25.882 1.164 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -5.890 -25.084 3.378 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -6.245 -26.894 1.258 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -6.886 -26.071 3.457 1.00 0.00 C ATOM 2166 CZ PHE A 139 -7.057 -26.983 2.401 1.00 0.00 C ATOM 0 H PHE A 139 -2.871 -24.429 4.268 1.00 0.00 H new ATOM 0 HA PHE A 139 -2.441 -25.150 1.526 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.254 -23.141 2.877 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.212 -23.382 1.142 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.673 -25.794 0.272 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -5.741 -24.401 4.201 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -6.366 -27.603 0.452 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -7.521 -26.129 4.329 1.00 0.00 H new ATOM 0 HZ PHE A 139 -7.812 -27.752 2.468 1.00 0.00 H new ATOM 2176 N VAL A 140 -1.428 -22.989 0.504 1.00 0.00 N ATOM 2177 CA VAL A 140 -0.682 -21.854 -0.040 1.00 0.00 C ATOM 2178 C VAL A 140 -1.513 -20.556 -0.042 1.00 0.00 C ATOM 2179 O VAL A 140 -1.038 -19.527 -0.518 1.00 0.00 O ATOM 2180 CB VAL A 140 -0.181 -22.167 -1.470 1.00 0.00 C ATOM 2181 CG1 VAL A 140 0.754 -23.379 -1.477 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -1.314 -22.352 -2.499 1.00 0.00 C ATOM 0 H VAL A 140 -1.700 -23.675 -0.200 1.00 0.00 H new ATOM 0 HA VAL A 140 0.175 -21.693 0.614 1.00 0.00 H new ATOM 0 HB VAL A 140 0.376 -21.284 -1.784 1.00 0.00 H new ATOM 0 HG11 VAL A 140 1.089 -23.574 -2.496 1.00 0.00 H new ATOM 0 HG12 VAL A 140 1.617 -23.176 -0.843 1.00 0.00 H new ATOM 0 HG13 VAL A 140 0.222 -24.251 -1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -0.885 -22.568 -3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -1.953 -23.180 -2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -1.906 -21.439 -2.556 1.00 0.00 H new ATOM 2192 N GLY A 141 -2.767 -20.582 0.411 1.00 0.00 N ATOM 2193 CA GLY A 141 -3.690 -19.469 0.318 1.00 0.00 C ATOM 2194 C GLY A 141 -5.005 -19.812 1.008 1.00 0.00 C ATOM 2195 O GLY A 141 -5.201 -20.966 1.391 1.00 0.00 O ATOM 0 H GLY A 141 -3.171 -21.402 0.863 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.250 -18.584 0.778 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.873 -19.226 -0.729 1.00 0.00 H new ATOM 2199 N LEU A 142 -5.908 -18.837 1.159 1.00 0.00 N ATOM 2200 CA LEU A 142 -7.210 -19.061 1.798 1.00 0.00 C ATOM 2201 C LEU A 142 -8.060 -20.025 0.979 1.00 0.00 C ATOM 2202 O LEU A 142 -8.177 -19.893 -0.240 1.00 0.00 O ATOM 2203 CB LEU A 142 -7.908 -17.729 2.139 1.00 0.00 C ATOM 2204 CG LEU A 142 -9.451 -17.705 2.107 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.042 -18.386 3.351 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -9.982 -16.268 2.010 1.00 0.00 C ATOM 0 H LEU A 142 -5.759 -17.878 0.845 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.053 -19.552 2.759 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -7.587 -17.427 3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.545 -16.972 1.444 1.00 0.00 H new ATOM 0 HG LEU A 142 -9.762 -18.257 1.220 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -11.130 -18.354 3.301 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -9.711 -19.424 3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -9.705 -17.864 4.246 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -11.072 -16.283 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -9.643 -15.696 2.874 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -9.608 -15.803 1.098 1.00 0.00 H new ATOM 2218 N ALA A 143 -8.690 -20.953 1.699 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.616 -21.939 1.186 1.00 0.00 C ATOM 2220 C ALA A 143 -11.045 -21.486 1.498 1.00 0.00 C ATOM 2221 O ALA A 143 -11.435 -21.459 2.669 1.00 0.00 O ATOM 2222 CB ALA A 143 -9.265 -23.264 1.877 1.00 0.00 C ATOM 0 H ALA A 143 -8.555 -21.034 2.707 1.00 0.00 H new ATOM 0 HA ALA A 143 -9.547 -22.061 0.105 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -9.937 -24.047 1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.236 -23.536 1.642 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -9.373 -23.152 2.956 1.00 0.00 H new ATOM 2228 N LEU A 144 -11.830 -21.147 0.477 1.00 0.00 N ATOM 2229 CA LEU A 144 -13.267 -20.885 0.588 1.00 0.00 C ATOM 2230 C LEU A 144 -14.044 -22.054 -0.025 1.00 0.00 C ATOM 2231 O LEU A 144 -13.542 -22.767 -0.894 1.00 0.00 O ATOM 2232 CB LEU A 144 -13.645 -19.561 -0.121 1.00 0.00 C ATOM 2233 CG LEU A 144 -13.072 -18.271 0.481 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -13.440 -17.077 -0.406 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -13.597 -18.025 1.898 1.00 0.00 C ATOM 0 H LEU A 144 -11.477 -21.044 -0.475 1.00 0.00 H new ATOM 0 HA LEU A 144 -13.526 -20.787 1.642 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -13.320 -19.626 -1.159 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -14.732 -19.479 -0.132 1.00 0.00 H new ATOM 0 HG LEU A 144 -11.989 -18.383 0.533 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -13.031 -16.163 0.026 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -13.026 -17.224 -1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -14.525 -16.993 -0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -13.168 -17.103 2.290 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -14.683 -17.939 1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -13.314 -18.858 2.541 1.00 0.00 H new ATOM 2247 N ASP A 145 -15.303 -22.191 0.380 1.00 0.00 N ATOM 2248 CA ASP A 145 -16.299 -23.072 -0.211 1.00 0.00 C ATOM 2249 C ASP A 145 -17.596 -22.273 -0.178 1.00 0.00 C ATOM 2250 O ASP A 145 -17.883 -21.634 0.837 1.00 0.00 O ATOM 2251 CB ASP A 145 -16.393 -24.393 0.573 1.00 0.00 C ATOM 2252 CG ASP A 145 -17.455 -25.365 0.041 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -18.640 -24.988 -0.081 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -17.135 -26.558 -0.165 1.00 0.00 O ATOM 0 H ASP A 145 -15.673 -21.662 1.170 1.00 0.00 H new ATOM 0 HA ASP A 145 -16.051 -23.367 -1.231 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -15.421 -24.886 0.550 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -16.612 -24.168 1.617 1.00 0.00 H new ATOM 2259 N GLU A 146 -18.334 -22.240 -1.289 1.00 0.00 N ATOM 2260 CA GLU A 146 -19.629 -21.554 -1.372 1.00 0.00 C ATOM 2261 C GLU A 146 -20.694 -22.467 -2.016 1.00 0.00 C ATOM 2262 O GLU A 146 -21.712 -21.996 -2.531 1.00 0.00 O ATOM 2263 CB GLU A 146 -19.477 -20.174 -2.045 1.00 0.00 C ATOM 2264 CG GLU A 146 -18.669 -19.204 -1.167 1.00 0.00 C ATOM 2265 CD GLU A 146 -18.733 -17.749 -1.672 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -19.830 -17.139 -1.633 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -17.674 -17.195 -2.052 1.00 0.00 O ATOM 0 H GLU A 146 -18.051 -22.689 -2.160 1.00 0.00 H new ATOM 0 HA GLU A 146 -19.996 -21.347 -0.367 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -18.983 -20.291 -3.009 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -20.463 -19.753 -2.241 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -19.046 -19.246 -0.145 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.629 -19.528 -1.137 1.00 0.00 H new ATOM 2274 N THR A 147 -20.467 -23.786 -1.984 1.00 0.00 N ATOM 2275 CA THR A 147 -21.435 -24.811 -2.368 1.00 0.00 C ATOM 2276 C THR A 147 -22.117 -25.360 -1.112 1.00 0.00 C ATOM 2277 O THR A 147 -23.319 -25.635 -1.121 1.00 0.00 O ATOM 2278 CB THR A 147 -20.689 -25.899 -3.169 1.00 0.00 C ATOM 2279 OG1 THR A 147 -20.346 -25.357 -4.437 1.00 0.00 O ATOM 2280 CG2 THR A 147 -21.478 -27.201 -3.392 1.00 0.00 C ATOM 0 H THR A 147 -19.576 -24.178 -1.680 1.00 0.00 H new ATOM 0 HA THR A 147 -22.222 -24.404 -3.002 1.00 0.00 H new ATOM 0 HB THR A 147 -19.820 -26.176 -2.572 1.00 0.00 H new ATOM 0 HG1 THR A 147 -20.167 -26.086 -5.067 1.00 0.00 H new ATOM 0 HG21 THR A 147 -20.870 -27.902 -3.964 1.00 0.00 H new ATOM 0 HG22 THR A 147 -21.731 -27.643 -2.428 1.00 0.00 H new ATOM 0 HG23 THR A 147 -22.393 -26.982 -3.942 1.00 0.00 H new ATOM 2288 N ASN A 148 -21.350 -25.501 -0.033 1.00 0.00 N ATOM 2289 CA ASN A 148 -21.727 -26.199 1.187 1.00 0.00 C ATOM 2290 C ASN A 148 -21.754 -25.222 2.345 1.00 0.00 C ATOM 2291 O ASN A 148 -22.678 -25.230 3.158 1.00 0.00 O ATOM 2292 CB ASN A 148 -20.709 -27.310 1.502 1.00 0.00 C ATOM 2293 CG ASN A 148 -20.570 -28.226 0.315 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -21.422 -29.086 0.140 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -19.573 -28.004 -0.528 1.00 0.00 N ATOM 0 H ASN A 148 -20.408 -25.113 0.013 1.00 0.00 H new ATOM 0 HA ASN A 148 -22.714 -26.639 1.044 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -19.742 -26.871 1.749 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -21.034 -27.877 2.374 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -19.487 -28.565 -1.376 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -18.891 -27.272 -0.330 1.00 0.00 H new ATOM 2302 N GLN A 149 -20.717 -24.384 2.409 1.00 0.00 N ATOM 2303 CA GLN A 149 -20.567 -23.335 3.402 1.00 0.00 C ATOM 2304 C GLN A 149 -21.169 -22.041 2.836 1.00 0.00 C ATOM 2305 O GLN A 149 -21.276 -21.873 1.617 1.00 0.00 O ATOM 2306 CB GLN A 149 -19.079 -23.202 3.761 1.00 0.00 C ATOM 2307 CG GLN A 149 -18.555 -24.411 4.561 1.00 0.00 C ATOM 2308 CD GLN A 149 -17.040 -24.589 4.448 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -16.543 -25.681 4.198 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -16.243 -23.544 4.597 1.00 0.00 N ATOM 0 H GLN A 149 -19.940 -24.423 1.749 1.00 0.00 H new ATOM 0 HA GLN A 149 -21.100 -23.568 4.324 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -18.496 -23.095 2.846 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -18.929 -22.293 4.343 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -18.824 -24.290 5.610 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -19.049 -25.316 4.207 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -16.638 -22.627 4.805 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -15.233 -23.655 4.504 1.00 0.00 H new ATOM 2319 N TYR A 150 -21.571 -21.134 3.730 1.00 0.00 N ATOM 2320 CA TYR A 150 -22.028 -19.793 3.374 1.00 0.00 C ATOM 2321 C TYR A 150 -21.912 -18.897 4.605 1.00 0.00 C ATOM 2322 O TYR A 150 -21.278 -17.844 4.553 1.00 0.00 O ATOM 2323 CB TYR A 150 -23.485 -19.843 2.877 1.00 0.00 C ATOM 2324 CG TYR A 150 -24.075 -18.480 2.560 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -23.715 -17.822 1.367 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -24.966 -17.864 3.461 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -24.248 -16.555 1.068 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -25.500 -16.595 3.171 1.00 0.00 C ATOM 2329 CZ TYR A 150 -25.141 -15.932 1.974 1.00 0.00 C ATOM 2330 OH TYR A 150 -25.665 -14.700 1.706 1.00 0.00 O ATOM 0 H TYR A 150 -21.588 -21.315 4.734 1.00 0.00 H new ATOM 0 HA TYR A 150 -21.412 -19.391 2.570 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -23.532 -20.465 1.983 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -24.101 -20.327 3.635 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -23.027 -18.292 0.680 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -25.240 -18.367 4.377 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -23.977 -16.058 0.149 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -26.185 -16.127 3.863 1.00 0.00 H new ATOM 0 HH TYR A 150 -26.258 -14.430 2.438 1.00 0.00 H new ATOM 2340 N ASP A 151 -22.472 -19.351 5.737 1.00 0.00 N ATOM 2341 CA ASP A 151 -22.617 -18.532 6.941 1.00 0.00 C ATOM 2342 C ASP A 151 -21.261 -18.073 7.480 1.00 0.00 C ATOM 2343 O ASP A 151 -21.103 -16.890 7.794 1.00 0.00 O ATOM 2344 CB ASP A 151 -23.365 -19.317 8.024 1.00 0.00 C ATOM 2345 CG ASP A 151 -23.479 -18.488 9.312 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -24.307 -17.545 9.356 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -22.760 -18.791 10.294 1.00 0.00 O ATOM 0 H ASP A 151 -22.836 -20.298 5.839 1.00 0.00 H new ATOM 0 HA ASP A 151 -23.189 -17.645 6.669 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -24.360 -19.582 7.667 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -22.842 -20.250 8.231 1.00 0.00 H new ATOM 2352 N LEU A 152 -20.272 -18.983 7.528 1.00 0.00 N ATOM 2353 CA LEU A 152 -18.909 -18.640 7.942 1.00 0.00 C ATOM 2354 C LEU A 152 -17.938 -18.450 6.781 1.00 0.00 C ATOM 2355 O LEU A 152 -16.785 -18.109 7.032 1.00 0.00 O ATOM 2356 CB LEU A 152 -18.387 -19.517 9.094 1.00 0.00 C ATOM 2357 CG LEU A 152 -17.466 -20.699 8.725 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -16.613 -21.050 9.946 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -18.264 -21.907 8.221 1.00 0.00 C ATOM 0 H LEU A 152 -20.397 -19.965 7.283 1.00 0.00 H new ATOM 0 HA LEU A 152 -18.976 -17.642 8.376 