USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 821 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 96 HIS : no HD1:sc= -0.0985 X(o=-0.23,f=-0.017) USER MOD Set 1.2: A 97 HIS : no HD1:sc= -0.133 X(o=-0.23,f=-0.18) USER MOD Set 2.1: A 38 HIS : no HD1:sc= -2.06! C(o=-3.6!,f=-4.8!) USER MOD Set 2.2: A 89 THR OG1 : rot 175:sc= -1.57! USER MOD Set 3.1: A 78 ASN : amide:sc= 0 K(o=0.0037,f=-1.5) USER MOD Set 3.2: A 85 ASN : amide:sc= 0.00371 X(o=0.0037,f=-0.41) USER MOD Set 4.1: A 24 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 28 HIS : no HD1:sc= 0 X(o=0,f=0.0032) USER MOD Set 5.1: A 23 ASN : amide:sc= -0.0529 K(o=-0.079,f=-1.2!) USER MOD Set 5.2: A 66 MET CE :methyl -163:sc= -0.0263 (180deg=-0.314) USER MOD Set 6.1: A 19 GLN : amide:sc= 0.851 K(o=2.1,f=-6.6!) USER MOD Set 6.2: A 62 LYS NZ :NH3+ -135:sc= 1.22 (180deg=0) USER MOD Set 7.1: A 12 LYS NZ :NH3+ -166:sc= 0.0936 (180deg=0) USER MOD Set 7.2: A 83 TYR OH : rot 30:sc= 0.0907 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 164:sc= 1.75 (180deg=0.169!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 174:sc= -0.0065 (180deg=-0.07) USER MOD Single : A 20 ASN : amide:sc= -0.0604 K(o=-0.06,f=-3.3!) USER MOD Single : A 25 LYS NZ :NH3+ 175:sc= 0.944 (180deg=0.833) USER MOD Single : A 27 LYS NZ :NH3+ 164:sc= 1.2 (180deg=0.703) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 37 LYS NZ :NH3+ -168:sc=-0.00585 (180deg=-0.126) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -166:sc= -0.41 (180deg=-0.86) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 7:sc= 0.282 USER MOD Single : A 69 ASN : amide:sc= -0.459 K(o=-0.46,f=-7.8!) USER MOD Single : A 72 ASN : amide:sc= -1.6 K(o=-1.6,f=-2.7!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -115:sc= -0.752 (180deg=-0.928) USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 1.01 (180deg=1.01) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 HIS : no HD1:sc= 0.947 K(o=0.95,f=-5.1!) USER MOD Single : A 99 HIS :FLIP no HD1:sc= -0.532 F(o=-1.4,f=-0.53) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 101 HIS : no HD1:sc=-0.000129 X(o=-0.00013,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -15.664 -48.613 16.430 1.00 0.00 N ATOM 2 CA LYS A 4 -14.726 -47.943 15.545 1.00 0.00 C ATOM 3 C LYS A 4 -13.750 -47.106 16.355 1.00 0.00 C ATOM 4 O LYS A 4 -14.155 -46.412 17.290 1.00 0.00 O ATOM 5 CB LYS A 4 -15.486 -47.056 14.563 1.00 0.00 C ATOM 6 CG LYS A 4 -16.370 -47.830 13.597 1.00 0.00 C ATOM 7 CD LYS A 4 -17.220 -46.904 12.743 1.00 0.00 C ATOM 8 CE LYS A 4 -16.371 -46.056 11.812 1.00 0.00 C ATOM 9 NZ LYS A 4 -17.204 -45.204 10.934 1.00 0.00 N ATOM 0 HA LYS A 4 -14.165 -48.693 14.988 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -16.103 -46.354 15.124 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -14.770 -46.465 13.992 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -15.747 -48.450 12.952 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -17.018 -48.504 14.158 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -17.923 -47.495 12.156 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -17.811 -46.254 13.389 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -15.702 -45.428 12.401 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -15.743 -46.704 11.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -16.589 -44.640 10.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -17.824 -45.805 10.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -17.785 -44.568 11.517 1.00 0.00 H new ATOM 23 N VAL A 5 -12.464 -47.161 15.976 1.00 0.00 N ATOM 24 CA VAL A 5 -11.393 -46.438 16.676 1.00 0.00 C ATOM 25 C VAL A 5 -11.185 -46.999 18.103 1.00 0.00 C ATOM 26 O VAL A 5 -12.106 -47.544 18.714 1.00 0.00 O ATOM 27 CB VAL A 5 -11.687 -44.905 16.733 1.00 0.00 C ATOM 28 CG1 VAL A 5 -10.601 -44.147 17.493 1.00 0.00 C ATOM 29 CG2 VAL A 5 -11.836 -44.341 15.327 1.00 0.00 C ATOM 0 H VAL A 5 -12.139 -47.706 15.178 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.474 -46.587 16.109 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.624 -44.771 17.274 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.843 -43.084 17.510 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -10.543 -44.522 18.515 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.641 -44.293 16.998 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.041 -43.272 15.384 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.914 -44.505 14.770 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -12.661 -44.842 14.820 1.00 0.00 H new ATOM 39 N ILE A 6 -9.969 -46.894 18.612 1.00 0.00 N ATOM 40 CA ILE A 6 -9.676 -47.354 19.952 1.00 0.00 C ATOM 41 C ILE A 6 -10.113 -46.297 20.961 1.00 0.00 C ATOM 42 O ILE A 6 -9.403 -45.317 21.205 1.00 0.00 O ATOM 43 CB ILE A 6 -8.160 -47.655 20.143 1.00 0.00 C ATOM 44 CG1 ILE A 6 -7.667 -48.688 19.111 1.00 0.00 C ATOM 45 CG2 ILE A 6 -7.883 -48.147 21.561 1.00 0.00 C ATOM 46 CD1 ILE A 6 -8.356 -50.037 19.197 1.00 0.00 C ATOM 0 H ILE A 6 -9.172 -46.494 18.116 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.225 -48.281 20.113 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.612 -46.726 19.984 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.813 -48.282 18.110 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.595 -48.832 19.243 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.818 -48.352 21.674 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.183 -47.382 22.277 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.449 -49.060 21.747 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.949 -50.703 18.436 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -8.189 -50.469 20.184 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -9.426 -49.910 19.033 1.00 0.00 H new ATOM 58 N ASP A 7 -11.298 -46.483 21.517 1.00 0.00 N ATOM 59 CA ASP A 7 -11.837 -45.546 22.496 1.00 0.00 C ATOM 60 C ASP A 7 -11.118 -45.686 23.826 1.00 0.00 C ATOM 61 O ASP A 7 -11.103 -46.769 24.429 1.00 0.00 O ATOM 62 CB ASP A 7 -13.341 -45.754 22.685 1.00 0.00 C ATOM 63 CG ASP A 7 -13.928 -44.796 23.702 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.093 -43.604 23.384 1.00 0.00 O ATOM 65 OD2 ASP A 7 -14.227 -45.236 24.833 1.00 0.00 O ATOM 0 H ASP A 7 -11.908 -47.274 21.309 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.675 -44.537 22.116 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -13.847 -45.621 21.729 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.527 -46.779 23.005 1.00 0.00 H new ATOM 70 N ILE A 8 -10.538 -44.597 24.286 1.00 0.00 N ATOM 71 CA ILE A 8 -9.782 -44.587 25.520 1.00 0.00 C ATOM 72 C ILE A 8 -10.633 -44.084 26.678 1.00 0.00 C ATOM 73 O ILE A 8 -11.350 -43.086 26.553 1.00 0.00 O ATOM 74 CB ILE A 8 -8.489 -43.752 25.372 1.00 0.00 C ATOM 75 CG1 ILE A 8 -7.599 -44.395 24.303 1.00 0.00 C ATOM 76 CG2 ILE A 8 -7.747 -43.635 26.704 1.00 0.00 C ATOM 77 CD1 ILE A 8 -6.360 -43.610 23.974 1.00 0.00 C ATOM 0 H ILE A 8 -10.578 -43.694 23.814 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.491 -45.613 25.743 1.00 0.00 H new ATOM 0 HB ILE A 8 -8.752 -42.740 25.064 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.306 -45.389 24.641 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.183 -44.527 23.392 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.843 -43.042 26.566 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.391 -43.150 27.438 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.478 -44.630 27.059 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.788 -44.136 23.209 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.641 -42.625 23.603 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.750 -43.499 24.871 1.00 0.00 H new ATOM 89 N LYS A 9 -10.568 -44.798 27.788 1.00 0.00 N ATOM 90 CA LYS A 9 -11.382 -44.507 28.953 1.00 0.00 C ATOM 91 C LYS A 9 -10.668 -43.556 29.876 1.00 0.00 C ATOM 92 O LYS A 9 -9.441 -43.574 29.984 1.00 0.00 O ATOM 93 CB LYS A 9 -11.726 -45.807 29.709 1.00 0.00 C ATOM 94 CG LYS A 9 -12.840 -46.656 29.084 1.00 0.00 C ATOM 95 CD LYS A 9 -12.737 -46.692 27.575 1.00 0.00 C ATOM 96 CE LYS A 9 -13.556 -47.800 26.962 1.00 0.00 C ATOM 97 NZ LYS A 9 -13.558 -47.710 25.489 1.00 0.00 N ATOM 0 H LYS A 9 -9.947 -45.598 27.906 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.306 -44.039 28.612 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.825 -46.416 29.779 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.017 -45.549 30.727 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -12.787 -47.671 29.477 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -13.810 -46.253 29.373 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -13.066 -45.735 27.170 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -11.693 -46.817 27.289 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -13.154 -48.766 27.269 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.579 -47.748 27.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -13.887 -48.611 25.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -14.194 -46.944 25.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -12.594 -47.512 25.152 1.00 0.00 H new ATOM 111 N GLU A 10 -11.427 -42.729 30.534 1.00 0.00 N ATOM 112 CA GLU A 10 -10.873 -41.787 31.465 1.00 0.00 C ATOM 113 C GLU A 10 -11.535 -41.921 32.819 1.00 0.00 C ATOM 114 O GLU A 10 -12.765 -42.003 32.924 1.00 0.00 O ATOM 115 CB GLU A 10 -11.000 -40.351 30.951 1.00 0.00 C ATOM 116 CG GLU A 10 -12.426 -39.895 30.758 1.00 0.00 C ATOM 117 CD GLU A 10 -12.517 -38.455 30.317 1.00 0.00 C ATOM 118 OE1 GLU A 10 -12.077 -38.151 29.188 1.00 0.00 O ATOM 119 OE2 GLU A 10 -13.018 -37.614 31.099 1.00 0.00 O ATOM 0 H GLU A 10 -12.442 -42.687 30.442 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.812 -42.014 31.570 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.506 -39.679 31.653 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.470 -40.267 30.002 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.910 -40.530 30.016 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.974 -40.021 31.692 1.00 0.00 H new ATOM 126 N ILE A 11 -10.724 -41.977 33.840 1.00 0.00 N ATOM 127 CA ILE A 11 -11.207 -42.038 35.193 1.00 0.00 C ATOM 128 C ILE A 11 -10.677 -40.837 35.976 1.00 0.00 C ATOM 129 O ILE A 11 -9.468 -40.703 36.203 1.00 0.00 O ATOM 130 CB ILE A 11 -10.840 -43.393 35.879 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.646 -44.533 35.229 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.095 -43.342 37.385 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.278 -45.917 35.726 1.00 0.00 C ATOM 0 H ILE A 11 -9.707 -41.982 33.757 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.296 -41.992 35.181 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.775 -43.578 35.736 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.707 -44.363 35.413 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.500 -44.496 34.149 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.829 -44.300 37.832 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.488 -42.553 37.830 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.149 -43.136 37.569 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.892 -46.661 35.218 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.226 -46.111 35.517 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.452 -45.976 36.800 1.00 0.00 H new ATOM 145 N LYS A 12 -11.588 -39.944 36.346 1.00 0.00 N ATOM 146 CA LYS A 12 -11.232 -38.716 37.031 1.00 0.00 C ATOM 147 C LYS A 12 -11.121 -38.925 38.536 1.00 0.00 C ATOM 148 O LYS A 12 -11.896 -39.672 39.136 1.00 0.00 O ATOM 149 CB LYS A 12 -12.223 -37.598 36.686 1.00 0.00 C ATOM 150 CG LYS A 12 -11.822 -36.226 37.217 1.00 0.00 C ATOM 151 CD LYS A 12 -12.771 -35.141 36.731 1.00 0.00 C ATOM 152 CE LYS A 12 -12.638 -34.927 35.224 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.457 -33.784 34.739 1.00 0.00 N ATOM 0 H LYS A 12 -12.588 -40.054 36.179 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.246 -38.409 36.681 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.327 -37.540 35.602 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.203 -37.859 37.087 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.816 -36.244 38.307 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.807 -35.993 36.896 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.797 -35.417 36.973 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -12.560 -34.208 37.254 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.591 -34.752 34.976 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -12.941 -35.835 34.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.525 -33.821 33.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.410 -33.840 35.