USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=17 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 97 HIS : no HD1:sc= 0 K(o=0.027,f=-1.1) USER MOD Set 1.2: A 98 HIS : no HD1:sc= 0.0324 K(o=0.027,f=-1) USER MOD Set 1.3: A 100 HIS : no HD1:sc=-0.00552 X(o=0.027,f=-0.45) USER MOD Set 2.1: A 38 HIS : no HE2:sc= -5.05! C(o=-4.1!,f=-13!) USER MOD Set 2.2: A 89 THR OG1 : rot -82:sc= 0.911 USER MOD Set 3.1: A 24 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 19 GLN : amide:sc= -0.137 X(o=-0.004,f=0.059) USER MOD Set 4.2: A 23 ASN : amide:sc= 0.133 X(o=-0.004,f=0.059) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.16) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -157:sc= 1.14 (180deg=-0.244) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.00043) USER MOD Single : A 25 LYS NZ :NH3+ 168:sc= 2.03 (180deg=1.8) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.0446 K(o=0.045,f=-0.47) USER MOD Single : A 37 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.118) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -163:sc= -0.477 (180deg=-1.71!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 167:sc= -0.0208 (180deg=-0.226) USER MOD Single : A 65 THR OG1 : rot 75:sc= 1.26 USER MOD Single : A 66 MET CE :methyl -162:sc= -0.0442 (180deg=-0.415) USER MOD Single : A 69 ASN : amide:sc= 0.127 K(o=0.13,f=-8.9!) USER MOD Single : A 72 ASN : amide:sc= -4.01! C(o=-4!,f=-5.2!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.0603 K(o=-0.06,f=-1.3) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 86 MET CE :methyl 132:sc= -0.0478 (180deg=-0.578) USER MOD Single : A 91 LYS NZ :NH3+ 171:sc= 1.2 (180deg=1.14) USER MOD Single : A 92 LYS NZ :NH3+ 168:sc= -0.0184 (180deg=-0.174) USER MOD Single : A 96 HIS : no HD1:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -12.270 -49.016 13.245 1.00 0.00 N ATOM 2 CA LYS A 4 -11.740 -48.071 14.202 1.00 0.00 C ATOM 3 C LYS A 4 -12.791 -47.655 15.205 1.00 0.00 C ATOM 4 O LYS A 4 -13.539 -46.704 14.988 1.00 0.00 O ATOM 5 CB LYS A 4 -11.159 -46.842 13.496 1.00 0.00 C ATOM 6 CG LYS A 4 -9.973 -47.153 12.594 1.00 0.00 C ATOM 7 CD LYS A 4 -8.800 -47.686 13.402 1.00 0.00 C ATOM 8 CE LYS A 4 -7.604 -48.001 12.520 1.00 0.00 C ATOM 9 NZ LYS A 4 -6.457 -48.500 13.315 1.00 0.00 N ATOM 0 HA LYS A 4 -10.936 -48.570 14.743 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.942 -46.373 12.901 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.851 -46.115 14.248 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -10.265 -47.887 11.843 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.672 -46.252 12.059 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -8.513 -46.951 14.154 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.105 -48.586 13.936 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.885 -48.748 11.777 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -7.307 -47.105 11.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -5.658 -48.705 12.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -6.173 -47.777 14.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -6.733 -49.369 13.816 1.00 0.00 H new ATOM 23 N VAL A 5 -12.863 -48.392 16.286 1.00 0.00 N ATOM 24 CA VAL A 5 -13.772 -48.079 17.356 1.00 0.00 C ATOM 25 C VAL A 5 -13.063 -48.231 18.703 1.00 0.00 C ATOM 26 O VAL A 5 -13.213 -49.229 19.414 1.00 0.00 O ATOM 27 CB VAL A 5 -15.083 -48.927 17.282 1.00 0.00 C ATOM 28 CG1 VAL A 5 -14.792 -50.426 17.271 1.00 0.00 C ATOM 29 CG2 VAL A 5 -16.035 -48.559 18.416 1.00 0.00 C ATOM 0 H VAL A 5 -12.294 -49.223 16.447 1.00 0.00 H new ATOM 0 HA VAL A 5 -14.082 -47.040 17.248 1.00 0.00 H new ATOM 0 HB VAL A 5 -15.572 -48.688 16.337 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -15.730 -50.978 17.219 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -14.178 -50.671 16.404 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -14.260 -50.700 18.182 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -16.939 -49.163 18.342 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -15.550 -48.747 19.374 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -16.297 -47.503 18.343 1.00 0.00 H new ATOM 39 N ILE A 6 -12.241 -47.255 19.018 1.00 0.00 N ATOM 40 CA ILE A 6 -11.498 -47.274 20.255 1.00 0.00 C ATOM 41 C ILE A 6 -11.963 -46.146 21.157 1.00 0.00 C ATOM 42 O ILE A 6 -11.702 -44.973 20.890 1.00 0.00 O ATOM 43 CB ILE A 6 -9.974 -47.140 19.999 1.00 0.00 C ATOM 44 CG1 ILE A 6 -9.490 -48.269 19.076 1.00 0.00 C ATOM 45 CG2 ILE A 6 -9.203 -47.166 21.320 1.00 0.00 C ATOM 46 CD1 ILE A 6 -8.053 -48.119 18.629 1.00 0.00 C ATOM 0 H ILE A 6 -12.071 -46.437 18.432 1.00 0.00 H new ATOM 0 HA ILE A 6 -11.681 -48.232 20.741 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.787 -46.184 19.511 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.602 -49.222 19.593 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.132 -48.307 18.196 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.136 -47.071 21.120 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -9.530 -46.338 21.948 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -9.393 -48.108 21.834 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.785 -48.953 17.981 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -7.938 -47.183 18.082 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -7.399 -48.112 19.501 1.00 0.00 H new ATOM 58 N ASP A 7 -12.675 -46.500 22.202 1.00 0.00 N ATOM 59 CA ASP A 7 -13.151 -45.526 23.166 1.00 0.00 C ATOM 60 C ASP A 7 -12.298 -45.581 24.413 1.00 0.00 C ATOM 61 O ASP A 7 -12.367 -46.537 25.178 1.00 0.00 O ATOM 62 CB ASP A 7 -14.623 -45.772 23.507 1.00 0.00 C ATOM 63 CG ASP A 7 -15.188 -44.721 24.444 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.975 -43.522 24.194 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.857 -45.099 25.435 1.00 0.00 O ATOM 0 H ASP A 7 -12.941 -47.463 22.410 1.00 0.00 H new ATOM 0 HA ASP A 7 -13.072 -44.531 22.727 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -15.208 -45.786 22.587 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -14.727 -46.756 23.965 1.00 0.00 H new ATOM 70 N ILE A 8 -11.475 -44.577 24.598 1.00 0.00 N ATOM 71 CA ILE A 8 -10.588 -44.527 25.739 1.00 0.00 C ATOM 72 C ILE A 8 -11.266 -43.852 26.913 1.00 0.00 C ATOM 73 O ILE A 8 -11.828 -42.766 26.781 1.00 0.00 O ATOM 74 CB ILE A 8 -9.255 -43.828 25.387 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.516 -44.669 24.345 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.394 -43.624 26.635 1.00 0.00 C ATOM 77 CD1 ILE A 8 -7.262 -44.034 23.807 1.00 0.00 C ATOM 0 H ILE A 8 -11.400 -43.777 23.969 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.352 -45.552 26.026 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.464 -42.841 24.975 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.260 -45.631 24.788 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.192 -44.871 23.514 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.463 -43.130 26.358 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.933 -43.005 27.352 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.172 -44.591 27.086 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.803 -44.698 23.075 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.510 -43.085 23.331 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.564 -43.858 24.625 1.00 0.00 H new ATOM 89 N LYS A 9 -11.223 -44.515 28.054 1.00 0.00 N ATOM 90 CA LYS A 9 -11.892 -44.031 29.238 1.00 0.00 C ATOM 91 C LYS A 9 -10.987 -43.172 30.065 1.00 0.00 C ATOM 92 O LYS A 9 -9.792 -43.450 30.226 1.00 0.00 O ATOM 93 CB LYS A 9 -12.412 -45.189 30.093 1.00 0.00 C ATOM 94 CG LYS A 9 -13.716 -45.811 29.604 1.00 0.00 C ATOM 95 CD LYS A 9 -13.594 -46.297 28.179 1.00 0.00 C ATOM 96 CE LYS A 9 -14.759 -47.178 27.769 1.00 0.00 C ATOM 97 NZ LYS A 9 -16.036 -46.427 27.736 1.00 0.00 N ATOM 0 H LYS A 9 -10.726 -45.397 28.182 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.737 -43.430 28.901 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.648 -45.965 30.131 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.556 -44.833 31.113 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -13.989 -46.644 30.252 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -14.519 -45.077 29.672 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -13.537 -45.439 27.509 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -12.663 -46.853 28.066 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -14.563 -47.604 26.785 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.846 -48.012 28.