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -17.848 -18.874 9.789 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -19.248 -19.915 9.631 1.00 0.00 H new ATOM 0 HG LEU A 152 -16.815 -20.407 7.901 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -15.955 -21.884 9.703 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -16.013 -20.186 10.231 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -17.263 -21.330 10.775 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -17.579 -22.717 7.972 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.951 -22.239 8.999 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -18.830 -21.625 7.333 1.00 0.00 H new ATOM 2371 N SER A 153 -18.352 -18.588 5.521 1.00 0.00 N ATOM 2372 CA SER A 153 -17.499 -18.182 4.409 1.00 0.00 C ATOM 2373 C SER A 153 -17.223 -16.671 4.515 1.00 0.00 C ATOM 2374 O SER A 153 -16.113 -16.220 4.235 1.00 0.00 O ATOM 2375 CB SER A 153 -18.140 -18.600 3.077 1.00 0.00 C ATOM 2376 OG SER A 153 -18.522 -19.968 3.159 1.00 0.00 O ATOM 0 H SER A 153 -19.257 -18.971 5.250 1.00 0.00 H new ATOM 0 HA SER A 153 -16.534 -18.688 4.451 1.00 0.00 H new ATOM 0 HB2 SER A 153 -19.010 -17.978 2.865 1.00 0.00 H new ATOM 0 HB3 SER A 153 -17.436 -18.454 2.258 1.00 0.00 H new ATOM 0 HG SER A 153 -18.264 -20.430 2.334 1.00 0.00 H new ATOM 2382 N ASP A 154 -18.184 -15.905 5.048 1.00 0.00 N ATOM 2383 CA ASP A 154 -18.006 -14.499 5.420 1.00 0.00 C ATOM 2384 C ASP A 154 -16.908 -14.328 6.471 1.00 0.00 C ATOM 2385 O ASP A 154 -16.061 -13.446 6.342 1.00 0.00 O ATOM 2386 CB ASP A 154 -19.324 -13.949 5.968 1.00 0.00 C ATOM 2387 CG ASP A 154 -19.142 -12.533 6.538 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -19.080 -11.574 5.733 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -19.104 -12.376 7.781 1.00 0.00 O ATOM 0 H ASP A 154 -19.124 -16.254 5.235 1.00 0.00 H new ATOM 0 HA ASP A 154 -17.707 -13.949 4.528 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -20.071 -13.931 5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -19.702 -14.612 6.747 1.00 0.00 H new ATOM 2394 N GLU A 155 -16.881 -15.210 7.471 1.00 0.00 N ATOM 2395 CA GLU A 155 -15.891 -15.208 8.543 1.00 0.00 C ATOM 2396 C GLU A 155 -14.506 -15.484 7.969 1.00 0.00 C ATOM 2397 O GLU A 155 -13.549 -14.767 8.260 1.00 0.00 O ATOM 2398 CB GLU A 155 -16.263 -16.248 9.623 1.00 0.00 C ATOM 2399 CG GLU A 155 -15.379 -16.153 10.868 1.00 0.00 C ATOM 2400 CD GLU A 155 -15.810 -15.014 11.814 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -15.640 -13.820 11.471 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -16.320 -15.312 12.920 1.00 0.00 O ATOM 0 H GLU A 155 -17.564 -15.962 7.558 1.00 0.00 H new ATOM 0 HA GLU A 155 -15.879 -14.226 9.016 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -17.305 -16.109 9.911 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -16.181 -17.249 9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -15.413 -17.100 11.406 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -14.344 -15.996 10.564 1.00 0.00 H new ATOM 2409 N ARG A 156 -14.407 -16.502 7.114 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.159 -16.842 6.442 1.00 0.00 C ATOM 2411 C ARG A 156 -12.640 -15.649 5.642 1.00 0.00 C ATOM 2412 O ARG A 156 -11.464 -15.325 5.783 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.313 -18.085 5.554 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.541 -19.386 6.343 1.00 0.00 C ATOM 2415 CD ARG A 156 -13.163 -20.613 5.495 1.00 0.00 C ATOM 2416 NE ARG A 156 -13.202 -21.851 6.300 1.00 0.00 N ATOM 2417 CZ ARG A 156 -12.647 -23.031 5.988 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -12.007 -23.201 4.833 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -12.730 -24.042 6.840 1.00 0.00 N ATOM 0 H ARG A 156 -15.188 -17.111 6.870 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.423 -17.087 7.208 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.150 -17.932 4.873 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.419 -18.195 4.940 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.946 -19.372 7.256 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.586 -19.455 6.645 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.849 -20.702 4.653 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -12.164 -20.478 