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.009 -32.890 35.024 1.00 0.00 H new ATOM 167 N LEU A 13 -10.151 -38.264 39.121 1.00 0.00 N ATOM 168 CA LEU A 13 -9.830 -38.405 40.524 1.00 0.00 C ATOM 169 C LEU A 13 -9.765 -37.039 41.201 1.00 0.00 C ATOM 170 O LEU A 13 -9.875 -35.997 40.545 1.00 0.00 O ATOM 171 CB LEU A 13 -8.469 -39.067 40.639 1.00 0.00 C ATOM 172 CG LEU A 13 -8.311 -40.402 39.922 1.00 0.00 C ATOM 173 CD1 LEU A 13 -6.852 -40.792 39.874 1.00 0.00 C ATOM 174 CD2 LEU A 13 -9.125 -41.482 40.613 1.00 0.00 C ATOM 0 H LEU A 13 -9.552 -37.602 38.629 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.601 -39.003 41.009 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.718 -38.378 40.251 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.248 -39.217 41.696 1.00 0.00 H new ATOM 0 HG LEU A 13 -8.683 -40.296 38.903 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.748 -41.747 39.360 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.289 -40.028 39.338 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.466 -40.882 40.889 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.998 -42.427 40.085 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.783 -41.593 41.642 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -10.179 -41.203 40.608 1.00 0.00 H new ATOM 186 N SER A 14 -9.577 -37.053 42.505 1.00 0.00 N ATOM 187 CA SER A 14 -9.414 -35.845 43.282 1.00 0.00 C ATOM 188 C SER A 14 -8.521 -36.156 44.479 1.00 0.00 C ATOM 189 O SER A 14 -8.447 -37.291 44.902 1.00 0.00 O ATOM 190 CB SER A 14 -10.780 -35.326 43.748 1.00 0.00 C ATOM 191 OG SER A 14 -11.508 -36.336 44.424 1.00 0.00 O ATOM 0 H SER A 14 -9.533 -37.909 43.057 1.00 0.00 H new ATOM 0 HA SER A 14 -8.951 -35.069 42.672 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.641 -34.470 44.409 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.351 -34.976 42.888 1.00 0.00 H new ATOM 0 HG SER A 14 -12.374 -35.978 44.712 1.00 0.00 H new ATOM 197 N VAL A 15 -7.826 -35.161 44.997 1.00 0.00 N ATOM 198 CA VAL A 15 -6.955 -35.365 46.161 1.00 0.00 C ATOM 199 C VAL A 15 -7.803 -35.619 47.428 1.00 0.00 C ATOM 200 O VAL A 15 -7.338 -36.192 48.410 1.00 0.00 O ATOM 201 CB VAL A 15 -5.989 -34.160 46.369 1.00 0.00 C ATOM 202 CG1 VAL A 15 -5.079 -34.378 47.567 1.00 0.00 C ATOM 203 CG2 VAL A 15 -5.157 -33.943 45.127 1.00 0.00 C ATOM 0 H VAL A 15 -7.840 -34.206 44.640 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.341 -36.245 45.972 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.595 -33.275 46.561 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.418 -33.519 47.683 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.683 -34.495 48.466 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.482 -35.276 47.412 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.485 -33.099 45.282 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.572 -34.839 44.920 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.813 -33.734 44.282 1.00 0.00 H new ATOM 213 N LYS A 16 -9.062 -35.201 47.368 1.00 0.00 N ATOM 214 CA LYS A 16 -10.003 -35.384 48.470 1.00 0.00 C ATOM 215 C LYS A 16 -10.730 -36.729 48.345 1.00 0.00 C ATOM 216 O LYS A 16 -11.754 -36.952 48.989 1.00 0.00 O ATOM 217 CB LYS A 16 -11.034 -34.242 48.487 1.00 0.00 C ATOM 218 CG LYS A 16 -10.538 -32.921 49.085 1.00 0.00 C ATOM 219 CD LYS A 16 -9.382 -32.312 48.301 1.00 0.00 C ATOM 220 CE LYS A 16 -9.016 -30.927 48.830 1.00 0.00 C ATOM 221 NZ LYS A 16 -8.606 -30.957 50.258 1.00 0.00 N ATOM 0 H LYS A 16 -9.460 -34.727 46.557 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.438 -35.374 49.402 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.364 -34.058 47.465 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -11.907 -34.571 49.050 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -11.363 -32.210 49.117 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.223 -33.090 50.115 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.513 -32.968 48.363 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.653 -32.241 47.248 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.205 -30.515 48.230 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -9.870 -30.259 48.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.271 -30.015 50.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -9.419 -31.228 50.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.841 -31.650 50.385 1.00 0.00 H new ATOM 235 N ILE A 17 -10.195 -37.611 47.515 1.00 0.00 N ATOM 236 CA ILE A 17 -10.799 -38.917 47.267 1.00 0.00 C ATOM 237 C ILE A 17 -10.613 -39.854 48.464 1.00 0.00 C ATOM 238 O ILE A 17 -9.628 -39.759 49.201 1.00 0.00 O ATOM 239 CB ILE A 17 -10.197 -39.570 45.995 1.00 0.00 C ATOM 240 CG1 ILE A 17 -10.990 -40.807 45.574 1.00 0.00 C ATOM 241 CG2 ILE A 17 -8.732 -39.935 46.217 1.00 0.00 C ATOM 242 CD1 ILE A 17 -10.576 -41.360 44.227 1.00 0.00 C ATOM 0 H ILE A 17 -9.333 -37.446 46.995 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.866 -38.757 47.115 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.259 -38.838 45.190 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -10.866 -41.583 46.330 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.050 -40.556 45.545 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.330 -40.391 45.313 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.164 -39.035 46.452 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.654 -40.640 47.045 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.180 -42.236 43.992 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -10.726 -40.600 43.460 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.524 -41.642 44.257 1.00 0.00 H new ATOM 254 N ALA A 18 -11.575 -40.737 48.667 1.00 0.00 N ATOM 255 CA ALA A 18 -11.507 -41.708 49.747 1.00 0.00 C ATOM 256 C ALA A 18 -10.798 -42.970 49.275 1.00 0.00 C ATOM 257 O ALA A 18 -10.832 -43.302 48.092 1.00 0.00 O ATOM 258 CB ALA A 18 -12.900 -42.035 50.249 1.00 0.00 C ATOM 0 H ALA A 18 -12.417 -40.802 48.095 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.937 -41.278 50.571 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.834 -42.763 51.057 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.377 -41.126 50.617 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.492 -42.451 49.434 1.00 0.00 H new ATOM 264 N GLN A 19 -10.171 -43.678 50.203 1.00 0.00 N ATOM 265 CA GLN A 19 -9.406 -44.876 49.869 1.00 0.00 C ATOM 266 C GLN A 19 -10.294 -45.977 49.289 1.00 0.00 C ATOM 267 O GLN A 19 -9.905 -46.658 48.336 1.00 0.00 O ATOM 268 CB GLN A 19 -8.645 -45.398 51.084 1.00 0.00 C ATOM 269 CG GLN A 19 -7.732 -46.568 50.759 1.00 0.00 C ATOM 270 CD GLN A 19 -6.666 -46.194 49.747 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.199 -45.052 49.709 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.280 -47.138 48.918 1.00 0.00 N ATOM 0 H GLN A 19 -10.176 -43.445 51.196 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.686 -44.589 49.102 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.051 -44.589 51.508 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.359 -45.704 51.849 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.255 -46.921 51.674 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.327 -47.395 50.370 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.689 -48.070 48.980 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.571 -46.938 48.212 1.00 0.00 H new ATOM 281 N ASN A 20 -11.484 -46.146 49.848 1.00 0.00 N ATOM 282 CA ASN A 20 -12.409 -47.159 49.353 1.00 0.00 C ATOM 283 C ASN A 20 -12.850 -46.820 47.937 1.00 0.00 C ATOM 284 O ASN A 20 -13.152 -47.708 47.135 1.00 0.00 O ATOM 285 CB ASN A 20 -13.632 -47.329 50.288 1.00 0.00 C ATOM 286 CG ASN A 20 -14.528 -46.101 50.377 1.00 0.00 C ATOM 287 OD1 ASN A 20 -14.071 -44.965 50.245 1.00 0.00 O ATOM 288 ND2 ASN A 20 -15.813 -46.323 50.613 1.00 0.00 N ATOM 0 H ASN A 20 -11.831 -45.601 50.637 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.883 -48.113 49.338 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.226 -48.174 49.940 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.278 -47.579 51.288 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.460 -45.538 50.691 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -16.155 -47.278 50.717 1.00 0.00 H new ATOM 295 N ASP A 21 -12.883 -45.534 47.632 1.00 0.00 N ATOM 296 CA ASP A 21 -13.231 -45.072 46.300 1.00 0.00 C ATOM 297 C ASP A 21 -12.099 -45.380 45.318 1.00 0.00 C ATOM 298 O ASP A 21 -12.346 -45.777 44.180 1.00 0.00 O ATOM 299 CB ASP A 21 -13.533 -43.579 46.320 1.00 0.00 C ATOM 300 CG ASP A 21 -14.172 -43.099 45.039 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.387 -43.308 44.863 1.00 0.00 O ATOM 302 OD2 ASP A 21 -13.474 -42.494 44.215 1.00 0.00 O ATOM 0 H ASP A 21 -12.671 -44.787 48.294 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.126 -45.600 45.970 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.195 -43.357 47.157 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.608 -43.027 46.490 1.00 0.00 H new ATOM 307 N ILE A 22 -10.850 -45.216 45.785 1.00 0.00 N ATOM 308 CA ILE A 22 -9.664 -45.511 44.970 1.00 0.00 C ATOM 309 C ILE A 22 -9.644 -46.991 44.612 1.00 0.00 C ATOM 310 O ILE A 22 -9.409 -47.366 43.456 1.00 0.00 O ATOM 311 CB ILE A 22 -8.350 -45.176 45.740 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.229 -43.673 45.987 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.127 -45.686 44.982 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.078 -43.303 46.900 1.00 0.00 C ATOM 0 H ILE A 22 -10.637 -44.880 46.724 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.717 -44.897 44.071 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.394 -45.682 46.704 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.103 -43.164 45.031 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.159 -43.308 46.422 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.224 -45.439 45.540 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.197 -46.767 44.864 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.086 -45.216 43.999 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.051 -42.221 47.032 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.213 -43.783 47.869 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.140 -43.638 46.457 1.00 0.00 H new ATOM 326 N ASN A 23 -9.928 -47.821 45.610 1.00 0.00 N ATOM 327 CA ASN A 23 -9.968 -49.269 45.443 1.00 0.00 C ATOM 328 C ASN A 23 -11.025 -49.678 44.444 1.00 0.00 C ATOM 329 O ASN A 23 -10.820 -50.571 43.624 1.00 0.00 O ATOM 330 CB ASN A 23 -10.261 -49.942 46.783 1.00 0.00 C ATOM 331 CG ASN A 23 -9.025 -50.118 47.652 1.00 0.00 C ATOM 332 OD1 ASN A 23 -7.912 -50.264 47.146 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.206 -50.104 48.964 1.00 0.00 N ATOM 0 H ASN A 23 -10.137 -47.508 46.558 1.00 0.00 H new ATOM 0 HA ASN A 23 -8.994 -49.587 45.071 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -10.997 -49.349 47.326 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.710 -50.918 46.601 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.409 -50.216 49.590 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.143 -49.981 49.348 1.00 0.00 H new ATOM 340 N TYR A 24 -12.153 -49.040 44.531 1.00 0.00 N ATOM 341 CA TYR A 24 -13.247 -49.313 43.649 1.00 0.00 C ATOM 342 C TYR A 24 -12.899 -48.931 42.197 1.00 0.00 C ATOM 343 O TYR A 24 -13.163 -49.695 41.265 1.00 0.00 O ATOM 344 CB TYR A 24 -14.473 -48.572 44.151 1.00 0.00 C ATOM 345 CG TYR A 24 -15.691 -48.691 43.279 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.484 -49.815 43.341 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.052 -47.678 42.407 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.608 -49.943 42.563 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.181 -47.791 41.614 1.00 0.00 C ATOM 350 CZ TYR A 24 -17.955 -48.930 41.699 1.00 0.00 C ATOM 351 OH TYR A 24 -19.086 -49.057 40.924 1.00 0.00 O ATOM 0 H TYR A 24 -12.341 -48.311 45.220 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.457 -50.382 43.644 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.720 -48.942 45.146 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.223 -47.516 44.257 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.216 -50.614 44.017 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.444 -46.787 42.345 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.216 -50.833 42.629 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.453 -46.996 40.936 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.193 -48.257 40.368 1.00 0.00 H new ATOM 361 N LYS A 25 -12.288 -47.757 42.017 1.00 0.00 N ATOM 362 CA LYS A 25 -11.911 -47.285 40.687 1.00 0.00 C ATOM 363 C LYS A 25 -10.858 -48.154 40.011 1.00 0.00 C ATOM 364 O LYS A 25 -10.963 -48.429 38.817 1.00 0.00 O ATOM 365 CB LYS A 25 -11.481 -45.820 40.705 1.00 0.00 C ATOM 366 CG LYS A 25 -12.639 -44.853 40.837 1.00 0.00 C ATOM 367 CD LYS A 25 -12.160 -43.413 40.907 1.00 0.00 C ATOM 368 CE LYS A 25 -13.316 -42.426 40.780 1.00 0.00 C ATOM 369 NZ LYS A 25 -14.364 -42.642 41.806 1.00 0.00 N ATOM 0 H LYS A 25 -12.045 -47.119 42.775 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.814 -47.368 40.082 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.790 -45.662 41.533 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.935 -45.598 39.788 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.312 -44.972 39.988 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.212 -45.091 41.733 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.642 -43.247 41.852 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.437 -43.231 40.112 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.932 -41.409 40.866 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.759 -42.517 39.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.084 -41.895 41.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.810 -43.569 41.