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.801 -47.056 27.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.254 -46.070 28.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.951 -45.626 27.078 1.00 0.00 H new ATOM 111 N GLU A 10 -11.558 -42.141 30.588 1.00 0.00 N ATOM 112 CA GLU A 10 -10.848 -41.234 31.449 1.00 0.00 C ATOM 113 C GLU A 10 -11.503 -41.235 32.816 1.00 0.00 C ATOM 114 O GLU A 10 -12.624 -40.750 32.982 1.00 0.00 O ATOM 115 CB GLU A 10 -10.808 -39.812 30.855 1.00 0.00 C ATOM 116 CG GLU A 10 -10.108 -39.735 29.497 1.00 0.00 C ATOM 117 CD GLU A 10 -9.950 -38.318 28.983 1.00 0.00 C ATOM 118 OE1 GLU A 10 -10.905 -37.781 28.384 1.00 0.00 O ATOM 119 OE2 GLU A 10 -8.850 -37.743 29.150 1.00 0.00 O ATOM 0 H GLU A 10 -12.536 -41.895 30.435 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.815 -41.568 31.543 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.828 -39.442 30.750 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.299 -39.149 31.555 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.124 -40.197 29.577 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.675 -40.317 28.770 1.00 0.00 H new ATOM 126 N ILE A 11 -10.815 -41.796 33.782 1.00 0.00 N ATOM 127 CA ILE A 11 -11.333 -41.904 35.126 1.00 0.00 C ATOM 128 C ILE A 11 -10.883 -40.714 35.974 1.00 0.00 C ATOM 129 O ILE A 11 -9.689 -40.482 36.158 1.00 0.00 O ATOM 130 CB ILE A 11 -10.919 -43.258 35.784 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.635 -44.425 35.084 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.212 -43.261 37.282 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.167 -45.795 35.540 1.00 0.00 C ATOM 0 H ILE A 11 -9.882 -42.190 33.659 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.422 -41.887 35.072 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.843 -43.382 35.662 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.707 -44.340 35.262 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.483 -44.339 34.008 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.912 -44.218 37.709 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.654 -42.458 37.763 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.279 -43.110 37.444 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.718 -46.566 35.001 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.101 -45.902 35.337 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.345 -45.903 36.610 1.00 0.00 H new ATOM 145 N LYS A 12 -11.859 -39.952 36.462 1.00 0.00 N ATOM 146 CA LYS A 12 -11.592 -38.753 37.244 1.00 0.00 C ATOM 147 C LYS A 12 -11.467 -39.054 38.735 1.00 0.00 C ATOM 148 O LYS A 12 -12.250 -39.823 39.311 1.00 0.00 O ATOM 149 CB LYS A 12 -12.661 -37.696 36.986 1.00 0.00 C ATOM 150 CG LYS A 12 -12.481 -36.405 37.780 1.00 0.00 C ATOM 151 CD LYS A 12 -13.529 -35.379 37.368 1.00 0.00 C ATOM 152 CE LYS A 12 -13.402 -34.076 38.143 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.855 -34.218 39.554 1.00 0.00 N ATOM 0 H LYS A 12 -12.851 -40.149 36.326 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.629 -38.360 36.919 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -12.667 -37.456 35.923 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.637 -38.120 37.222 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.565 -36.612 38.847 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -11.482 -36.002 37.611 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.434 -35.175 36.302 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -14.524 -35.796 37.525 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -12.364 -33.745 38.128 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.990 -33.302 37.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.751 -33.307 40.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.853 -34.509 39.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.277 -34.938 40.033 1.00 0.00 H new ATOM 167 N LEU A 13 -10.474 -38.440 39.338 1.00 0.00 N ATOM 168 CA LEU A 13 -10.156 -38.619 40.735 1.00 0.00 C ATOM 169 C LEU A 13 -10.002 -37.260 41.410 1.00 0.00 C ATOM 170 O LEU A 13 -9.967 -36.222 40.733 1.00 0.00 O ATOM 171 CB LEU A 13 -8.845 -39.375 40.833 1.00 0.00 C ATOM 172 CG LEU A 13 -8.832 -40.749 40.179 1.00 0.00 C ATOM 173 CD1 LEU A 13 -7.420 -41.249 40.049 1.00 0.00 C ATOM 174 CD2 LEU A 13 -9.672 -41.731 40.979 1.00 0.00 C ATOM 0 H LEU A 13 -9.852 -37.788 38.860 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.955 -39.173 41.228 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.061 -38.768 40.380 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.590 -39.491 41.886 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.265 -40.662 39.182 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -7.424 -42.233 39.580 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.844 -40.557 39.435 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.967 -41.321 41.038 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.650 -42.707 40.495 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -9.269 -41.817 41.988 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -10.701 -41.374 41.029 1.00 0.00 H new ATOM 186 N SER A 14 -9.915 -37.265 42.725 1.00 0.00 N ATOM 187 CA SER A 14 -9.708 -36.050 43.485 1.00 0.00 C ATOM 188 C SER A 14 -8.538 -36.253 44.433 1.00 0.00 C ATOM 189 O SER A 14 -8.278 -37.369 44.855 1.00 0.00 O ATOM 190 CB SER A 14 -10.967 -35.697 44.283 1.00 0.00 C ATOM 191 OG SER A 14 -12.104 -35.630 43.440 1.00 0.00 O ATOM 0 H SER A 14 -9.986 -38.108 43.295 1.00 0.00 H new ATOM 0 HA SER A 14 -9.493 -35.230 42.800 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.130 -36.444 45.060 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.826 -34.740 44.786 1.00 0.00 H new ATOM 0 HG SER A 14 -12.894 -35.405 43.974 1.00 0.00 H new ATOM 197 N VAL A 15 -7.818 -35.188 44.740 1.00 0.00 N ATOM 198 CA VAL A 15 -6.710 -35.272 45.683 1.00 0.00 C ATOM 199 C VAL A 15 -7.235 -35.640 47.061 1.00 0.00 C ATOM 200 O VAL A 15 -6.679 -36.497 47.754 1.00 0.00 O ATOM 201 CB VAL A 15 -5.917 -33.948 45.750 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.837 -34.017 46.816 1.00 0.00 C ATOM 203 CG2 VAL A 15 -5.305 -33.655 44.409 1.00 0.00 C ATOM 0 H VAL A 15 -7.977 -34.258 44.353 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.028 -36.047 45.334 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.604 -33.144 46.016 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.292 -33.073 46.844 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.296 -34.200 47.788 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.147 -34.827 46.582 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.747 -32.720 44.460 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.631 -34.466 44.132 