5.079 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.704 -21.803 7.187 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -11.934 -22.428 4.172 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -11.590 -24.104 4.609 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -13.215 -23.921 7.729 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -12.309 -24.941 6.607 1.00 0.00 H new ATOM 2433 N ILE A 157 -13.484 -14.966 4.854 1.00 0.00 N ATOM 2434 CA ILE A 157 -13.051 -13.779 4.114 1.00 0.00 C ATOM 2435 C ILE A 157 -12.586 -12.721 5.125 1.00 0.00 C ATOM 2436 O ILE A 157 -11.470 -12.230 4.992 1.00 0.00 O ATOM 2437 CB ILE A 157 -14.156 -13.242 3.164 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -14.566 -14.260 2.073 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -13.666 -11.970 2.440 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -15.969 -14.009 1.505 1.00 0.00 C ATOM 0 H ILE A 157 -14.463 -15.216 4.716 1.00 0.00 H new ATOM 0 HA ILE A 157 -12.219 -14.044 3.462 1.00 0.00 H new ATOM 0 HB ILE A 157 -15.019 -13.039 3.799 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -13.841 -14.223 1.260 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -14.525 -15.266 2.491 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -14.450 -11.604 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -13.425 -11.203 3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -12.776 -12.204 1.855 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -16.193 -14.758 0.745 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -16.704 -14.075 2.308 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -16.008 -13.016 1.058 1.00 0.00 H new ATOM 2452 N GLN A 158 -13.400 -12.390 6.132 1.00 0.00 N ATOM 2453 CA GLN A 158 -13.109 -11.370 7.131 1.00 0.00 C ATOM 2454 C GLN A 158 -11.754 -11.606 7.784 1.00 0.00 C ATOM 2455 O GLN A 158 -10.856 -10.773 7.633 1.00 0.00 O ATOM 2456 CB GLN A 158 -14.267 -11.283 8.132 1.00 0.00 C ATOM 2457 CG GLN A 158 -14.004 -10.243 9.228 1.00 0.00 C ATOM 2458 CD GLN A 158 -14.014 -8.797 8.737 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -14.927 -8.357 8.046 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -13.000 -8.026 9.096 1.00 0.00 N ATOM 0 H GLN A 158 -14.304 -12.840 6.274 1.00 0.00 H new ATOM 0 HA GLN A 158 -13.030 -10.396 6.648 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -15.185 -11.027 7.603 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -14.424 -12.260 8.590 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -14.758 -10.355 10.007 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.038 -10.452 9.687 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.248 -8.407 9.671 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.970 -7.051 8.798 1.00 0.00 H new ATOM 2469 N SER A 159 -11.602 -12.711 8.498 1.00 0.00 N ATOM 2470 CA SER A 159 -10.414 -12.935 9.306 1.00 0.00 C ATOM 2471 C SER A 159 -9.170 -13.088 8.432 1.00 0.00 C ATOM 2472 O SER A 159 -8.101 -12.617 8.818 1.00 0.00 O ATOM 2473 CB SER A 159 -10.623 -14.141 10.230 1.00 0.00 C ATOM 2474 OG SER A 159 -11.769 -13.937 11.048 1.00 0.00 O ATOM 0 H SER A 159 -12.287 -13.466 8.534 1.00 0.00 H new ATOM 0 HA SER A 159 -10.248 -12.060 9.934 1.00 0.00 H new ATOM 0 HB2 SER A 159 -10.747 -15.047 9.636 1.00 0.00 H new ATOM 0 HB3 SER A 159 -9.742 -14.287 10.855 1.00 0.00 H new ATOM 0 HG SER A 159 -11.895 -14.713 11.633 1.00 0.00 H new ATOM 2480 N TRP A 160 -9.296 -13.663 7.232 1.00 0.00 N ATOM 2481 CA TRP A 160 -8.185 -13.744 6.295 1.00 0.00 C ATOM 2482 C TRP A 160 -7.778 -12.358 5.823 1.00 0.00 C ATOM 2483 O TRP A 160 -6.599 -12.029 5.864 1.00 0.00 O ATOM 2484 CB TRP A 160 -8.567 -14.604 5.095 1.00 0.00 C ATOM 2485 CG TRP A 160 -7.466 -14.773 4.107 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -6.373 -15.539 4.286 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -7.321 -14.177 2.785 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -5.609 -15.531 3.138 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -6.109 -14.647 2.208 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -8.111 -13.306 2.012 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -5.668 -14.226 0.947 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -7.698 -12.900 0.731 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -6.460 -13.324 0.216 1.00 0.00 C ATOM 0 H TRP A 160 -10.163 -14.079 6.891 1.00 0.00 H new ATOM 0 HA TRP A 160 -7.340 -14.201 6.809 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -8.881 -15.586 5.448 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.426 -14.155 4.596 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -6.132 -16.077 5.191 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.779 -16.107 2.996 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -9.048 -12.944 2.