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.934 -42.613 42.753 1.00 0.00 H new ATOM 383 N VAL A 26 -9.845 -48.594 40.756 1.00 0.00 N ATOM 384 CA VAL A 26 -8.817 -49.454 40.167 1.00 0.00 C ATOM 385 C VAL A 26 -9.410 -50.773 39.691 1.00 0.00 C ATOM 386 O VAL A 26 -8.969 -51.332 38.689 1.00 0.00 O ATOM 387 CB VAL A 26 -7.606 -49.721 41.103 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.731 -48.484 41.233 1.00 0.00 C ATOM 389 CG2 VAL A 26 -8.050 -50.206 42.465 1.00 0.00 C ATOM 0 H VAL A 26 -9.714 -48.377 41.744 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.432 -48.898 39.313 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.013 -50.513 40.646 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.891 -48.700 41.894 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.355 -48.199 40.250 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.318 -47.665 41.648 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.176 -50.382 43.091 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.684 -49.452 42.931 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.611 -51.134 42.356 1.00 0.00 H new ATOM 399 N LYS A 27 -10.426 -51.255 40.401 1.00 0.00 N ATOM 400 CA LYS A 27 -11.125 -52.467 39.997 1.00 0.00 C ATOM 401 C LYS A 27 -11.737 -52.296 38.613 1.00 0.00 C ATOM 402 O LYS A 27 -11.566 -53.147 37.735 1.00 0.00 O ATOM 403 CB LYS A 27 -12.227 -52.815 41.005 1.00 0.00 C ATOM 404 CG LYS A 27 -13.251 -53.790 40.453 1.00 0.00 C ATOM 405 CD LYS A 27 -14.291 -54.178 41.478 1.00 0.00 C ATOM 406 CE LYS A 27 -15.452 -54.916 40.821 1.00 0.00 C ATOM 407 NZ LYS A 27 -14.987 -55.943 39.848 1.00 0.00 N ATOM 0 H LYS A 27 -10.781 -50.826 41.255 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.399 -53.280 39.968 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.772 -53.242 41.899 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.734 -51.900 41.311 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.745 -53.343 39.590 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.741 -54.686 40.100 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.837 -54.811 42.241 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.661 -53.286 41.983 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -16.058 -55.395 41.590 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.094 -54.198 40.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -15.768 -56.595 39.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.673 -55.476 38.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.195 -56.477 40.259 1.00 0.00 H new ATOM 421 N HIS A 28 -12.428 -51.189 38.420 1.00 0.00 N ATOM 422 CA HIS A 28 -13.060 -50.906 37.146 1.00 0.00 C ATOM 423 C HIS A 28 -12.037 -50.617 36.074 1.00 0.00 C ATOM 424 O HIS A 28 -12.211 -51.013 34.925 1.00 0.00 O ATOM 425 CB HIS A 28 -14.075 -49.774 37.266 1.00 0.00 C ATOM 426 CG HIS A 28 -15.444 -50.266 37.598 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.899 -50.433 38.888 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.454 -50.651 36.792 1.00 0.00 C ATOM 429 CE1 HIS A 28 -17.133 -50.904 38.856 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.493 -51.045 37.600 1.00 0.00 N ATOM 0 H HIS A 28 -12.566 -50.470 39.130 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.603 -51.802 36.846 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.747 -49.076 38.036 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -14.109 -49.220 36.328 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.447 -50.650 35.712 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.743 -51.134 39.717 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.397 -51.391 37.277 1.00 0.00 H new ATOM 438 N ALA A 29 -10.964 -49.936 36.451 1.00 0.00 N ATOM 439 CA ALA A 29 -9.898 -49.630 35.514 1.00 0.00 C ATOM 440 C ALA A 29 -9.318 -50.915 34.949 1.00 0.00 C ATOM 441 O ALA A 29 -9.079 -51.020 33.751 1.00 0.00 O ATOM 442 CB ALA A 29 -8.810 -48.815 36.194 1.00 0.00 C ATOM 0 H ALA A 29 -10.811 -49.587 37.397 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.310 -49.039 34.696 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.019 -48.595 35.477 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.233 -47.882 36.566 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.397 -49.383 37.027 1.00 0.00 H new ATOM 448 N LEU A 30 -9.131 -51.903 35.818 1.00 0.00 N ATOM 449 CA LEU A 30 -8.616 -53.207 35.418 1.00 0.00 C ATOM 450 C LEU A 30 -9.566 -53.877 34.441 1.00 0.00 C ATOM 451 O LEU A 30 -9.139 -54.470 33.453 1.00 0.00 O ATOM 452 CB LEU A 30 -8.417 -54.103 36.645 1.00 0.00 C ATOM 453 CG LEU A 30 -7.297 -53.686 37.600 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.335 -54.523 38.868 1.00 0.00 C ATOM 455 CD2 LEU A 30 -5.952 -53.826 36.918 1.00 0.00 C ATOM 0 H LEU A 30 -9.331 -51.823 36.815 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.654 -53.058 34.929 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.352 -54.134 37.204 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.217 -55.118 36.302 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.446 -52.642 37.874 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.531 -54.211 39.534 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.294 -54.384 39.367 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.208 -55.575 38.613 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.162 -53.527 37.607 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.801 -54.864 36.621 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.924 -53.188 36.034 1.00 0.00 H new ATOM 467 N GLU A 31 -10.860 -53.762 34.717 1.00 0.00 N ATOM 468 CA GLU A 31 -11.880 -54.359 33.878 1.00 0.00 C ATOM 469 C GLU A 31 -11.910 -53.717 32.491 1.00 0.00 C ATOM 470 O GLU A 31 -12.130 -54.396 31.496 1.00 0.00 O ATOM 471 CB GLU A 31 -13.238 -54.272 34.561 1.00 0.00 C ATOM 472 CG GLU A 31 -13.302 -55.105 35.829 1.00 0.00 C ATOM 473 CD GLU A 31 -14.631 -55.029 36.533 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.615 -55.598 36.023 1.00 0.00 O ATOM 475 OE2 GLU A 31 -14.693 -54.436 37.621 1.00 0.00 O ATOM 0 H GLU A 31 -11.225 -53.255 35.524 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.634 -55.411 33.736 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.455 -53.231 34.802 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.011 -54.607 33.870 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.090 -56.145 35.582 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.519 -54.774 36.511 1.00 0.00 H new ATOM 482 N PHE A 32 -11.710 -52.411 32.430 1.00 0.00 N ATOM 483 CA PHE A 32 -11.615 -51.732 31.142 1.00 0.00 C ATOM 484 C PHE A 32 -10.318 -52.100 30.422 1.00 0.00 C ATOM 485 O PHE A 32 -10.304 -52.273 29.204 1.00 0.00 O ATOM 486 CB PHE A 32 -11.743 -50.209 31.282 1.00 0.00 C ATOM 487 CG PHE A 32 -13.146 -49.743 31.559 1.00 0.00 C ATOM 488 CD1 PHE A 32 -14.064 -49.627 30.524 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.550 -49.422 32.842 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.353 -49.201 30.766 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.838 -48.995 33.091 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.742 -48.884 32.050 1.00 0.00 C ATOM 0 H PHE A 32 -11.611 -51.804 33.244 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.455 -52.075 30.539 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.092 -49.871 32.088 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.387 -49.738 30.366 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.765 -49.874 29.516 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.849 -49.507 33.659 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -16.057 -49.116 29.951 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -15.140 -48.748 34.098 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.751 -48.550 32.243 1.00 0.00 H new ATOM 502 N LEU A 33 -9.239 -52.231 31.185 1.00 0.00 N ATOM 503 CA LEU A 33 -7.937 -52.578 30.628 1.00 0.00 C ATOM 504 C LEU A 33 -7.950 -53.958 29.960 1.00 0.00 C ATOM 505 O LEU A 33 -7.466 -54.113 28.840 1.00 0.00 O ATOM 506 CB LEU A 33 -6.866 -52.535 31.725 1.00 0.00 C ATOM 507 CG LEU A 33 -6.513 -51.145 32.259 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.639 -51.260 33.488 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.807 -50.331 31.192 1.00 0.00 C ATOM 0 H LEU A 33 -9.241 -52.101 32.197 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.701 -51.842 29.860 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.204 -53.149 32.560 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.957 -52.996 31.337 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.437 -50.636 32.532 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.396 -50.263 33.856 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.171 -51.813 34.262 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.719 -51.786 33.233 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.563 -49.345 31.588 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.890 -50.839 30.894 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.460 -50.222 30.326 1.00 0.00 H new ATOM 521 N GLU A 34 -8.542 -54.944 30.624 1.00 0.00 N ATOM 522 CA GLU A 34 -8.613 -56.308 30.079 1.00 0.00 C ATOM 523 C GLU A 34 -9.445 -56.360 28.790 1.00 0.00 C ATOM 524 O GLU A 34 -9.341 -57.307 28.007 1.00 0.00 O ATOM 525 CB GLU A 34 -9.146 -57.303 31.120 1.00 0.00 C ATOM 526 CG GLU A 34 -10.469 -56.911 31.744 1.00 0.00 C ATOM 527 CD GLU A 34 -11.615 -57.805 31.316 1.00 0.00 C ATOM 528 OE1 GLU A 34 -12.266 -57.509 30.296 1.00 0.00 O ATOM 529 OE2 GLU A 34 -11.875 -58.814 32.000 1.00 0.00 O ATOM 0 H GLU A 34 -8.980 -54.832 31.538 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.595 -56.605 29.826 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -9.257 -58.279 30.648 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.404 -57.414 31.911 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -10.376 -56.944 32.830 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.700 -55.880 31.475 1.00 0.00 H new ATOM 536 N GLN A 35 -10.255 -55.336 28.576 1.00 0.00 N ATOM 537 CA GLN A 35 -11.059 -55.226 27.375 1.00 0.00 C ATOM 538 C GLN A 35 -10.218 -54.699 26.210 1.00 0.00 C ATOM 539 O GLN A 35 -10.728 -54.502 25.104 1.00 0.00 O ATOM 540 CB GLN A 35 -12.244 -54.298 27.621 1.00 0.00 C ATOM 541 CG GLN A 35 -13.219 -54.826 28.651 1.00 0.00 C ATOM 542 CD GLN A 35 -14.369 -53.874 28.920 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.738 -53.062 28.068 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.937 -53.962 30.106 1.00 0.00 N ATOM 0 H GLN A 35 -10.372 -54.561 29.229 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.429 -56.218 27.116 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.873 -53.326 27.948 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.772 -54.138 26.681 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.618 -55.781 28.310 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.687 -55.017 29.583 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.602 -54.648 30.783 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.712 -53.344 30.347 1.00 0.00 H new ATOM 553 N GLY A 36 -8.935 -54.458 26.471 1.00 0.00 N ATOM 554 CA GLY A 36 -8.049 -53.949 25.445 1.00 0.00 C ATOM 555 C GLY A 36 -8.158 -52.450 25.320 1.00 0.00 C ATOM 556 O GLY A 36 -8.032 -51.891 24.233 1.00 0.00 O ATOM 0 H GLY A 36 -8.495 -54.608 27.379 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.021 -54.222 25.681 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.291 -54.414 24.489 1.00 0.00 H new ATOM 560 N LYS A 37 -8.421 -51.800 26.438 1.00 0.00 N ATOM 561 CA LYS A 37 -8.598 -50.366 26.462 1.00 0.00 C ATOM 562 C LYS A 37 -7.570 -49.705 27.359 1.00 0.00 C ATOM 563 O LYS A 37 -7.000 -50.340 28.238 1.00 0.00 O ATOM 564 CB LYS A 37 -9.998 -50.034 26.958 1.00 0.00 C ATOM 565 CG LYS A 37 -11.099 -50.608 26.092 1.00 0.00 C ATOM 566 CD LYS A 37 -11.135 -49.954 24.722 1.00 0.00 C ATOM 567 CE LYS A 37 -12.220 -50.565 23.851 1.00 0.00 C ATOM 568 NZ LYS A 37 -11.921 -51.985 23.494 1.00 0.00 N ATOM 0 H LYS A 37 -8.517 -52.250 27.348 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.464 -49.986 25.449 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.113 -50.410 27.975 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.111 -48.951 27.004 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.950 -51.682 25.979 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.060 -50.470 26.587 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.312 -48.884 24.831 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.166 -50.069 24.235 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.175 -50.517 24.375 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.326 -49.977 22.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.570 -52.298 22.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.940 -52.059 23.