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.093 -33.566 43.661 1.00 0.00 H new ATOM 213 N LYS A 16 -8.323 -35.000 47.444 1.00 0.00 N ATOM 214 CA LYS A 16 -8.969 -35.287 48.702 1.00 0.00 C ATOM 215 C LYS A 16 -10.083 -36.290 48.423 1.00 0.00 C ATOM 216 O LYS A 16 -11.272 -35.970 48.502 1.00 0.00 O ATOM 217 CB LYS A 16 -9.533 -33.998 49.310 1.00 0.00 C ATOM 218 CG LYS A 16 -8.553 -32.831 49.266 1.00 0.00 C ATOM 219 CD LYS A 16 -9.096 -31.605 49.978 1.00 0.00 C ATOM 220 CE LYS A 16 -8.214 -30.385 49.736 1.00 0.00 C ATOM 221 NZ LYS A 16 -6.768 -30.683 49.907 1.00 0.00 N ATOM 0 H LYS A 16 -8.778 -34.272 46.893 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.260 -35.703 49.418 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.442 -33.720 48.776 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -9.816 -34.187 50.346 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.612 -33.131 49.727 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.334 -32.580 48.228 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.108 -31.399 49.630 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.161 -31.803 51.048 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.387 -30.010 48.727 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.502 -29.591 50.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.255 -29.804 50.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.642 -31.355 50.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.393 -31.099 49.031 1.00 0.00 H new ATOM 235 N ILE A 17 -9.668 -37.487 48.055 1.00 0.00 N ATOM 236 CA ILE A 17 -10.568 -38.549 47.625 1.00 0.00 C ATOM 237 C ILE A 17 -10.804 -39.576 48.734 1.00 0.00 C ATOM 238 O ILE A 17 -9.932 -39.814 49.578 1.00 0.00 O ATOM 239 CB ILE A 17 -9.974 -39.261 46.381 1.00 0.00 C ATOM 240 CG1 ILE A 17 -10.936 -40.301 45.807 1.00 0.00 C ATOM 241 CG2 ILE A 17 -8.635 -39.905 46.719 1.00 0.00 C ATOM 242 CD1 ILE A 17 -10.474 -40.889 44.491 1.00 0.00 C ATOM 0 H ILE A 17 -8.684 -37.756 48.045 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.527 -38.094 47.378 1.00 0.00 H new ATOM 0 HB ILE A 17 -9.816 -38.501 45.616 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.063 -41.106 46.531 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -11.914 -39.841 45.667 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.235 -40.399 45.834 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.936 -39.138 47.053 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.774 -40.639 47.512 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.204 -41.619 44.142 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -10.375 -40.094 43.752 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.510 -41.378 44.630 1.00 0.00 H new ATOM 254 N ALA A 18 -11.996 -40.159 48.738 1.00 0.00 N ATOM 255 CA ALA A 18 -12.342 -41.193 49.693 1.00 0.00 C ATOM 256 C ALA A 18 -11.545 -42.461 49.407 1.00 0.00 C ATOM 257 O ALA A 18 -11.276 -42.791 48.249 1.00 0.00 O ATOM 258 CB ALA A 18 -13.833 -41.480 49.648 1.00 0.00 C ATOM 0 H ALA A 18 -12.742 -39.928 48.083 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.091 -40.842 50.694 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -14.076 -42.259 50.371 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -14.386 -40.573 49.892 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -14.109 -41.815 48.648 1.00 0.00 H new ATOM 264 N GLN A 19 -11.180 -43.164 50.459 1.00 0.00 N ATOM 265 CA GLN A 19 -10.381 -44.373 50.344 1.00 0.00 C ATOM 266 C GLN A 19 -11.145 -45.460 49.578 1.00 0.00 C ATOM 267 O GLN A 19 -10.568 -46.173 48.748 1.00 0.00 O ATOM 268 CB GLN A 19 -9.980 -44.863 51.740 1.00 0.00 C ATOM 269 CG GLN A 19 -8.579 -45.446 51.810 1.00 0.00 C ATOM 270 CD GLN A 19 -8.456 -46.789 51.122 1.00 0.00 C ATOM 271 OE1 GLN A 19 -9.378 -47.602 51.146 1.00 0.00 O ATOM 272 NE2 GLN A 19 -7.332 -47.013 50.480 1.00 0.00 N ATOM 0 H GLN A 19 -11.427 -42.917 51.417 1.00 0.00 H new ATOM 0 HA GLN A 19 -9.476 -44.147 49.780 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -10.052 -44.031 52.441 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -10.694 -45.619 52.068 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.878 -44.746 51.354 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.289 -45.553 52.855 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.592 -46.311 50.486 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.199 -47.889 49.975 1.00 0.00 H new ATOM 281 N ASN A 20 -12.441 -45.563 49.842 1.00 0.00 N ATOM 282 CA ASN A 20 -13.282 -46.548 49.170 1.00 0.00 C ATOM 283 C ASN A 20 -13.351 -46.267 47.669 1.00 0.00 C ATOM 284 O ASN A 20 -13.317 -47.189 46.851 1.00 0.00 O ATOM 285 CB ASN A 20 -14.692 -46.562 49.772 1.00 0.00 C ATOM 286 CG ASN A 20 -15.538 -47.708 49.244 1.00 0.00 C ATOM 287 OD1 ASN A 20 -16.248 -47.570 48.244 1.00 0.00 O ATOM 288 ND2 ASN A 20 -15.469 -48.844 49.914 1.00 0.00 N ATOM 0 H ASN A 20 -12.934 -44.977 50.516 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.833 -47.530 49.319 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -14.620 -46.638 50.857 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -15.188 -45.617 49.551 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.015 -49.650 49.610 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.869 -48.916 50.736 1.00 0.00 H new ATOM 295 N ASP A 21 -13.421 -44.982 47.324 1.00 0.00 N ATOM 296 CA ASP A 21 -13.523 -44.553 45.926 1.00 0.00 C ATOM 297 C ASP A 21 -12.282 -44.972 45.136 1.00 0.00 C ATOM 298 O ASP A 21 -12.386 -45.383 43.980 1.00 0.00 O ATOM 299 CB ASP A 21 -13.717 -43.029 45.847 1.00 0.00 C ATOM 300 CG ASP A 21 -14.134 -42.542 44.463 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.236 -42.919 44.005 1.00 0.00 O ATOM 302 OD2 ASP A 21 -13.389 -41.747 43.852 1.00 0.00 O ATOM 0 H ASP A 21 -13.409 -44.215 47.996 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.391 -45.041 45.482 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.473 -42.728 46.573 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.787 -42.537 46.132 1.00 0.00 H new ATOM 307 N ILE A 22 -11.104 -44.891 45.780 1.00 0.00 N ATOM 308 CA ILE A 22 -9.852 -45.290 45.127 1.00 0.00 C ATOM 309 C ILE A 22 -9.896 -46.761 44.748 1.00 0.00 C ATOM 310 O ILE A 22 -9.629 -47.126 43.612 1.00 0.00 O ATOM 311 CB ILE A 22 -8.622 -45.077 46.054 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.494 -43.613 46.468 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.341 -45.555 45.366 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.397 -43.367 47.482 1.00 0.00 C ATOM 0 H ILE A 22 -10.996 -44.558 46.738 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.750 -44.664 44.240 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.773 -45.670 46.956 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.301 -43.008 45.582 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.444 -43.276 46.883 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.491 -45.398 46.030 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.428 -46.616 45.132 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.191 -44.992 44.445 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.363 -42.306 47.731 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.599 -43.945 48.384 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.439 -43.673 47.062 1.00 0.00 H new ATOM 326 N ASN A 23 -10.286 -47.588 45.697 1.00 0.00 N ATOM 327 CA ASN A 23 -10.324 -49.028 45.487 1.00 0.00 C ATOM 328 C ASN A 23 -11.285 -49.403 44.391 1.00 0.00 C ATOM 329 O ASN A 23 -10.967 -50.211 43.523 1.00 0.00 O ATOM 330 CB ASN A 23 -10.736 -49.736 46.768 1.00 0.00 C ATOM 331 CG ASN A 23 -9.587 -49.927 