USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 911 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 55 GLN : amide:sc= -0.847 K(o=-0.85,f=-0.33) USER MOD Set 1.2: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 34 HIS : no HE2:sc= 0.862 K(o=0.89,f=-2.9!) USER MOD Set 2.2: A 39 THR OG1 : rot 180:sc= 0.0324 USER MOD Single : A 1 GLY N :NH3+ -101:sc= 0.115 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -1.67 X(o=-1.7,f=-1.6) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.049 K(o=-0.049,f=-1.8) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -23:sc= 0.531 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 40 CYS SG : rot 32:sc= 0.308 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -1.71! K(o=-1.7!,f=-0.052) USER MOD Single : A 61 LYS NZ :NH3+ -174:sc= 1.39 (180deg=1.35) USER MOD Single : A 63 SER OG : rot 180:sc= 0.139 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl -174:sc= -0.019 (180deg=-0.125) USER MOD Single : A 85 GLN : amide:sc= -0.554 K(o=-0.55,f=-1.6) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0.0496 USER MOD Single : A 92 THR OG1 : rot 113:sc= 1.19 USER MOD Single : A 99 HIS : no HD1:sc= -0.398 K(o=-0.4,f=-1.1) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.793 -23.249 0.917 1.00 0.00 N ATOM 2 CA GLY A 1 2.541 -22.576 1.287 1.00 0.00 C ATOM 3 C GLY A 1 2.764 -21.070 1.361 1.00 0.00 C ATOM 4 O GLY A 1 3.901 -20.602 1.439 1.00 0.00 O ATOM 0 H1 GLY A 1 3.770 -23.493 -0.094 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.596 -22.614 1.102 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.901 -24.116 1.481 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.766 -22.802 0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.189 -22.948 2.249 1.00 0.00 H new ATOM 8 N HIS A 2 1.682 -20.288 1.315 1.00 0.00 N ATOM 9 CA HIS A 2 1.746 -18.827 1.369 1.00 0.00 C ATOM 10 C HIS A 2 1.963 -18.398 2.838 1.00 0.00 C ATOM 11 O HIS A 2 1.684 -19.160 3.768 1.00 0.00 O ATOM 12 CB HIS A 2 0.433 -18.281 0.763 1.00 0.00 C ATOM 13 CG HIS A 2 0.192 -18.564 -0.706 1.00 0.00 C ATOM 14 ND1 HIS A 2 0.493 -19.702 -1.425 1.00 0.00 N ATOM 15 CD2 HIS A 2 -0.427 -17.704 -1.570 1.00 0.00 C ATOM 16 CE1 HIS A 2 0.033 -19.545 -2.675 1.00 0.00 C ATOM 17 NE2 HIS A 2 -0.557 -18.342 -2.806 1.00 0.00 N ATOM 0 H HIS A 2 0.733 -20.654 1.239 1.00 0.00 H new ATOM 0 HA HIS A 2 2.578 -18.421 0.793 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -0.401 -18.694 1.330 1.00 0.00 H new ATOM 0 HB3 HIS A 2 0.414 -17.201 0.909 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -0.759 -16.703 -1.337 1.00 0.00 H new ATOM 0 HE1 HIS A 2 0.123 -20.278 -3.463 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -1.009 -17.970 -3.641 1.00 0.00 H new ATOM 25 N VAL A 3 2.464 -17.188 3.076 1.00 0.00 N ATOM 26 CA VAL A 3 2.661 -16.594 4.411 1.00 0.00 C ATOM 27 C VAL A 3 1.367 -15.878 4.776 1.00 0.00 C ATOM 28 O VAL A 3 0.730 -15.355 3.872 1.00 0.00 O ATOM 29 CB VAL A 3 3.832 -15.595 4.349 1.00 0.00 C ATOM 30 CG1 VAL A 3 4.149 -14.924 5.694 1.00 0.00 C ATOM 31 CG2 VAL A 3 5.113 -16.255 3.820 1.00 0.00 C ATOM 0 H VAL A 3 2.757 -16.566 2.322 1.00 0.00 H new ATOM 0 HA VAL A 3 2.897 -17.352 5.158 1.00 0.00 H new ATOM 0 HB VAL A 3 3.493 -14.821 3.660 1.00 0.00 H new ATOM 0 HG11 VAL A 3 4.984 -14.235 5.569 1.00 0.00 H new ATOM 0 HG12 VAL A 3 3.274 -14.374 6.041 1.00 0.00 H new ATOM 0 HG13 VAL A 3 4.414 -15.686 6.427 1.00 0.00 H new ATOM 0 HG21 VAL A 3 5.916 -15.519 3.791 1.00 0.00 H new ATOM 0 HG22 VAL A 3 5.397 -17.076 4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 3 4.936 -16.639 2.815 1.00 0.00 H new ATOM 41 N GLN A 4 0.960 -15.809 6.043 1.00 0.00 N ATOM 42 CA GLN A 4 -0.180 -15.032 6.479 1.00 0.00 C ATOM 43 C GLN A 4 0.287 -13.723 7.092 1.00 0.00 C ATOM 44 O GLN A 4 1.272 -13.709 7.832 1.00 0.00 O ATOM 45 CB GLN A 4 -1.006 -15.856 7.474 1.00 0.00 C ATOM 46 CG GLN A 4 -2.459 -15.453 7.284 1.00 0.00 C ATOM 47 CD GLN A 4 -3.442 -16.297 8.086 1.00 0.00 C ATOM 48 OE1 GLN A 4 -3.488 -17.519 7.956 1.00 0.00 O ATOM 49 NE2 GLN A 4 -4.255 -15.670 8.916 1.00 0.00 N ATOM 0 H GLN A 4 1.428 -16.304 6.802 1.00 0.00 H new ATOM 0 HA GLN A 4 -0.813 -14.790 5.625 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.875 -16.923 7.294 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -0.683 -15.663 8.497 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -2.576 -14.407 7.568 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -2.711 -15.526 6.226 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -4.203 -14.656 9.012 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -4.935 -16.200 9.462 1.00 0.00 H new ATOM 58 N LEU A 5 -0.440 -12.644 6.811 1.00 0.00 N ATOM 59 CA LEU A 5 -0.169 -11.307 7.314 1.00 0.00 C ATOM 60 C LEU A 5 -1.479 -10.682 7.753 1.00 0.00 C ATOM 61 O LEU A 5 -2.536 -10.996 7.199 1.00 0.00 O ATOM 62 CB LEU A 5 0.468 -10.439 6.214 1.00 0.00 C ATOM 63 CG LEU A 5 1.893 -10.841 5.785 1.00 0.00 C ATOM 64 CD1 LEU A 5 2.339 -9.915 4.646 1.00 0.00 C ATOM 65 CD2 LEU A 5 2.903 -10.719 6.928 1.00 0.00 C ATOM 0 H LEU A 5 -1.261 -12.682 6.206 1.00 0.00 H new ATOM 0 HA LEU A 5 0.524 -11.369 8.153 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -0.177 -10.467 5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 5 0.491 -9.406 6.560 1.00 0.00 H new ATOM 0 HG LEU A 5 1.864 -11.885 5.472 1.00 0.00 H new ATOM 0 HD11 LEU A 5 3.346 -10.186 4.330 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.655 -10.018 3.804 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.333 -8.882 4.994 1.00 0.00 H new ATOM 0 HD21 LEU A 5 3.891 -11.014 6.574 1.00 0.00 H new ATOM 0 HD22 LEU A 5 2.935 -9.687 7.276 1.00 0.00 H new ATOM 0 HD23 LEU A 5 2.603 -11.370 7.749 1.00 0.00 H new ATOM 77 N SER A 6 -1.398 -9.754 8.697 1.00 0.00 N ATOM 78 CA SER A 6 -2.473 -8.848 9.031 1.00 0.00 C ATOM 79 C SER A 6 -2.010 -7.418 8.782 1.00 0.00 C ATOM 80 O SER A 6 -0.810 -7.139 8.797 1.00 0.00 O ATOM 81 CB SER A 6 -2.887 -9.013 10.491 1.00 0.00 C ATOM 82 OG SER A 6 -2.364 -10.135 11.189 1.00 0.00 O ATOM 0 H SER A 6 -0.560 -9.612 9.261 1.00 0.00 H new ATOM 0 HA SER A 6 -3.337 -9.074 8.406 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.593 -8.112 11.030 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.975 -9.067 10.530 1.00 0.00 H new ATOM 0 HG SER A 6 -2.697 -10.132 12.111 1.00 0.00 H new ATOM 88 N LEU A 7 -2.960 -6.502 8.601 1.00 0.00 N ATOM 89 CA LEU A 7 -2.715 -5.065 8.540 1.00 0.00 C ATOM 90 C LEU A 7 -3.863 -4.343 9.238 1.00 0.00 C ATOM 91 O LEU A 7 -5.000 -4.814 9.127 1.00 0.00 O ATOM 92 CB LEU A 7 -2.645 -4.586 7.080 1.00 0.00 C ATOM 93 CG LEU A 7 -1.469 -5.154 6.264 1.00 0.00 C ATOM 94 CD1 LEU A 7 -1.642 -4.728 4.810 1.00 0.00 C ATOM 95 CD2 LEU A 7 -0.109 -4.649 6.751 1.00 0.00 C ATOM 0 H LEU A 7 -3.944 -6.746 8.490 1.00 0.00 H new ATOM 0 HA LEU A 7 -1.765 -4.848 9.028 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.576 -4.853 6.581 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.580 -3.498 7.073 1.00 0.00 H new ATOM 0 HG LEU A 7 -1.482 -6.238 6.381 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.818 -5.121 4.215 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.585 -5.118 4.426 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -1.648 -3.640 4.748 1.00 0.00 H new ATOM 0 HD21 LEU A 7 0.681 -5.083 6.138 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.075 -3.562 6.671 1.00 0.00 H new ATOM 0 HD23 LEU A 7 0.037 -4.941 7.791 1.00 0.00 H new ATOM 107 N PRO A 8 -3.611 -3.209 9.912 1.00 0.00 N ATOM 108 CA PRO A 8 -4.674 -2.346 10.399 1.00 0.00 C ATOM 109 C PRO A 8 -5.331 -1.665 9.195 1.00 0.00 C ATOM 110 O PRO A 8 -4.640 -1.268 8.254 1.00 0.00 O ATOM 111 CB PRO A 8 -3.969 -1.349 11.319 1.00 0.00 C ATOM 112 CG PRO A 8 -2.588 -1.187 10.695 1.00 0.00 C ATOM 113 CD PRO A 8 -2.310 -2.585 10.141 1.00 0.00 C ATOM 0 HA PRO A 8 -5.465 -2.867 10.938 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -4.502 -0.399 11.362 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -3.904 -1.725 12.340 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.583 -0.431 9.910 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.843 -0.886 11.431 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -1.739 -2.528 9.214 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -1.718 -3.170 10.845 1.00 0.00 H new ATOM 121 N VAL A 9 -6.650 -1.514 9.219 1.00 0.00 N ATOM 122 CA VAL A 9 -7.388 -0.671 8.293 1.00 0.00 C ATOM 123 C VAL A 9 -7.491 0.687 8.981 1.00 0.00 C ATOM 124 O VAL A 9 -7.903 0.754 10.143 1.00 0.00 O ATOM 125 CB VAL A 9 -8.771 -1.256 7.937 1.00 0.00 C ATOM 126 CG1 VAL A 9 -9.329 -0.575 6.676 1.00 0.00 C ATOM 127 CG2 VAL A 9 -8.707 -2.766 7.663 1.00 0.00 C ATOM 0 H VAL A 9 -7.247 -1.986 9.899 1.00 0.00 H new ATOM 0 HA VAL A 9 -6.877 -0.594 7.333 1.00 0.00 H new ATOM 0 HB VAL A 9 -9.415 -1.075 8.797 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.305 -0.997 6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -9.431 0.495 6.855 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -8.647 -0.740 5.842 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -9.703 -3.134 7.417 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.033 -2.956 6.827 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.339 -3.281 8.550 1.00 0.00 H new ATOM 137 N LEU A 10 -7.091 1.748 8.286 1.00 0.00 N ATOM 138 CA LEU A 10 -6.973 3.117 8.785 1.00 0.00 C ATOM 139 C LEU A 10 -7.843 3.991 7.866 1.00 0.00 C ATOM 140 O LEU A 10 -7.961 3.664 6.682 1.00 0.00 O ATOM 141 CB LEU A 10 -5.493 3.540 8.704 1.00 0.00 C ATOM 142 CG LEU A 10 -4.467 2.653 9.449 1.00 0.00 C ATOM 143 CD1 LEU A 10 -3.074 2.772 8.816 1.00 0.00 C ATOM 144 CD2 LEU A 10 -4.345 3.025 10.927 1.00 0.00 C ATOM 0 H LEU A 10 -6.825 1.672 7.304 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.301 3.215 9.820 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.208 3.577 7.652 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.409 4.555 9.093 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.838 1.631 9.366 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.372 2.139 9.359 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.119 2.454 7.774 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.740 3.808 8.865 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -3.613 2.375 11.407 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.022 4.062 11.016 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.313 2.904 11.414 1.00 0.00 H new ATOM 156 N GLN A 11 -8.499 5.056 8.343 1.00 0.00 N ATOM 157 CA GLN A 11 -9.260 5.941 7.453 1.00 0.00 C ATOM 158 C GLN A 11 -8.286 6.771 6.632 1.00 0.00 C ATOM 159 O GLN A 11 -7.326 7.314 7.171 1.00 0.00 O ATOM 160 CB GLN A 11 -10.248 6.865 8.192 1.00 0.00 C ATOM 161 CG GLN A 11 -11.557 6.169 8.542 1.00 0.00 C ATOM 162 CD GLN A 11 -12.762 7.091 8.389 1.00 0.00 C ATOM 163 OE1 GLN A 11 -12.892 8.155 8.991 1.00 0.00 O ATOM 164 NE2 GLN A 11 -13.640 6.700 7.489 1.00 0.00 N ATOM 0 H GLN A 11 -8.519 5.324 9.327 1.00 0.00 H new ATOM 0 HA GLN A 11 -9.869 5.304 6.812 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.781 7.232 9.106 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -10.459 7.735 7.570 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -11.685 5.298 7.900 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -11.509 5.805 9.568 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -13.511 5.813 7.002 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.449 7.284 7.279 1.00 0.00 H new ATOM 173 N VAL A 12 -8.561 6.952 5.341 1.00 0.00 N ATOM 174 CA VAL A 12 -7.650 7.656 4.445 1.00 0.00 C ATOM 175 C VAL A 12 -7.456 9.109 4.892 1.00 0.00 C ATOM 176 O VAL A 12 -6.397 9.696 4.659 1.00 0.00 O ATOM 177 CB VAL A 12 -8.120 7.473 2.985 1.00 0.00 C ATOM 178 CG1 VAL A 12 -9.457 8.108 2.595 1.00 0.00 C ATOM 179 CG2 VAL A 12 -7.060 7.903 1.974 1.00 0.00 C ATOM 0 H VAL A 12 -9.414 6.618 4.892 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.651 7.224 4.494 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.285 6.396 2.948 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -9.665 7.903 1.545 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -10.252 7.688 3.211 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.407 9.186 2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -7.440 7.754 0.963 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.823 8.957 2.121 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.159 7.305 2.115 1.00 0.00 H new ATOM 189 N ARG A 13 -8.431 9.674 5.612 1.00 0.00 N ATOM 190 CA ARG A 13 -8.292 11.019 6.139 1.00 0.00 C ATOM 191 C ARG A 13 -7.308 11.058 7.311 1.00 0.00 C ATOM 192 O ARG A 13 -6.536 12.012 7.405 1.00 0.00 O ATOM 193 CB ARG A 13 -9.669 11.613 6.485 1.00 0.00 C ATOM 194 CG ARG A 13 -10.452 10.760 7.487 1.00 0.00 C ATOM 195 CD ARG A 13 -11.631 11.474 8.159 1.00 0.00 C ATOM 196 NE ARG A 13 -11.913 10.821 9.444 1.00 0.00 N ATOM 197 CZ ARG A 13 -11.039 10.741 10.453 1.00 0.00 C ATOM 198 NH1 ARG A 13 -10.072 11.635 10.574 1.00 0.00 N ATOM 199 NH2 ARG A 13 -11.103 9.739 11.310 1.00 0.00 N ATOM 0 H ARG A 13 -9.315 9.218 5.837 1.00 0.00 H new ATOM 0 HA ARG A 13 -7.863 11.655 5.365 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -9.534 12.614 6.895 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -10.253 11.719 5.571 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -10.827 9.875 6.974 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -9.767 10.414 8.261 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -11.395 12.527 8.315 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.510 11.436 7.516 1.00 0.00 H new ATOM 0 HE ARG A 13 -12.834 10.402 9.575 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -9.989 12.392 9.895 