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.045 -52.587 24.333 1.00 0.00 H new ATOM 582 N HIS A 38 -7.326 -48.436 27.114 1.00 0.00 N ATOM 583 CA HIS A 38 -6.408 -47.657 27.931 1.00 0.00 C ATOM 584 C HIS A 38 -7.198 -46.792 28.889 1.00 0.00 C ATOM 585 O HIS A 38 -8.310 -46.362 28.565 1.00 0.00 O ATOM 586 CB HIS A 38 -5.526 -46.748 27.062 1.00 0.00 C ATOM 587 CG HIS A 38 -4.444 -47.445 26.290 1.00 0.00 C ATOM 588 ND1 HIS A 38 -3.227 -46.859 26.031 1.00 0.00 N ATOM 589 CD2 HIS A 38 -4.403 -48.662 25.701 1.00 0.00 C ATOM 590 CE1 HIS A 38 -2.485 -47.680 25.317 1.00 0.00 C ATOM 591 NE2 HIS A 38 -3.174 -48.783 25.106 1.00 0.00 N ATOM 0 H HIS A 38 -7.753 -47.914 26.349 1.00 0.00 H new ATOM 0 HA HIS A 38 -5.769 -48.351 28.477 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.166 -46.216 26.358 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.065 -45.997 27.704 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -5.191 -49.400 25.700 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -1.483 -47.483 24.965 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -2.846 -49.596 24.584 1.00 0.00 H new ATOM 599 N VAL A 39 -6.642 -46.546 30.059 1.00 0.00 N ATOM 600 CA VAL A 39 -7.275 -45.672 31.030 1.00 0.00 C ATOM 601 C VAL A 39 -6.382 -44.483 31.316 1.00 0.00 C ATOM 602 O VAL A 39 -5.180 -44.634 31.573 1.00 0.00 O ATOM 603 CB VAL A 39 -7.608 -46.400 32.374 1.00 0.00 C ATOM 604 CG1 VAL A 39 -7.967 -45.391 33.461 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.759 -47.364 32.196 1.00 0.00 C ATOM 0 H VAL A 39 -5.751 -46.940 30.362 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.217 -45.345 30.591 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.719 -46.955 32.674 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.195 -45.919 34.387 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.125 -44.718 33.625 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.837 -44.814 33.149 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.971 -47.857 33.145 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.643 -46.818 31.866 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.494 -48.113 31.449 1.00 0.00 H new ATOM 615 N ARG A 40 -6.957 -43.311 31.241 1.00 0.00 N ATOM 616 CA ARG A 40 -6.251 -42.106 31.559 1.00 0.00 C ATOM 617 C ARG A 40 -6.782 -41.571 32.878 1.00 0.00 C ATOM 618 O ARG A 40 -7.957 -41.208 32.984 1.00 0.00 O ATOM 619 CB ARG A 40 -6.455 -41.065 30.455 1.00 0.00 C ATOM 620 CG ARG A 40 -5.648 -39.789 30.651 1.00 0.00 C ATOM 621 CD ARG A 40 -5.931 -38.786 29.544 1.00 0.00 C ATOM 622 NE ARG A 40 -5.023 -37.632 29.593 1.00 0.00 N ATOM 623 CZ ARG A 40 -5.180 -36.520 28.856 1.00 0.00 C ATOM 624 NH1 ARG A 40 -6.228 -36.394 28.045 1.00 0.00 N ATOM 625 NH2 ARG A 40 -4.287 -35.537 28.933 1.00 0.00 N ATOM 0 H ARG A 40 -7.927 -43.169 30.958 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.184 -42.315 31.641 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.186 -41.509 29.497 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.513 -40.809 30.402 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -5.890 -39.347 31.617 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.584 -40.027 30.667 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.836 -39.279 28.577 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -6.961 -38.439 29.626 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.224 -37.678 30.226 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.916 -37.144 27.981 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.343 -35.548 27.488 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -3.482 -35.627 29.552 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -4.408 -34.693 28.373 1.00 0.00 H new ATOM 639 N PHE A 41 -5.940 -41.541 33.879 1.00 0.00 N ATOM 640 CA PHE A 41 -6.340 -41.040 35.178 1.00 0.00 C ATOM 641 C PHE A 41 -6.063 -39.566 35.244 1.00 0.00 C ATOM 642 O PHE A 41 -4.937 -39.140 35.041 1.00 0.00 O ATOM 643 CB PHE A 41 -5.588 -41.755 36.304 1.00 0.00 C ATOM 644 CG PHE A 41 -6.023 -43.173 36.541 1.00 0.00 C ATOM 645 CD1 PHE A 41 -7.151 -43.445 37.297 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.305 -44.232 36.014 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.554 -44.747 37.528 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.699 -45.535 36.242 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.826 -45.795 37.000 1.00 0.00 C ATOM 0 H PHE A 41 -4.972 -41.857 33.824 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.405 -41.229 35.309 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.523 -41.749 36.073 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.718 -41.189 37.227 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.724 -42.629 37.712 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.426 -44.037 35.417 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.436 -44.944 38.120 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -5.127 -46.352 35.828 1.00 0.00 H new ATOM 0 HZ PHE A 41 -7.136 -46.814 37.178 1.00 0.00 H new ATOM 659 N ARG A 42 -7.091 -38.787 35.497 1.00 0.00 N ATOM 660 CA ARG A 42 -6.952 -37.347 35.567 1.00 0.00 C ATOM 661 C ARG A 42 -7.496 -36.845 36.885 1.00 0.00 C ATOM 662 O ARG A 42 -8.663 -37.035 37.190 1.00 0.00 O ATOM 663 CB ARG A 42 -7.684 -36.693 34.386 1.00 0.00 C ATOM 664 CG ARG A 42 -7.096 -37.078 33.034 1.00 0.00 C ATOM 665 CD ARG A 42 -7.894 -36.518 31.870 1.00 0.00 C ATOM 666 NE ARG A 42 -7.878 -35.054 31.821 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.646 -34.327 31.002 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.499 -34.931 30.183 1.00 0.00 N ATOM 669 NH2 ARG A 42 -8.550 -33.001 30.993 1.00 0.00 N ATOM 0 H ARG A 42 -8.039 -39.128 35.659 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.897 -37.080 35.505 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.735 -36.980 34.414 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.646 -35.609 34.497 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.069 -36.718 32.973 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.058 -38.164 32.954 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.492 -36.912 30.937 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.925 -36.863 31.943 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.244 -34.560 32.449 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.568 -35.949 30.179 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.085 -34.377 29.558 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.888 -32.533 31.613 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -9.138 -32.451 30.366 1.00 0.00 H new ATOM 683 N VAL A 43 -6.658 -36.189 37.655 1.00 0.00 N ATOM 684 CA VAL A 43 -7.050 -35.724 38.971 1.00 0.00 C ATOM 685 C VAL A 43 -7.103 -34.209 39.034 1.00 0.00 C ATOM 686 O VAL A 43 -6.184 -33.517 38.586 1.00 0.00 O ATOM 687 CB VAL A 43 -6.101 -36.267 40.089 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.656 -35.962 39.780 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.478 -35.698 41.446 1.00 0.00 C ATOM 0 H VAL A 43 -5.698 -35.964 37.394 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.051 -36.117 39.151 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.221 -37.350 40.120 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.023 -36.353 40.577 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.380 -36.429 38.835 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.520 -34.883 39.705 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.803 -36.091 42.206 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.400 -34.611 41.419 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.502 -35.983 41.688 1.00 0.00 H new ATOM 699 N PHE A 44 -8.197 -33.706 39.568 1.00 0.00 N ATOM 700 CA PHE A 44 -8.383 -32.286 39.748 1.00 0.00 C ATOM 701 C PHE A 44 -7.934 -31.908 41.152 1.00 0.00 C ATOM 702 O PHE A 44 -8.453 -32.444 42.144 1.00 0.00 O ATOM 703 CB PHE A 44 -9.863 -31.929 39.540 1.00 0.00 C ATOM 704 CG PHE A 44 -10.184 -30.462 39.667 1.00 0.00 C ATOM 705 CD1 PHE A 44 -9.968 -29.601 38.603 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.710 -29.950 40.839 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.271 -28.256 38.708 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.013 -28.605 40.951 1.00 0.00 C ATOM 709 CZ PHE A 44 -10.795 -27.757 39.883 1.00 0.00 C ATOM 0 H PHE A 44 -8.982 -34.273 39.889 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.790 -31.733 39.020 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.168 -32.269 38.550 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.461 -32.481 40.265 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.558 -29.985 37.681 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.886 -30.608 41.677 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.098 -27.596 37.871 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.420 -28.218 41.874 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.034 -26.707 39.967 1.00 0.00 H new ATOM 719 N LEU A 45 -6.970 -31.011 41.251 1.00 0.00 N ATOM 720 CA LEU A 45 -6.462 -30.615 42.549 1.00 0.00 C ATOM 721 C LEU A 45 -7.336 -29.516 43.136 1.00 0.00 C ATOM 722 O LEU A 45 -7.069 -28.329 42.966 1.00 0.00 O ATOM 723 CB LEU A 45 -5.003 -30.155 42.461 1.00 0.00 C ATOM 724 CG LEU A 45 -4.039 -31.107 41.738 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.613 -30.615 41.866 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.163 -32.522 42.268 1.00 0.00 C ATOM 0 H LEU A 45 -6.528 -30.548 40.457 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.494 -31.483 43.207 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -4.977 -29.190 41.955 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.632 -29.994 43.473 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.310 -31.121 40.682 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.943 -31.302 41.348 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.529 -29.623 41.423 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.338 -30.566 42.920 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.468 -33.172 41.736 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.929 -32.534 43.332 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.182 -32.879 42.117 1.00 0.00 H new ATOM 738 N LYS A 46 -8.396 -29.934 43.795 1.00 0.00 N ATOM 739 CA LYS A 46 -9.357 -29.023 44.393 1.00 0.00 C ATOM 740 C LYS A 46 -8.725 -28.230 45.532 1.00 0.00 C ATOM 741 O LYS A 46 -8.102 -28.802 46.424 1.00 0.00 O ATOM 742 CB LYS A 46 -10.567 -29.817 44.898 1.00 0.00 C ATOM 743 CG LYS A 46 -11.670 -28.968 45.506 1.00 0.00 C ATOM 744 CD LYS A 46 -12.848 -29.823 45.954 1.00 0.00 C ATOM 745 CE LYS A 46 -13.596 -30.416 44.764 1.00 0.00 C ATOM 746 NZ LYS A 46 -14.830 -31.127 45.176 1.00 0.00 N ATOM 0 H LYS A 46 -8.619 -30.920 43.933 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.683 -28.311 43.635 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.982 -30.389 44.068 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.228 -30.537 45.643 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.276 -28.414 46.358 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.009 -28.233 44.776 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.491 -30.627 46.597 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.532 -29.218 46.550 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -13.853 -29.620 44.066 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.941 -31.107 44.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -15.305 -31.513 44.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.584 -31.904 45.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.468 -30.463 45.660 1.00 0.00 H new ATOM 760 N GLY A 47 -8.893 -26.918 45.489 1.00 0.00 N ATOM 761 CA GLY A 47 -8.347 -26.064 46.518 1.00 0.00 C ATOM 762 C GLY A 47 -7.117 -25.320 46.047 1.00 0.00 C ATOM 763 O GLY A 47 -6.996 -24.983 44.868 1.00 0.00 O ATOM 0 H GLY A 47 -9.402 -26.428 44.753 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.105 -25.347 46.833 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.094 -26.665 47.391 1.00 0.00 H new ATOM 767 N ARG A 48 -6.204 -25.058 46.964 1.00 0.00 N ATOM 768 CA ARG A 48 -4.963 -24.365 46.641 1.00 0.00 C ATOM 769 C ARG A 48 -3.850 -25.371 46.375 1.00 0.00 C ATOM 770 O ARG A 48 -2.688 -25.001 46.208 1.00 0.00 O ATOM 771 CB ARG A 48 -4.564 -23.426 47.787 1.00 0.00 C ATOM 772 CG ARG A 48 -5.495 -22.233 47.972 1.00 0.00 C ATOM 773 CD ARG A 48 -5.089 -21.402 49.183 1.00 0.00 C ATOM 774 NE ARG A 48 -5.939 -20.218 49.356 1.00 0.00 N ATOM 775 CZ ARG A 48 -5.976 -19.472 50.466 1.00 0.00 C ATOM 776 NH1 ARG A 48 -5.268 -19.829 51.534 1.00 0.00 N ATOM 777 NH2 ARG A 48 -6.730 -18.374 50.505 1.00 0.00 N ATOM 0 H ARG A 48 -6.297 -25.316 47.947 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.121 -23.771 45.741 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.534 -23.997 48.715 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.554 -23.059 47.606 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.476 -21.611 47.077 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.520 -22.583 48.095 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.143 -22.020 50.079 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.051 -21.088 49.074 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.541 -19.946 48.579 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.696 -20.673 51.508 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -5.298 -19.259 52.379 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.278 -18.103 49.689 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.759 -17.805 51.351 1.00 0.00 H new ATOM 791 N GLU A 49 -4.226 -26.647 46.312 1.00 0.00 N ATOM 792 CA GLU A 49 -3.274 -27.738 46.119 1.00 0.00 C ATOM 793 C GLU A 49 -2.571 -27.643 44.758 1.00 0.00 C ATOM 794 O GLU A 49 -1.515 -28.236 44.562 1.00 0.00 O ATOM 795 CB GLU A 49 -3.990 -29.083 46.232 1.00 