47.734 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.814 -50.881 47.627 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.466 -49.033 48.692 1.00 0.00 N ATOM 0 H ASN A 23 -10.583 -47.290 46.626 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.321 -49.339 45.194 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.523 -49.162 47.257 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.159 -50.709 46.519 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.714 -49.117 49.376 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.124 -48.256 48.750 1.00 0.00 H new ATOM 340 N TYR A 24 -12.439 -48.799 44.428 1.00 0.00 N ATOM 341 CA TYR A 24 -13.484 -49.071 43.479 1.00 0.00 C ATOM 342 C TYR A 24 -13.066 -48.707 42.040 1.00 0.00 C ATOM 343 O TYR A 24 -13.197 -49.522 41.124 1.00 0.00 O ATOM 344 CB TYR A 24 -14.725 -48.298 43.914 1.00 0.00 C ATOM 345 CG TYR A 24 -15.907 -48.383 42.989 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.761 -49.465 43.041 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.177 -47.371 42.082 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.859 -49.549 42.211 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.273 -47.441 41.242 1.00 0.00 C ATOM 350 CZ TYR A 24 -18.112 -48.534 41.310 1.00 0.00 C ATOM 351 OH TYR A 24 -19.206 -48.610 40.478 1.00 0.00 O ATOM 0 H TYR A 24 -12.684 -48.096 45.125 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.696 -50.140 43.465 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -15.029 -48.660 44.896 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.454 -47.249 44.031 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.566 -50.261 43.745 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.521 -46.514 42.030 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.517 -50.404 42.265 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.471 -46.646 40.538 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.239 -47.814 39.907 1.00 0.00 H new ATOM 361 N LYS A 25 -12.550 -47.498 41.857 1.00 0.00 N ATOM 362 CA LYS A 25 -12.146 -47.020 40.534 1.00 0.00 C ATOM 363 C LYS A 25 -10.935 -47.764 39.964 1.00 0.00 C ATOM 364 O LYS A 25 -10.923 -48.120 38.789 1.00 0.00 O ATOM 365 CB LYS A 25 -11.906 -45.521 40.563 1.00 0.00 C ATOM 366 CG LYS A 25 -13.183 -44.724 40.745 1.00 0.00 C ATOM 367 CD LYS A 25 -12.914 -43.236 40.836 1.00 0.00 C ATOM 368 CE LYS A 25 -14.210 -42.459 40.974 1.00 0.00 C ATOM 369 NZ LYS A 25 -13.966 -41.021 41.225 1.00 0.00 N ATOM 0 H LYS A 25 -12.400 -46.826 42.609 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.973 -47.235 39.857 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -11.217 -45.284 41.373 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.423 -45.217 39.634 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.855 -44.921 39.910 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.692 -45.057 41.649 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.269 -43.031 41.691 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.379 -42.904 39.946 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.801 -42.574 40.065 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -14.798 -42.876 41.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.855 -40.493 41.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.608 -40.893 42.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.263 -40.665 40.547 1.00 0.00 H new ATOM 383 N VAL A 26 -9.932 -47.994 40.796 1.00 0.00 N ATOM 384 CA VAL A 26 -8.725 -48.709 40.371 1.00 0.00 C ATOM 385 C VAL A 26 -9.073 -50.150 39.997 1.00 0.00 C ATOM 386 O VAL A 26 -8.589 -50.678 38.996 1.00 0.00 O ATOM 387 CB VAL A 26 -7.638 -48.680 41.475 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.395 -49.394 41.019 1.00 0.00 C ATOM 389 CG2 VAL A 26 -7.299 -47.250 41.848 1.00 0.00 C ATOM 0 H VAL A 26 -9.924 -47.698 41.772 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.320 -48.204 39.494 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.035 -49.192 42.351 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.646 -49.361 41.810 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.635 -50.432 40.790 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.002 -48.907 40.127 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.534 -47.248 42.625 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.926 -46.724 40.970 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.193 -46.749 42.218 1.00 0.00 H new ATOM 399 N LYS A 27 -9.921 -50.773 40.805 1.00 0.00 N ATOM 400 CA LYS A 27 -10.399 -52.126 40.530 1.00 0.00 C ATOM 401 C LYS A 27 -11.166 -52.157 39.205 1.00 0.00 C ATOM 402 O LYS A 27 -10.981 -53.062 38.385 1.00 0.00 O ATOM 403 CB LYS A 27 -11.305 -52.599 41.665 1.00 0.00 C ATOM 404 CG LYS A 27 -11.854 -54.002 41.486 1.00 0.00 C ATOM 405 CD LYS A 27 -12.744 -54.383 42.651 1.00 0.00 C ATOM 406 CE LYS A 27 -13.290 -55.786 42.495 1.00 0.00 C ATOM 407 NZ LYS A 27 -14.160 -56.164 43.630 1.00 0.00 N ATOM 0 H LYS A 27 -10.295 -50.362 41.661 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.540 -52.793 40.456 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -10.747 -52.557 42.600 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.140 -51.905 41.760 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -12.420 -54.060 40.556 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.031 -54.712 41.404 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.179 -54.312 43.580 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.570 -53.676 42.726 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -13.854 -55.856 41.565 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.463 -56.492 42.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.515 -57.131 43.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -13.615 -56.122 44.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.963 -55.505 43.687 1.00 0.00 H new ATOM 421 N HIS A 28 -12.028 -51.165 39.009 1.00 0.00 N ATOM 422 CA HIS A 28 -12.811 -51.045 37.782 1.00 0.00 C ATOM 423 C HIS A 28 -11.925 -50.835 36.567 1.00 0.00 C ATOM 424 O HIS A 28 -12.202 -51.365 35.491 1.00 0.00 O ATOM 425 CB HIS A 28 -13.828 -49.912 37.887 1.00 0.00 C ATOM 426 CG HIS A 28 -15.238 -50.395 37.944 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.980 -50.427 39.102 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.047 -50.865 36.969 1.00 0.00 C ATOM 429 CE1 HIS A 28 -17.184 -50.896 38.836 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.251 -51.168 37.550 1.00 0.00 N ATOM 0 H HIS A 28 -12.204 -50.426 39.690 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.345 -51.986 37.654 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.616 -49.323 38.779 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.712 -49.247 37.031 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.792 -50.980 35.926 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.980 -51.034 39.553 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -18.066 -51.543 37.065 1.00 0.00 H new ATOM 438 N ALA A 29 -10.855 -50.067 36.748 1.00 0.00 N ATOM 439 CA ALA A 29 -9.914 -49.774 35.671 1.00 0.00 C ATOM 440 C ALA A 29 -9.344 -51.052 35.081 1.00 0.00 C ATOM 441 O ALA A 29 -9.080 -51.130 33.883 1.00 0.00 O ATOM 442 CB ALA A 29 -8.793 -48.882 36.179 1.00 0.00 C ATOM 0 H ALA A 29 -10.616 -49.632 37.639 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.454 -49.249 34.883 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.099 -48.671 35.366 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.212 -47.947 36.550 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.263 -49.387 36.987 1.00 0.00 H new ATOM 448 N LEU