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -9.409 11.568 11.346 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -11.821 9.022 11.204 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -10.435 9.682 12.078 1.00 0.00 H new ATOM 213 N ASP A 14 -7.315 10.030 8.167 1.00 0.00 N ATOM 214 CA ASP A 14 -6.489 9.956 9.372 1.00 0.00 C ATOM 215 C ASP A 14 -5.039 9.783 8.945 1.00 0.00 C ATOM 216 O ASP A 14 -4.163 10.463 9.460 1.00 0.00 O ATOM 217 CB ASP A 14 -6.886 8.769 10.280 1.00 0.00 C ATOM 218 CG ASP A 14 -7.989 9.066 11.304 1.00 0.00 C ATOM 219 OD1 ASP A 14 -8.114 10.214 11.794 1.00 0.00 O ATOM 220 OD2 ASP A 14 -8.829 8.171 11.548 1.00 0.00 O ATOM 0 H ASP A 14 -7.908 9.211 8.036 1.00 0.00 H new ATOM 0 HA ASP A 14 -6.634 10.873 9.943 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -7.213 7.943 9.648 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -5.999 8.430 10.815 1.00 0.00 H new ATOM 225 N VAL A 15 -4.834 8.887 7.979 1.00 0.00 N ATOM 226 CA VAL A 15 -3.648 8.568 7.193 1.00 0.00 C ATOM 227 C VAL A 15 -3.088 9.777 6.452 1.00 0.00 C ATOM 228 O VAL A 15 -3.295 9.898 5.245 1.00 0.00 O ATOM 229 CB VAL A 15 -3.836 7.322 6.313 1.00 0.00 C ATOM 230 CG1 VAL A 15 -2.497 6.881 5.720 1.00 0.00 C ATOM 231 CG2 VAL A 15 -4.318 6.108 7.109 1.00 0.00 C ATOM 0 H VAL A 15 -5.607 8.286 7.693 1.00 0.00 H new ATOM 0 HA VAL A 15 -2.870 8.293 7.905 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.567 7.612 5.558 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -2.647 5.998 5.099 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -2.086 7.686 5.111 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -1.802 6.644 6.526 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.434 5.256 6.439 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.587 5.866 7.881 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.276 6.336 7.575 1.00 0.00 H new ATOM 241 N LEU A 16 -2.590 10.773 7.171 1.00 0.00 N ATOM 242 CA LEU A 16 -1.898 11.950 6.664 1.00 0.00 C ATOM 243 C LEU A 16 -1.145 11.695 5.351 1.00 0.00 C ATOM 244 O LEU A 16 -1.211 12.538 4.447 1.00 0.00 O ATOM 245 CB LEU A 16 -0.894 12.429 7.724 1.00 0.00 C ATOM 246 CG LEU A 16 -1.522 12.965 9.022 1.00 0.00 C ATOM 247 CD1 LEU A 16 -0.433 13.108 10.085 1.00 0.00 C ATOM 248 CD2 LEU A 16 -2.207 14.322 8.810 1.00 0.00 C ATOM 0 H LEU A 16 -2.663 10.781 8.188 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.658 12.703 6.457 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.231 11.601 7.974 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.275 13.213 7.288 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.283 12.255 9.345 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.873 13.488 11.007 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.022 12.135 10.273 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.330 13.803 9.734 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.637 14.664 9.752 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.474 15.049 8.461 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.998 14.218 8.067 1.00 0.00 H new ATOM 260 N VAL A 17 -0.437 10.564 5.250 1.00 0.00 N ATOM 261 CA VAL A 17 0.490 10.253 4.173 1.00 0.00 C ATOM 262 C VAL A 17 0.090 8.933 3.508 1.00 0.00 C ATOM 263 O VAL A 17 0.261 7.855 4.085 1.00 0.00 O ATOM 264 CB VAL A 17 1.932 10.170 4.717 1.00 0.00 C ATOM 265 CG1 VAL A 17 2.949 10.203 3.574 1.00 0.00 C ATOM 266 CG2 VAL A 17 2.302 11.269 5.717 1.00 0.00 C ATOM 0 H VAL A 17 -0.501 9.819 5.944 1.00 0.00 H new ATOM 0 HA VAL A 17 0.450 11.047 3.428 1.00 0.00 H new ATOM 0 HB VAL A 17 1.966 9.221 5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.958 10.143 3.983 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.776 9.357 2.909 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.838 11.132 3.015 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.332 11.131 6.045 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.201 12.244 5.240 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.637 11.216 6.579 1.00 0.00 H new ATOM 276 N ARG A 18 -0.420 8.990 2.277 1.00 0.00 N ATOM 277 CA ARG A 18 -0.868 7.838 1.502 1.00 0.00 C ATOM 278 C ARG A 18 -0.032 7.603 0.241 1.00 0.00 C ATOM 279 O ARG A 18 -0.512 6.962 -0.702 1.00 0.00 O ATOM 280 CB ARG A 18 -2.341 7.986 1.148 1.00 0.00 C ATOM 281 CG ARG A 18 -3.215 8.683 2.191 1.00 0.00 C ATOM 282 CD ARG A 18 -3.400 10.175 1.911 1.00 0.00 C ATOM 283 NE ARG A 18 -4.386 10.737 2.833 1.00 0.00 N ATOM 284 CZ ARG A 18 -4.883 11.971 2.833 1.00 0.00 C ATOM 285 NH1 ARG A 18 -4.707 12.788 1.803 1.00 0.00 N ATOM 286 NH2 ARG A 18 -5.555 12.383 3.897 1.00 0.00 N ATOM 0 H ARG A 18 -0.535 9.872 1.777 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.731 6.959 2.131 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -2.415 8.540 0.212 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.751 6.993 0.964 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -4.192 8.200 2.220 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -2.767 8.556 3.177 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.448 10.695 2.021 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.726 10.323 0.882 1.00 0.00 H new ATOM 0 HE ARG A 18 -4.733 10.111 3.560 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.181 12.474 0.987 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -5.098 13.730 1.827 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -5.682 11.758 4.693 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -5.945 13.325 3.920 1.00 0.00 H new ATOM 300 N GLY A 19 1.189 8.124 0.200 1.00 0.00 N ATOM 301 CA GLY A 19 2.120 7.954 -0.895 1.00 0.00 C ATOM 302 C GLY A 19 3.446 7.451 -0.338 1.00 0.00 C ATOM 303 O GLY A 19 4.247 8.249 0.157 1.00 0.00 O ATOM 0 H GLY A 19 1.565 8.695 0.957 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.723 7.245 -1.622 1.00 0.00 H new ATOM 0 HA3 GLY A 19 2.265 8.899 -1.418 1.00 0.00 H new ATOM 307 N PHE A 20 3.690 6.135 -0.421 1.00 0.00 N ATOM 308 CA PHE A 20 4.970 5.536 -0.031 1.00 0.00 C ATOM 309 C PHE A 20 6.169 6.226 -0.705 1.00 0.00 C ATOM 310 O PHE A 20 7.258 6.227 -0.139 1.00 0.00 O ATOM 311 CB PHE A 20 5.000 4.033 -0.344 1.00 0.00 C ATOM 312 CG PHE A 20 4.264 3.090 0.603 1.00 0.00 C ATOM 313 CD1 PHE A 20 4.763 2.814 1.897 1.00 0.00 C ATOM 314 CD2 PHE A 20 3.143 2.377 0.139 1.00 0.00 C ATOM 315 CE1 PHE A 20 4.140 1.839 2.699 1.00 0.00 C ATOM 316 CE2 PHE A 20 2.543 1.382 0.932 1.00 0.00 C ATOM 317 CZ PHE A 20 3.045 1.110 2.213 1.00 0.00 C ATOM 0 H PHE A 20 3.006 5.459 -0.760 1.00 0.00 H new ATOM 0 HA PHE A 20 5.058 5.681 1.046 1.00 0.00 H new ATOM 0 HB2 PHE A 20 4.588 3.892 -1.343 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.044 3.721 -0.382 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.622 3.351 2.270 1.00 0.00 H new ATOM 0 HD2 PHE A 20 2.738 2.596 -0.838 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.508 1.651 3.697 1.00 0.00 H new ATOM 0 HE2 PHE A 20 1.696 0.828 0.555 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.590 0.343 2.822 1.00 0.00 H new ATOM 327 N GLY A 21 5.976 6.801 -1.892 1.00 0.00 N ATOM 328 CA GLY A 21 6.977 7.511 -2.669 1.00 0.00 C ATOM 329 C GLY A 21 6.269 8.347 -3.722 1.00 0.00 C ATOM 330 O GLY A 21 5.128 8.774 -3.514 1.00 0.00 O ATOM 0 H GLY A 21 5.068 6.780 -2.357 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.577 8.149 -2.020 1.00 0.00 H new ATOM 0 HA3 GLY A 21 7.660 6.805 -3.142 1.00 0.00 H new ATOM 334 N ASP A 22 6.912 8.517 -4.876 1.00 0.00 N ATOM 335 CA ASP A 22 6.406 9.349 -5.973 1.00 0.00 C ATOM 336 C ASP A 22 6.210 8.587 -7.283 1.00 0.00 C ATOM 337 O ASP A 22 5.475 9.049 -8.150 1.00 0.00 O ATOM 338 CB ASP A 22 7.448 10.459 -6.158 1.00 0.00 C ATOM 339 CG ASP A 22 6.894 11.792 -6.631 1.00 0.00 C ATOM 340 OD1 ASP A 22 6.629 11.955 -7.836 1.00 0.00 O ATOM 341 OD2 ASP A 22 6.894 12.714 -5.780 1.00 0.00 O ATOM 0 H ASP A 22 7.809 8.077 -5.081 1.00 0.00 H new ATOM 0 HA ASP A 22 5.416 9.727 -5.719 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.963 10.613 -5.210 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.195 10.119 -6.875 1.00 0.00 H new ATOM 346 N SER A 23 6.797 7.394 -7.423 1.00 0.00 N ATOM 347 CA SER A 23 6.719 6.584 -8.645 1.00 0.00 C ATOM 348 C SER A 23 6.314 5.143 -8.333 1.00 0.00 C ATOM 349 O SER A 23 6.237 4.761 -7.164 1.00 0.00 O ATOM 350 CB SER A 23 8.040 6.703 -9.408 1.00 0.00 C ATOM 351 OG SER A 23 8.187 8.056 -9.802 1.00 0.00 O ATOM 0 H SER A 23 7.346 6.958 -6.683 1.00 0.00 H new ATOM 0 HA SER A 23 5.931 6.963 -9.296 1.00 0.00 H new ATOM 0 HB2 SER A 23 8.875 6.395 -8.779 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.039 6.048 -10.280 1.00 0.00 H new ATOM 0 HG SER A 23 9.028 8.164 -10.293 1.00 0.00 H new ATOM 357 N VAL A 24 5.983 4.344 -9.344 1.00 0.00 N ATOM 358 CA VAL A 24 5.430 3.011 -9.125 1.00 0.00 C ATOM 359 C VAL A 24 6.454 2.143 -8.446 1.00 0.00 C ATOM 360 O VAL A 24 6.164 1.555 -7.404 1.00 0.00 O ATOM 361 CB VAL A 24 4.924 2.372 -10.431 1.00 0.00 C ATOM 362 CG1 VAL A 24 4.197 1.078 -10.144 1.00 0.00 C ATOM 363 CG2 VAL A 24 3.953 3.319 -11.092 1.00 0.00 C ATOM 0 H VAL A 24 6.089 4.598 -10.326 1.00 0.00 H new ATOM 0 HA VAL A 24 4.561 3.105 -8.474 1.00 0.00 H new ATOM 0 HB VAL A 24 5.779 2.171 -11.076 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.847 0.642 -11.080 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.875 0.382 -9.650 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.344 1.276 -9.495 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.587 2.877 -12.019 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.113 3.505 -10.423 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.456 4.260 -11.313 1.00 0.00 H new ATOM 373 N GLU A 25 7.637 2.064 -9.047 1.00 0.00 N ATOM 374 CA GLU A 25 8.640 1.154 -8.551 1.00 0.00 C ATOM 375 C GLU A 25 9.143 1.604 -7.175 1.00 0.00 C ATOM 376 O GLU A 25 9.614 0.785 -6.395 1.00 0.00 O ATOM 377 CB GLU A 25 9.780 1.024 -9.564 1.00 0.00 C ATOM 378 CG GLU A 25 9.332 0.240 -10.812 1.00 0.00 C ATOM 379 CD GLU A 25 10.470 -0.517 -11.505 1.00 0.00 C ATOM 380 OE1 GLU A 25 11.585 0.021 -11.659 1.00 0.00 O ATOM 381 OE2 GLU A 25 10.245 -1.684 -11.912 1.00 0.00 O ATOM 0 H GLU A 25 7.913 2.611 -9.862 1.00 0.00 H new ATOM 0 HA GLU A 25 8.196 0.167 -8.424 1.00 0.00 H new ATOM 0 HB2 GLU A 25 10.123 2.016 -9.858 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.627 0.519 -9.099 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.557 -0.470 -10.525 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.882 0.933 -11.523 1.00 0.00 H new ATOM 388 N GLU A 26 9.035 2.898 -6.867 1.00 0.00 N ATOM 389 CA GLU A 26 9.277 3.456 -5.539 1.00 0.00 C ATOM 390 C GLU A 26 8.313 2.818 -4.542 1.00 0.00 C ATOM 391 O GLU A 26 8.730 2.057 -3.674 1.00 0.00 O ATOM 392 CB GLU A 26 9.151 4.987 -5.541 1.00 0.00 C ATOM 393 CG GLU A 26 10.189 5.650 -6.445 1.00 0.00 C ATOM 394 CD GLU A 26 11.579 5.556 -5.835 1.00 0.00 C ATOM 395 OE1 GLU A 26 12.269 4.540 -6.090 1.00 0.00 O ATOM 396 OE2 GLU A 26 11.950 6.477 -5.076 1.00 0.00 O ATOM 0 H GLU A 26 8.770 3.604 -7.554 1.00 0.00 H new ATOM 0 HA GLU A 26 10.300 3.227 -5.240 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.151 5.267 -5.872 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.266 5.361 -4.524 1.00 0.00 H new ATOM 0 HG2 GLU A 26 10.184 5.171 -7.424 1.00 0.00 H new ATOM 0 HG3 GLU A 26 9.926 6.696 -6.601 1.00 0.00 H new ATOM 403 N ALA A 27 7.012 3.095 -4.695 1.00 0.00 N ATOM 404 CA ALA A 27 5.991 2.656 -3.751 1.00 0.00 C ATOM 405 C ALA A 27 6.000 1.136 -3.590 1.00 0.00 C ATOM 406 O ALA A 27 5.846 0.650 -2.476 1.00 0.00 O ATOM 407 CB ALA A 27 4.605 3.089 -4.231 1.00 0.00 C ATOM 0 H ALA A 27 6.643 3.631 -5.480 1.00 0.00 H new ATOM 0 HA ALA A 27 6.216 3.117 -2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 27 3.852 2.755 -3.517 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.571 4.175 -4.312 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.403 2.646 -5.206 1.00 0.00 H new ATOM 413 N LEU A 28 6.159 0.384 -4.682 1.00 0.00 N ATOM 414 CA LEU A 28 6.217 -1.076 -4.638 1.00 0.00 C ATOM 415 C LEU A 28 7.378 -1.562 -3.752 1.00 0.00 C ATOM 416 O LEU A 28 7.201 -2.479 -2.947 1.00 0.00 O ATOM 417 CB LEU A 28 6.320 -1.641 -6.071 1.00 0.00 C ATOM 418 CG LEU A 28 5.384 -2.837 -6.315 1.00 0.00 C ATOM 419 CD1 LEU A 28 5.412 -3.231 -7.795 1.00 0.00 C ATOM 420 CD2 LEU A 28 5.734 -4.060 -5.465 1.00 0.00 C ATOM 0 H LEU A 28 6.251 0.772 -5.621 1.00 0.00 H new ATOM 0 HA LEU A 28 5.297 -1.449 -4.188 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.085 -0.851 -6.785 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.349 -1.947 -6.262 1.00 0.00 H new ATOM 0 HG LEU A 28 4.386 -2.512 -6.021 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.746 -4.079 -7.959 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.082 -2.388 -8.402 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.428 -3.507 -8.079 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.036 -4.868 -5.685 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.749 -4.385 -5.695 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.667 -3.800 -4.409 1.00 0.00 H new ATOM 432 N SER A 29 8.555 -0.938 -3.881 1.00 0.00 N ATOM 433 CA SER A 29 9.730 -1.249 -3.080 1.00 0.00 C ATOM 434 C SER A 29 9.486 -0.932 -1.613 1.00 0.00 C ATOM 435 O SER A 29 9.811 -1.730 -0.729 1.00 0.00 O ATOM 436 CB SER A 29 10.912 -0.408 -3.562 1.00 0.00 C ATOM 437 OG SER A 29 12.134 -1.089 -3.352 1.00 0.00 O ATOM 0 H SER A 29 8.713 -0.192 -4.558 1.00 0.00 H new ATOM 0 HA SER A 29 9.943 -2.313 -3.189 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.794 -0.182 -4.622 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.926 0.545 -3.032 1.00 0.00 H new ATOM 0 HG SER A 29 12.021 -1.752 -2.640 1.00 0.00 H new ATOM 443 N GLU A 