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -4.734 -14.589 0.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -8.335 -12.259 0.139 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -6.118 -12.957 -0.740 1.00 0.00 H new ATOM 2504 N CYS A 161 -8.735 -11.525 5.415 1.00 0.00 N ATOM 2505 CA CYS A 161 -8.452 -10.185 4.924 1.00 0.00 C ATOM 2506 C CYS A 161 -7.783 -9.352 6.014 1.00 0.00 C ATOM 2507 O CYS A 161 -6.807 -8.663 5.733 1.00 0.00 O ATOM 2508 CB CYS A 161 -9.761 -9.522 4.482 1.00 0.00 C ATOM 2509 SG CYS A 161 -10.336 -10.253 2.932 1.00 0.00 S ATOM 0 H CYS A 161 -9.727 -11.764 5.417 1.00 0.00 H new ATOM 0 HA CYS A 161 -7.772 -10.249 4.074 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -10.519 -9.646 5.255 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -9.609 -8.450 4.353 1.00 0.00 H new ATOM 0 HG CYS A 161 -11.012 -11.334 3.186 1.00 0.00 H new ATOM 2515 N GLU A 162 -8.254 -9.444 7.260 1.00 0.00 N ATOM 2516 CA GLU A 162 -7.601 -8.767 8.370 1.00 0.00 C ATOM 2517 C GLU A 162 -6.177 -9.290 8.538 1.00 0.00 C ATOM 2518 O GLU A 162 -5.232 -8.515 8.660 1.00 0.00 O ATOM 2519 CB GLU A 162 -8.397 -8.920 9.668 1.00 0.00 C ATOM 2520 CG GLU A 162 -9.684 -8.099 9.597 1.00 0.00 C ATOM 2521 CD GLU A 162 -10.352 -8.020 10.978 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -9.932 -7.189 11.819 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -11.334 -8.765 11.202 1.00 0.00 O ATOM 0 H GLU A 162 -9.082 -9.980 7.519 1.00 0.00 H new ATOM 0 HA GLU A 162 -7.559 -7.702 8.141 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.636 -9.970 9.835 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -7.794 -8.592 10.514 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -9.462 -7.095 9.237 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.370 -8.550 8.880 1.00 0.00 H new ATOM 2530 N GLN A 163 -6.010 -10.609 8.472 1.00 0.00 N ATOM 2531 CA GLN A 163 -4.733 -11.260 8.687 1.00 0.00 C ATOM 2532 C GLN A 163 -3.746 -10.813 7.632 1.00 0.00 C ATOM 2533 O GLN A 163 -2.661 -10.380 8.012 1.00 0.00 O ATOM 2534 CB GLN A 163 -4.892 -12.788 8.727 1.00 0.00 C ATOM 2535 CG GLN A 163 -3.557 -13.547 8.856 1.00 0.00 C ATOM 2536 CD GLN A 163 -3.748 -15.047 8.630 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -3.618 -15.861 9.544 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -4.064 -15.442 7.402 1.00 0.00 N ATOM 0 H GLN A 163 -6.770 -11.257 8.265 1.00 0.00 H new ATOM 0 HA GLN A 163 -4.339 -10.964 9.659 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -5.534 -13.056 9.566 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -5.400 -13.115 7.820 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -2.842 -13.156 8.132 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -3.133 -13.377 9.846 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -4.168 -14.754 6.656 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -4.203 -16.433 7.205 1.00 0.00 H new ATOM 2547 N ILE A 164 -4.092 -10.872 6.346 1.00 0.00 N ATOM 2548 CA ILE A 164 -3.145 -10.521 5.297 1.00 0.00 C ATOM 2549 C ILE A 164 -2.772 -9.057 5.410 1.00 0.00 C ATOM 2550 O ILE A 164 -1.619 -8.746 5.156 1.00 0.00 O ATOM 2551 CB ILE A 164 -3.640 -10.882 3.874 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -4.898 -10.134 3.379 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -3.900 -12.384 3.761 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.240 -10.409 1.902 1.00 0.00 C ATOM 0 H ILE A 164 -5.012 -11.157 6.011 1.00 0.00 H new ATOM 0 HA ILE A 164 -2.253 -11.128 5.449 1.00 0.00 H new ATOM 0 HB ILE A 164 -2.823 -10.556 3.230 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -5.748 -10.420 3.999 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -4.750 -9.063 3.515 