0.00 C ATOM 796 CG GLU A 49 -4.852 -29.230 47.481 1.00 0.00 C ATOM 797 CD GLU A 49 -4.081 -29.046 48.774 1.00 0.00 C ATOM 798 OE1 GLU A 49 -3.135 -29.820 49.031 1.00 0.00 O ATOM 799 OE2 GLU A 49 -4.433 -28.134 49.548 1.00 0.00 O ATOM 0 H GLU A 49 -5.196 -26.953 46.393 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.516 -27.656 46.898 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.618 -29.222 45.352 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.246 -29.880 46.222 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.661 -28.500 47.443 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.314 -30.217 47.480 1.00 0.00 H new ATOM 806 N MET A 50 -3.157 -26.878 43.829 1.00 0.00 N ATOM 807 CA MET A 50 -2.596 -26.721 42.482 1.00 0.00 C ATOM 808 C MET A 50 -1.244 -26.014 42.496 1.00 0.00 C ATOM 809 O MET A 50 -0.562 -25.948 41.469 1.00 0.00 O ATOM 810 CB MET A 50 -3.566 -25.975 41.572 1.00 0.00 C ATOM 811 CG MET A 50 -4.811 -26.766 41.215 1.00 0.00 C ATOM 812 SD MET A 50 -5.922 -25.869 40.115 1.00 0.00 S ATOM 813 CE MET A 50 -7.323 -26.979 40.092 1.00 0.00 C ATOM 0 H MET A 50 -4.020 -26.358 43.986 1.00 0.00 H new ATOM 0 HA MET A 50 -2.439 -27.726 42.090 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.865 -25.047 42.060 1.00 0.00 H new ATOM 0 HB3 MET A 50 -3.047 -25.699 40.654 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.517 -27.702 40.741 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.345 -27.026 42.129 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.991 -26.705 39.276 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.975 -28.002 39.948 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.859 -26.908 41.039 1.00 0.00 H new ATOM 823 N ALA A 51 -0.875 -25.465 43.645 1.00 0.00 N ATOM 824 CA ALA A 51 0.427 -24.830 43.810 1.00 0.00 C ATOM 825 C ALA A 51 1.546 -25.868 43.688 1.00 0.00 C ATOM 826 O ALA A 51 2.676 -25.548 43.293 1.00 0.00 O ATOM 827 CB ALA A 51 0.503 -24.116 45.150 1.00 0.00 C ATOM 0 H ALA A 51 -1.461 -25.446 44.480 1.00 0.00 H new ATOM 0 HA ALA A 51 0.556 -24.091 43.019 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.481 -23.647 45.258 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.273 -23.352 45.200 1.00 0.00 H new ATOM 0 HB3 ALA A 51 0.355 -24.836 45.955 1.00 0.00 H new ATOM 833 N THR A 52 1.219 -27.109 44.023 1.00 0.00 N ATOM 834 CA THR A 52 2.159 -28.197 43.943 1.00 0.00 C ATOM 835 C THR A 52 1.551 -29.392 43.182 1.00 0.00 C ATOM 836 O THR A 52 0.637 -30.067 43.665 1.00 0.00 O ATOM 837 CB THR A 52 2.661 -28.631 45.351 1.00 0.00 C ATOM 838 OG1 THR A 52 3.498 -29.791 45.243 1.00 0.00 O ATOM 839 CG2 THR A 52 1.502 -28.918 46.299 1.00 0.00 C ATOM 0 H THR A 52 0.294 -27.380 44.356 1.00 0.00 H new ATOM 0 HA THR A 52 3.025 -27.840 43.385 1.00 0.00 H new ATOM 0 HB THR A 52 3.237 -27.803 45.764 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.809 -30.054 46.134 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.893 -29.218 47.271 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.895 -28.020 46.413 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.889 -29.721 45.891 1.00 0.00 H new ATOM 847 N PRO A 53 2.051 -29.649 41.965 1.00 0.00 N ATOM 848 CA PRO A 53 1.578 -30.756 41.115 1.00 0.00 C ATOM 849 C PRO A 53 1.850 -32.118 41.744 1.00 0.00 C ATOM 850 O PRO A 53 1.217 -33.119 41.391 1.00 0.00 O ATOM 851 CB PRO A 53 2.407 -30.599 39.834 1.00 0.00 C ATOM 852 CG PRO A 53 2.889 -29.191 39.862 1.00 0.00 C ATOM 853 CD PRO A 53 3.107 -28.873 41.302 1.00 0.00 C ATOM 0 HA PRO A 53 0.501 -30.715 40.955 1.00 0.00 H new ATOM 0 HB2 PRO A 53 3.240 -31.302 39.814 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.804 -30.793 38.947 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.811 -29.081 39.292 1.00 0.00 H new ATOM 0 HG3 PRO A 53 2.157 -28.517 39.418 1.00 0.00 H new ATOM 0 HD2 PRO A 53 4.100 -29.171 41.637 1.00 0.00 H new ATOM 0 HD3 PRO A 53 3.011 -27.806 41.500 1.00 0.00 H new ATOM 861 N GLU A 54 2.785 -32.139 42.687 1.00 0.00 N ATOM 862 CA GLU A 54 3.205 -33.359 43.356 1.00 0.00 C ATOM 863 C GLU A 54 2.049 -34.022 44.088 1.00 0.00 C ATOM 864 O GLU A 54 2.020 -35.243 44.230 1.00 0.00 O ATOM 865 CB GLU A 54 4.335 -33.051 44.328 1.00 0.00 C ATOM 866 CG GLU A 54 5.567 -32.489 43.651 1.00 0.00 C ATOM 867 CD GLU A 54 6.683 -32.194 44.619 1.00 0.00 C ATOM 868 OE1 GLU A 54 7.272 -33.150 45.171 1.00 0.00 O ATOM 869 OE2 GLU A 54 6.979 -31.008 44.839 1.00 0.00 O ATOM 0 H GLU A 54 3.274 -31.304 43.009 1.00 0.00 H new ATOM 0 HA GLU A 54 3.558 -34.056 42.596 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.981 -32.339 45.073 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.605 -33.962 44.862 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.920 -33.198 42.902 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.300 -31.574 43.122 1.00 0.00 H new ATOM 876 N ALA A 55 1.098 -33.218 44.543 1.00 0.00 N ATOM 877 CA ALA A 55 -0.077 -33.744 45.234 1.00 0.00 C ATOM 878 C ALA A 55 -0.844 -34.709 44.323 1.00 0.00 C ATOM 879 O ALA A 55 -1.252 -35.795 44.744 1.00 0.00 O ATOM 880 CB ALA A 55 -0.980 -32.608 45.689 1.00 0.00 C ATOM 0 H ALA A 55 1.114 -32.203 44.448 1.00 0.00 H new ATOM 0 HA ALA A 55 0.256 -34.292 46.116 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -1.850 -33.018 46.202 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.431 -31.957 46.370 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.307 -32.034 44.822 1.00 0.00 H new ATOM 886 N GLY A 56 -1.024 -34.305 43.072 1.00 0.00 N ATOM 887 CA GLY A 56 -1.701 -35.149 42.104 1.00 0.00 C ATOM 888 C GLY A 56 -0.871 -36.348 41.729 1.00 0.00 C ATOM 889 O GLY A 56 -1.391 -37.452 41.573 1.00 0.00 O ATOM 0 H GLY A 56 -0.712 -33.404 42.709 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.654 -35.481 42.515 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.925 -34.568 41.209 1.00 0.00 H new ATOM 893 N VAL A 57 0.428 -36.132 41.596 1.00 0.00 N ATOM 894 CA VAL A 57 1.353 -37.188 41.219 1.00 0.00 C ATOM 895 C VAL A 57 1.385 -38.285 42.284 1.00 0.00 C ATOM 896 O VAL A 57 1.317 -39.465 41.966 1.00 0.00 O ATOM 897 CB VAL A 57 2.783 -36.627 40.992 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.745 -37.728 40.592 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.764 -35.547 39.928 1.00 0.00 C ATOM 0 H VAL A 57 0.869 -35.224 41.746 1.00 0.00 H new ATOM 0 HA VAL A 57 0.999 -37.617 40.281 1.00 0.00 H new ATOM 0 HB VAL A 57 3.126 -36.196 41.933 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.738 -37.306 40.440 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.787 -38.479 41.381 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.402 -38.192 39.667 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.774 -35.164 39.780 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.394 -35.965 38.992 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.110 -34.735 40.246 1.00 0.00 H new ATOM 909 N ALA A 58 1.448 -37.877 43.550 1.00 0.00 N ATOM 910 CA ALA A 58 1.495 -38.818 44.669 1.00 0.00 C ATOM 911 C ALA A 58 0.249 -39.702 44.705 1.00 0.00 C ATOM 912 O ALA A 58 0.327 -40.894 45.018 1.00 0.00 O ATOM 913 CB ALA A 58 1.654 -38.070 45.986 1.00 0.00 C ATOM 0 H ALA A 58 1.468 -36.896 43.828 1.00 0.00 H new ATOM 0 HA ALA A 58 2.360 -39.465 44.525 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.687 -38.784 46.809 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.579 -37.494 45.968 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.809 -37.395 46.125 1.00 0.00 H new ATOM 919 N LEU A 59 -0.897 -39.113 44.382 1.00 0.00 N ATOM 920 CA LEU A 59 -2.154 -39.853 44.331 1.00 0.00 C ATOM 921 C LEU A 59 -2.061 -40.944 43.266 1.00 0.00 C ATOM 922 O LEU A 59 -2.434 -42.097 43.498 1.00 0.00 O ATOM 923 CB LEU A 59 -3.302 -38.893 43.983 1.00 0.00 C ATOM 924 CG LEU A 59 -4.696 -39.519 43.842 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.228 -39.971 45.185 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.654 -38.544 43.196 1.00 0.00 C ATOM 0 H LEU A 59 -0.982 -38.123 44.151 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.345 -40.309 45.302 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.349 -38.124 44.754 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.056 -38.392 43.047 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.607 -40.396 43.200 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.217 -40.411 45.055 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.554 -40.714 45.612 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.297 -39.115 45.856 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.637 -39.006 43.105 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.730 -37.647 43.811 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.286 -38.275 42.206 1.00 0.00 H new ATOM 938 N LEU A 60 -1.539 -40.568 42.109 1.00 0.00 N ATOM 939 CA LEU A 60 -1.364 -41.486 41.004 1.00 0.00 C ATOM 940 C LEU A 60 -0.344 -42.565 41.342 1.00 0.00 C ATOM 941 O LEU A 60 -0.523 -43.719 40.984 1.00 0.00 O ATOM 942 CB LEU A 60 -0.971 -40.731 39.741 1.00 0.00 C ATOM 943 CG LEU A 60 -2.045 -39.793 39.186 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.533 -39.048 37.979 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.305 -40.571 38.839 1.00 0.00 C ATOM 0 H LEU A 60 -1.226 -39.617 41.914 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.316 -41.983 40.820 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.074 -40.148 39.949 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.709 -41.455 38.970 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.292 -39.063 39.957 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.313 -38.387 37.601 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.661 -38.457 38.259 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.254 -39.761 37.203 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.058 -39.888 38.446 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.072 -41.325 38.087 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.690 -41.058 39.735 1.00 0.00 H new ATOM 957 N GLU A 61 0.724 -42.174 42.036 1.00 0.00 N ATOM 958 CA GLU A 61 1.757 -43.112 42.474 1.00 0.00 C ATOM 959 C GLU A 61 1.142 -44.240 43.302 1.00 0.00 C ATOM 960 O GLU A 61 1.472 -45.417 43.112 1.00 0.00 O ATOM 961 CB GLU A 61 2.809 -42.380 43.314 1.00 0.00 C ATOM 962 CG GLU A 61 3.642 -41.372 42.541 1.00 0.00 C ATOM 963 CD GLU A 61 4.561 -42.017 41.532 1.00 0.00 C ATOM 964 OE1 GLU A 61 5.456 -42.791 41.950 1.00 0.00 O ATOM 965 OE2 GLU A 61 4.413 -41.756 40.327 1.00 0.00 O ATOM 0 H GLU A 61 0.897 -41.206 42.309 1.00 0.00 H new ATOM 0 HA GLU A 61 2.230 -43.539 41.589 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.307 -41.866 44.134 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.476 -43.117 43.761 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.977 -40.677 42.027 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.236 -40.785 43.242 1.00 0.00 H new ATOM 972 N LYS A 62 0.252 -43.874 44.223 1.00 0.00 N ATOM 973 CA LYS A 62 -0.416 -44.847 45.076 1.00 0.00 C ATOM 974 C LYS A 62 -1.326 -45.756 44.257 1.00 0.00 C ATOM 975 O LYS A 62 -1.383 -46.965 44.477 1.00 0.00 O ATOM 976 CB LYS A 62 -1.228 -44.143 46.160 1.00 0.00 C ATOM 977 CG LYS A 62 -1.788 -45.090 47.197 1.00 0.00 C ATOM 978 CD LYS A 62 -2.495 -44.354 48.313 1.00 0.00 C ATOM 979 CE LYS A 62 -3.006 -45.331 49.357 1.00 0.00 C ATOM 980 NZ LYS A 62 -3.668 -44.648 50.491 1.00 0.00 N ATOM 0 H LYS A 62 -0.022 -42.907 44.395 1.00 0.00 H new ATOM 0 HA LYS A 62 0.352 -45.458 45.549 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -0.597 -43.405 46.655 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.049 -43.599 45.694 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.484 -45.780 46.720 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.979 -45.690 47.614 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -1.812 -43.642 48.777 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.327 -43.779 47.907 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.709 -46.022 48.891 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -2.174 -45.927 49.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.341 -45.064 51.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.431 -43.636 50.