30 8.942 0.245 -1.337 1.00 0.00 N ATOM 444 CA GLU A 30 8.704 0.636 0.031 1.00 0.00 C ATOM 445 C GLU A 30 7.651 -0.275 0.632 1.00 0.00 C ATOM 446 O GLU A 30 7.812 -0.689 1.769 1.00 0.00 O ATOM 447 CB GLU A 30 8.159 2.052 0.070 1.00 0.00 C ATOM 448 CG GLU A 30 9.100 3.139 -0.424 1.00 0.00 C ATOM 449 CD GLU A 30 10.479 3.029 0.213 1.00 0.00 C ATOM 450 OE1 GLU A 30 10.574 3.283 1.435 1.00 0.00 O ATOM 451 OE2 GLU A 30 11.446 2.701 -0.511 1.00 0.00 O ATOM 0 H GLU A 30 8.663 0.933 -2.037 1.00 0.00 H new ATOM 0 HA GLU A 30 9.640 0.572 0.586 1.00 0.00 H new ATOM 0 HB2 GLU A 30 7.249 2.087 -0.528 1.00 0.00 H new ATOM 0 HB3 GLU A 30 7.875 2.283 1.097 1.00 0.00 H new ATOM 0 HG2 GLU A 30 9.194 3.072 -1.508 1.00 0.00 H new ATOM 0 HG3 GLU A 30 8.674 4.117 -0.201 1.00 0.00 H new ATOM 458 N ALA A 31 6.595 -0.610 -0.106 1.00 0.00 N ATOM 459 CA ALA A 31 5.508 -1.438 0.366 1.00 0.00 C ATOM 460 C ALA A 31 6.053 -2.766 0.874 1.00 0.00 C ATOM 461 O ALA A 31 5.787 -3.118 2.018 1.00 0.00 O ATOM 462 CB ALA A 31 4.479 -1.616 -0.745 1.00 0.00 C ATOM 0 H ALA A 31 6.477 -0.301 -1.071 1.00 0.00 H new ATOM 0 HA ALA A 31 5.003 -0.955 1.203 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.661 -2.241 -0.386 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.089 -0.642 -1.040 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.950 -2.093 -1.604 1.00 0.00 H new ATOM 468 N ARG A 32 6.860 -3.482 0.084 1.00 0.00 N ATOM 469 CA ARG A 32 7.469 -4.738 0.538 1.00 0.00 C ATOM 470 C ARG A 32 8.299 -4.556 1.787 1.00 0.00 C ATOM 471 O ARG A 32 8.254 -5.391 2.692 1.00 0.00 O ATOM 472 CB ARG A 32 8.264 -5.387 -0.595 1.00 0.00 C ATOM 473 CG ARG A 32 9.529 -4.690 -1.093 1.00 0.00 C ATOM 474 CD ARG A 32 10.306 -5.550 -2.088 1.00 0.00 C ATOM 475 NE ARG A 32 11.255 -4.721 -2.846 1.00 0.00 N ATOM 476 CZ ARG A 32 11.388 -4.683 -4.178 1.00 0.00 C ATOM 477 NH1 ARG A 32 10.894 -5.663 -4.927 1.00 0.00 N ATOM 478 NH2 ARG A 32 11.986 -3.643 -4.744 1.00 0.00 N ATOM 0 H ARG A 32 7.106 -3.215 -0.869 1.00 0.00 H new ATOM 0 HA ARG A 32 6.663 -5.418 0.814 1.00 0.00 H new ATOM 0 HB2 ARG A 32 8.544 -6.389 -0.271 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.593 -5.503 -1.446 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.260 -3.745 -1.565 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.169 -4.451 -0.244 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.843 -6.337 -1.558 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.614 -6.041 -2.772 1.00 0.00 H new ATOM 0 HE ARG A 32 11.872 -4.116 -2.304 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.412 -6.447 -4.488 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.997 -5.631 -5.941 1.00 0.00 H new ATOM 0 HH21 ARG A 32 12.340 -2.881 -4.165 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.092 -3.605 -5.758 1.00 0.00 H new ATOM 492 N GLU A 33 9.017 -3.449 1.856 1.00 0.00 N ATOM 493 CA GLU A 33 9.891 -3.165 2.954 1.00 0.00 C ATOM 494 C GLU A 33 9.054 -2.848 4.210 1.00 0.00 C ATOM 495 O GLU A 33 9.336 -3.373 5.286 1.00 0.00 O ATOM 496 CB GLU A 33 10.844 -2.060 2.467 1.00 0.00 C ATOM 497 CG GLU A 33 11.317 -1.128 3.561 1.00 0.00 C ATOM 498 CD GLU A 33 12.694 -0.514 3.274 1.00 0.00 C ATOM 499 OE1 GLU A 33 13.691 -1.275 3.293 1.00 0.00 O ATOM 500 OE2 GLU A 33 12.807 0.716 3.102 1.00 0.00 O ATOM 0 H GLU A 33 9.002 -2.723 1.140 1.00 0.00 H new ATOM 0 HA GLU A 33 10.510 -4.006 3.266 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.712 -2.524 1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.341 -1.474 1.697 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.588 -0.328 3.689 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.359 -1.675 4.503 1.00 0.00 H new ATOM 507 N HIS A 34 7.989 -2.055 4.107 1.00 0.00 N ATOM 508 CA HIS A 34 7.124 -1.703 5.222 1.00 0.00 C ATOM 509 C HIS A 34 6.350 -2.944 5.665 1.00 0.00 C ATOM 510 O HIS A 34 6.186 -3.166 6.859 1.00 0.00 O ATOM 511 CB HIS A 34 6.164 -0.566 4.839 1.00 0.00 C ATOM 512 CG HIS A 34 6.800 0.800 4.719 1.00 0.00 C ATOM 513 ND1 HIS A 34 7.676 1.222 3.747 1.00 0.00 N ATOM 514 CD2 HIS A 34 6.477 1.901 5.462 1.00 0.00 C ATOM 515 CE1 HIS A 34 7.870 2.543 3.889 1.00 0.00 C ATOM 516 NE2 HIS A 34 7.186 2.990 4.957 1.00 0.00 N ATOM 0 H HIS A 34 7.701 -1.632 3.225 1.00 0.00 H new ATOM 0 HA HIS A 34 7.736 -1.345 6.050 1.00 0.00 H new ATOM 0 HB2 HIS A 34 5.693 -0.815 3.888 1.00 0.00 H new ATOM 0 HB3 HIS A 34 5.370 -0.515 5.584 1.00 0.00 H new ATOM 0 HD1 HIS A 34 8.107 0.630 3.037 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.791 1.923 6.296 1.00 0.00 H new ATOM 0 HE1 HIS A 34 8.483 3.154 3.243 1.00 0.00 H new ATOM 524 N LEU A 35 5.919 -3.805 4.738 1.00 0.00 N ATOM 525 CA LEU A 35 5.264 -5.072 5.055 1.00 0.00 C ATOM 526 C LEU A 35 6.222 -6.025 5.782 1.00 0.00 C ATOM 527 O LEU A 35 5.767 -6.862 6.567 1.00 0.00 O ATOM 528 CB LEU A 35 4.746 -5.752 3.772 1.00 0.00 C ATOM 529 CG LEU A 35 3.561 -5.068 3.068 1.00 0.00 C ATOM 530 CD1 LEU A 35 3.320 -5.733 1.709 1.00 0.00 C ATOM 531 CD2 LEU A 35 2.280 -5.145 3.886 1.00 0.00 C ATOM 0 H LEU A 35 6.017 -3.638 3.737 1.00 0.00 H new ATOM 0 HA LEU A 35 4.423 -4.849 5.712 1.00 0.00 H new ATOM 0 HB2 LEU A 35 5.572 -5.820 3.064 1.00 0.00 H new ATOM 0 HB3 LEU A 35 4.454 -6.772 4.020 1.00 0.00 H new ATOM 0 HG LEU A 35 3.820 -4.016 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.481 -5.248 1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.214 -5.635 1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.094 -6.789 1.856 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.473 -4.648 3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.016 -6.190 4.052 1.00 0.00 H new ATOM 0 HD23 LEU A 35 2.431 -4.652 4.846 1.00 0.00 H new ATOM 543 N LYS A 36 7.535 -5.947 5.537 1.00 0.00 N ATOM 544 CA LYS A 36 8.557 -6.695 6.242 1.00 0.00 C ATOM 545 C LYS A 36 8.757 -6.104 7.639 1.00 0.00 C ATOM 546 O LYS A 36 8.759 -6.857 8.617 1.00 0.00 O ATOM 547 CB LYS A 36 9.807 -6.692 5.348 1.00 0.00 C ATOM 548 CG LYS A 36 10.986 -7.450 5.954 1.00 0.00 C ATOM 549 CD LYS A 36 11.745 -8.334 4.950 1.00 0.00 C ATOM 550 CE LYS A 36 12.196 -7.607 3.675 1.00 0.00 C ATOM 551 NZ LYS A 36 13.299 -6.646 3.874 1.00 0.00 N ATOM 0 H LYS A 36 7.918 -5.337 4.815 1.00 0.00 H new ATOM 0 HA LYS A 36 8.282 -7.735 6.420 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.557 -7.135 4.384 1.00 0.00 H new ATOM 0 HB3 LYS A 36 10.106 -5.661 5.157 1.00 0.00 H new ATOM 0 HG2 LYS A 36 11.682 -6.732 6.388 1.00 0.00 H new ATOM 0 HG3 LYS A 36 10.622 -8.075 6.770 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.622 -8.752 5.444 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.107 -9.172 4.669 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.506 -8.349 2.940 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.342 -7.078 3.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.540 -6.201 2.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.003 -5.913 4.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 14.132 -7.145 4.247 1.00 0.00 H new ATOM 565 N ASN A 37 8.866 -4.778 7.757 1.00 0.00 N ATOM 566 CA ASN A 37 8.971 -4.070 9.040 1.00 0.00 C ATOM 567 C ASN A 37 7.705 -4.229 9.896 1.00 0.00 C ATOM 568 O ASN A 37 7.779 -4.159 11.121 1.00 0.00 O ATOM 569 CB ASN A 37 9.200 -2.568 8.821 1.00 0.00 C ATOM 570 CG ASN A 37 10.633 -2.203 8.471 1.00 0.00 C ATOM 571 OD1 ASN A 37 11.460 -1.988 9.351 1.00 0.00 O ATOM 572 ND2 ASN A 37 10.940 -2.115 7.192 1.00 0.00 N ATOM 0 H ASN A 37 8.884 -4.154 6.951 1.00 0.00 H new ATOM 0 HA ASN A 37 9.818 -4.516 9.561 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.543 -2.224 8.022 1.00 0.00 H new ATOM 0 HB3 ASN A 37 8.910 -2.032 9.725 1.00 0.00 H new ATOM 0 HD21 ASN A 37 11.887 -1.862 6.911 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.230 -2.300 6.483 1.00 0.00 H new ATOM 579 N GLY A 38 6.540 -4.424 9.275 1.00 0.00 N ATOM 580 CA GLY A 38 5.230 -4.385 9.916 1.00 0.00 C ATOM 581 C GLY A 38 4.622 -2.976 9.939 1.00 0.00 C ATOM 582 O GLY A 38 3.566 -2.778 10.537 1.00 0.00 O ATOM 0 H GLY A 38 6.484 -4.620 8.276 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.553 -5.059 9.391 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.319 -4.754 10.938 1.00 0.00 H new ATOM 586 N THR A 39 5.245 -1.981 9.310 1.00 0.00 N ATOM 587 CA THR A 39 4.880 -0.566 9.362 1.00 0.00 C ATOM 588 C THR A 39 3.963 -0.191 8.198 1.00 0.00 C ATOM 589 O THR A 39 4.059 0.893 7.627 1.00 0.00 O ATOM 590 CB THR A 39 6.183 0.253 9.413 1.00 0.00 C ATOM 591 OG1 THR A 39 7.085 -0.163 8.406 1.00 0.00 O ATOM 592 CG2 THR A 39 6.885 0.054 10.757 1.00 0.00 C ATOM 0 H THR A 39 6.060 -2.148 8.720 1.00 0.00 H new ATOM 0 HA THR A 39 4.299 -0.343 10.257 1.00 0.00 H new ATOM 0 HB THR A 39 5.909 1.298 9.267 1.00 0.00 H new ATOM 0 HG1 THR A 39 7.904 0.373 8.458 1.00 0.00 H new ATOM 0 HG21 THR A 39 7.804 0.639 10.778 1.00 0.00 H new ATOM 0 HG22 THR A 39 6.228 0.382 11.563 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.124 -1.001 10.890 1.00 0.00 H new ATOM 600 N CYS A 40 3.026 -1.068 7.842 1.00 0.00 N ATOM 601 CA CYS A 40 2.090 -0.851 6.753 1.00 0.00 C ATOM 602 C CYS A 40 0.671 -1.020 7.297 1.00 0.00 C ATOM 603 O CYS A 40 0.459 -1.711 8.294 1.00 0.00 O ATOM 604 CB CYS A 40 2.476 -1.791 5.605 1.00 0.00 C ATOM 605 SG CYS A 40 1.325 -1.725 4.207 1.00 0.00 S ATOM 0 H CYS A 40 2.898 -1.963 8.314 1.00 0.00 H new ATOM 0 HA CYS A 40 2.127 0.157 6.341 1.00 0.00 H new ATOM 0 HB2 CYS A 40 3.476 -1.535 5.256 1.00 0.00 H new ATOM 0 HB3 CYS A 40 2.522 -2.813 5.981 1.00 0.00 H new ATOM 0 HG CYS A 40 0.830 -0.527 4.109 1.00 0.00 H new ATOM 611 N GLY A 41 -0.293 -0.372 6.649 1.00 0.00 N ATOM 612 CA GLY A 41 -1.713 -0.454 6.916 1.00 0.00 C ATOM 613 C GLY A 41 -2.488 -0.471 5.593 1.00 0.00 C ATOM 614 O GLY A 41 -1.891 -0.401 4.514 1.00 0.00 O ATOM 0 H GLY A 41 -0.083 0.261 5.877 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -1.934 -1.354 7.489 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.028 0.395 7.522 1.00 0.00 H new ATOM 618 N LEU A 42 -3.815 -0.574 5.666 1.00 0.00 N ATOM 619 CA LEU A 42 -4.725 -0.750 4.538 1.00 0.00 C ATOM 620 C LEU A 42 -5.784 0.345 4.557 1.00 0.00 C ATOM 621 O LEU A 42 -6.214 0.808 5.614 1.00 0.00 O ATOM 622 CB LEU A 42 -5.382 -2.147 4.649 1.00 0.00 C ATOM 623 CG LEU A 42 -6.335 -2.525 3.491 1.00 0.00 C ATOM 624 CD1 LEU A 42 -5.557 -2.787 2.197 1.00 0.00 C ATOM 625 CD2 LEU A 42 -7.194 -3.751 3.821 1.00 0.00 C ATOM 0 H LEU A 42 -4.307 -0.535 6.559 1.00 0.00 H new ATOM 0 HA LEU A 42 -4.180 -0.680 3.597 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -4.593 -2.897 4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.938 -2.195 5.585 1.00 0.00 H new ATOM 0 HG LEU A 42 -6.998 -1.671 3.350 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -6.253 -3.050 1.401 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -5.007 -1.889 1.915 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.857 -3.608 2.353 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.846 -3.976 2.977 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.547 -4.606 4.018 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.800 -3.544 4.703 1.00 0.00 H new ATOM 637 N VAL A 43 -6.272 0.682 3.372 1.00 0.00 N ATOM 638 CA VAL A 43 -7.451 1.484 3.128 1.00 0.00 C ATOM 639 C VAL A 43 -8.219 0.720 2.049 1.00 0.00 C ATOM 640 O VAL A 43 -7.635 0.420 1.003 1.00 0.00 O ATOM 641 CB VAL A 43 -6.980 2.867 2.644 1.00 0.00 C ATOM 642 CG1 VAL A 43 -8.176 3.741 2.256 1.00 0.00 C ATOM 643 CG2 VAL A 43 -6.119 3.639 3.658 1.00 0.00 C ATOM 0 H VAL A 43 -5.824 0.382 2.506 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.085 1.643 4.000 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.348 2.658 1.781 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.821 4.714 1.917 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -8.734 3.259 1.454 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.826 3.873 3.121 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.832 4.601 3.234 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.691 3.801 4.572 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.223 3.062 3.888 1.00 0.00 H new ATOM 653 N GLU A 44 -9.492 0.363 2.251 1.00 0.00 N ATOM 654 CA GLU A 44 -10.258 -0.266 1.174 1.00 0.00 C ATOM 655 C GLU A 44 -10.626 0.762 0.114 1.00 0.00 C ATOM 656 O GLU A 44 -10.550 1.976 0.317 1.00 0.00 O ATOM 657 CB GLU A 44 -11.502 -1.021 1.652 1.00 0.00 C ATOM 658 CG GLU A 44 -11.076 -2.079 2.665 1.00 0.00 C ATOM 659 CD GLU A 44 -12.097 -3.194 2.903 1.00 0.00 C ATOM 660 OE1 GLU A 44 -13.190 -3.222 2.296 1.00 0.00 O ATOM 661 OE2 GLU A 44 -11.777 -4.115 3.687 1.00 0.00 O ATOM 0 H GLU A 44 -10.001 0.494 3.125 1.00 0.00 H new ATOM 0 HA GLU A 44 -9.603 -1.022 0.740 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -12.212 -0.329 2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -12.007 -1.489 0.807 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -10.142 -2.528 2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -10.869 -1.588 3.616 1.00 0.00 H new ATOM 668 N LEU A 45 -10.961 0.252 -1.059 1.00 0.00 N ATOM 669 CA LEU A 45 -11.259 1.098 -2.217 1.00 0.00 C ATOM 670 C LEU A 45 -12.736 1.436 -2.264 1.00 0.00 C ATOM 671 O LEU A 45 -13.580 0.543 -2.280 1.00 0.00 O ATOM 672 CB LEU A 45 -10.813 0.462 -3.538 1.00 0.00 C ATOM 673 CG LEU A 45 -9.335 0.742 -3.846 1.00 0.00 C ATOM 674 CD1 LEU A 45 -8.928 -0.122 -5.038 1.00 0.00 C ATOM 675 CD2 LEU A 45 -9.064 2.218 -4.188 1.00 0.00 C ATOM 0 H LEU A 45 -11.035 -0.749 -1.241 1.00 0.00 H new ATOM 0 HA LEU A 45 -10.686 2.017 -2.095 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -10.976 -0.615 -3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -11.431 0.845 -4.350 1.00 0.00 H new ATOM 0 HG LEU A 45 -8.756 0.507 -2.953 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.880 