A 30 -9.189 -52.063 35.924 1.00 0.00 N ATOM 449 CA LEU A 30 -8.657 -53.344 35.499 1.00 0.00 C ATOM 450 C LEU A 30 -9.556 -53.979 34.443 1.00 0.00 C ATOM 451 O LEU A 30 -9.072 -54.515 33.456 1.00 0.00 O ATOM 452 CB LEU A 30 -8.517 -54.292 36.692 1.00 0.00 C ATOM 453 CG LEU A 30 -7.489 -53.893 37.753 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.535 -54.859 38.926 1.00 0.00 C ATOM 455 CD2 LEU A 30 -6.090 -53.854 37.153 1.00 0.00 C ATOM 0 H LEU A 30 -9.427 -52.017 36.915 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.672 -53.170 35.066 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.490 -54.382 37.174 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.255 -55.281 36.315 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.737 -52.895 38.115 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.798 -54.561 39.672 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.529 -54.843 39.372 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.311 -55.867 38.576 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.372 -53.568 37.922 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.833 -54.840 36.765 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.062 -53.126 36.342 1.00 0.00 H new ATOM 467 N GLU A 31 -10.870 -53.884 34.647 1.00 0.00 N ATOM 468 CA GLU A 31 -11.824 -54.479 33.727 1.00 0.00 C ATOM 469 C GLU A 31 -11.780 -53.798 32.363 1.00 0.00 C ATOM 470 O GLU A 31 -11.923 -54.455 31.333 1.00 0.00 O ATOM 471 CB GLU A 31 -13.236 -54.449 34.312 1.00 0.00 C ATOM 472 CG GLU A 31 -13.384 -55.281 35.577 1.00 0.00 C ATOM 473 CD GLU A 31 -14.800 -55.309 36.119 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.397 -54.231 36.326 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.316 -56.420 36.360 1.00 0.00 O ATOM 0 H GLU A 31 -11.292 -53.401 35.440 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.540 -55.521 33.582 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.509 -53.417 34.531 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.939 -54.812 33.563 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.062 -56.302 35.371 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.718 -54.885 36.343 1.00 0.00 H new ATOM 482 N PHE A 32 -11.575 -52.483 32.357 1.00 0.00 N ATOM 483 CA PHE A 32 -11.454 -51.734 31.102 1.00 0.00 C ATOM 484 C PHE A 32 -10.184 -52.145 30.364 1.00 0.00 C ATOM 485 O PHE A 32 -10.162 -52.237 29.134 1.00 0.00 O ATOM 486 CB PHE A 32 -11.447 -50.222 31.352 1.00 0.00 C ATOM 487 CG PHE A 32 -12.750 -49.680 31.870 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.806 -49.438 31.006 1.00 0.00 C ATOM 489 CD2 PHE A 32 -12.918 -49.409 33.216 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.005 -48.940 31.477 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.111 -48.907 33.693 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.156 -48.673 32.823 1.00 0.00 C ATOM 0 H PHE A 32 -11.489 -51.914 33.199 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.322 -51.971 30.487 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.658 -49.986 32.066 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.198 -49.712 30.422 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.690 -49.641 29.952 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.105 -49.593 33.902 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.822 -48.760 30.794 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.227 -48.697 34.746 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.091 -48.281 33.195 1.00 0.00 H new ATOM 502 N LEU A 33 -9.132 -52.396 31.130 1.00 0.00 N ATOM 503 CA LEU A 33 -7.853 -52.834 30.583 1.00 0.00 C ATOM 504 C LEU A 33 -8.022 -54.183 29.890 1.00 0.00 C ATOM 505 O LEU A 33 -7.472 -54.429 28.820 1.00 0.00 O ATOM 506 CB LEU A 33 -6.823 -52.952 31.708 1.00 0.00 C ATOM 507 CG LEU A 33 -6.439 -51.646 32.402 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.470 -51.921 33.535 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.846 -50.655 31.411 1.00 0.00 C ATOM 0 H LEU A 33 -9.139 -52.303 32.146 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.504 -52.101 29.855 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.212 -53.639 32.459 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.919 -53.404 31.300 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.342 -51.199 32.818 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.204 -50.983 34.022 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.938 -52.586 34.261 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.571 -52.392 33.138 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.581 -49.734 31.931 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.953 -51.085 30.957 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.578 -50.435 30.634 1.00 0.00 H new ATOM 521 N GLU A 34 -8.800 -55.037 30.518 1.00 0.00 N ATOM 522 CA GLU A 34 -9.106 -56.369 30.009 1.00 0.00 C ATOM 523 C GLU A 34 -9.783 -56.294 28.633 1.00 0.00 C ATOM 524 O GLU A 34 -9.689 -57.222 27.830 1.00 0.00 O ATOM 525 CB GLU A 34 -10.029 -57.073 30.996 1.00 0.00 C ATOM 526 CG GLU A 34 -9.407 -57.288 32.363 1.00 0.00 C ATOM 527 CD GLU A 34 -8.257 -58.259 32.331 1.00 0.00 C ATOM 528 OE1 GLU A 34 -8.495 -59.454 32.065 1.00 0.00 O ATOM 529 OE2 GLU A 34 -7.113 -57.834 32.558 1.00 0.00 O ATOM 0 H GLU A 34 -9.248 -54.829 31.410 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.175 -56.925 29.897 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.941 -56.487 31.109 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.320 -58.039 30.583 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -9.059 -56.332 32.754 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.169 -57.656 33.051 1.00 0.00 H new ATOM 536 N GLN A 35 -10.452 -55.179 28.371 1.00 0.00 N ATOM 537 CA GLN A 35 -11.155 -54.968 27.111 1.00 0.00 C ATOM 538 C GLN A 35 -10.172 -54.610 26.001 1.00 0.00 C ATOM 539 O GLN A 35 -10.541 -54.531 24.826 1.00 0.00 O ATOM 540 CB GLN A 35 -12.174 -53.834 27.265 1.00 0.00 C ATOM 541 CG GLN A 35 -13.099 -53.991 28.443 1.00 0.00 C ATOM 542 CD GLN A 35 -13.869 -55.275 28.405 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.233 -55.770 27.339 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.103 -55.835 29.558 1.00 0.00 N ATOM 0 H GLN A 35 -10.523 -54.398 29.023 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.669 -55.892 26.847 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.638 -52.890 27.361 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.770 -53.771 26.355 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -12.518 -53.947 29.364 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -13.797 -53.154 28.466 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -13.782 -55.388 30.417 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -14.607 -56.721 29.602 1.00 0.00 H new ATOM 553 N GLY A 36 -8.925 -54.380 26.380 1.00 0.00 N ATOM 554 CA GLY A 36 -7.918 -54.002 25.419 1.00 0.00 C ATOM 555 C GLY A 36 -7.902 -52.511 25.183 1.00 0.00 C ATOM 556 O GLY A 36 -7.391 -52.040 24.169 1.00 0.00 O ATOM 0 H GLY A 36 -8.593 -54.450 27.342 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.939 -54.325 25.772 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.103 -54.518 24.477 1.00 0.00 H new ATOM 560 N LYS A 37 -8.477 -51.764 26.116 1.00 0.00 N ATOM 561 CA LYS A 37 -8.527 -50.321 26.007 1.00 0.00 C ATOM 562 C LYS A 37 -7.577 -49.660 26.988 1.00 0.00 C ATOM 563 O LYS A 37 -6.862 -50.324 27.728 1.00 0.00 O ATOM 564 CB LYS A 37 -9.941 -49.798 26.236 1.00 0.00 C ATOM 565 CG LYS A 37 -10.928 -50.179 25.154 1.00 0.00 C ATOM 566 CD LYS A 37 -12.284 -49.569 25.436 1.00 0.00 C ATOM 567 CE LYS A 37 -13.284 -49.878 24.333 1.00 0.00 C ATOM 568 NZ LYS A 37 -13.494 -51.337 24.150 1.00 0.00 N ATOM 0 H LYS A 37 -8.915 -52.139 26.957 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.217 -50.068 24.993 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.305 -50.174 27.192 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.906 -48.711 26.313 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.564 -49.838 24.185 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.015 -51.264 25.098 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.662 -49.948 26.386 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.182 -48.489 25.541 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.237 -49.403 24.567 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.933 -49.444 23.