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.699 -44.763 50.412 1.00 0.00 H new ATOM 994 N ILE A 63 -2.045 -45.160 43.329 1.00 0.00 N ATOM 995 CA ILE A 63 -2.951 -45.892 42.453 1.00 0.00 C ATOM 996 C ILE A 63 -2.191 -46.853 41.551 1.00 0.00 C ATOM 997 O ILE A 63 -2.607 -47.995 41.350 1.00 0.00 O ATOM 998 CB ILE A 63 -3.800 -44.927 41.604 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.753 -44.164 42.516 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.572 -45.675 40.518 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.513 -43.071 41.827 1.00 0.00 C ATOM 0 H ILE A 63 -2.022 -44.155 43.157 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.618 -46.474 43.089 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.137 -44.223 41.102 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.463 -44.867 42.952 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.184 -43.733 43.340 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.161 -44.966 39.936 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.870 -46.189 39.861 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.236 -46.405 40.981 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.169 -42.576 42.543 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.812 -42.345 41.415 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.111 -43.496 41.021 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.082 -46.383 41.024 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.257 -47.163 40.129 1.00 0.00 C ATOM 1015 C TRP A 64 0.155 -48.497 40.746 1.00 0.00 C ATOM 1016 O TRP A 64 0.047 -49.531 40.101 1.00 0.00 O ATOM 1017 CB TRP A 64 0.986 -46.370 39.704 1.00 0.00 C ATOM 1018 CG TRP A 64 1.977 -47.208 38.970 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.268 -47.461 39.328 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.743 -47.946 37.776 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.844 -48.305 38.413 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.934 -48.614 37.461 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.643 -48.107 36.938 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 3.054 -49.424 36.358 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.770 -48.910 35.841 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.964 -49.563 35.565 1.00 0.00 C ATOM 0 H TRP A 64 -0.726 -45.445 41.205 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.859 -47.379 39.246 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.682 -45.536 39.072 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.460 -45.943 40.588 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.762 -47.058 40.200 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.805 -48.645 38.445 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.291 -47.608 37.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.981 -49.930 36.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.072 -49.039 35.177 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.026 -50.199 34.694 1.00 0.00 H new ATOM 1037 N THR A 65 0.583 -48.486 41.996 1.00 0.00 N ATOM 1038 CA THR A 65 1.013 -49.719 42.638 1.00 0.00 C ATOM 1039 C THR A 65 -0.155 -50.695 42.834 1.00 0.00 C ATOM 1040 O THR A 65 0.043 -51.893 43.035 1.00 0.00 O ATOM 1041 CB THR A 65 1.730 -49.447 43.976 1.00 0.00 C ATOM 1042 OG1 THR A 65 0.978 -48.510 44.757 1.00 0.00 O ATOM 1043 CG2 THR A 65 3.128 -48.901 43.729 1.00 0.00 C ATOM 0 H THR A 65 0.642 -47.652 42.580 1.00 0.00 H new ATOM 0 HA THR A 65 1.731 -50.189 41.966 1.00 0.00 H new ATOM 0 HB THR A 65 1.809 -50.387 44.521 1.00 0.00 H new ATOM 0 HG1 THR A 65 0.120 -48.332 44.318 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.620 -48.715 44.684 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.707 -49.627 43.158 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.061 -47.969 43.168 1.00 0.00 H new ATOM 1051 N MET A 66 -1.369 -50.168 42.798 1.00 0.00 N ATOM 1052 CA MET A 66 -2.566 -50.979 42.913 1.00 0.00 C ATOM 1053 C MET A 66 -2.856 -51.747 41.611 1.00 0.00 C ATOM 1054 O MET A 66 -3.281 -52.898 41.645 1.00 0.00 O ATOM 1055 CB MET A 66 -3.773 -50.108 43.273 1.00 0.00 C ATOM 1056 CG MET A 66 -3.672 -49.427 44.628 1.00 0.00 C ATOM 1057 SD MET A 66 -3.458 -50.587 45.993 1.00 0.00 S ATOM 1058 CE MET A 66 -5.005 -51.492 45.923 1.00 0.00 C ATOM 0 H MET A 66 -1.550 -49.170 42.689 1.00 0.00 H new ATOM 0 HA MET A 66 -2.392 -51.704 43.708 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.898 -49.345 42.505 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.670 -50.727 43.256 1.00 0.00 H new ATOM 0 HG2 MET A 66 -2.833 -48.731 44.616 1.00 0.00 H new ATOM 0 HG3 MET A 66 -4.573 -48.837 44.799 1.00 0.00 H new ATOM 0 HE1 MET A 66 -5.158 -52.024 46.862 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.827 -50.795 45.762 1.00 0.00 H new ATOM 0 HE3 MET A 66 -4.971 -52.208 45.102 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.617 -51.091 40.467 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.966 -51.665 39.151 1.00 0.00 C ATOM 1070 C ILE A 67 -1.768 -52.193 38.370 1.00 0.00 C ATOM 1071 O ILE A 67 -1.946 -52.823 37.339 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.694 -50.630 38.264 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.888 -49.322 38.189 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -5.102 -50.386 38.773 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.474 -48.297 37.244 1.00 0.00 C ATOM 0 H ILE A 67 -2.186 -50.168 40.421 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.618 -52.507 39.382 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.773 -51.031 37.253 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.824 -48.888 39.187 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.870 -49.551 37.875 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.598 -49.654 38.135 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.662 -51.321 38.756 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.059 -50.007 39.794 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.851 -47.403 37.245 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.512 -48.711 36.236 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.482 -48.037 37.568 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.558 -51.953 38.856 1.00 0.00 N ATOM 1088 CA GLU A 68 0.659 -52.399 38.149 1.00 0.00 C ATOM 1089 C GLU A 68 0.676 -53.925 37.941 1.00 0.00 C ATOM 1090 O GLU A 68 1.456 -54.451 37.138 1.00 0.00 O ATOM 1091 CB GLU A 68 1.920 -51.972 38.892 1.00 0.00 C ATOM 1092 CG GLU A 68 2.047 -52.577 40.271 1.00 0.00 C ATOM 1093 CD GLU A 68 3.468 -52.950 40.610 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.253 -52.065 40.974 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.808 -54.152 40.506 1.00 0.00 O ATOM 0 H GLU A 68 -0.382 -51.457 39.729 1.00 0.00 H new ATOM 0 HA GLU A 68 0.643 -51.918 37.171 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.792 -52.252 38.301 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.929 -50.886 38.979 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.675 -51.868 41.011 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.417 -53.464 40.334 1.00 0.00 H new ATOM 1102 N ASN A 69 -0.160 -54.622 38.685 1.00 0.00 N ATOM 1103 CA ASN A 69 -0.267 -56.066 38.576 1.00 0.00 C ATOM 1104 C ASN A 69 -0.788 -56.494 37.195 1.00 0.00 C ATOM 1105 O ASN A 69 -0.269 -57.442 36.602 1.00 0.00 O ATOM 1106 CB ASN A 69 -1.147 -56.651 39.710 1.00 0.00 C ATOM 1107 CG ASN A 69 -2.446 -55.876 39.945 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -2.980 -55.235 39.047 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -2.958 -55.934 41.164 1.00 0.00 N ATOM 0 H ASN A 69 -0.782 -54.207 39.379 1.00 0.00 H new ATOM 0 HA ASN A 69 0.738 -56.474 38.687 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -1.390 -57.686 39.471 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -0.570 -56.664 40.635 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -3.822 -55.436 41.378 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -2.489 -56.477 41.889 1.00 0.00 H new ATOM 1116 N GLU A 70 -1.776 -55.771 36.671 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.377 -56.108 35.379 1.00 0.00 C ATOM 1118 C GLU A 70 -2.308 -54.917 34.416 1.00 0.00 C ATOM 1119 O GLU A 70 -2.946 -54.911 33.356 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.835 -56.515 35.580 1.00 0.00 C ATOM 1121 CG GLU A 70 -4.022 -57.678 36.533 1.00 0.00 C ATOM 1122 CD GLU A 70 -5.475 -58.068 36.709 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -6.143 -57.512 37.606 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -5.949 -58.952 35.967 1.00 0.00 O ATOM 0 H GLU A 70 -2.178 -54.948 37.120 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.818 -56.938 34.947 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.393 -55.657 35.955 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.265 -56.777 34.613 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.463 -58.537 36.164 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.601 -57.417 37.504 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.497 -53.939 34.762 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.382 -52.725 33.969 1.00 0.00 C ATOM 1133 C ALA A 71 0.061 -52.278 33.884 1.00 0.00 C ATOM 1134 O ALA A 71 0.817 -52.409 34.845 1.00 0.00 O ATOM 1135 CB ALA A 71 -2.247 -51.609 34.554 1.00 0.00 C ATOM 0 H ALA A 71 -0.903 -53.958 35.591 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.738 -52.946 32.963 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.144 -50.711 33.944 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.290 -51.924 34.563 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.924 -51.394 35.573 1.00 0.00 H new ATOM 1141 N ASN A 72 0.444 -51.777 32.733 1.00 0.00 N ATOM 1142 CA ASN A 72 1.788 -51.285 32.529 1.00 0.00 C ATOM 1143 C ASN A 72 1.760 -49.784 32.275 1.00 0.00 C ATOM 1144 O ASN A 72 0.810 -49.259 31.681 1.00 0.00 O ATOM 1145 CB ASN A 72 2.503 -52.023 31.381 1.00 0.00 C ATOM 1146 CG ASN A 72 1.824 -51.861 30.036 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.071 -50.900 29.312 1.00 0.00 O ATOM 1148 ND2 ASN A 72 0.991 -52.814 29.682 1.00 0.00 N ATOM 0 H ASN A 72 -0.162 -51.699 31.916 1.00 0.00 H new ATOM 0 HA ASN A 72 2.358 -51.481 33.437 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.527 -51.657 31.308 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.561 -53.084 31.623 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.523 -52.772 28.777 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.813 -53.596 30.312 1.00 0.00 H new ATOM 1155 N ARG A 73 2.780 -49.104 32.753 1.00 0.00 N ATOM 1156 CA ARG A 73 2.897 -47.689 32.634 1.00 0.00 C ATOM 1157 C ARG A 73 3.185 -47.273 31.192 1.00 0.00 C ATOM 1158 O ARG A 73 4.168 -47.714 30.593 1.00 0.00 O ATOM 1159 CB ARG A 73 4.007 -47.220 33.573 1.00 0.00 C ATOM 1160 CG ARG A 73 4.739 -45.991 33.111 1.00 0.00 C ATOM 1161 CD ARG A 73 5.863 -45.625 34.063 1.00 0.00 C ATOM 1162 NE ARG A 73 6.730 -44.572 33.523 1.00 0.00 N ATOM 1163 CZ ARG A 73 8.004 -44.786 33.142 1.00 0.00 C ATOM 1164 NH1 ARG A 73 8.523 -46.007 33.223 1.00 0.00 N ATOM 1165 NH2 ARG A 73 8.750 -43.790 32.675 1.00 0.00 N ATOM 0 H ARG A 73 3.561 -49.540 33.243 1.00 0.00 H new ATOM 0 HA ARG A 73 1.953 -47.220 32.912 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.576 -47.023 34.554 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.726 -48.030 33.698 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.146 -46.161 32.114 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.041 -45.158 33.033 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.440 -45.293 35.011 1.00 0.00 H new ATOM 0 HD3 ARG A 73 6.461 -46.512 34.274 1.00 0.00 H new ATOM 0 HE ARG A 73 6.349 -43.630 33.431 1.00 0.00 H new ATOM 0 HH11 ARG A 73 7.957 -46.780 33.573 1.00 0.00 H new ATOM 0 HH12 ARG A 73 9.488 -46.171 32.935 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.359 -42.851 32.602 1.00 0.00 H new ATOM 0 HH22 ARG A 73 9.714 -43.965 32.390 1.00 0.00 H new ATOM 1179 N ASP A 74 2.315 -46.447 30.634 1.00 0.00 N ATOM 1180 CA ASP A 74 2.522 -45.929 29.288 1.00 0.00 C ATOM 1181 C ASP A 74 3.227 -44.591 29.351 1.00 0.00 C ATOM 1182 O ASP A 74 4.151 -44.316 28.583 1.00 0.00 O ATOM 1183 CB ASP A 74 1.196 -45.769 28.543 1.00 0.00 C ATOM 1184 CG ASP A 74 1.385 -45.193 27.153 1.00 0.00 C ATOM 1185 OD1 ASP A 74 1.752 -45.958 26.231 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.182 -43.970 26.969 1.00 0.00 O ATOM 0 H ASP A 74 1.462 -46.121 31.088 1.00 0.00 H new ATOM 0 HA ASP A 74 3.138 -46.647 28.746 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.704 -46.739 28.469 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.535 -45.119 29.117 1.00 0.00 H new ATOM 1191 N LYS A 75 2.796 -43.768 30.285 1.00 0.00 N ATOM 1192 CA LYS A 75 3.349 -42.448 30.449 1.00 0.00 C ATOM 1193 C LYS A 75 3.390 -42.087 31.924 1.00 0.00 C ATOM 1194 O LYS A 75 2.650 -42.657 32.727 1.00 0.00 O ATOM 1195 CB LYS A 75 2.503 -41.432 29.682 1.00 0.00 C ATOM 1196 CG LYS A 75 3.123 -40.049 29.585 1.00 0.00 C ATOM 1197 CD LYS A 75 2.269 -39.129 28.746 1.00 0.00 C ATOM 1198 CE LYS A 75 2.898 -37.753 28.608 1.00 0.00 C ATOM 1199 NZ LYS A 75 2.111 -36.875 27.714 1.00 0.00 N ATOM 0 H LYS A 75 2.055 -43.998 30.947 1.00 0.00 H new ATOM 0 HA LYS A 75 4.364 -42.432 30.053 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.327 -41.810 28.675 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.530 -41.348 30.166 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.242 -39.629 30.584 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.119 -40.123 29.150 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.126 -39.565 27.757 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.282 -39.035 29.198 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.980 -37.291 29.592 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.911 -37.854 28.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.573 -35.946 27.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.054 -37.304 26.