0.059 -5.277 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -9.067 -1.174 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -9.546 0.132 -5.899 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.003 2.354 -4.396 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.645 2.501 -5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -9.352 2.846 -3.345 1.00 0.00 H new ATOM 687 N GLU A 46 -13.043 2.726 -2.345 1.00 0.00 N ATOM 688 CA GLU A 46 -14.382 3.257 -2.551 1.00 0.00 C ATOM 689 C GLU A 46 -14.254 4.431 -3.528 1.00 0.00 C ATOM 690 O GLU A 46 -13.135 4.892 -3.790 1.00 0.00 O ATOM 691 CB GLU A 46 -15.000 3.706 -1.216 1.00 0.00 C ATOM 692 CG GLU A 46 -14.965 2.626 -0.123 1.00 0.00 C ATOM 693 CD GLU A 46 -15.616 3.049 1.192 1.00 0.00 C ATOM 694 OE1 GLU A 46 -16.038 4.221 1.330 1.00 0.00 O ATOM 695 OE2 GLU A 46 -15.698 2.212 2.117 1.00 0.00 O ATOM 0 H GLU A 46 -12.337 3.458 -2.266 1.00 0.00 H new ATOM 0 HA GLU A 46 -15.044 2.494 -2.960 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.469 4.589 -0.859 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.035 4.004 -1.387 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -15.467 1.733 -0.494 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.928 2.352 0.069 1.00 0.00 H new ATOM 702 N LYS A 47 -15.378 4.920 -4.062 1.00 0.00 N ATOM 703 CA LYS A 47 -15.444 5.864 -5.181 1.00 0.00 C ATOM 704 C LYS A 47 -14.418 6.985 -5.056 1.00 0.00 C ATOM 705 O LYS A 47 -13.552 7.110 -5.920 1.00 0.00 O ATOM 706 CB LYS A 47 -16.879 6.408 -5.321 1.00 0.00 C ATOM 707 CG LYS A 47 -17.066 7.293 -6.569 1.00 0.00 C ATOM 708 CD LYS A 47 -18.518 7.770 -6.745 1.00 0.00 C ATOM 709 CE LYS A 47 -18.817 8.907 -5.764 1.00 0.00 C ATOM 710 NZ LYS A 47 -20.251 9.261 -5.684 1.00 0.00 N ATOM 0 H LYS A 47 -16.300 4.659 -3.713 1.00 0.00 H new ATOM 0 HA LYS A 47 -15.186 5.327 -6.094 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -17.576 5.572 -5.367 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -17.132 6.985 -4.431 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -16.409 8.160 -6.497 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -16.761 6.735 -7.454 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -18.676 8.110 -7.768 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.205 6.941 -6.575 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.466 8.621 -4.772 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -18.250 9.789 -6.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -20.380 10.036 -5.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -20.587 9.564 -6.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -20.796 8.432 -5.372 1.00 0.00 H new ATOM 724 N GLY A 48 -14.493 7.786 -3.997 1.00 0.00 N ATOM 725 CA GLY A 48 -13.753 9.028 -3.886 1.00 0.00 C ATOM 726 C GLY A 48 -12.412 8.895 -3.185 1.00 0.00 C ATOM 727 O GLY A 48 -11.880 9.917 -2.753 1.00 0.00 O ATOM 0 H GLY A 48 -15.077 7.584 -3.186 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -13.589 9.430 -4.886 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -14.362 9.753 -3.346 1.00 0.00 H new ATOM 731 N VAL A 49 -11.867 7.684 -3.042 1.00 0.00 N ATOM 732 CA VAL A 49 -10.662 7.447 -2.254 1.00 0.00 C ATOM 733 C VAL A 49 -9.417 7.926 -3.001 1.00 0.00 C ATOM 734 O VAL A 49 -8.688 8.761 -2.472 1.00 0.00 O ATOM 735 CB VAL A 49 -10.620 5.972 -1.807 1.00 0.00 C ATOM 736 CG1 VAL A 49 -9.331 5.613 -1.069 1.00 0.00 C ATOM 737 CG2 VAL A 49 -11.787 5.672 -0.849 1.00 0.00 C ATOM 0 H VAL A 49 -12.251 6.842 -3.471 1.00 0.00 H new ATOM 0 HA VAL A 49 -10.681 8.042 -1.341 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.685 5.382 -2.721 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -9.358 4.563 -0.779 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.477 5.787 -1.723 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -9.237 6.233 -0.178 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -11.746 4.627 -0.541 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.710 6.313 0.030 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -12.733 5.863 -1.356 1.00 0.00 H new ATOM 747 N LEU A 50 -9.212 7.436 -4.225 1.00 0.00 N ATOM 748 CA LEU A 50 -8.055 7.679 -5.092 1.00 0.00 C ATOM 749 C LEU A 50 -7.676 9.164 -5.199 1.00 0.00 C ATOM 750 O LEU A 50 -6.513 9.449 -4.925 1.00 0.00 O ATOM 751 CB LEU A 50 -8.363 7.064 -6.468 1.00 0.00 C ATOM 752 CG LEU A 50 -8.100 5.548 -6.618 1.00 0.00 C ATOM 753 CD1 LEU A 50 -7.980 5.180 -8.098 1.00 0.00 C ATOM 754 CD2 LEU A 50 -6.866 5.019 -5.886 1.00 0.00 C ATOM 0 H LEU A 50 -9.893 6.819 -4.667 1.00 0.00 H new ATOM 0 HA LEU A 50 -7.178 7.205 -4.652 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.411 7.253 -6.700 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.771 7.589 -7.217 1.00 0.00 H new ATOM 0 HG LEU A 50 -8.961 5.074 -6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.795 4.110 -8.193 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.906 5.435 -8.613 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.153 5.732 -8.544 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.774 3.946 -6.057 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -5.976 5.524 -6.261 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.967 5.209 -4.818 1.00 0.00 H new ATOM 766 N PRO A 51 -8.554 10.129 -5.540 1.00 0.00 N ATOM 767 CA PRO A 51 -8.137 11.509 -5.814 1.00 0.00 C ATOM 768 C PRO A 51 -7.976 12.332 -4.518 1.00 0.00 C ATOM 769 O PRO A 51 -8.357 13.503 -4.430 1.00 0.00 O ATOM 770 CB PRO A 51 -9.222 12.024 -6.764 1.00 0.00 C ATOM 771 CG PRO A 51 -10.484 11.350 -6.237 1.00 0.00 C ATOM 772 CD PRO A 51 -9.991 9.999 -5.719 1.00 0.00 C ATOM 0 HA PRO A 51 -7.148 11.588 -6.266 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -9.302 13.111 -6.735 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -9.018 11.747 -7.798 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -10.949 11.936 -5.444 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -11.230 11.229 -7.023 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.478 9.742 -4.778 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -10.224 9.203 -6.426 1.00 0.00 H new ATOM 780 N GLN A 52 -7.353 11.712 -3.520 1.00 0.00 N ATOM 781 CA GLN A 52 -6.945 12.213 -2.209 1.00 0.00 C ATOM 782 C GLN A 52 -5.564 11.638 -1.846 1.00 0.00 C ATOM 783 O GLN A 52 -4.866 12.158 -0.968 1.00 0.00 O ATOM 784 CB GLN A 52 -7.936 11.733 -1.138 1.00 0.00 C ATOM 785 CG GLN A 52 -9.419 11.894 -1.485 1.00 0.00 C ATOM 786 CD GLN A 52 -10.254 11.472 -0.283 1.00 0.00 C ATOM 787 OE1 GLN A 52 -10.664 12.272 0.550 1.00 0.00 O ATOM 788 NE2 GLN A 52 -10.409 10.179 -0.084 1.00 0.00 N ATOM 0 H GLN A 52 -7.091 10.732 -3.622 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.916 13.302 -2.247 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.742 10.680 -0.935 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.737 12.277 -0.215 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -9.634 12.929 -1.749 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -9.672 11.285 -2.353 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.068 9.512 -0.776 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.870 9.845 0.762 1.00 0.00 H new ATOM 797 N LEU A 53 -5.185 10.542 -2.501 1.00 0.00 N ATOM 798 CA LEU A 53 -3.910 9.857 -2.429 1.00 0.00 C ATOM 799 C LEU A 53 -2.924 10.631 -3.299 1.00 0.00 C ATOM 800 O LEU A 53 -3.284 11.654 -3.881 1.00 0.00 O ATOM 801 CB LEU A 53 -4.133 8.410 -2.885 1.00 0.00 C ATOM 802 CG LEU A 53 -5.251 7.643 -2.162 1.00 0.00 C ATOM 803 CD1 LEU A 53 -5.457 6.273 -2.799 1.00 0.00 C ATOM 804 CD2 LEU A 53 -4.961 7.431 -0.688 1.00 0.00 C ATOM 0 H LEU A 53 -5.821 10.077 -3.149 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.494 9.817 -1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.354 8.416 -3.952 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.200 7.861 -2.756 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.146 8.258 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.252 5.744 -2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -5.733 6.396 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.533 5.698 -2.732 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.785 6.884 -0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.040 6.859 -0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.849 8.397 -0.196 1.00 0.00 H new ATOM 816 N GLU A 54 -1.674 10.171 -3.355 1.00 0.00 N ATOM 817 CA GLU A 54 -0.727 10.717 -4.302 1.00 0.00 C ATOM 818 C GLU A 54 -1.073 10.157 -5.668 1.00 0.00 C ATOM 819 O GLU A 54 -1.973 10.685 -6.320 1.00 0.00 O ATOM 820 CB GLU A 54 0.719 10.477 -3.836 1.00 0.00 C ATOM 821 CG GLU A 54 1.133 11.304 -2.612 1.00 0.00 C ATOM 822 CD GLU A 54 1.094 12.831 -2.774 1.00 0.00 C ATOM 823 OE1 GLU A 54 1.125 13.360 -3.911 1.00 0.00 O ATOM 824 OE2 GLU A 54 1.065 13.519 -1.727 1.00 0.00 O ATOM 0 H GLU A 54 -1.305 9.430 -2.759 1.00 0.00 H new ATOM 0 HA GLU A 54 -0.796 11.803 -4.370 1.00 0.00 H new ATOM 0 HB2 GLU A 54 0.843 9.419 -3.604 1.00 0.00 H new ATOM 0 HB3 GLU A 54 1.396 10.704 -4.659 1.00 0.00 H new ATOM 0 HG2 GLU A 54 0.483 11.032 -1.780 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.146 11.016 -2.332 1.00 0.00 H new ATOM 831 N GLN A 55 -0.418 9.087 -6.104 1.00 0.00 N ATOM 832 CA GLN A 55 -0.620 8.604 -7.455 1.00 0.00 C ATOM 833 C GLN A 55 -0.225 7.146 -7.646 1.00 0.00 C ATOM 834 O GLN A 55 -1.052 6.418 -8.182 1.00 0.00 O ATOM 835 CB GLN A 55 0.079 9.507 -8.491 1.00 0.00 C ATOM 836 CG GLN A 55 -0.822 10.525 -9.216 1.00 0.00 C ATOM 837 CD GLN A 55 -2.140 9.960 -9.717 1.00 0.00 C ATOM 838 OE1 GLN A 55 -3.170 10.630 -9.752 1.00 0.00 O ATOM 839 NE2 GLN A 55 -2.144 8.707 -10.126 1.00 0.00 N ATOM 0 H GLN A 55 0.246 8.548 -5.548 1.00 0.00 H new ATOM 0 HA GLN A 55 -1.695 8.653 -7.625 1.00 0.00 H new ATOM 0 HB2 GLN A 55 0.878 10.052 -7.988 1.00 0.00 H new ATOM 0 HB3 GLN A 55 0.550 8.870 -9.240 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -1.031 11.353 -8.538 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -0.273 10.937 -10.063 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -1.285 8.157 -10.094 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -3.006 8.287 -10.475 1.00 0.00 H new ATOM 848 N PRO A 56 0.997 6.687 -7.323 1.00 0.00 N ATOM 849 CA PRO A 56 1.308 5.265 -7.363 1.00 0.00 C ATOM 850 C PRO A 56 0.549 4.527 -6.260 1.00 0.00 C ATOM 851 O PRO A 56 1.039 4.369 -5.137 1.00 0.00 O ATOM 852 CB PRO A 56 2.827 5.134 -7.280 1.00 0.00 C ATOM 853 CG PRO A 56 3.360 6.559 -7.431 1.00 0.00 C ATOM 854 CD PRO A 56 2.195 7.486 -7.120 1.00 0.00 C ATOM 0 HA PRO A 56 0.979 4.794 -8.290 1.00 0.00 H new ATOM 0 HB2 PRO A 56 3.133 4.697 -6.329 1.00 0.00 H new ATOM 0 HB3 PRO A 56 3.210 4.485 -8.067 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.191 6.737 -6.749 1.00 0.00 H new ATOM 0 HG3 PRO A 56 3.734 6.729 -8.441 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.251 7.856 -6.096 1.00 0.00 H new ATOM 0 HD3 PRO A 56 2.201 8.357 -7.775 1.00 0.00 H new ATOM 862 N TYR A 57 -0.682 4.129 -6.552 1.00 0.00 N ATOM 863 CA TYR A 57 -1.555 3.483 -5.581 1.00 0.00 C ATOM 864 C TYR A 57 -1.147 2.011 -5.469 1.00 0.00 C ATOM 865 O TYR A 57 -1.279 1.264 -6.440 1.00 0.00 O ATOM 866 CB TYR A 57 -3.023 3.628 -6.002 1.00 0.00 C ATOM 867 CG TYR A 57 -3.417 5.000 -6.520 1.00 0.00 C ATOM 868 CD1 TYR A 57 -3.270 6.151 -5.712 1.00 0.00 C ATOM 869 CD2 TYR A 57 -3.898 5.111 -7.839 1.00 0.00 C ATOM 870 CE1 TYR A 57 -3.635 7.420 -6.206 1.00 0.00 C ATOM 871 CE2 TYR A 57 -4.241 6.378 -8.348 1.00 0.00 C ATOM 872 CZ TYR A 57 -4.142 7.518 -7.519 1.00 0.00 C ATOM 873 OH TYR A 57 -4.551 8.709 -8.019 1.00 0.00 O ATOM 0 H TYR A 57 -1.105 4.246 -7.473 1.00 0.00 H new ATOM 0 HA TYR A 57 -1.452 3.959 -4.606 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -3.236 2.891 -6.776 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.655 3.385 -5.147 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.876 6.058 -4.711 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -4.003 4.231 -8.456 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -3.528 8.301 -5.591 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -4.579 6.478 -9.369 1.00 0.00 H new ATOM 0 HH TYR A 57 -4.869 8.586 -8.938 1.00 0.00 H new ATOM 883 N VAL A 58 -0.605 1.602 -4.318 1.00 0.00 N ATOM 884 CA VAL A 58 -0.188 0.222 -4.066 1.00 0.00 C ATOM 885 C VAL A 58 -1.418 -0.639 -3.807 1.00 0.00 C ATOM 886 O VAL A 58 -1.859 -0.753 -2.663 1.00 0.00 O ATOM 887 CB VAL A 58 0.800 0.139 -2.889 1.00 0.00 C ATOM 888 CG1 VAL A 58 1.319 -1.289 -2.662 1.00 0.00 C ATOM 889 CG2 VAL A 58 2.009 1.018 -3.157 1.00 0.00 C ATOM 0 H VAL A 58 -0.442 2.227 -3.528 1.00 0.00 H new ATOM 0 HA VAL A 58 0.332 -0.152 -4.948 1.00 0.00 H new ATOM 0 HB VAL A 58 0.253 0.469 -2.006 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.012 -1.295 -1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.480 -1.951 -2.445 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.833 -1.636 -3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.701 0.951 -2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.508 0.683 -4.066 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.687 2.052 -3.280 1.00 0.00 H new ATOM 899 N PHE A 59 -1.992 -1.247 -4.838 1.00 0.00 N ATOM 900 CA PHE A 59 -3.166 -2.086 -4.667 1.00 0.00 C ATOM 901 C PHE A 59 -2.799 -3.463 -4.142 1.00 0.00 C ATOM 902 O PHE A 59 -1.638 -3.883 -4.137 1.00 0.00 O ATOM 903 CB PHE A 59 -3.896 -2.233 -6.006 1.00 0.00 C ATOM 904 CG PHE A 59 -4.443 -0.964 -6.617 1.00 0.00 C ATOM 905 CD1 PHE A 59 -5.293 -0.133 -5.870 1.00 0.00 C ATOM 906 CD2 PHE A 59 -4.124 -0.622 -7.943 1.00 0.00 C ATOM 907 CE1 PHE A 59 -5.794 1.054 -6.434 1.00 0.00 C ATOM 908 CE2 PHE A 59 -4.656 0.547 -8.506 1.00 0.00 C ATOM 909 CZ PHE