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -4.247 -12.618 2.755 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -2.978 -12.929 3.963 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -4.661 -12.677 4.485 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -6.134 -9.850 1.626 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.408 -10.097 1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -5.420 -11.475 1.763 1.00 0.00 H new ATOM 2566 N LEU A 165 -3.683 -8.173 5.827 1.00 0.00 N ATOM 2567 CA LEU A 165 -3.410 -6.731 5.852 1.00 0.00 C ATOM 2568 C LEU A 165 -2.423 -6.434 6.972 1.00 0.00 C ATOM 2569 O LEU A 165 -1.554 -5.580 6.833 1.00 0.00 O ATOM 2570 CB LEU A 165 -4.726 -5.925 5.871 1.00 0.00 C ATOM 2571 CG LEU A 165 -5.229 -5.419 7.235 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -4.584 -4.078 7.604 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -6.749 -5.240 7.189 1.00 0.00 C ATOM 0 H LEU A 165 -4.615 -8.429 6.152 1.00 0.00 H new ATOM 0 HA LEU A 165 -2.921 -6.399 4.936 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -4.601 -5.062 5.217 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -5.507 -6.546 5.434 1.00 0.00 H new ATOM 0 HG LEU A 165 -4.956 -6.158 7.988 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -4.960 -3.748 8.572 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -3.502 -4.197 7.656 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -4.831 -3.335 6.846 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -7.103 -4.882 8.156 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -7.007 -4.515 6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -7.221 -6.196 6.961 1.00 0.00 H new ATOM 2585 N ASN A 166 -2.506 -7.214 8.040 1.00 0.00 N ATOM 2586 CA ASN A 166 -1.576 -7.179 9.154 1.00 0.00 C ATOM 2587 C ASN A 166 -0.236 -7.748 8.711 1.00 0.00 C ATOM 2588 O ASN A 166 0.779 -7.071 8.803 1.00 0.00 O ATOM 2589 CB ASN A 166 -2.213 -7.971 10.300 1.00 0.00 C ATOM 2590 CG ASN A 166 -1.295 -8.948 11.020 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -0.539 -8.587 11.915 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -1.379 -10.213 10.624 1.00 0.00 N ATOM 0 H ASN A 166 -3.244 -7.908 8.157 1.00 0.00 H new ATOM 0 HA ASN A 166 -1.381 -6.163 9.498 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -2.605 -7.264 11.031 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -3.064 -8.525 9.904 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -0.801 -10.926 11.069 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -2.022 -10.471 9.875 1.00 0.00 H new ATOM 2599 N GLU A 167 -0.244 -8.956 8.153 1.00 0.00 N ATOM 2600 CA GLU A 167 0.922 -9.764 7.880 1.00 0.00 C ATOM 2601 C GLU A 167 1.749 -9.126 6.761 1.00 0.00 C ATOM 2602 O GLU A 167 2.979 -9.181 6.784 1.00 0.00 O ATOM 2603 CB GLU A 167 0.364 -11.168 7.582 1.00 0.00 C ATOM 2604 CG GLU A 167 1.335 -12.081 6.871 1.00 0.00 C ATOM 2605 CD GLU A 167 0.844 -13.538 6.853 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -0.042 -13.864 6.028 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 1.355 -14.359 7.651 1.00 0.00 O ATOM 0 H GLU A 167 -1.111 -9.412 7.868 1.00 0.00 H new ATOM 0 HA GLU A 167 1.629 -9.836 8.706 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.064 -11.635 8.520 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -0.535 -11.068 6.974 1.00 0.00 H new ATOM 0 HG2 GLU A 167 1.477 -11.733 5.848 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.307 -12.031 7.363 1.00 0.00 H new ATOM 2614 N MET A 168 1.086 -8.437 5.829 1.00 0.00 N ATOM 2615 CA MET A 168 1.764 -7.688 4.777 1.00 0.00 C ATOM 2616 C MET A 168 2.385 -6.411 5.328 1.00 0.00 C ATOM 2617 O MET A 168 3.453 -5.989 4.886 1.00 0.00 O ATOM 2618 CB MET A 168 0.816 -7.424 3.601 1.00 0.00 C ATOM 2619 CG MET A 168 -0.294 -6.392 3.795 1.00 0.00 C ATOM 2620 SD MET A 168 -1.381 -6.284 2.348 1.00 0.00 S ATOM 2621 CE MET A 168 -2.439 -7.762 2.393 1.00 0.00 C ATOM 0 H MET A 168 0.068 -8.385 5.785 1.00 0.00 H new ATOM 0 HA MET A 168 2.585 -8.293 4.393 1.00 0.00 H new ATOM 0 HB2 MET A 168 1.419 -7.110 2.749 1.00 0.00 H new ATOM 0 HB3 MET A 168 0.349 -8.371 3.329 1.00 0.00 H new ATOM 0 HG2 MET A 168 -0.884 -6.655 4.673 1.00 0.00 H new ATOM 0 HG3 MET A 168 0.149 -5.415 3.989 1.00 0.00 H new ATOM 0 HE1 MET A 