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.152 -36.758 28.099 1.00 0.00 H new ATOM 1213 N GLU A 76 4.251 -41.155 32.275 1.00 0.00 N ATOM 1214 CA GLU A 76 4.375 -40.714 33.646 1.00 0.00 C ATOM 1215 C GLU A 76 3.363 -39.618 33.933 1.00 0.00 C ATOM 1216 O GLU A 76 2.932 -38.914 33.011 1.00 0.00 O ATOM 1217 CB GLU A 76 5.795 -40.218 33.919 1.00 0.00 C ATOM 1218 CG GLU A 76 6.837 -41.311 33.855 1.00 0.00 C ATOM 1219 CD GLU A 76 8.229 -40.816 34.168 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.460 -40.363 35.304 1.00 0.00 O ATOM 1221 OE2 GLU A 76 9.097 -40.883 33.282 1.00 0.00 O ATOM 0 H GLU A 76 4.879 -40.686 31.623 1.00 0.00 H new ATOM 0 HA GLU A 76 4.174 -41.557 34.307 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.047 -39.444 33.194 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.826 -39.754 34.905 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.571 -42.101 34.558 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.830 -41.755 32.859 1.00 0.00 H new ATOM 1228 N PRO A 77 2.959 -39.461 35.206 1.00 0.00 N ATOM 1229 CA PRO A 77 1.985 -38.442 35.607 1.00 0.00 C ATOM 1230 C PRO A 77 2.396 -37.037 35.164 1.00 0.00 C ATOM 1231 O PRO A 77 3.541 -36.605 35.363 1.00 0.00 O ATOM 1232 CB PRO A 77 1.958 -38.549 37.144 1.00 0.00 C ATOM 1233 CG PRO A 77 3.176 -39.336 37.498 1.00 0.00 C ATOM 1234 CD PRO A 77 3.405 -40.262 36.352 1.00 0.00 C ATOM 0 HA PRO A 77 1.011 -38.606 35.145 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.976 -37.563 37.609 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.052 -39.047 37.489 1.00 0.00 H new ATOM 0 HG2 PRO A 77 4.034 -38.682 37.650 1.00 0.00 H new ATOM 0 HG3 PRO A 77 3.029 -39.890 38.425 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.453 -40.548 36.264 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.830 -41.183 36.452 1.00 0.00 H new ATOM 1242 N ASN A 78 1.458 -36.336 34.572 1.00 0.00 N ATOM 1243 CA ASN A 78 1.691 -35.000 34.055 1.00 0.00 C ATOM 1244 C ASN A 78 0.646 -34.024 34.537 1.00 0.00 C ATOM 1245 O ASN A 78 -0.545 -34.295 34.472 1.00 0.00 O ATOM 1246 CB ASN A 78 1.714 -35.027 32.521 1.00 0.00 C ATOM 1247 CG ASN A 78 1.509 -33.660 31.878 1.00 0.00 C ATOM 1248 OD1 ASN A 78 0.388 -33.302 31.503 1.00 0.00 O ATOM 1249 ND2 ASN A 78 2.567 -32.894 31.759 1.00 0.00 N ATOM 0 H ASN A 78 0.506 -36.674 34.433 1.00 0.00 H new ATOM 0 HA ASN A 78 2.658 -34.664 34.429 1.00 0.00 H new ATOM 0 HB2 ASN A 78 2.668 -35.435 32.188 1.00 0.00 H new ATOM 0 HB3 ASN A 78 0.937 -35.705 32.167 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.481 -31.966 31.344 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.476 -33.226 32.081 1.00 0.00 H new ATOM 1256 N PHE A 79 1.098 -32.903 35.025 1.00 0.00 N ATOM 1257 CA PHE A 79 0.209 -31.854 35.467 1.00 0.00 C ATOM 1258 C PHE A 79 0.073 -30.803 34.388 1.00 0.00 C ATOM 1259 O PHE A 79 1.012 -30.057 34.107 1.00 0.00 O ATOM 1260 CB PHE A 79 0.713 -31.222 36.772 1.00 0.00 C ATOM 1261 CG PHE A 79 -0.076 -30.006 37.222 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -1.302 -30.144 37.858 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.424 -28.726 37.024 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -2.009 -29.035 38.279 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.284 -27.616 37.444 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.500 -27.772 38.071 1.00 0.00 C ATOM 0 H PHE A 79 2.089 -32.686 35.129 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.771 -32.290 35.661 1.00 0.00 H new ATOM 0 HB2 PHE A 79 0.682 -31.973 37.561 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.757 -30.936 36.644 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.708 -31.131 38.026 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.378 -28.596 36.536 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.962 -29.158 38.772 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.116 -26.626 37.280 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.054 -26.905 38.399 1.00 0.00 H new ATOM 1276 N GLU A 80 -1.084 -30.762 33.782 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.375 -29.789 32.763 1.00 0.00 C ATOM 1278 C GLU A 80 -2.867 -29.524 32.736 1.00 0.00 C ATOM 1279 O GLU A 80 -3.673 -30.453 32.877 1.00 0.00 O ATOM 1280 CB GLU A 80 -0.914 -30.267 31.389 1.00 0.00 C ATOM 1281 CG GLU A 80 -1.010 -29.181 30.330 1.00 0.00 C ATOM 1282 CD GLU A 80 -0.730 -29.680 28.941 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -1.683 -30.120 28.267 1.00 0.00 O ATOM 1284 OE2 GLU A 80 0.430 -29.604 28.500 1.00 0.00 O ATOM 0 H GLU A 80 -1.852 -31.403 33.981 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.835 -28.872 32.999 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.117 -30.614 31.456 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.518 -31.121 31.084 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.008 -28.744 30.357 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -0.306 -28.384 30.571 1.00 0.00 H new ATOM 1291 N GLY A 81 -3.236 -28.272 32.578 1.00 0.00 N ATOM 1292 CA GLY A 81 -4.629 -27.924 32.525 1.00 0.00 C ATOM 1293 C GLY A 81 -5.300 -28.078 33.867 1.00 0.00 C ATOM 1294 O GLY A 81 -6.475 -28.428 33.938 1.00 0.00 O ATOM 0 H GLY A 81 -2.592 -27.486 32.485 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.733 -26.894 32.184 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.133 -28.555 31.793 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.528 -27.852 34.939 1.00 0.00 N ATOM 1299 CA ARG A 82 -5.031 -27.925 36.316 1.00 0.00 C ATOM 1300 C ARG A 82 -5.369 -29.366 36.734 1.00 0.00 C ATOM 1301 O ARG A 82 -5.972 -29.597 37.787 1.00 0.00 O ATOM 1302 CB ARG A 82 -6.229 -27.006 36.478 1.00 0.00 C ATOM 1303 CG ARG A 82 -5.866 -25.542 36.306 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.089 -24.666 36.287 1.00 0.00 C ATOM 1305 NE ARG A 82 -7.820 -24.665 37.555 1.00 0.00 N ATOM 1306 CZ ARG A 82 -9.153 -24.586 37.643 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -9.895 -24.573 36.536 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -9.738 -24.518 38.831 1.00 0.00 N ATOM 0 H ARG A 82 -3.538 -27.614 34.875 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.237 -27.589 36.983 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.992 -27.276 35.747 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.666 -27.155 37.465 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.208 -25.232 37.118 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.310 -25.411 35.378 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.793 -23.645 36.046 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.755 -25.001 35.492 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.283 -24.728 38.420 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.447 -24.623 35.621 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.911 -24.513 36.604 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -9.172 -24.526 39.679 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -10.754 -24.458 38.896 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.968 -30.320 35.902 1.00 0.00 N ATOM 1323 CA TYR A 83 -5.175 -31.735 36.175 1.00 0.00 C ATOM 1324 C TYR A 83 -3.866 -32.495 36.092 1.00 0.00 C ATOM 1325 O TYR A 83 -3.009 -32.188 35.258 1.00 0.00 O ATOM 1326 CB TYR A 83 -6.146 -32.370 35.173 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.611 -32.046 35.353 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -8.156 -30.855 34.893 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.459 -32.963 35.958 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.504 -30.590 35.033 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.800 -32.706 36.107 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.321 -31.521 35.644 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.667 -31.269 35.783 1.00 0.00 O ATOM 0 H TYR A 83 -4.491 -30.133 35.020 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.593 -31.798 37.180 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.850 -32.063 34.170 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.028 -33.452 35.223 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.517 -30.125 34.419 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.056 -33.898 36.319 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.916 -29.661 34.667 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.442 -33.431 36.585 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.971 -30.700 35.045 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.718 -33.476 36.943 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.585 -34.376 36.881 1.00 0.00 C ATOM 1345 C VAL A 84 -3.076 -35.671 36.241 1.00 0.00 C ATOM 1346 O VAL A 84 -4.033 -36.274 36.717 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.997 -34.663 38.292 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.846 -35.641 38.225 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.549 -33.377 38.957 1.00 0.00 C ATOM 0 H VAL A 84 -4.374 -33.677 37.698 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.785 -33.922 36.296 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.789 -35.114 38.890 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.460 -35.818 39.229 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.193 -36.582 37.798 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.054 -35.229 37.599 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.141 -33.600 39.943 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.783 -32.900 38.347 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.401 -32.705 39.061 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.456 -36.075 35.156 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.940 -37.224 34.410 1.00 0.00 C ATOM 1361 C ASN A 85 -1.849 -38.237 34.116 1.00 0.00 C ATOM 1362 O ASN A 85 -0.688 -37.885 33.933 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.619 -36.762 33.115 1.00 0.00 C ATOM 1364 CG ASN A 85 -2.660 -36.195 32.088 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -2.207 -36.903 31.184 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -2.348 -34.918 32.214 1.00 0.00 N ATOM 0 H ASN A 85 -1.622 -35.633 34.769 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.670 -37.733 35.039 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.151 -37.605 32.674 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.365 -36.006 33.357 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.710 -34.481 31.549 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.745 -34.369 32.976 1.00 0.00 H new ATOM 1373 N MET A 86 -2.244 -39.504 34.095 1.00 0.00 N ATOM 1374 CA MET A 86 -1.343 -40.608 33.805 1.00 0.00 C ATOM 1375 C MET A 86 -2.048 -41.634 32.921 1.00 0.00 C ATOM 1376 O MET A 86 -3.253 -41.869 33.066 1.00 0.00 O ATOM 1377 CB MET A 86 -0.875 -41.263 35.113 1.00 0.00 C ATOM 1378 CG MET A 86 0.108 -42.408 34.934 1.00 0.00 C ATOM 1379 SD MET A 86 0.677 -43.091 36.506 1.00 0.00 S ATOM 1380 CE MET A 86 -0.842 -43.801 37.149 1.00 0.00 C ATOM 0 H MET A 86 -3.204 -39.794 34.280 1.00 0.00 H new ATOM 0 HA MET A 86 -0.470 -40.227 33.275 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.413 -40.500 35.740 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.748 -41.632 35.651 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.363 -43.198 34.349 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.967 -42.057 34.363 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.136 -43.272 38.056 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.631 -43.708 36.403 1.00 0.00 H new ATOM 0 HE3 MET A 86 -0.682 -44.854 37.379 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.300 -42.232 32.007 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.834 -43.239 31.096 1.00 0.00 C ATOM 1392 C LEU A 87 -1.343 -44.627 31.454 1.00 0.00 C ATOM 1393 O LEU A 87 -0.134 -44.852 31.630 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.444 -42.915 29.655 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.342 -41.934 28.911 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.636 -41.415 27.666 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.642 -42.623 28.520 1.00 0.00 C ATOM 0 H LEU A 87 -0.308 -42.036 31.874 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.920 -43.223 31.191 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.430 -42.515 29.658 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.417 -43.847 29.091 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.564 -41.091 29.565 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.288 -40.715 27.143 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.716 -40.907 27.955 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.398 -42.251 27.008 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.282 -41.918 27.988 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.423 -43.473 27.874 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.153 -42.971 29.417 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.274 -45.553 31.557 1.00 0.00 N ATOM 1410 CA VAL A 88 -1.951 -46.932 31.852 1.00 0.00 C ATOM 1411 C VAL A 88 -2.469 -47.850 30.752 1.00 0.00 C ATOM 1412 O VAL A 88 -3.598 -47.692 30.260 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.496 -47.391 33.229 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.803 -46.637 34.350 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.005 -47.204 33.317 1.00 0.00 C ATOM 0 H VAL A 88 -3.271 -45.371 31.439 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.864 -46.997 31.897 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.284 -48.455 33.336 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.196 -46.970 35.310 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.731 -46.830 34.310 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.983 -45.568 