A 59 -5.486 1.394 -7.757 1.00 0.00 C ATOM 0 H PHE A 59 -1.662 -1.173 -5.800 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.815 -1.604 -3.936 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.210 -2.688 -6.721 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -4.723 -2.930 -5.869 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.563 -0.406 -4.860 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -3.472 -1.257 -8.525 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -6.420 1.707 -5.843 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -4.423 0.799 -9.530 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.883 2.298 -8.195 1.00 0.00 H new ATOM 919 N ILE A 60 -3.845 -4.183 -3.741 1.00 0.00 N ATOM 920 CA ILE A 60 -3.795 -5.576 -3.360 1.00 0.00 C ATOM 921 C ILE A 60 -4.951 -6.286 -4.056 1.00 0.00 C ATOM 922 O ILE A 60 -6.107 -5.886 -3.912 1.00 0.00 O ATOM 923 CB ILE A 60 -3.799 -5.718 -1.823 1.00 0.00 C ATOM 924 CG1 ILE A 60 -5.090 -5.290 -1.095 1.00 0.00 C ATOM 925 CG2 ILE A 60 -2.611 -4.953 -1.241 1.00 0.00 C ATOM 926 CD1 ILE A 60 -5.137 -5.721 0.374 1.00 0.00 C ATOM 0 H ILE A 60 -4.783 -3.788 -3.673 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.868 -6.050 -3.681 1.00 0.00 H new ATOM 0 HB ILE A 60 -3.729 -6.791 -1.647 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.186 -4.206 -1.150 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -5.949 -5.713 -1.617 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -2.611 -5.052 -0.155 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -1.683 -5.361 -1.642 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -2.690 -3.900 -1.510 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.073 -5.386 0.822 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -5.073 -6.807 0.437 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -4.299 -5.277 0.911 1.00 0.00 H new ATOM 938 N LYS A 61 -4.651 -7.331 -4.826 1.00 0.00 N ATOM 939 CA LYS A 61 -5.651 -8.164 -5.501 1.00 0.00 C ATOM 940 C LYS A 61 -5.529 -9.584 -4.999 1.00 0.00 C ATOM 941 O LYS A 61 -4.425 -9.968 -4.617 1.00 0.00 O ATOM 942 CB LYS A 61 -5.572 -8.119 -7.032 1.00 0.00 C ATOM 943 CG LYS A 61 -4.289 -7.550 -7.578 1.00 0.00 C ATOM 944 CD LYS A 61 -4.203 -7.764 -9.091 1.00 0.00 C ATOM 945 CE LYS A 61 -2.731 -7.934 -9.401 1.00 0.00 C ATOM 946 NZ LYS A 61 -2.442 -8.561 -10.710 1.00 0.00 N ATOM 0 H LYS A 61 -3.692 -7.629 -5.003 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.630 -7.753 -5.254 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.699 -9.130 -7.419 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -6.406 -7.526 -7.408 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.233 -6.485 -7.353 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.438 -8.025 -7.090 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -4.771 -8.644 -9.394 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.620 -6.914 -9.630 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -2.252 -6.956 -9.369 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.276 -8.538 -8.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -1.420 -8.731 -10.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.950 -9.465 -10.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.753 -7.928 -11.474 1.00 0.00 H new ATOM 960 N ARG A 62 -6.624 -10.354 -4.980 1.00 0.00 N ATOM 961 CA ARG A 62 -6.666 -11.731 -4.459 1.00 0.00 C ATOM 962 C ARG A 62 -5.942 -12.741 -5.356 1.00 0.00 C ATOM 963 O ARG A 62 -6.558 -13.652 -5.903 1.00 0.00 O ATOM 964 CB ARG A 62 -8.090 -12.194 -4.098 1.00 0.00 C ATOM 965 CG ARG A 62 -9.085 -11.919 -5.224 1.00 0.00 C ATOM 966 CD ARG A 62 -10.389 -12.734 -5.099 1.00 0.00 C ATOM 967 NE ARG A 62 -11.118 -12.797 -6.381 1.00 0.00 N ATOM 968 CZ ARG A 62 -11.674 -13.879 -6.952 1.00 0.00 C ATOM 969 NH1 ARG A 62 -11.882 -15.012 -6.292 1.00 0.00 N ATOM 970 NH2 ARG A 62 -12.022 -13.824 -8.227 1.00 0.00 N ATOM 0 H ARG A 62 -7.525 -10.033 -5.333 1.00 0.00 H new ATOM 0 HA ARG A 62 -6.105 -11.698 -3.525 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.079 -13.261 -3.877 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.418 -11.684 -3.192 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.328 -10.857 -5.233 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -8.613 -12.146 -6.180 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.156 -13.744 -4.763 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.028 -12.284 -4.339 1.00 0.00 H new ATOM 0 HE ARG A 62 -11.210 -11.919 -6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -11.616 -15.086 -5.310 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.307 -15.808 -6.767 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.867 -12.969 -8.762 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.445 -14.636 -8.676 1.00 0.00 H new ATOM 984 N SER A 63 -4.624 -12.585 -5.445 1.00 0.00 N ATOM 985 CA SER A 63 -3.758 -13.188 -6.445 1.00 0.00 C ATOM 986 C SER A 63 -4.452 -12.976 -7.790 1.00 0.00 C ATOM 987 O SER A 63 -4.725 -11.827 -8.140 1.00 0.00 O ATOM 988 CB SER A 63 -3.504 -14.647 -6.009 1.00 0.00 C ATOM 989 OG SER A 63 -2.799 -15.445 -6.934 1.00 0.00 O ATOM 0 H SER A 63 -4.108 -12.003 -4.785 1.00 0.00 H new ATOM 0 HA SER A 63 -2.765 -12.749 -6.546 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.951 -14.636 -5.070 1.00 0.00 H new ATOM 0 HB3 SER A 63 -4.465 -15.120 -5.807 1.00 0.00 H new ATOM 0 HG SER A 63 -2.686 -16.347 -6.569 1.00 0.00 H new ATOM 995 N ASP A 64 -4.839 -14.064 -8.445 1.00 0.00 N ATOM 996 CA ASP A 64 -5.737 -14.100 -9.578 1.00 0.00 C ATOM 997 C ASP A 64 -6.444 -15.445 -9.522 1.00 0.00 C ATOM 998 O ASP A 64 -7.661 -15.504 -9.356 1.00 0.00 O ATOM 999 CB ASP A 64 -4.960 -13.869 -10.886 1.00 0.00 C ATOM 1000 CG ASP A 64 -5.869 -13.446 -12.038 1.00 0.00 C ATOM 1001 OD1 ASP A 64 -7.061 -13.841 -12.063 1.00 0.00 O ATOM 1002 OD2 ASP A 64 -5.370 -12.735 -12.945 1.00 0.00 O ATOM 0 H ASP A 64 -4.513 -14.993 -8.180 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.480 -13.303 -9.545 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -4.202 -13.102 -10.724 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.434 -14.784 -11.159 1.00 0.00 H new ATOM 1007 N ALA A 65 -5.675 -16.535 -9.562 1.00 0.00 N ATOM 1008 CA ALA A 65 -6.189 -17.889 -9.463 1.00 0.00 C ATOM 1009 C ALA A 65 -6.340 -18.314 -8.005 1.00 0.00 C ATOM 1010 O ALA A 65 -5.346 -18.527 -7.309 1.00 0.00 O ATOM 1011 CB ALA A 65 -5.231 -18.838 -10.165 1.00 0.00 C ATOM 0 H ALA A 65 -4.661 -16.493 -9.666 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.171 -17.922 -9.935 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.611 -19.857 -10.094 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -5.143 -18.556 -11.214 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -4.251 -18.783 -9.691 1.00 0.00 H new ATOM 1017 N LEU A 66 -7.579 -18.500 -7.564 1.00 0.00 N ATOM 1018 CA LEU A 66 -7.954 -19.247 -6.365 1.00 0.00 C ATOM 1019 C LEU A 66 -9.136 -20.142 -6.740 1.00 0.00 C ATOM 1020 O LEU A 66 -9.695 -19.993 -7.826 1.00 0.00 O ATOM 1021 CB LEU A 66 -8.344 -18.285 -5.224 1.00 0.00 C ATOM 1022 CG LEU A 66 -7.185 -17.418 -4.696 1.00 0.00 C ATOM 1023 CD1 LEU A 66 -7.739 -16.308 -3.795 1.00 0.00 C ATOM 1024 CD2 LEU A 66 -6.193 -18.262 -3.888 1.00 0.00 C ATOM 0 H LEU A 66 -8.388 -18.117 -8.054 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.116 -19.846 -6.010 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.141 -17.629 -5.575 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.751 -18.868 -4.398 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.668 -16.986 -5.553 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.917 -15.697 -3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.425 -15.684 -4.367 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -8.269 -16.753 -2.953 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.385 -17.627 -3.527 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -6.706 -18.714 -3.039 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.782 -19.047 -4.523 1.00 0.00 H new ATOM 1036 N SER A 67 -9.555 -21.023 -5.837 1.00 0.00 N ATOM 1037 CA SER A 67 -10.772 -21.817 -5.944 1.00 0.00 C ATOM 1038 C SER A 67 -11.500 -21.695 -4.600 1.00 0.00 C ATOM 1039 O SER A 67 -10.874 -21.325 -3.602 1.00 0.00 O ATOM 1040 CB SER A 67 -10.365 -23.255 -6.307 1.00 0.00 C ATOM 1041 OG SER A 67 -11.473 -24.119 -6.437 1.00 0.00 O ATOM 0 H SER A 67 -9.036 -21.210 -4.979 1.00 0.00 H new ATOM 0 HA SER A 67 -11.454 -21.478 -6.723 1.00 0.00 H new ATOM 0 HB2 SER A 67 -9.806 -23.245 -7.243 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.695 -23.643 -5.540 1.00 0.00 H new ATOM 0 HG SER A 67 -11.161 -25.018 -6.670 1.00 0.00 H new ATOM 1047 N THR A 68 -12.799 -21.987 -4.538 1.00 0.00 N ATOM 1048 CA THR A 68 -13.580 -21.916 -3.301 1.00 0.00 C ATOM 1049 C THR A 68 -13.429 -23.201 -2.470 1.00 0.00 C ATOM 1050 O THR A 68 -14.099 -23.364 -1.448 1.00 0.00 O ATOM 1051 CB THR A 68 -15.068 -21.626 -3.597 1.00 0.00 C ATOM 1052 OG1 THR A 68 -15.258 -20.927 -4.816 1.00 0.00 O ATOM 1053 CG2 THR A 68 -15.639 -20.751 -2.481 1.00 0.00 C ATOM 0 H THR A 68 -13.343 -22.281 -5.349 1.00 0.00 H new ATOM 0 HA THR A 68 -13.185 -21.088 -2.712 1.00 0.00 H new ATOM 0 HB THR A 68 -15.569 -22.591 -3.665 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.215 -20.770 -4.957 1.00 0.00 H new ATOM 0 HG21 THR A 68 -16.689 -20.542 -2.684 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.550 -21.273 -1.528 1.00 0.00 H new ATOM 0 HG23 THR A 68 -15.085 -19.813 -2.434 1.00 0.00 H new ATOM 1061 N ASN A 69 -12.577 -24.133 -2.907 1.00 0.00 N ATOM 1062 CA ASN A 69 -12.347 -25.460 -2.348 1.00 0.00 C ATOM 1063 C ASN A 69 -11.623 -25.411 -0.992 1.00 0.00 C ATOM 1064 O ASN A 69 -10.494 -25.884 -0.866 1.00 0.00 O ATOM 1065 CB ASN A 69 -11.613 -26.305 -3.398 1.00 0.00 C ATOM 1066 CG ASN A 69 -11.786 -27.785 -3.107 1.00 0.00 C ATOM 1067 OD1 ASN A 69 -12.800 -28.372 -3.466 1.00 0.00 O ATOM 1068 ND2 ASN A 69 -10.817 -28.430 -2.501 1.00 0.00 N ATOM 0 H ASN A 69 -11.988 -23.962 -3.722 1.00 0.00 H new ATOM 0 HA ASN A 69 -13.303 -25.933 -2.123 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -11.999 -26.076 -4.391 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -10.553 -26.051 -3.401 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.903 -29.431 -2.324 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.978 -27.930 -2.207 1.00 0.00 H new ATOM 1075 N HIS A 70 -12.247 -24.766 0.001 1.00 0.00 N ATOM 1076 CA HIS A 70 -11.751 -24.429 1.334 1.00 0.00 C ATOM 1077 C HIS A 70 -10.308 -23.919 1.257 1.00 0.00 C ATOM 1078 O HIS A 70 -9.349 -24.611 1.624 1.00 0.00 O ATOM 1079 CB HIS A 70 -12.016 -25.591 2.308 1.00 0.00 C ATOM 1080 CG HIS A 70 -11.480 -25.427 3.709 1.00 0.00 C ATOM 1081 ND1 HIS A 70 -10.765 -26.374 4.411 1.00 0.00 N ATOM 1082 CD2 HIS A 70 -11.663 -24.350 4.533 1.00 0.00 C ATOM 1083 CE1 HIS A 70 -10.467 -25.859 5.614 1.00 0.00 C ATOM 1084 NE2 HIS A 70 -11.000 -24.628 5.734 1.00 0.00 N ATOM 0 H HIS A 70 -13.204 -24.437 -0.125 1.00 0.00 H new ATOM 0 HA HIS A 70 -12.304 -23.590 1.757 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -13.093 -25.746 2.370 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -11.588 -26.498 1.882 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -12.216 -23.452 4.300 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -9.885 -26.359 6.374 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -10.933 -24.015 6.546 1.00 0.00 H new ATOM 1092 N GLY A 71 -10.166 -22.693 0.755 1.00 0.00 N ATOM 1093 CA GLY A 71 -8.919 -21.957 0.664 1.00 0.00 C ATOM 1094 C GLY A 71 -9.101 -20.531 1.168 1.00 0.00 C ATOM 1095 O GLY A 71 -10.229 -20.028 1.239 1.00 0.00 O ATOM 0 H GLY A 71 -10.958 -22.167 0.385 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.150 -22.460 1.250 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -8.574 -21.942 -0.370 1.00 0.00 H new ATOM 1099 N HIS A 72 -7.994 -19.873 1.502 1.00 0.00 N ATOM 1100 CA HIS A 72 -7.996 -18.495 1.979 1.00 0.00 C ATOM 1101 C HIS A 72 -7.925 -17.511 0.821 1.00 0.00 C ATOM 1102 O HIS A 72 -7.379 -17.823 -0.245 1.00 0.00 O ATOM 1103 CB HIS A 72 -6.798 -18.274 2.908 1.00 0.00 C ATOM 1104 CG HIS A 72 -6.911 -19.014 4.214 1.00 0.00 C ATOM 1105 ND1 HIS A 72 -6.837 -20.378 4.385 1.00 0.00 N ATOM 1106 CD2 HIS A 72 -7.137 -18.450 5.439 1.00 0.00 C ATOM 1107 CE1 HIS A 72 -7.037 -20.643 5.683 1.00 0.00 C ATOM 1108 NE2 HIS A 72 -7.216 -19.495 6.363 1.00 0.00 N ATOM 0 H HIS A 72 -7.063 -20.286 1.448 1.00 0.00 H new ATOM 0 HA HIS A 72 -8.927 -18.322 2.519 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -5.888 -18.590 2.397 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -6.696 -17.208 3.110 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.236 -17.396 5.652 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -7.052 -21.631 6.119 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -7.379 -19.405 7.366 1.00 0.00 H new ATOM 1116 N LYS A 73 -8.390 -16.286 1.075 1.00 0.00 N ATOM 1117 CA LYS A 73 -8.054 -15.130 0.269 1.00 0.00 C ATOM 1118 C LYS A 73 -6.614 -14.742 0.567 1.00 0.00 C ATOM 1119 O LYS A 73 -6.312 -14.039 1.534 1.00 0.00 O ATOM 1120 CB LYS A 73 -9.004 -13.952 0.523 1.00 0.00 C ATOM 1121 CG LYS A 73 -10.287 -14.106 -0.300 1.00 0.00 C ATOM 1122 CD LYS A 73 -11.143 -12.837 -0.233 1.00 0.00 C ATOM 1123 CE LYS A 73 -12.079 -12.807 0.981 1.00 0.00 C ATOM 1124 NZ LYS A 73 -13.362 -13.462 0.668 1.00 0.00 N ATOM 0 H LYS A 73 -9.014 -16.076 1.854 1.00 0.00 H new ATOM 0 HA LYS A 73 -8.164 -15.388 -0.784 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -9.250 -13.899 1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -8.509 -13.016 0.263 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -10.033 -14.322 -1.338 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -10.861 -14.955 0.071 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -10.489 -11.966 -0.202 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -11.736 -12.757 -1.144 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -11.605 -13.310 1.824 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -12.256 -11.775 1.