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.290 -51.494 23.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.633 -51.765 23.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.707 -51.775 25.069 1.00 0.00 H new ATOM 582 N HIS A 38 -7.582 -48.345 26.983 1.00 0.00 N ATOM 583 CA HIS A 38 -6.730 -47.571 27.842 1.00 0.00 C ATOM 584 C HIS A 38 -7.512 -46.792 28.881 1.00 0.00 C ATOM 585 O HIS A 38 -8.632 -46.341 28.632 1.00 0.00 O ATOM 586 CB HIS A 38 -5.883 -46.612 27.014 1.00 0.00 C ATOM 587 CG HIS A 38 -4.589 -47.189 26.587 1.00 0.00 C ATOM 588 ND1 HIS A 38 -4.285 -47.551 25.293 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.498 -47.440 27.306 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.040 -48.010 25.259 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.552 -47.944 26.470 1.00 0.00 N ATOM 0 H HIS A 38 -8.182 -47.785 26.378 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.087 -48.273 28.372 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.447 -46.311 26.131 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.696 -45.710 27.596 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -4.913 -47.478 24.493 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.384 -47.273 28.367 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.521 -48.374 24.384 1.00 0.00 H new ATOM 599 N VAL A 39 -6.905 -46.650 30.048 1.00 0.00 N ATOM 600 CA VAL A 39 -7.454 -45.853 31.118 1.00 0.00 C ATOM 601 C VAL A 39 -6.548 -44.673 31.380 1.00 0.00 C ATOM 602 O VAL A 39 -5.335 -44.828 31.560 1.00 0.00 O ATOM 603 CB VAL A 39 -7.625 -46.668 32.438 1.00 0.00 C ATOM 604 CG1 VAL A 39 -7.791 -45.737 33.635 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.833 -47.566 32.353 1.00 0.00 C ATOM 0 H VAL A 39 -6.013 -47.089 30.275 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.443 -45.520 30.803 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.726 -47.271 32.570 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.908 -46.329 34.543 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.910 -45.102 33.727 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.674 -45.114 33.492 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.936 -48.126 33.282 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.726 -46.961 32.193 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.712 -48.261 31.522 1.00 0.00 H new ATOM 615 N ARG A 40 -7.128 -43.507 31.377 1.00 0.00 N ATOM 616 CA ARG A 40 -6.401 -42.312 31.672 1.00 0.00 C ATOM 617 C ARG A 40 -6.889 -41.769 32.996 1.00 0.00 C ATOM 618 O ARG A 40 -8.040 -41.352 33.115 1.00 0.00 O ATOM 619 CB ARG A 40 -6.606 -41.286 30.555 1.00 0.00 C ATOM 620 CG ARG A 40 -5.799 -40.009 30.719 1.00 0.00 C ATOM 621 CD ARG A 40 -6.055 -39.047 29.567 1.00 0.00 C ATOM 622 NE ARG A 40 -5.609 -39.591 28.275 1.00 0.00 N ATOM 623 CZ ARG A 40 -6.261 -39.398 27.115 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.391 -38.705 27.092 1.00 0.00 N ATOM 625 NH2 ARG A 40 -5.777 -39.899 25.977 1.00 0.00 N ATOM 0 H ARG A 40 -8.116 -43.361 31.170 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.334 -42.526 31.739 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.344 -41.747 29.603 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.664 -41.029 30.504 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.060 -39.529 31.662 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -4.737 -40.250 30.767 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -7.120 -38.821 29.515 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.539 -38.107 29.760 1.00 0.00 H new ATOM 0 HE ARG A 40 -4.754 -40.148 28.258 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -7.768 -38.316 27.956 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.883 -38.561 26.210 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -4.907 -40.432 25.984 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -6.277 -39.749 25.100 1.00 0.00 H new ATOM 639 N PHE A 41 -6.033 -41.791 33.994 1.00 0.00 N ATOM 640 CA PHE A 41 -6.408 -41.305 35.308 1.00 0.00 C ATOM 641 C PHE A 41 -6.209 -39.811 35.368 1.00 0.00 C ATOM 642 O PHE A 41 -5.087 -39.331 35.284 1.00 0.00 O ATOM 643 CB PHE A 41 -5.571 -41.976 36.407 1.00 0.00 C ATOM 644 CG PHE A 41 -5.709 -43.475 36.481 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.728 -44.057 37.225 1.00 0.00 C ATOM 646 CD2 PHE A 41 -4.811 -44.297 35.830 1.00 0.00 C ATOM 647 CE1 PHE A 41 -6.845 -45.427 37.309 1.00 0.00 C ATOM 648 CE2 PHE A 41 -4.925 -45.666 35.907 1.00 0.00 C ATOM 649 CZ PHE A 41 -5.942 -46.233 36.648 1.00 0.00 C ATOM 0 H PHE A 41 -5.076 -42.138 33.924 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.457 -41.550 35.477 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.521 -41.729 36.246 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.854 -41.551 37.370 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.437 -43.428 37.743 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.009 -43.860 35.253 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -7.641 -45.868 37.890 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.219 -46.297 35.388 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.031 -47.308 36.710 1.00 0.00 H new ATOM 659 N ARG A 42 -7.296 -39.080 35.484 1.00 0.00 N ATOM 660 CA ARG A 42 -7.233 -37.639 35.556 1.00 0.00 C ATOM 661 C ARG A 42 -7.726 -37.184 36.907 1.00 0.00 C ATOM 662 O ARG A 42 -8.787 -37.591 37.351 1.00 0.00 O ATOM 663 CB ARG A 42 -8.083 -36.999 34.452 1.00 0.00 C ATOM 664 CG ARG A 42 -7.671 -37.397 33.045 1.00 0.00 C ATOM 665 CD ARG A 42 -8.573 -36.757 32.002 1.00 0.00 C ATOM 666 NE ARG A 42 -8.389 -35.302 31.934 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.044 -34.638 30.819 1.00 0.00 C ATOM 668 NH1 ARG A 42 -7.994 -35.272 29.650 1.00 0.00 N ATOM 669 NH2 ARG A 42 -7.792 -33.335 30.869 1.00 0.00 N ATOM 0 H ARG A 42 -8.240 -39.464 35.531 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.198 -37.327 35.415 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -9.126 -37.274 34.605 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -8.023 -35.915 34.544 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.638 -37.098 32.868 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.710 -38.482 32.946 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.365 -37.195 31.026 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.614 -36.980 32.237 1.00 0.00 H new ATOM 0 HE ARG A 42 -8.532 -34.762 32.787 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.218 -36.266 29.599 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -7.732 -34.764 28.805 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.860 -32.836 31.756 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -7.530 -32.833 30.020 1.00 0.00 H new ATOM 683 N VAL A 43 -6.982 -36.337 37.547 1.00 0.00 N ATOM 684 CA VAL A 43 -7.353 -35.865 38.854 1.00 