34.235 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.356 -47.535 34.294 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.250 -46.151 33.181 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.491 -47.792 32.539 1.00 0.00 H new ATOM 1425 N THR A 89 -1.636 -48.772 30.349 1.00 0.00 N ATOM 1426 CA THR A 89 -1.969 -49.714 29.311 1.00 0.00 C ATOM 1427 C THR A 89 -2.160 -51.099 29.931 1.00 0.00 C ATOM 1428 O THR A 89 -1.462 -51.447 30.875 1.00 0.00 O ATOM 1429 CB THR A 89 -0.825 -49.767 28.282 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.470 -48.437 27.904 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.216 -50.538 27.041 1.00 0.00 C ATOM 0 H THR A 89 -0.699 -48.892 30.734 1.00 0.00 H new ATOM 0 HA THR A 89 -2.889 -49.404 28.815 1.00 0.00 H new ATOM 0 HB THR A 89 0.017 -50.278 28.749 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.311 -48.462 27.312 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.380 -50.550 26.342 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.475 -51.561 27.315 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.075 -50.059 26.571 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.112 -51.895 29.437 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.342 -53.251 29.948 1.00 0.00 C ATOM 1441 C PRO A 90 -2.131 -54.146 29.701 1.00 0.00 C ATOM 1442 O PRO A 90 -1.463 -54.028 28.665 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.538 -53.729 29.120 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.467 -52.915 27.880 1.00 0.00 C ATOM 1445 CD PRO A 90 -4.031 -51.566 28.340 1.00 0.00 C ATOM 0 HA PRO A 90 -3.515 -53.277 31.024 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.472 -54.795 28.902 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.478 -53.570 29.648 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.759 -53.339 27.168 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.434 -52.870 27.380 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.535 -51.006 27.547 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.871 -50.961 28.680 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.839 -55.035 30.637 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.703 -55.926 30.494 1.00 0.00 C ATOM 1455 C LYS A 91 -1.020 -57.112 29.594 1.00 0.00 C ATOM 1456 O LYS A 91 -1.086 -58.256 30.042 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.175 -56.373 31.858 1.00 0.00 C ATOM 1458 CG LYS A 91 0.674 -55.310 32.540 1.00 0.00 C ATOM 1459 CD LYS A 91 1.047 -55.686 33.969 1.00 0.00 C ATOM 1460 CE LYS A 91 1.859 -56.954 34.030 1.00 0.00 C ATOM 1461 NZ LYS A 91 2.311 -57.251 35.411 1.00 0.00 N ATOM 0 H LYS A 91 -2.371 -55.157 31.499 1.00 0.00 H new ATOM 0 HA LYS A 91 0.091 -55.364 30.003 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.016 -56.628 32.502 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.417 -57.280 31.734 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.584 -55.150 31.961 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.130 -54.365 32.547 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.613 -54.872 34.421 1.00 0.00 H new ATOM 0 HD3 LYS A 91 0.139 -55.809 34.559 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.263 -57.786 33.656 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.726 -56.863 33.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.881 -58.121 35.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.887 -56.461 35.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.483 -57.380 36.027 1.00 0.00 H new ATOM 1475 N LYS A 92 -1.232 -56.796 28.318 1.00 0.00 N ATOM 1476 CA LYS A 92 -1.495 -57.774 27.263 1.00 0.00 C ATOM 1477 C LYS A 92 -2.687 -58.690 27.578 1.00 0.00 C ATOM 1478 O LYS A 92 -3.829 -58.374 27.241 1.00 0.00 O ATOM 1479 CB LYS A 92 -0.239 -58.600 26.977 1.00 0.00 C ATOM 1480 CG LYS A 92 0.950 -57.770 26.503 1.00 0.00 C ATOM 1481 CD LYS A 92 2.174 -58.639 26.257 1.00 0.00 C ATOM 1482 CE LYS A 92 2.672 -59.267 27.554 1.00 0.00 C ATOM 1483 NZ LYS A 92 3.839 -60.150 27.326 1.00 0.00 N ATOM 0 H LYS A 92 -1.226 -55.833 27.981 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.766 -57.210 26.371 1.00 0.00 H new ATOM 0 HB2 LYS A 92 0.044 -59.139 27.881 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -0.472 -59.348 26.220 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.685 -57.244 25.586 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.185 -57.011 27.249 1.00 0.00 H new ATOM 0 HD2 LYS A 92 1.929 -59.423 25.541 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.967 -58.038 25.813 1.00 0.00 H new ATOM 0 HE2 LYS A 92 2.944 -58.480 28.258 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.867 -59.841 28.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 4.148 -60.558 28.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.573 -60.916 26.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 4.617 -59.598 26.912 1.00 0.00 H new ATOM 1497 N ALA A 93 -2.410 -59.810 28.235 1.00 0.00 N ATOM 1498 CA ALA A 93 -3.434 -60.791 28.556 1.00 0.00 C ATOM 1499 C ALA A 93 -3.060 -61.571 29.811 1.00 0.00 C ATOM 1500 O ALA A 93 -3.299 -62.777 29.902 1.00 0.00 O ATOM 1501 CB ALA A 93 -3.617 -61.741 27.381 1.00 0.00 C ATOM 0 H ALA A 93 -1.475 -60.061 28.557 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.372 -60.270 28.748 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.385 -62.476 27.623 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -3.921 -61.176 26.500 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.677 -62.253 27.177 1.00 0.00 H new ATOM 1507 N GLU A 94 -2.473 -60.884 30.774 1.00 0.00 N ATOM 1508 CA GLU A 94 -2.067 -61.514 32.025 1.00 0.00 C ATOM 1509 C GLU A 94 -3.256 -61.805 32.931 1.00 0.00 C ATOM 1510 O GLU A 94 -4.288 -61.132 32.866 1.00 0.00 O ATOM 1511 CB GLU A 94 -1.026 -60.662 32.750 1.00 0.00 C ATOM 1512 CG GLU A 94 0.324 -60.659 32.059 1.00 0.00 C ATOM 1513 CD GLU A 94 0.946 -62.038 32.028 1.00 0.00 C ATOM 1514 OE1 GLU A 94 1.258 -62.579 33.114 1.00 0.00 O ATOM 1515 OE2 GLU A 94 1.096 -62.603 30.929 1.00 0.00 O ATOM 0 H GLU A 94 -2.265 -59.887 30.717 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.614 -62.472 31.771 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.392 -59.638 32.825 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.906 -61.033 33.768 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.209 -60.290 31.040 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.994 -59.970 32.574 1.00 0.00 H new ATOM 1522 N GLY A 95 -3.105 -62.826 33.759 1.00 0.00 N ATOM 1523 CA GLY A 95 -4.157 -63.220 34.666 1.00 0.00 C ATOM 1524 C GLY A 95 -4.828 -64.504 34.230 1.00 0.00 C ATOM 1525 O GLY A 95 -5.622 -64.509 33.288 1.00 0.00 O ATOM 0 H GLY A 95 -2.260 -63.395 33.818 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -3.744 -63.348 35.667 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -4.900 -62.425 34.727 1.00 0.00 H new ATOM 1529 N HIS A 96 -4.496 -65.601 34.895 1.00 0.00 N ATOM 1530 CA HIS A 96 -5.093 -66.895 34.574 1.00 0.00 C ATOM 1531 C HIS A 96 -6.509 -66.954 35.124 1.00 0.00 C ATOM 1532 O HIS A 96 -7.463 -67.219 34.395 1.00 0.00 O ATOM 1533 CB HIS A 96 -4.241 -68.044 35.146 1.00 0.00 C ATOM 1534 CG HIS A 96 -4.785 -69.415 34.857 1.00 0.00 C ATOM 1535 ND1 HIS A 96 -4.608 -70.059 33.650 1.00 0.00 N ATOM 1536 CD2 HIS A 96 -5.514 -70.261 35.626 1.00 0.00 C ATOM 1537 CE1 HIS A 96 -5.205 -71.240 33.695 1.00 0.00 C ATOM 1538 NE2 HIS A 96 -5.757 -71.383 34.880 1.00 0.00 N ATOM 0 H HIS A 96 -3.819 -65.624 35.658 1.00 0.00 H new ATOM 0 HA HIS A 96 -5.127 -67.010 33.491 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -3.233 -67.972 34.738 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -4.158 -67.918 36.226 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -5.842 -70.083 36.639 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -5.234 -71.964 32.894 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -6.282 -72.199 35.193 1.00 0.00 H new ATOM 1546 N HIS A 97 -6.631 -66.693 36.406 1.00 0.00 N ATOM 1547 CA HIS A 97 -7.920 -66.654 37.066 1.00 0.00 C ATOM 1548 C HIS A 97 -7.973 -65.450 37.978 1.00 0.00 C ATOM 1549 O HIS A 97 -7.150 -65.304 38.883 1.00 0.00 O ATOM 1550 CB HIS A 97 -8.217 -67.970 37.836 1.00 0.00 C ATOM 1551 CG HIS A 97 -7.247 -68.310 38.940 1.00 0.00 C ATOM 1552 ND1 HIS A 97 -5.977 -68.790 38.707 1.00 0.00 N ATOM 1553 CD2 HIS A 97 -7.383 -68.256 40.289 1.00 0.00 C ATOM 1554 CE1 HIS A 97 -5.374 -69.018 39.865 1.00 0.00 C ATOM 1555 NE2 HIS A 97 -6.202 -68.702 40.837 1.00 0.00 N ATOM 0 H HIS A 97 -5.841 -66.502 37.022 1.00 0.00 H new ATOM 0 HA HIS A 97 -8.700 -66.563 36.310 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -9.217 -67.902 38.263 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -8.230 -68.793 37.122 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -8.256 -67.925 40.832 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -4.371 -69.399 39.990 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -6.001 -68.776 41.834 1.00 0.00 H new ATOM 1563 N HIS A 98 -8.928 -64.581 37.739 1.00 0.00 N ATOM 1564 CA HIS A 98 -9.028 -63.359 38.495 1.00 0.00 C ATOM 1565 C HIS A 98 -9.822 -63.590 39.767 1.00 0.00 C ATOM 1566 O HIS A 98 -11.055 -63.500 39.779 1.00 0.00 O ATOM 1567 CB HIS A 98 -9.667 -62.255 37.647 1.00 0.00 C ATOM 1568 CG HIS A 98 -9.218 -60.877 38.020 1.00 0.00 C ATOM 1569 ND1 HIS A 98 -10.036 -59.937 38.616 1.00 0.00 N ATOM 1570 CD2 HIS A 98 -8.021 -60.275 37.862 1.00 0.00 C ATOM 1571 CE1 HIS A 98 -9.349 -58.816 38.801 1.00 0.00 C ATOM 1572 NE2 HIS A 98 -8.128 -59.004 38.349 1.00 0.00 N ATOM 0 H HIS A 98 -9.647 -64.700 37.025 1.00 0.00 H new ATOM 0 HA HIS A 98 -8.024 -63.036 38.772 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -9.432 -62.433 36.598 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -10.751 -62.314 37.746 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -7.137 -60.719 37.428 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -9.727 -57.907 39.246 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -7.380 -58.311 38.361 1.00 0.00 H new ATOM 1580 N HIS A 99 -9.108 -63.937 40.816 1.00 0.00 N ATOM 1581 CA HIS A 99 -9.691 -64.172 42.125 1.00 0.00 C ATOM 1582 C HIS A 99 -8.573 -64.199 43.152 1.00 0.00 C ATOM 1583 O HIS A 99 -7.639 -64.991 43.036 1.00 0.00 O ATOM 1584 CB HIS A 99 -10.463 -65.501 42.138 1.00 0.00 C ATOM 1585 CG HIS A 99 -11.332 -65.700 43.347 1.00 0.00 C ATOM 1586 ND1 HIS A 99 -12.508 -65.127 43.692 1.00 0.00 N flip ATOM 1587 CD2 HIS A 99 -11.040 -66.599 44.353 1.00 0.00 C flip ATOM 1588 CE1 HIS A 99 -12.902 -65.687 44.885 1.00 0.00 C flip ATOM 1589 NE2 HIS A 99 -12.002 -66.571 45.261 1.00 0.00 N flip ATOM 0 H HIS A 99 -8.097 -64.066 40.787 1.00 0.00 H new ATOM 0 HA HIS A 99 -10.394 -63.375 42.365 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -11.086 -65.555 41.245 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -9.749 -66.323 42.079 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -10.163 -67.228 44.393 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -13.804 -65.441 45.426 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -12.040 -67.138 46.108 1.00 0.00 H new ATOM 1597 N HIS A 100 -8.652 -63.332 44.143 1.00 0.00 N ATOM 1598 CA HIS A 100 -7.593 -63.243 45.149 1.00 0.00 C ATOM 1599 C HIS A 100 -7.892 -64.126 46.354 1.00 0.00 C ATOM 1600 O HIS A 100 -7.060 -64.267 47.247 1.00 0.00 O ATOM 1601 CB HIS A 100 -7.353 -61.783 45.585 1.00 0.00 C ATOM 1602 CG HIS A 100 -8.463 -61.166 46.384 1.00 0.00 C ATOM 1603 ND1 HIS A 100 -8.580 -61.312 47.747 1.00 0.00 N ATOM 1604 CD2 HIS A 100 -9.501 -60.386 46.006 1.00 0.00 C ATOM 1605 CE1 HIS A 100 -9.639 -60.655 48.171 1.00 0.00 C ATOM 1606 NE2 HIS A 100 -10.215 -60.083 47.138 1.00 0.00 N ATOM 0 H HIS A 100 -9.427 -62.683 44.279 1.00 0.00 H new ATOM 0 HA HIS A 100 -6.677 -63.610 44.686 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -6.437 -61.742 46.174 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.187 -61.177 44.694 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -9.726 -60.062 45.001 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -9.977 -60.596 49.195 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -11.056 -59.507 47.172 1.00 0.00 H new ATOM 1614 N HIS A 101 -9.087 -64.712 46.359 1.00 0.00 N ATOM 1615 CA HIS A 101 -9.545 -65.582 47.442 1.00 0.00 C ATOM 1616 C HIS A 101 -9.702 -64.783 48.731 1.00 0.00 C ATOM 1617 O HIS A 101 -8.796 -64.829 49.584 1.00 0.00 O ATOM 1618 CB HIS A 101 -8.588 -66.780 47.639 1.00 0.00 C ATOM 1619 CG HIS A 101 -9.078 -67.806 48.622 1.00 0.00 C ATOM 1620 ND1 HIS A 101 -9.808 -68.921 48.249 1.00 0.00 N ATOM 1621 CD2 HIS A 101 -8.935 -67.891 49.966 1.00 0.00 C ATOM 1622 CE1 HIS A 101 -10.086 -69.640 49.323 1.00 0.00 C ATOM 1623 NE2 HIS A 101 -9.570 -69.037 50.374 1.00 0.00 N ATOM 1624 OXT HIS A 101 -10.728 -64.097 48.877 1.00 0.00 O ATOM 0 H HIS A 101 -9.769 -64.597 45.609 1.00 0.00 H new ATOM 0 HA HIS A 101 -10.520 -65.986 47.169 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -8.427 -67.264 46.676 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -7.620 -66.406 47.973 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -8.417 -67.187 50.600 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -10.642 -70.566 49.336 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -9.632 -69.369 51.337 1.00 0.00 H new TER 1632 HIS A 101