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.981 -13.431 1.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -13.821 -12.966 -0.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -13.190 -14.452 0.402 1.00 0.00 H new ATOM 1138 N VAL A 74 -5.710 -15.219 -0.273 1.00 0.00 N ATOM 1139 CA VAL A 74 -4.412 -14.594 -0.431 1.00 0.00 C ATOM 1140 C VAL A 74 -4.617 -13.246 -1.135 1.00 0.00 C ATOM 1141 O VAL A 74 -5.675 -13.027 -1.724 1.00 0.00 O ATOM 1142 CB VAL A 74 -3.447 -15.566 -1.151 1.00 0.00 C ATOM 1143 CG1 VAL A 74 -3.729 -17.044 -0.810 1.00 0.00 C ATOM 1144 CG2 VAL A 74 -3.385 -15.455 -2.667 1.00 0.00 C ATOM 0 H VAL A 74 -5.855 -16.042 -0.858 1.00 0.00 H new ATOM 0 HA VAL A 74 -3.936 -14.382 0.526 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.482 -15.242 -0.760 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.023 -17.681 -1.342 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -3.618 -17.197 0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -4.745 -17.299 -1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.676 -16.186 -3.057 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -4.372 -15.648 -3.087 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.062 -14.452 -2.945 1.00 0.00 H new ATOM 1154 N VAL A 75 -3.611 -12.370 -1.136 1.00 0.00 N ATOM 1155 CA VAL A 75 -3.492 -11.260 -2.077 1.00 0.00 C ATOM 1156 C VAL A 75 -2.056 -11.220 -2.609 1.00 0.00 C ATOM 1157 O VAL A 75 -1.240 -12.073 -2.244 1.00 0.00 O ATOM 1158 CB VAL A 75 -3.935 -9.913 -1.469 1.00 0.00 C ATOM 1159 CG1 VAL A 75 -5.419 -9.914 -1.136 1.00 0.00 C ATOM 1160 CG2 VAL A 75 -3.169 -9.466 -0.222 1.00 0.00 C ATOM 0 H VAL A 75 -2.841 -12.415 -0.468 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.176 -11.427 -2.909 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.703 -9.197 -2.257 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.697 -8.950 -0.710 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.996 -10.089 -2.044 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.630 -10.704 -0.415 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.561 -8.509 0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -3.288 -10.211 0.565 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.111 -9.360 -0.463 1.00 0.00 H new ATOM 1170 N GLU A 76 -1.738 -10.262 -3.479 1.00 0.00 N ATOM 1171 CA GLU A 76 -0.374 -9.916 -3.862 1.00 0.00 C ATOM 1172 C GLU A 76 -0.182 -8.400 -3.682 1.00 0.00 C ATOM 1173 O GLU A 76 -1.064 -7.731 -3.129 1.00 0.00 O ATOM 1174 CB GLU A 76 -0.003 -10.397 -5.266 1.00 0.00 C ATOM 1175 CG GLU A 76 -0.666 -9.679 -6.449 1.00 0.00 C ATOM 1176 CD GLU A 76 0.149 -9.846 -7.740 1.00 0.00 C ATOM 1177 OE1 GLU A 76 1.391 -10.007 -7.701 1.00 0.00 O ATOM 1178 OE2 GLU A 76 -0.483 -9.898 -8.817 1.00 0.00 O ATOM 0 H GLU A 76 -2.442 -9.692 -3.948 1.00 0.00 H new ATOM 0 HA GLU A 76 0.318 -10.444 -3.206 1.00 0.00 H new ATOM 0 HB2 GLU A 76 1.077 -10.309 -5.379 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -0.245 -11.458 -5.335 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.671 -10.074 -6.599 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.772 -8.619 -6.219 1.00 0.00 H new ATOM 1185 N LEU A 77 0.948 -7.862 -4.146 1.00 0.00 N ATOM 1186 CA LEU A 77 1.191 -6.439 -4.365 1.00 0.00 C ATOM 1187 C LEU A 77 0.959 -6.107 -5.828 1.00 0.00 C ATOM 1188 O LEU A 77 1.224 -6.909 -6.721 1.00 0.00 O ATOM 1189 CB LEU A 77 2.659 -6.099 -4.027 1.00 0.00 C ATOM 1190 CG LEU A 77 2.944 -5.936 -2.526 1.00 0.00 C ATOM 1191 CD1 LEU A 77 4.444 -6.076 -2.237 1.00 0.00 C ATOM 1192 CD2 LEU A 77 2.459 -4.571 -2.035 1.00 0.00 C ATOM 0 H LEU A 77 1.755 -8.436 -4.390 1.00 0.00 H new ATOM 0 HA LEU A 77 0.516 -5.866 -3.729 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.302 -6.885 -4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 77 2.932 -5.176 -4.539 1.00 0.00 H new ATOM 0 HG LEU A 77 2.406 -6.723 -1.997 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.621 -5.957 -1.168 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.785 -7.062 -2.554 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.993 -5.309 -2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.669 -4.472 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 77 2.977 -3.783 -2.582 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.386 -4.484 -2.203 1.00 0.00 H new ATOM 1204 N VAL A 78 0.524 -4.876 -6.041 1.00 0.00 N ATOM 1205 CA VAL A 78 0.495 -4.170 -7.303 1.00 0.00 C ATOM 1206 C VAL A 78 0.752 -2.697 -6.947 1.00 0.00 C ATOM 1207 O VAL A 78 0.763 -2.344 -5.764 1.00 0.00 O ATOM 1208 CB VAL A 78 -0.848 -4.402 -8.031 1.00 0.00 C ATOM 1209 CG1 VAL A 78 -0.604 -5.010 -9.416 1.00 0.00 C ATOM 1210 CG2 VAL A 78 -1.879 -5.300 -7.344 1.00 0.00 C ATOM 0 H VAL A 78 0.156 -4.307 -5.279 1.00 0.00 H new ATOM 0 HA VAL A 78 1.250 -4.525 -8.004 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.275 -3.399 -8.050 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.559 -5.168 -9.917 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.009 -4.331 -10.009 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.088 -5.964 -9.309 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.770 -5.373 -7.967 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.456 -6.294 -7.198 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.146 -4.874 -6.377 1.00 0.00 H new ATOM 1220 N ALA A 79 1.001 -1.839 -7.927 1.00 0.00 N ATOM 1221 CA ALA A 79 1.312 -0.429 -7.751 1.00 0.00 C ATOM 1222 C ALA A 79 1.056 0.205 -9.111 1.00 0.00 C ATOM 1223 O ALA A 79 1.611 -0.270 -10.105 1.00 0.00 O ATOM 1224 CB ALA A 79 2.766 -0.253 -7.288 1.00 0.00 C ATOM 0 H ALA A 79 0.991 -2.120 -8.908 1.00 0.00 H new ATOM 0 HA ALA A 79 0.702 0.044 -6.981 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.982 0.808 -7.161 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.910 -0.769 -6.339 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.439 -0.673 -8.035 1.00 0.00 H new ATOM 1230 N GLU A 80 0.235 1.253 -9.172 1.00 0.00 N ATOM 1231 CA GLU A 80 -0.219 1.817 -10.438 1.00 0.00 C ATOM 1232 C GLU A 80 -0.229 3.340 -10.358 1.00 0.00 C ATOM 1233 O GLU A 80 -1.022 3.888 -9.596 1.00 0.00 O ATOM 1234 CB GLU A 80 -1.642 1.328 -10.744 1.00 0.00 C ATOM 1235 CG GLU A 80 -1.763 0.176 -11.731 1.00 0.00 C ATOM 1236 CD GLU A 80 -0.972 -1.079 -11.377 1.00 0.00 C ATOM 1237 OE1 GLU A 80 -1.076 -1.593 -10.242 1.00 0.00 O ATOM 1238 OE2 GLU A 80 -0.304 -1.580 -12.314 1.00 0.00 O ATOM 0 H GLU A 80 -0.131 1.731 -8.349 1.00 0.00 H new ATOM 0 HA GLU A 80 0.461 1.496 -11.227 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -2.108 1.025 -9.806 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -2.217 2.170 -11.129 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.815 -0.093 -11.821 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.438 0.525 -12.711 1.00 0.00 H new ATOM 1245 N MET A 81 0.578 4.033 -11.168 1.00 0.00 N ATOM 1246 CA MET A 81 0.670 5.501 -11.169 1.00 0.00 C ATOM 1247 C MET A 81 -0.527 6.212 -11.799 1.00 0.00 C ATOM 1248 O MET A 81 -0.500 7.434 -11.926 1.00 0.00 O ATOM 1249 CB MET A 81 1.980 5.991 -11.804 1.00 0.00 C ATOM 1250 CG MET A 81 2.132 5.651 -13.293 1.00 0.00 C ATOM 1251 SD MET A 81 3.778 5.969 -13.989 1.00 0.00 S ATOM 1252 CE MET A 81 3.999 7.732 -13.608 1.00 0.00 C ATOM 0 H MET A 81 1.193 3.588 -11.849 1.00 0.00 H new ATOM 0 HA MET A 81 0.661 5.774 -10.114 1.00 0.00 H new ATOM 0 HB2 MET A 81 2.046 7.072 -11.683 1.00 0.00 H new ATOM 0 HB3 MET A 81 2.818 5.558 -11.258 1.00 0.00 H new ATOM 0 HG2 MET A 81 1.891 4.598 -13.436 1.00 0.00 H new ATOM 0 HG3 MET A 81 1.398 6.226 -13.858 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.919 8.091 -14.069 1.00 0.00 H new ATOM 0 HE2 MET A 81 3.152 8.297 -13.998 1.00 0.00 H new ATOM 0 HE3 MET A 81 4.059 7.866 -12.528 1.00 0.00 H new ATOM 1262 N ASP A 82 -1.573 5.495 -12.200 1.00 0.00 N ATOM 1263 CA ASP A 82 -2.832 6.073 -12.691 1.00 0.00 C ATOM 1264 C ASP A 82 -4.029 5.255 -12.210 1.00 0.00 C ATOM 1265 O ASP A 82 -5.163 5.469 -12.625 1.00 0.00 O ATOM 1266 CB ASP A 82 -2.806 6.135 -14.230 1.00 0.00 C ATOM 1267 CG ASP A 82 -3.369 7.452 -14.753 1.00 0.00 C ATOM 1268 OD1 ASP A 82 -4.587 7.717 -14.662 1.00 0.00 O ATOM 1269 OD2 ASP A 82 -2.570 8.284 -15.244 1.00 0.00 O ATOM 0 H ASP A 82 -1.575 4.475 -12.195 1.00 0.00 H new ATOM 0 HA ASP A 82 -2.934 7.083 -12.293 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.782 6.013 -14.581 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -3.384 5.305 -14.637 1.00 0.00 H new ATOM 1274 N GLY A 83 -3.783 4.247 -11.373 1.00 0.00 N ATOM 1275 CA GLY A 83 -4.700 3.142 -11.172 1.00 0.00 C ATOM 1276 C GLY A 83 -5.158 2.495 -12.488 1.00 0.00 C ATOM 1277 O GLY A 83 -6.328 2.118 -12.602 1.00 0.00 O ATOM 0 H GLY A 83 -2.932 4.181 -10.814 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.219 2.387 -10.550 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.573 3.497 -10.625 1.00 0.00 H new ATOM 1281 N ILE A 84 -4.232 2.383 -13.456 1.00 0.00 N ATOM 1282 CA ILE A 84 -4.416 1.909 -14.832 1.00 0.00 C ATOM 1283 C ILE A 84 -5.387 0.733 -14.872 1.00 0.00 C ATOM 1284 O ILE A 84 -6.449 0.815 -15.495 1.00 0.00 O ATOM 1285 CB ILE A 84 -3.040 1.527 -15.439 1.00 0.00 C ATOM 1286 CG1 ILE A 84 -2.156 2.777 -15.632 1.00 0.00 C ATOM 1287 CG2 ILE A 84 -3.208 0.707 -16.736 1.00 0.00 C ATOM 1288 CD1 ILE A 84 -0.737 2.466 -16.117 1.00 0.00 C ATOM 0 H ILE A 84 -3.262 2.643 -13.279 1.00 0.00 H new ATOM 0 HA ILE A 84 -4.849 2.709 -15.432 1.00 0.00 H new ATOM 0 HB ILE A 84 -2.520 0.881 -14.732 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -2.637 3.442 -16.349 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -2.096 3.317 -14.687 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.226 0.455 -17.137 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.757 -0.209 -16.519 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.759 1.295 -17.470 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.179 3.395 -16.228 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -0.236 1.827 -15.390 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -0.785 1.954 -17.078 1.00 0.00 H new ATOM 1300 N GLN A 85 -5.002 -0.366 -14.228 1.00 0.00 N ATOM 1301 CA GLN A 85 -5.810 -1.549 -14.050 1.00 0.00 C ATOM 1302 C GLN A 85 -5.772 -1.940 -12.578 1.00 0.00 C ATOM 1303 O GLN A 85 -5.138 -1.278 -11.749 1.00 0.00 O ATOM 1304 CB GLN A 85 -5.353 -2.675 -15.001 1.00 0.00 C ATOM 1305 CG GLN A 85 -5.777 -2.428 -16.457 1.00 0.00 C ATOM 1306 CD GLN A 85 -7.283 -2.586 -16.658 1.00 0.00 C ATOM 1307 OE1 GLN A 85 -8.094 -1.754 -16.259 1.00 0.00 O ATOM 1308 NE2 GLN A 85 -7.720 -3.680 -17.248 1.00 0.00 N ATOM 0 H GLN A 85 -4.079 -0.451 -13.802 1.00 0.00 H new ATOM 0 HA GLN A 85 -6.848 -1.352 -14.317 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -4.268 -2.768 -14.953 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -5.769 -3.623 -14.661 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -5.477 -1.423 -16.755 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -5.251 -3.125 -17.109 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -7.057 -4.378 -17.584 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -8.722 -3.829 -17.369 1.00 0.00 H new ATOM 1317 N TYR A 86 -6.486 -3.018 -12.267 1.00 0.00 N ATOM 1318 CA TYR A 86 -6.616 -3.668 -10.973 1.00 0.00 C ATOM 1319 C TYR A 86 -7.501 -2.849 -10.038 1.00 0.00 C ATOM 1320 O TYR A 86 -8.457 -3.400 -9.488 1.00 0.00 O ATOM 1321 CB TYR A 86 -5.246 -3.990 -10.350 1.00 0.00 C ATOM 1322 CG TYR A 86 -4.225 -4.555 -11.325 1.00 0.00 C ATOM 1323 CD1 TYR A 86 -4.411 -5.830 -11.892 1.00 0.00 C ATOM 1324 CD2 TYR A 86 -3.095 -3.795 -11.681 1.00 0.00 C ATOM 1325 CE1 TYR A 86 -3.450 -6.376 -12.758 1.00 0.00 C ATOM 1326 CE2 TYR A 86 -2.144 -4.329 -12.568 1.00 0.00 C ATOM 1327 CZ TYR A 86 -2.310 -5.619 -13.105 1.00 0.00 C ATOM 1328 OH TYR A 86 -1.362 -6.119 -13.937 1.00 0.00 O ATOM 0 H TYR A 86 -7.036 -3.499 -12.979 1.00 0.00 H new ATOM 0 HA TYR A 86 -7.110 -4.627 -11.131 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -4.841 -3.081 -9.906 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -5.389 -4.704 -9.539 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -5.302 -6.394 -11.659 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -2.959 -2.804 -11.274 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -3.582 -7.371 -13.157 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -1.278 -3.744 -12.840 1.00 0.00 H new ATOM 0 HH TYR A 86 -0.652 -5.455 -14.061 1.00 0.00 H new ATOM 1338 N GLY A 87 -7.196 -1.566 -9.834 1.00 0.00 N ATOM 1339 CA GLY A 87 -7.970 -0.635 -9.027 1.00 0.00 C ATOM 1340 C GLY A 87 -9.460 -0.780 -9.317 1.00 0.00 C ATOM 1341 O GLY A 87 -9.860 -0.924 -10.470 1.00 0.00 O ATOM 0 H GLY A 87 -6.368 -1.135 -10.246 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.781 -0.818 -7.969 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -7.652 0.386 -9.235 1.00 0.00 H new ATOM 1345 N ARG A 88 -10.284 -0.786 -8.261 1.00 0.00 N ATOM 1346 CA ARG A 88 -11.751 -0.778 -8.338 1.00 0.00 C ATOM 1347 C ARG A 88 -12.371 -2.018 -9.023 1.00 0.00 C ATOM 1348 O ARG A 88 -13.594 -2.167 -8.988 1.00 0.00 O ATOM 1349 CB ARG A 88 -12.145 0.592 -8.942 1.00 0.00 C ATOM 1350 CG ARG A 88 -13.626 0.988 -8.929 1.00 0.00 C ATOM 1351 CD ARG A 88 -14.305 0.785 -10.291 1.00 0.00 C ATOM 1352 NE ARG A 88 -15.471 1.675 -10.431 1.00 