168 -2.838 -7.954 1.397 1.00 0.00 H new ATOM 0 HE2 MET A 168 -1.852 -8.620 2.720 1.00 0.00 H new ATOM 0 HE3 MET A 168 -3.262 -7.599 3.089 1.00 0.00 H new ATOM 2631 N ALA A 169 1.736 -5.801 6.312 1.00 0.00 N ATOM 2632 CA ALA A 169 2.194 -4.555 6.875 1.00 0.00 C ATOM 2633 C ALA A 169 3.402 -4.753 7.778 1.00 0.00 C ATOM 2634 O ALA A 169 4.323 -3.941 7.736 1.00 0.00 O ATOM 2635 CB ALA A 169 1.049 -3.862 7.607 1.00 0.00 C ATOM 0 H ALA A 169 0.881 -6.162 6.735 1.00 0.00 H new ATOM 0 HA ALA A 169 2.521 -3.910 6.059 1.00 0.00 H new ATOM 0 HB1 ALA A 169 1.403 -2.922 8.029 1.00 0.00 H new ATOM 0 HB2 ALA A 169 0.238 -3.663 6.907 1.00 0.00 H new ATOM 0 HB3 ALA A 169 0.687 -4.506 8.408 1.00 0.00 H new ATOM 2641 N GLU A 170 3.446 -5.851 8.537 1.00 0.00 N ATOM 2642 CA GLU A 170 4.604 -6.139 9.386 1.00 0.00 C ATOM 2643 C GLU A 170 5.851 -6.320 8.514 1.00 0.00 C ATOM 2644 O GLU A 170 6.971 -6.007 8.918 1.00 0.00 O ATOM 2645 CB GLU A 170 4.453 -7.428 10.215 1.00 0.00 C ATOM 2646 CG GLU A 170 3.072 -7.720 10.791 1.00 0.00 C ATOM 2647 CD GLU A 170 3.149 -8.675 11.996 1.00 0.00 C ATOM 2648 OE1 GLU A 170 3.096 -9.915 11.801 1.00 0.00 O1- ATOM 2649 OE2 GLU A 170 3.273 -8.195 13.150 1.00 0.00 O ATOM 0 H GLU A 170 2.702 -6.548 8.581 1.00 0.00 H new ATOM 0 HA GLU A 170 4.688 -5.292 10.067 1.00 0.00 H new ATOM 0 HB2 GLU A 170 4.744 -8.271 9.588 1.00 0.00 H new ATOM 0 HB3 GLU A 170 5.163 -7.385 11.041 1.00 0.00 H new ATOM 0 HG2 GLU A 170 2.600 -6.786 11.096 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.441 -8.159 10.018 1.00 0.00 H new ATOM 2656 N HIS A 171 5.630 -6.861 7.313 1.00 0.00 N ATOM 2657 CA HIS A 171 6.663 -7.204 6.361 1.00 0.00 C ATOM 2658 C HIS A 171 7.228 -5.956 5.679 1.00 0.00 C ATOM 2659 O HIS A 171 8.430 -5.895 5.404 1.00 0.00 O ATOM 2660 CB HIS A 171 6.046 -8.198 5.379 1.00 0.00 C ATOM 2661 CG HIS A 171 7.065 -8.781 4.435 1.00 0.00 C ATOM 2662 ND1 HIS A 171 7.980 -9.793 4.741 1.00 0.00 N ATOM 2663 CD2 HIS A 171 7.296 -8.339 3.166 1.00 0.00 C ATOM 2664 CE1 HIS A 171 8.749 -9.922 3.645 1.00 0.00 C ATOM 2665 NE2 HIS A 171 8.355 -9.070 2.682 1.00 0.00 N ATOM 0 H HIS A 171 4.692 -7.075 6.975 1.00 0.00 H new ATOM 0 HA HIS A 171 7.520 -7.664 6.853 1.00 0.00 H new ATOM 0 HB2 HIS A 171 5.567 -9.004 5.935 1.00 0.00 H new ATOM 0 HB3 HIS A 171 5.266 -7.700 4.804 1.00 0.00 H new ATOM 0 HD2 HIS A 171 6.753 -7.566 2.643 1.00 0.00 H new ATOM 0 HE1 HIS A 171 9.571 -10.616 3.551 1.00 0.00 H new ATOM 0 HE2 HIS A 171 8.770 -8.982 1.754 1.00 0.00 H new ATOM 2673 N TYR A 172 6.380 -4.949 5.442 1.00 0.00 N ATOM 2674 CA TYR A 172 6.796 -3.652 4.925 1.00 0.00 C ATOM 2675 C TYR A 172 7.430 -2.755 5.999 1.00 0.00 C ATOM 2676 O TYR A 172 8.236 -1.883 5.654 1.00 0.00 O ATOM 2677 CB TYR A 172 5.625 -2.928 4.239 1.00 0.00 C ATOM 2678 CG TYR A 172 5.531 -3.165 2.743 1.00 0.00 C ATOM 2679 CD1 TYR A 172 6.615 -2.813 1.915 1.00 0.00 C ATOM 2680 CD2 TYR A 172 4.366 -3.710 2.171 1.00 0.00 C ATOM 2681 CE1 TYR A 172 6.560 -3.048 0.530 1.00 0.00 C ATOM 2682 CE2 TYR A 172 4.300 -3.936 0.780 1.00 0.00 C ATOM 2683 CZ TYR A 172 5.408 -3.626 -0.045 1.00 0.00 C ATOM 2684 OH TYR A 172 5.393 -3.888 -1.386 1.00 0.00 O ATOM 0 H TYR A 172 5.376 -5.018 5.607 1.00 0.00 H new ATOM 0 HA TYR A 172 7.569 -3.852 4.184 1.00 0.00 H new ATOM 0 HB2 TYR A 172 4.693 -3.248 4.705 1.00 0.00 H new ATOM 0 HB3 TYR A 172 5.720 -1.857 4.420 1.00 0.00 H new ATOM 0 HD1 TYR A 172 7.495 -2.359 2.347 1.00 0.00 H new ATOM 0 HD2 TYR A 172 3.522 -3.955 2.798 1.00 0.00 H new ATOM 0 HE1 TYR A 172 7.401 -2.786 -0.095 1.00 0.00 H new ATOM 0 HE2 TYR A 172 3.402 -4.347 0.343 1.00 0.00 H new ATOM 0 HH TYR A 172 4.526 -4.271 -1.635 1.00 0.00 H new ATOM 2694 N ALA A 173 7.060 -2.929 7.274 1.00 0.00 N ATOM 2695 CA ALA A 173 7.555 -2.108 8.375 1.00 0.00 C ATOM 2696 C ALA A 173 9.076 -2.239 8.508 1.00 0.00 C ATOM 2697 O ALA A 173 9.605 -3.372 8.414 1.00 0.00 O ATOM 2698 CB ALA A 173 6.860 -2.481 9.688 1.00 0.00 C ATOM 2699 OXT ALA A 173 9.740 -1.203 8.744 1.00 0.00 O1- ATOM 0 H ALA A 173 6.403 -3.651 7.568 1.00 0.00 H new ATOM 0 HA ALA A 173 7.322 -1.067 8.153 1.00 0.00 H new ATOM 0 HB1 ALA A 173 7.245 -1.856 10.494 1.00 0.00 H new ATOM 0 HB2 ALA A 173 5.786 -2.324 9.589 1.00 0.00 H new ATOM 0 HB3 ALA A 173 7.054 -3.529 9.917 1.00 0.00 H new TER 2705 ALA A 173