0.00 N ATOM 1353 CZ ARG A 88 -15.917 2.183 -11.585 1.00 0.00 C ATOM 1354 NH1 ARG A 88 -15.527 1.673 -12.749 1.00 0.00 N ATOM 1355 NH2 ARG A 88 -16.777 3.193 -11.569 1.00 0.00 N ATOM 0 H ARG A 88 -9.938 -0.797 -7.301 1.00 0.00 H new ATOM 0 HA ARG A 88 -12.188 -0.877 -7.344 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -11.589 1.363 -8.409 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -11.804 0.610 -9.977 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -14.149 0.399 -8.175 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -13.716 2.034 -8.635 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.592 0.983 -11.091 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -14.620 -0.253 -10.395 1.00 0.00 H new ATOM 0 HE ARG A 88 -15.978 1.923 -9.581 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -14.880 0.885 -12.769 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.875 2.070 -13.622 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -17.095 3.578 -10.680 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -17.120 3.584 -12.446 1.00 0.00 H new ATOM 1369 N SER A 89 -11.572 -2.933 -9.582 1.00 0.00 N ATOM 1370 CA SER A 89 -12.023 -4.131 -10.278 1.00 0.00 C ATOM 1371 C SER A 89 -12.510 -5.212 -9.302 1.00 0.00 C ATOM 1372 O SER A 89 -12.357 -5.105 -8.081 1.00 0.00 O ATOM 1373 CB SER A 89 -10.876 -4.666 -11.152 1.00 0.00 C ATOM 1374 OG SER A 89 -11.409 -5.488 -12.179 1.00 0.00 O ATOM 0 H SER A 89 -10.556 -2.851 -9.558 1.00 0.00 H new ATOM 0 HA SER A 89 -12.874 -3.866 -10.906 1.00 0.00 H new ATOM 0 HB2 SER A 89 -10.319 -3.837 -11.587 1.00 0.00 H new ATOM 0 HB3 SER A 89 -10.175 -5.236 -10.542 1.00 0.00 H new ATOM 0 HG SER A 89 -10.679 -5.828 -12.738 1.00 0.00 H new ATOM 1380 N GLY A 90 -13.027 -6.308 -9.863 1.00 0.00 N ATOM 1381 CA GLY A 90 -13.636 -7.459 -9.200 1.00 0.00 C ATOM 1382 C GLY A 90 -12.628 -8.394 -8.539 1.00 0.00 C ATOM 1383 O GLY A 90 -12.789 -9.612 -8.591 1.00 0.00 O ATOM 0 H GLY A 90 -13.029 -6.420 -10.877 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -14.336 -7.103 -8.445 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -14.215 -8.023 -9.931 1.00 0.00 H new ATOM 1387 N ILE A 91 -11.536 -7.851 -8.007 1.00 0.00 N ATOM 1388 CA ILE A 91 -10.400 -8.599 -7.503 1.00 0.00 C ATOM 1389 C ILE A 91 -9.625 -7.807 -6.457 1.00 0.00 C ATOM 1390 O ILE A 91 -9.034 -8.404 -5.555 1.00 0.00 O ATOM 1391 CB ILE A 91 -9.503 -8.985 -8.696 1.00 0.00 C ATOM 1392 CG1 ILE A 91 -8.407 -9.914 -8.243 1.00 0.00 C ATOM 1393 CG2 ILE A 91 -8.939 -7.802 -9.504 1.00 0.00 C ATOM 1394 CD1 ILE A 91 -7.618 -10.584 -9.368 1.00 0.00 C ATOM 0 H ILE A 91 -11.419 -6.842 -7.914 1.00 0.00 H new ATOM 0 HA ILE A 91 -10.753 -9.501 -7.003 1.00 0.00 H new ATOM 0 HB ILE A 91 -10.158 -9.499 -9.399 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.713 -9.353 -7.617 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -8.846 -10.690 -7.616 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -8.322 -8.180 -10.320 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -9.762 -7.215 -9.913 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -8.333 -7.172 -8.852 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.853 -11.232 -8.940 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -8.294 -11.178 -9.983 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.143 -9.820 -9.984 1.00 0.00 H new ATOM 1406 N THR A 92 -9.587 -6.483 -6.586 1.00 0.00 N ATOM 1407 CA THR A 92 -8.789 -5.657 -5.708 1.00 0.00 C ATOM 1408 C THR A 92 -9.573 -5.407 -4.430 1.00 0.00 C ATOM 1409 O THR A 92 -10.808 -5.400 -4.446 1.00 0.00 O ATOM 1410 CB THR A 92 -8.365 -4.392 -6.454 1.00 0.00 C ATOM 1411 OG1 THR A 92 -7.574 -4.836 -7.531 1.00 0.00 O ATOM 1412 CG2 THR A 92 -7.530 -3.410 -5.631 1.00 0.00 C ATOM 0 H THR A 92 -10.105 -5.965 -7.296 1.00 0.00 H new ATOM 0 HA THR A 92 -7.863 -6.150 -5.410 1.00 0.00 H new ATOM 0 HB THR A 92 -9.266 -3.848 -6.738 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.038 -4.653 -8.375 1.00 0.00 H new ATOM 0 HG21 THR A 92 -7.277 -2.545 -6.244 1.00 0.00 H new ATOM 0 HG22 THR A 92 -8.102 -3.085 -4.762 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.614 -3.900 -5.299 1.00 0.00 H new ATOM 1420 N LEU A 93 -8.856 -5.264 -3.317 1.00 0.00 N ATOM 1421 CA LEU A 93 -9.451 -5.132 -1.997 1.00 0.00 C ATOM 1422 C LEU A 93 -9.266 -3.704 -1.495 1.00 0.00 C ATOM 1423 O LEU A 93 -10.204 -3.098 -0.975 1.00 0.00 O ATOM 1424 CB LEU A 93 -8.836 -6.125 -1.001 1.00 0.00 C ATOM 1425 CG LEU A 93 -8.496 -7.547 -1.489 1.00 0.00 C ATOM 1426 CD1 LEU A 93 -8.136 -8.363 -0.247 1.00 0.00 C ATOM 1427 CD2 LEU A 93 -9.628 -8.269 -2.232 1.00 0.00 C ATOM 0 H LEU A 93 -7.836 -5.237 -3.311 1.00 0.00 H new ATOM 0 HA LEU A 93 -10.514 -5.359 -2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.919 -5.680 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.524 -6.219 -0.161 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.685 -7.455 -2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.886 -9.382 -0.541 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -7.279 -7.909 0.251 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.985 -8.380 0.436 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.291 -9.260 -2.534 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.492 -8.365 -1.574 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.907 -7.696 -3.116 1.00 0.00 H new ATOM 1439 N GLY A 94 -8.054 -3.161 -1.648 1.00 0.00 N ATOM 1440 CA GLY A 94 -7.700 -1.862 -1.107 1.00 0.00 C ATOM 1441 C GLY A 94 -6.378 -1.391 -1.685 1.00 0.00 C ATOM 1442 O GLY A 94 -5.839 -2.014 -2.606 1.00 0.00 O ATOM 0 H GLY A 94 -7.295 -3.618 -2.153 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -8.483 -1.139 -1.337 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.629 -1.920 -0.021 1.00 0.00 H new ATOM 1446 N VAL A 95 -5.876 -0.302 -1.119 1.00 0.00 N ATOM 1447 CA VAL A 95 -4.564 0.272 -1.346 1.00 0.00 C ATOM 1448 C VAL A 95 -3.849 0.288 0.001 1.00 0.00 C ATOM 1449 O VAL A 95 -4.469 0.493 1.051 1.00 0.00 O ATOM 1450 CB VAL A 95 -4.693 1.687 -1.951 1.00 0.00 C ATOM 1451 CG1 VAL A 95 -3.345 2.393 -2.125 1.00 0.00 C ATOM 1452 CG2 VAL A 95 -5.378 1.762 -3.302 1.00 0.00 C ATOM 0 H VAL A 95 -6.415 0.238 -0.443 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.989 -0.315 -2.063 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.316 2.181 -1.205 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.505 3.382 -2.554 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.859 2.493 -1.155 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.711 1.807 -2.790 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -5.415 2.800 -3.634 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.820 1.169 -4.026 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.392 1.371 -3.218 1.00 0.00 H new ATOM 1462 N LEU A 96 -2.545 0.047 -0.046 1.00 0.00 N ATOM 1463 CA LEU A 96 -1.666 0.025 1.100 1.00 0.00 C ATOM 1464 C LEU A 96 -1.076 1.398 1.353 1.00 0.00 C ATOM 1465 O LEU A 96 -0.813 2.175 0.434 1.00 0.00 O ATOM 1466 CB LEU A 96 -0.524 -0.960 0.853 1.00 0.00 C ATOM 1467 CG LEU A 96 -0.962 -2.424 0.778 1.00 0.00 C ATOM 1468 CD1 LEU A 96 0.264 -3.313 0.557 1.00 0.00 C ATOM 1469 CD2 LEU A 96 -1.695 -2.893 2.034 1.00 0.00 C ATOM 0 H LEU A 96 -2.058 -0.145 -0.922 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.248 -0.280 1.969 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.025 -0.694 -0.079 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.212 -0.853 1.650 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.659 -2.503 -0.056 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.048 -4.356 0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.754 -3.032 -0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.961 -3.185 1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.980 -3.939 1.920 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.040 -2.788 2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.589 -2.287 2.181 1.00 0.00 H new ATOM 1481 N VAL A 97 -0.797 1.641 2.623 1.00 0.00 N ATOM 1482 CA VAL A 97 -0.210 2.866 3.151 1.00 0.00 C ATOM 1483 C VAL A 97 0.807 2.496 4.232 1.00 0.00 C ATOM 1484 O VAL A 97 0.761 1.369 4.738 1.00 0.00 O ATOM 1485 CB VAL A 97 -1.327 3.801 3.670 1.00 0.00 C ATOM 1486 CG1 VAL A 97 -2.156 4.368 2.503 1.00 0.00 C ATOM 1487 CG2 VAL A 97 -2.266 3.109 4.678 1.00 0.00 C ATOM 0 H VAL A 97 -0.983 0.954 3.354 1.00 0.00 H new ATOM 0 HA VAL A 97 0.318 3.414 2.371 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.822 4.614 4.192 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -2.935 5.022 2.894 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.506 4.935 1.837 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.615 3.548 1.950 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.029 3.814 5.007 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.744 2.253 4.202 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.690 2.770 5.539 1.00 0.00 H new ATOM 1497 N PRO A 98 1.734 3.389 4.606 1.00 0.00 N ATOM 1498 CA PRO A 98 2.459 3.240 5.849 1.00 0.00 C ATOM 1499 C PRO A 98 1.471 3.289 7.018 1.00 0.00 C ATOM 1500 O PRO A 98 0.493 4.036 6.995 1.00 0.00 O ATOM 1501 CB PRO A 98 3.486 4.373 5.904 1.00 0.00 C ATOM 1502 CG PRO A 98 3.307 5.199 4.629 1.00 0.00 C ATOM 1503 CD PRO A 98 2.102 4.602 3.901 1.00 0.00 C ATOM 0 HA PRO A 98 2.978 2.284 5.914 1.00 0.00 H new ATOM 0 HB2 PRO A 98 3.332 4.991 6.789 1.00 0.00 H new ATOM 0 HB3 PRO A 98 4.498 3.974 5.966 1.00 0.00 H new ATOM 0 HG2 PRO A 98 3.138 6.249 4.866 1.00 0.00 H new ATOM 0 HG3 PRO A 98 4.200 5.153 4.006 1.00 0.00 H new ATOM 0 HD2 PRO A 98 1.271 5.307 3.889 1.00 0.00 H new ATOM 0 HD3 PRO A 98 2.349 4.383 2.862 1.00 0.00 H new ATOM 1511 N HIS A 99 1.716 2.487 8.052 1.00 0.00 N ATOM 1512 CA HIS A 99 1.071 2.634 9.343 1.00 0.00 C ATOM 1513 C HIS A 99 1.980 3.486 10.232 1.00 0.00 C ATOM 1514 O HIS A 99 3.126 3.095 10.473 1.00 0.00 O ATOM 1515 CB HIS A 99 0.818 1.255 9.964 1.00 0.00 C ATOM 1516 CG HIS A 99 0.328 1.348 11.384 1.00 0.00 C ATOM 1517 ND1 HIS A 99 0.810 0.615 12.443 1.00 0.00 N ATOM 1518 CD2 HIS A 99 -0.538 2.282 11.885 1.00 0.00 C ATOM 1519 CE1 HIS A 99 0.271 1.106 13.566 1.00 0.00 C ATOM 1520 NE2 HIS A 99 -0.549 2.127 13.268 1.00 0.00 N ATOM 0 H HIS A 99 2.376 1.710 8.011 1.00 0.00 H new ATOM 0 HA HIS A 99 0.104 3.126 9.237 1.00 0.00 H new ATOM 0 HB2 HIS A 99 0.084 0.718 9.363 1.00 0.00 H new ATOM 0 HB3 HIS A 99 1.739 0.673 9.937 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -1.105 3.003 11.315 1.00 0.00 H new ATOM 0 HE1 HIS A 99 0.466 0.737 14.562 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -1.082 2.686 13.934 1.00 0.00 H new ATOM 1528 N VAL A 100 1.464 4.615 10.728 1.00 0.00 N ATOM 1529 CA VAL A 100 2.183 5.614 11.525 1.00 0.00 C ATOM 1530 C VAL A 100 1.336 6.073 12.734 1.00 0.00 C ATOM 1531 O VAL A 100 1.301 7.250 13.092 1.00 0.00 O ATOM 1532 CB VAL A 100 2.651 6.771 10.603 1.00 0.00 C ATOM 1533 CG1 VAL A 100 3.714 6.301 9.603 1.00 0.00 C ATOM 1534 CG2 VAL A 100 1.488 7.402 9.830 1.00 0.00 C ATOM 0 H VAL A 100 0.488 4.869 10.578 1.00 0.00 H new ATOM 0 HA VAL A 100 3.081 5.174 11.959 1.00 0.00 H new ATOM 0 HB VAL A 100 3.082 7.523 11.264 1.00 0.00 H new ATOM 0 HG11 VAL A 100 4.018 7.138 8.974 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.580 5.921 10.145 1.00 0.00 H new ATOM 0 HG13 VAL A 100 3.301 5.509 8.978 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.865 8.207 9.199 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.012 6.645 9.207 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.759 7.804 10.534 1.00 0.00 H new ATOM 1544 N GLY A 101 0.625 5.140 13.380 1.00 0.00 N ATOM 1545 CA GLY A 101 -0.046 5.414 14.651 1.00 0.00 C ATOM 1546 C GLY A 101 -1.336 6.235 14.536 1.00 0.00 C ATOM 1547 O GLY A 101 -1.823 6.775 15.530 1.00 0.00 O ATOM 0 H GLY A 101 0.501 4.187 13.039 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.278 4.465 15.134 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.647 5.943 15.305 1.00 0.00 H new ATOM 1551 N GLU A 102 -1.908 6.317 13.334 1.00 0.00 N ATOM 1552 CA GLU A 102 -3.098 7.106 12.988 1.00 0.00 C ATOM 1553 C GLU A 102 -4.404 6.553 13.601 1.00 0.00 C ATOM 1554 O GLU A 102 -5.473 7.104 13.367 1.00 0.00 O ATOM 1555 CB GLU A 102 -3.243 7.145 11.456 1.00 0.00 C ATOM 1556 CG GLU A 102 -1.985 7.492 10.650 1.00 0.00 C ATOM 1557 CD GLU A 102 -1.634 8.993 10.595 1.00 0.00 C ATOM 1558 OE1 GLU A 102 -1.637 9.641 11.674 1.00 0.00 O ATOM 1559 OE2 GLU A 102 -1.292 9.463 9.482 1.00 0.00 O ATOM 0 H GLU A 102 -1.536 5.809 12.531 1.00 0.00 H new ATOM 0 HA GLU A 102 -2.950 8.103 13.404 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -3.601 6.170 11.124 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -4.017 7.871 11.207 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -1.139 6.953 11.077 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.114 7.128 9.631 1.00 0.00 H new ATOM 1566 N THR A 103 -4.315 5.454 14.356 1.00 0.00 N ATOM 1567 CA THR A 103 -5.388 4.670 14.965 1.00 0.00 C ATOM 1568 C THR A 103 -6.246 3.898 13.941 1.00 0.00 C ATOM 1569 O THR A 103 -6.874 4.499 13.067 1.00 0.00 O ATOM 1570 CB THR A 103 -6.151 5.504 16.007 1.00 0.00 C ATOM 1571 OG1 THR A 103 -5.402 5.412 17.206 1.00 0.00 O ATOM 1572 CG2 THR A 103 -7.559 4.989 16.307 1.00 0.00 C ATOM 0 H THR A 103 -3.402 5.055 14.576 1.00 0.00 H new ATOM 0 HA THR A 103 -4.939 3.855 15.532 1.00 0.00 H new ATOM 0 HB THR A 103 -6.263 6.515 15.616 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.845 5.931 17.909 1.00 0.00 H new ATOM 0 HG21 THR A 103 -8.030 5.631 17.051 1.00 0.00 H new ATOM 0 HG22 THR A 103 -8.152 4.997 15.392 1.00 0.00 H new ATOM 0 HG23 THR A 103 -7.500 3.971 16.692 1.00 0.00 H new ATOM 1580 N PRO A 104 -6.255 2.547 13.984 1.00 0.00 N ATOM 1581 CA PRO A 104 -7.096 1.748 13.103 1.00 0.00 C ATOM 1582 C PRO A 104 -8.573 1.887 13.465 1.00 0.00 C ATOM 1583 O PRO A 104 -8.933 2.189 14.607 1.00 0.00 O ATOM 1584 CB PRO A 104 -6.645 0.286 13.261 1.00 0.00 C ATOM 1585 CG PRO A 104 -5.400 0.360 14.146 1.00 0.00 C ATOM 1586 CD PRO A 104 -5.604 1.648 14.926 1.00 0.00 C ATOM 0 HA PRO A 104 -6.991 2.087 12.073 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -7.424 -0.321 13.722 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -6.419 -0.166 12.295 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -5.324 -0.503 14.807 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -4.486 0.389 13.553 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -6.222 1.483 15.809 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -4.655 2.056 15.273 1.00 0.00 H new ATOM 1594 N ILE A 105 -9.426 1.544 12.506 1.00 0.00 N ATOM 1595 CA ILE A 105 -10.842 1.289 12.724 1.00 0.00 C ATOM 1596 C ILE A 105 -11.113 -0.220 12.704 1.00 0.00 C ATOM 1597 O ILE A 105 -11.969 -0.689 13.459 1.00 0.00 O ATOM 1598 CB ILE A 105 -11.723 2.067 11.720 1.00 0.00 C ATOM 1599 CG1 ILE A 105 -11.406 1.811 10.228 1.00 0.00 C ATOM 1600 CG2 ILE A 105 -11.731 3.572 12.058 1.00 0.00 C ATOM 1601 CD1 ILE A 105 -10.330 2.700 9.611 1.00 0.00 C ATOM 0 H ILE A 105 -9.143 1.433 11.532 1.00 0.00 H new ATOM 0 HA ILE A 105 -11.117 1.660 13.711 1.00 0.00 H new ATOM 0 HB ILE A 105 -12.729 1.666 11.845 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -11.099 0.771 10.115 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -12.325 1.936 9.655 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -12.356 4.103 11.340 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -12.128 3.717 13.063 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -10.714 3.961 12.010 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -10.192 2.431 8.564 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -10.637 3.744 9.680 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -9.392 2.561 10.148 1.00 0.00 H new ATOM 1613 N ALA A 106 -10.360 -1.002 11.926 1.00 0.00 N ATOM 1614 CA ALA A 106 -10.494 -2.451 11.814 1.00 0.00 C ATOM 1615 C ALA A 106 -9.140 -3.051 11.437 1.00 0.00 C ATOM 1616 O ALA A 106 -8.144 -2.334 11.392 1.00 0.00 O ATOM 1617 CB ALA A 106 -11.562 -2.769 10.761 1.00 0.00 C ATOM 0 H ALA A 106 -9.616 -0.628 11.338 1.00 0.00 H new ATOM 0 HA ALA A 106 -10.806 -2.886 12.763 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -11.671 -3.850 10.668 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.514 -2.333 11.065 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -11.262 -2.351 9.800 1.00 0.00 H new ATOM 1623 N TYR A 107 -9.096 -4.351 11.139 1.00 0.00 N ATOM 1624 CA TYR A 107 -7.924 -5.061 10.627 1.00 0.00 C ATOM 1625 C TYR A 107 -8.341 -5.996 9.491 1.00 0.00 C ATOM 1626 O TYR A 107 -9.479 -6.487 9.444 1.00 0.00 O ATOM 1627 CB TYR A 107 -7.254 -5.855 11.755 1.00 0.00 C ATOM 1628 CG TYR A 107 -6.180 -5.111 12.514 1.00 0.00 C ATOM 1629 CD1 TYR A 107 -6.531 -4.101 13.428 1.00 0.00 C ATOM 1630 CD2 TYR A 107 -4.824 -5.435 12.307 1.00 0.00 C ATOM 1631 CE1 TYR A 107 -5.531 -3.415 14.131 1.00 0.00 C ATOM 1632 CE2 TYR A 107 -3.819 -4.758 13.019 1.00 0.00 C ATOM 1633 CZ TYR A 107 -4.176 -3.765 13.954 1.00 0.00 C ATOM 1634 OH TYR A 107 -3.211 -3.122 14.660 1.00 0.00 O ATOM 0 H TYR A 107 -9.906 -4.960 11.252 1.00 0.00 H new ATOM 0 HA TYR A 107 -7.207 -4.336 10.241 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -8.022 -6.172 12.461 1.00 0.00 H new ATOM 0 HB3 TYR A 107 -6.817 -6.759 11.332 1.00 0.00 H new ATOM 0 HD1 TYR A 107 -7.570 -3.854 13.588 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -4.556 -6.206 11.599 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -5.798 -2.618 14.809 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -2.779 -4.997 12.851 1.00 0.00 H new ATOM 0 HH TYR A 107 -2.333 -3.485 14.420 1.00 0.00 H new ATOM 1644 N ARG A 108 -7.405 -6.280 8.589 1.00 0.00 N ATOM 1645 CA ARG A 108 -7.570 -7.176 7.455 1.00 0.00 C ATOM 1646 C ARG A 108 -6.402 -8.136 7.448 1.00 0.00 C ATOM 1647 O ARG A 108 -5.260 -7.711 7.255 1.00 0.00 O ATOM 1648 CB ARG A 108 -7.652 -6.387 6.149 1.00 0.00 C ATOM 1649 CG ARG A 108 -9.094 -5.989 5.819 1.00 0.00 C ATOM 1650 CD ARG A 108 -9.868 -7.146 5.186 1.00 0.00 C ATOM 1651 NE ARG A 108 -11.171 -6.688 4.700 1.00 0.00 N ATOM 1652 CZ ARG A 108 -12.090 -7.385 4.031 1.00 0.00 C ATOM 1653 NH1 ARG A 108 -11.988 -8.705 3.896 1.00 0.00 N ATOM 1654 NH2 ARG A 108 -13.116 -6.721 3.511 1.00 0.00 N ATOM 0 H ARG A 108 -6.471 -5.872 8.633 1.00 0.00 H new ATOM 0 HA ARG A 108 -8.503 -7.733 7.544 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -7.035 -5.491 6.225 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -7.244 -6.986 5.335 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.600 -5.667 6.729 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -9.090 -5.138 5.138 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -9.293 -7.567 4.361 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -10.006 -7.942 5.918 1.00 0.00 H new ATOM 0 HE ARG A 108 -11.405 -5.715 4.898 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -11.197 -9.200 4.308 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.701 -9.222 3.381 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -13.182 -5.710 3.630 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -13.838 -7.222 2.993 1.00 0.00 H new ATOM 1668 N ASN A 109 -6.692 -9.421 7.620 1.00 0.00 N ATOM 1669 CA ASN A 109 -5.726 -10.480 7.376 1.00 0.00 C ATOM 1670 C ASN A 109 -5.931 -11.047 5.982 1.00 0.00 C ATOM 1671 O ASN A 109 -7.059 -11.132 5.480 1.00 0.00 O ATOM 1672 CB ASN A 109 -5.753 -11.594 8.425 1.00 0.00 C ATOM 1673 CG ASN A 109 -7.052 -12.383 8.471 1.00 0.00 C ATOM 1674 OD1 ASN A 109 -7.982 -11.992 9.165 1.00 0.00 O ATOM 1675 ND2 ASN A 109 -7.145 -13.523 7.811 1.00 0.00 N ATOM 0 H ASN A 109 -7.604 -9.755 7.932 1.00 0.00 H new ATOM 0 HA ASN A 109 -4.737 -10.029 7.454 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -4.931 -12.282 8.228 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -5.573 -11.156 9.407 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.995 -14.083 7.878 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -6.367 -13.843 7.234 1.00 0.00 H new ATOM 1682 N VAL A 110 -4.817 -11.439 5.382 1.00 0.00 N ATOM 1683 CA VAL A 110 -4.659 -11.971 4.041 1.00 0.00 C ATOM 1684 C VAL A 110 -3.477 -12.948 4.091 1.00 0.00 C ATOM 1685 O VAL A 110 -2.833 -13.108 5.133 1.00 0.00 O ATOM 1686 CB VAL A 110 -4.411 -10.817 3.039 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -5.651 -9.928 2.851 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -3.204 -9.937 3.423 1.00 0.00 C ATOM 0 H VAL A 110 -3.921 -11.387 5.867 1.00 0.00 H new ATOM 0 HA VAL A 110 -5.556 -12.490 3.703 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.186 -11.310 2.093 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.425 -9.134 2.139 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -6.477 -10.531 2.473 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -5.932 -9.488 3.808 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.081 -9.146 2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.375 -9.493 4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.303 -10.549 3.453 1.00 0.00 H new ATOM 1698 N LEU A 111 -3.144 -13.588 2.970 1.00 0.00 N ATOM 1699 CA LEU A 111 -1.840 -14.217 2.801 1.00 0.00 C ATOM 1700 C LEU A 111 -1.037 -13.395 1.791 1.00 0.00 C ATOM 1701 O LEU A 111 -1.616 -12.791 0.885 1.00 0.00 O ATOM 1702 CB LEU A 111 -1.947 -15.656 2.268 1.00 0.00 C ATOM 1703 CG LEU A 111 -2.584 -16.813 3.049 1.00 0.00 C ATOM 1704 CD1 LEU A 111 -1.672 -17.475 4.076 1.00 0.00 C ATOM 1705 CD2 LEU A 111 -3.950 -16.482 3.652 1.00 0.00 C ATOM 0 H LEU A 111 -3.763 -13.683 2.165 1.00 0.00 H new ATOM 0 HA LEU A 111 -1.358 -14.254 3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.487 -15.592 1.324 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -0.930 -15.970 2.033 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.751 -17.559 2.272 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -2.211 -18.280 4.576 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.795 -17.883 3.574 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.358 -16.736 4.813 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.332 -17.351 4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.849 -15.646 4.344 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.644 -16.213 2.856 1.00 0.00 H new ATOM 1717 N LEU A 112 0.285 -13.492 1.891 1.00 0.00 N ATOM 1718 CA LEU A 112 1.291 -13.103 0.907 1.00 0.00 C ATOM 1719 C LEU A 112 1.708 -14.394 0.209 1.00 0.00 C ATOM 1720 O LEU A 112 1.913 -15.400 0.886 1.00 0.00 O ATOM 1721 CB LEU A 112 2.521 -12.489 1.616 1.00 0.00 C ATOM 1722 CG LEU A 112 3.337 -11.457 0.801 1.00 0.00 C ATOM 1723 CD1 LEU A 112 4.682 -11.208 1.492 1.00 0.00 C ATOM 1724 CD2 LEU A 112 3.624 -11.868 -0.648 1.00 0.00 C ATOM 0 H LEU A 112 0.716 -13.876 2.732 1.00 0.00 H new ATOM 0 HA LEU A 112 0.899 -12.363 0.209 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.183 -12.009 2.534 1.00 0.00 H new ATOM 0 HB3 LEU A 112 3.188 -13.300 1.907 1.00 0.00 H new ATOM 0 HG LEU A 112 2.715 -10.563 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.257 -10.481 0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.509 -10.822 2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.238 -12.143 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.200 -11.085 -1.141 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.194 -12.797 -0.657 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.683 -12.014 -1.178 1.00 0.00 H new ATOM 1736 N ARG A 113 1.900 -14.395 -1.111 1.00 0.00 N ATOM 1737 CA ARG A 113 2.384 -15.527 -1.905 1.00 0.00 C ATOM 1738 C ARG A 113 3.839 -15.936 -1.611 1.00 0.00 C ATOM 1739 O ARG A 113 4.504 -16.490 -2.479 1.00 0.00 O ATOM 1740 CB ARG A 113 2.138 -15.197 -3.391 1.00 0.00 C ATOM 1741 CG ARG A 113 2.039 -16.451 -4.271 1.00 0.00 C ATOM 1742 CD ARG A 113 1.222 -16.238 -5.550 1.00 0.00 C ATOM 1743 NE ARG A 113 0.756 -17.511 -6.135 1.00 0.00 N ATOM 1744 CZ ARG A 113 0.775 -17.900 -7.423 1.00 0.00 C ATOM 1745 NH1 ARG A 113 1.269 -17.155 -8.404 1.00 0.00 N ATOM 1746 NH2 ARG A 113 0.294 -19.095 -7.734 1.00 0.00 N ATOM 0 H ARG A 113 1.714 -13.570 -1.682 1.00 0.00 H new ATOM 0 HA ARG A 113 1.822 -16.417 -1.620 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.217 -14.621 -3.483 1.00 0.00 H new ATOM 0 HB3 ARG A 113 2.947 -14.565 -3.757 1.00 0.00 H new ATOM 0 HG2 ARG A 113 3.044 -16.776 -4.541 1.00 0.00 H new ATOM 0 HG3 ARG A 113 1.589 -17.257 -3.692 1.00 0.00 H new ATOM 0 HD2 ARG A 113 0.362 -15.606 -5.328 1.00 0.00 H new ATOM 0 HD3 ARG A 113 1.829 -15.705 -6.282 1.00 0.00 H new ATOM 0 HE ARG A 113 0.368 -18.185 -5.475 1.00 0.00 H new ATOM 0 HH11 ARG A 113 1.661 -16.236 -8.199 1.00 0.00 H new ATOM 0 HH12 ARG A 113 1.257 -17.502 -9.363 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -0.081 -19.700 -7.003 1.00 0.00 H new ATOM 0 HH22 ARG A 113 0.299 -19.410 -8.704 1.00 0.00 H new ATOM 1760 N LYS A 114 4.325 -15.744 -0.383 1.00 0.00 N ATOM 1761 CA LYS A 114 5.697 -16.010 0.029 1.00 0.00 C ATOM 1762 C LYS A 114 6.606 -15.117 -0.815 1.00 0.00 C ATOM 1763 O LYS A 114 6.288 -13.934 -0.957 1.00 0.00 O ATOM 1764 CB LYS A 114 5.914 -17.543 0.036 1.00 0.00 C ATOM 1765 CG LYS A 114 7.138 -17.991 0.838 1.00 0.00 C ATOM 1766 CD LYS A 114 6.951 -19.376 1.477 1.00 0.00 C ATOM 1767 CE LYS A 114 6.231 -19.211 2.823 1.00 0.00 C ATOM 1768 NZ LYS A 114 6.193 -20.453 3.615 1.00 0.00 N ATOM 0 H LYS A 114 3.748 -15.385 0.378 1.00 0.00 H new ATOM 0 HA LYS A 114 5.952 -15.735 1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.026 -18.024 0.447 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.018 -17.890 -0.992 1.00 0.00 H new ATOM 0 HG2 LYS A 114 8.009 -18.012 0.183 1.00 0.00 H new ATOM 0 HG3 LYS A 114 7.344 -17.259 1.619 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.371 -20.021 0.816 1.00 0.00 H new ATOM 0 HD3 LYS A 114 7.918 -19.857 1.624 1.00 0.00 H new ATOM 0 HE2 LYS A 114 6.729 -18.433 3.402 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.211 -18.871 2.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.695 -20.278 4.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.693 -21.191 3.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 7.164 -20.767 3.814 1.00 0.00 H new ATOM 1782 N ASN A 115 7.754 -15.600 -1.283 1.00 0.00 N ATOM 1783 CA ASN A 115 8.610 -14.786 -2.140 1.00 0.00 C ATOM 1784 C ASN A 115 8.259 -15.102 -3.581 1.00 0.00 C ATOM 1785 O ASN A 115 7.499 -14.366 -4.210 1.00 0.00 O ATOM 1786 CB ASN A 115 10.099 -14.971 -1.795 1.00 0.00 C ATOM 1787 CG ASN A 115 10.504 -13.943 -0.751 1.00 0.00 C ATOM 1788 OD1 ASN A 115 10.558 -12.748 -1.027 1.00 0.00 O ATOM 1789 ND2 ASN A 115 10.702 -14.354 0.489 1.00 0.00 N ATOM 0 H ASN A 115 8.109 -16.536 -1.087 1.00 0.00 H new ATOM 0 HA ASN A 115 8.431 -13.724 -1.973 1.00 0.00 H new ATOM 0 HB2 ASN A 115 10.274 -15.978 -1.417 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.709 -14.856 -2.691 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.901 -13.677 1.225 1.00 0.00 H new ATOM 0 HD22 ASN A 115 10.655 -15.349 0.710 1.00 0.00 H new ATOM 1796 N GLY A 116 8.796 -16.203 -4.090 1.00 0.00 N ATOM 1797 CA GLY A 116 8.969 -16.413 -5.509 1.00 0.00 C ATOM 1798 C GLY A 116 10.402 -16.853 -5.660 1.00 0.00 C ATOM 1799 O GLY A 116 10.611 -17.917 -6.277 1.00 0.00 O ATOM 0 H GLY A 116 9.125 -16.980 -3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 116 8.281 -17.171 -5.884 1.00 0.00 H new ATOM 0 HA3 GLY A 116 8.774 -15.500 -6.071 1.00 0.00 H new TER 1803 GLY A 116