0.00 C ATOM 685 C VAL A 43 -7.437 -34.361 38.871 1.00 0.00 C ATOM 686 O VAL A 43 -6.532 -33.666 38.404 1.00 0.00 O ATOM 687 CB VAL A 43 -6.376 -36.368 39.970 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.929 -36.072 39.621 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.727 -35.755 41.313 1.00 0.00 C ATOM 0 H VAL A 43 -6.108 -35.953 37.187 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.336 -36.281 39.074 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.492 -37.450 40.038 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.281 -36.435 40.418 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.670 -36.571 38.687 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.795 -34.996 39.506 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.034 -36.120 42.072 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.655 -34.669 41.247 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.744 -36.035 41.586 1.00 0.00 H new ATOM 699 N PHE A 44 -8.533 -33.866 39.383 1.00 0.00 N ATOM 700 CA PHE A 44 -8.745 -32.453 39.500 1.00 0.00 C ATOM 701 C PHE A 44 -8.329 -32.007 40.883 1.00 0.00 C ATOM 702 O PHE A 44 -8.882 -32.472 41.894 1.00 0.00 O ATOM 703 CB PHE A 44 -10.217 -32.121 39.217 1.00 0.00 C ATOM 704 CG PHE A 44 -10.613 -30.698 39.497 1.00 0.00 C ATOM 705 CD1 PHE A 44 -10.310 -29.690 38.602 1.00 0.00 C ATOM 706 CD2 PHE A 44 -11.314 -30.376 40.650 1.00 0.00 C ATOM 707 CE1 PHE A 44 -10.688 -28.388 38.853 1.00 0.00 C ATOM 708 CE2 PHE A 44 -11.699 -29.078 40.904 1.00 0.00 C ATOM 709 CZ PHE A 44 -11.386 -28.081 40.008 1.00 0.00 C ATOM 0 H PHE A 44 -9.304 -34.436 39.731 1.00 0.00 H new ATOM 0 HA PHE A 44 -8.141 -31.918 38.768 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.429 -32.342 38.171 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.844 -32.781 39.816 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.771 -29.924 37.696 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.561 -31.153 41.358 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.439 -27.608 38.149 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -12.246 -28.843 41.805 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.684 -27.062 40.206 1.00 0.00 H new ATOM 719 N LEU A 45 -7.341 -31.135 40.933 1.00 0.00 N ATOM 720 CA LEU A 45 -6.827 -30.641 42.189 1.00 0.00 C ATOM 721 C LEU A 45 -7.838 -29.689 42.807 1.00 0.00 C ATOM 722 O LEU A 45 -8.534 -28.975 42.092 1.00 0.00 O ATOM 723 CB LEU A 45 -5.488 -29.931 41.967 1.00 0.00 C ATOM 724 CG LEU A 45 -4.429 -30.728 41.182 1.00 0.00 C ATOM 725 CD1 LEU A 45 -3.128 -29.981 41.149 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.224 -32.104 41.767 1.00 0.00 C ATOM 0 H LEU A 45 -6.877 -30.753 40.109 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.663 -31.477 42.869 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.677 -28.996 41.439 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -5.071 -29.669 42.940 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.796 -30.848 40.163 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.391 -30.558 40.591 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.275 -29.015 40.665 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.772 -29.826 42.167 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.470 -32.637 41.188 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.890 -32.014 42.801 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.163 -32.656 41.736 1.00 0.00 H new ATOM 738 N LYS A 46 -7.932 -29.678 44.121 1.00 0.00 N ATOM 739 CA LYS A 46 -8.926 -28.853 44.776 1.00 0.00 C ATOM 740 C LYS A 46 -8.397 -28.241 46.063 1.00 0.00 C ATOM 741 O LYS A 46 -8.041 -28.951 46.996 1.00 0.00 O ATOM 742 CB LYS A 46 -10.179 -29.692 45.053 1.00 0.00 C ATOM 743 CG LYS A 46 -11.327 -28.923 45.673 1.00 0.00 C ATOM 744 CD LYS A 46 -12.541 -29.815 45.877 1.00 0.00 C ATOM 745 CE LYS A 46 -13.139 -30.245 44.545 1.00 0.00 C ATOM 746 NZ LYS A 46 -14.398 -31.003 44.719 1.00 0.00 N ATOM 0 H LYS A 46 -7.341 -30.223 44.749 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.177 -28.027 44.111 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.519 -30.134 44.116 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.910 -30.515 45.715 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.014 -28.506 46.630 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.594 -28.083 45.032 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.256 -30.696 46.452 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.292 -29.283 46.461 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -13.329 -29.364 43.932 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.418 -30.859 44.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.771 -31.276 43.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.214 -31.858 45.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -15.096 -30.409 45.210 1.00 0.00 H new ATOM 760 N GLY A 47 -8.345 -26.921 46.103 1.00 0.00 N ATOM 761 CA GLY A 47 -7.924 -26.238 47.303 1.00 0.00 C ATOM 762 C GLY A 47 -6.536 -25.644 47.198 1.00 0.00 C ATOM 763 O GLY A 47 -5.686 -25.926 48.036 1.00 0.00 O ATOM 0 H GLY A 47 -8.588 -26.310 45.323 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.635 -25.444 47.529 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.950 -26.937 48.139 1.00 0.00 H new ATOM 767 N ARG A 48 -6.303 -24.831 46.153 1.00 0.00 N ATOM 768 CA ARG A 48 -4.998 -24.155 45.935 1.00 0.00 C ATOM 769 C ARG A 48 -3.896 -25.161 45.549 1.00 0.00 C ATOM 770 O ARG A 48 -2.757 -24.779 45.271 1.00 0.00 O ATOM 771 CB ARG A 48 -4.568 -23.367 47.199 1.00 0.00 C ATOM 772 CG ARG A 48 -3.283 -22.558 47.032 1.00 0.00 C ATOM 773 CD ARG A 48 -2.825 -21.964 48.352 1.00 0.00 C ATOM 774 NE ARG A 48 -3.764 -20.978 48.883 1.00 0.00 N ATOM 775 CZ ARG A 48 -3.797 -20.600 50.167 1.00 0.00 C ATOM 776 NH1 ARG A 48 -2.964 -21.148 51.044 1.00 0.00 N ATOM 777 NH2 ARG A 48 -4.659 -19.679 50.571 1.00 0.00 N ATOM 0 H ARG A 48 -7.001 -24.621 45.439 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.131 -23.458 45.108 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.374 -22.691 47.482 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.437 -24.069 48.023 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.499 -23.198 46.628 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.446 -21.759 46.309 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -2.695 -22.765 49.080 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -1.850 -21.495 48.216 1.00 0.00 H new ATOM 0 HE ARG A 48 -4.432 -20.554 48.239 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -2.298 -21.858 50.740 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -2.990 -20.859 52.022 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -5.302 -19.254 49.903 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -4.680 -19.395 51.550 1.00 0.00 H new ATOM 791 N GLU A 49 -4.253 -26.433 45.487 1.00 0.00 N ATOM 792 CA GLU A 49 -3.287 -27.484 45.231 1.00 0.00 C ATOM 793 C GLU A 49 -2.766 -27.469 43.796 1.00 0.00 C ATOM 794 O GLU A 49 -1.939 -28.285 43.428 1.00 0.00 O ATOM 795 CB GLU A 49 -3.859 -28.851 45.610 1.00 0.00 C ATOM 796 CG GLU A 49 -4.206 -28.943 47.085 1.00 0.00 C ATOM 797 CD GLU A 49 -4.510 -30.347 47.558 1.00 0.00 C ATOM 798 OE1 GLU A 49 -5.664 -30.796 47.428 1.00 0.00 O ATOM 799 OE2 GLU A 49 -3.594 -30.990 48.124 1.00 0.00 O ATOM 0 H GLU A 49 -5.210 -26.762 45.611 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.424 -27.287 45.868 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.752 -29.046 45.016 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.135 -29.627 45.360 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.376 -28.546 47.669 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.069 -28.308 47.285 1.00 0.00 H new ATOM 806 N MET A 50 -3.230 -26.505 43.005 1.00 0.00 N ATOM 807 CA MET A 50 -2.771 -26.340 41.626 1.00 0.00 C ATOM 808 C MET A 50 -1.283 -26.043 41.595 1.00 0.00 C ATOM 809 O MET A 50 -0.573 -26.460 40.689 1.00 0.00 O ATOM 810 CB MET A 50 -3.536 -25.214 40.926 1.00 0.00 C ATOM 811 CG MET A 50 -4.908 -25.616 40.417 1.00 0.00 C ATOM 812 SD MET A 50 -6.112 -25.871 41.735 1.00 0.00 S ATOM 813 CE MET A 50 -7.541 -26.379 40.774 1.00 0.00 C ATOM 0 H MET A 50 -3.928 -25.821 43.297 1.00 0.00 H new ATOM 0 HA MET A 50 -2.961 -27.273 41.096 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.648 -24.381 41.619 1.00 0.00 H new ATOM 0 HB3 MET A 50 -2.941 -24.853 40.087 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.277 -24.845 39.741 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.817 -26.533 39.835 1.00 0.00 H new ATOM 0 HE1 MET A 50 -8.441 -26.285 41.382 1.00 0.00 H new ATOM 0 HE2 MET A 50 -7.631 -25.744 39.893 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.420 -27.417 40.463 1.00 0.00 H new ATOM 823 N ALA A 51 -0.821 -25.316 42.599 1.00 0.00 N ATOM 824 CA ALA A 51 0.582 -24.961 42.704 1.00 0.00 C ATOM 825 C ALA A 51 1.424 -26.163 43.146 1.00 0.00 C ATOM 826 O ALA A 51 2.654 -26.105 43.142 1.00 0.00 O ATOM 827 CB ALA A 51 0.762 -23.795 43.670 1.00 0.00 C ATOM 0 H ALA A 51 -1.403 -24.959 43.357 1.00 0.00 H new ATOM 0 HA ALA A 51 0.930 -24.654 41.718 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.819 -23.540 43.739 1.00 0.00 H new ATOM 0 HB2 ALA A 51 0.203 -22.932 43.307 1.00 0.00 H new ATOM 0 HB3 ALA A 51 0.392 -24.079 44.655 1.00 0.00 H new ATOM 833 N THR A 52 0.760 -27.244 43.517 1.00 0.00 N ATOM 834 CA THR A 52 1.444 -28.431 43.980 1.00 0.00 C ATOM 835 C THR A 52 1.040 -29.657 43.154 1.00 0.00 C ATOM 836 O THR A 52 0.064 -30.342 43.464 1.00 0.00 O ATOM 837 CB THR A 52 1.149 -28.689 45.467 1.00 0.00 C ATOM 838 OG1 THR A 52 1.362 -27.487 46.228 1.00 0.00 O ATOM 839 CG2 THR A 52 2.039 -29.793 46.012 1.00 0.00 C ATOM 0 H THR A 52 -0.257 -27.321 43.505 1.00 0.00 H new ATOM 0 HA THR A 52 2.514 -28.262 43.856 1.00 0.00 H new ATOM 0 HB THR A 52 0.108 -29.000 45.556 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.170 -27.660 47.173 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.812 -29.957 47.065 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.861 -30.713 45.455 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.084 -29.503 45.908 1.00 0.00 H new ATOM 847 N PRO A 53 1.801 -29.945 42.093 1.00 0.00 N ATOM 848 CA PRO A 53 1.537 -31.080 41.192 1.00 0.00 C ATOM 849 C PRO A 53 1.684 -32.416 41.916 1.00 0.00 C ATOM 850 O PRO A 53 1.076 -33.419 41.528 1.00 0.00 O ATOM 851 CB PRO A 53 2.621 -30.928 40.110 1.00 0.00 C ATOM 852 CG PRO A 53 3.065 -29.511 40.226 1.00 0.00 C ATOM 853 CD PRO A 53 2.987 -29.191 41.677 1.00 0.00 C ATOM 0 HA PRO A 53 0.522 -31.074 40.795 1.00 0.00 H new ATOM 0 HB2 PRO A 53 3.448 -31.618 40.276 1.00 0.00 H new ATOM 0 HB3 PRO A 53 2.224 -31.140 39.117 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.080 -29.385 39.850 1.00 0.00 H new ATOM 0 HG3 PRO A 53 2.425 -28.849 39.643 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.881 -29.509 42.213 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.873 -28.121 41.853 1.00 0.00 H new ATOM 861 N GLU A 54 2.477 -32.403 42.989 1.00 0.00 N ATOM 862 CA GLU A 54 2.739 -33.585 43.810 1.00 0.00 C ATOM 863 C GLU A 54 1.439 -34.181 44.341 1.00 0.00 C ATOM 864 O GLU A 54 1.328 -35.387 44.525 1.00 0.00 O ATOM 865 CB GLU A 54 3.646 -33.200 44.987 1.00 0.00 C ATOM 866 CG GLU A 54 3.983 -34.347 45.928 1.00 0.00 C ATOM 867 CD GLU A 54 4.898 -35.371 45.300 1.00 0.00 C ATOM 868 OE1 GLU A 54 4.412 -36.223 44.535 1.00 0.00 O ATOM 869 OE2 GLU A 54 6.117 -35.330 45.575 1.00 0.00 O ATOM 0 H GLU A 54 2.959 -31.565 43.315 1.00 0.00 H new ATOM 0 HA GLU A 54 3.232 -34.333 43.190 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.574 -32.786 44.593 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.161 -32.409 45.559 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.455 -33.947 46.826 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.061 -34.835 46.243 1.00 0.00 H new ATOM 876 N ALA A 55 0.452 -33.323 44.560 1.00 0.00 N ATOM 877 CA ALA A 55 -0.828 -33.754 45.091 1.00 0.00 C ATOM 878 C ALA A 55 -1.484 -34.776 44.173 1.00 0.00 C ATOM 879 O ALA A 55 -2.086 -35.746 44.637 1.00 0.00 O ATOM 880 CB ALA A 55 -1.742 -32.558 45.301 1.00 0.00 C ATOM 0 H ALA A 55 0.517 -32.322 44.376 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.654 -34.233 46.055 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.698 -32.896 45.700 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.280 -31.866 46.005 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.904 -32.052 44.349 1.00 0.00 H new ATOM 886 N GLY A 56 -1.353 -34.563 42.874 1.00 0.00 N ATOM 887 CA GLY A 56 -1.914 -35.484 41.916 1.00 0.00 C ATOM 888 C GLY A 56 -0.983 -36.639 41.630 1.00 0.00 C ATOM 889 O GLY A 56 -1.423 -37.775 41.470 1.00 0.00 O ATOM 0 H GLY A 56 -0.866 -33.765 42.467 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.862 -35.867 42.294 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.131 -34.955 40.988 1.00 0.00 H new ATOM 893 N VAL A 57 0.310 -36.348 41.584 1.00 0.00 N ATOM 894 CA VAL A 57 1.315 -37.359 41.281 1.00 0.00 C ATOM 895 C VAL A 57 1.348 -38.445 42.359 1.00 0.00 C ATOM 896 O VAL A 57 1.345 -39.634 42.043 1.00 0.00 O ATOM 897 CB VAL A 57 2.726 -36.734 41.118 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.760 -37.799 40.805 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.713 -35.685 40.027 1.00 0.00 C ATOM 0 H VAL A 57 0.689 -35.416 41.753 1.00 0.00 H new ATOM 0 HA VAL A 57 1.031 -37.814 40.332 1.00 0.00 H new ATOM 0 HB VAL A 57 2.997 -36.261 42.062 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.740 -37.334 40.696 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.792 -38.525 41.617 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.493 -38.304 39.877 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.709 -35.255 39.924 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.416 -36.144 39.084 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.004 -34.899 40.286 1.00 0.00 H new ATOM 909 N ALA A 58 1.341 -38.030 43.627 1.00 0.00 N ATOM 910 CA ALA A 58 1.375 -38.976 44.742 1.00 0.00 C ATOM 911 C ALA A 58 0.128 -39.850 44.750 1.00 0.00 C ATOM 912 O ALA A 58 0.190 -41.045 45.056 1.00 0.00 O ATOM 913 CB ALA A 58 1.515 -38.241 46.067 1.00 0.00 C ATOM 0 H ALA A 58 1.312 -37.049 43.906 1.00 0.00 H new ATOM 0 HA ALA A 58 2.244 -39.620 44.610 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.538 -38.963 46.883 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.440 -37.664 46.067 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.668 -37.569 46.202 1.00 0.00 H new ATOM 919 N LEU A 59 -1.005 -39.246 44.403 1.00 0.00 N ATOM 920 CA LEU A 59 -2.273 -39.958 44.328 1.00 0.00 C ATOM 921 C LEU A 59 -2.187 -41.056 43.269 1.00 0.00 C ATOM 922 O LEU A 59 -2.590 -42.200 43.494 1.00 0.00 O ATOM 923 CB LEU A 59 -3.391 -38.976 43.949 1.00 0.00 C ATOM 924 CG LEU A 59 -4.795 -39.570 43.788 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.369 -39.991 45.126 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.714 -38.587 43.101 1.00 0.00 C ATOM 0 H LEU A 59 -1.068 -38.256 44.168 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.490 -40.405 45.298 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.435 -38.198 44.711 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.116 -38.490 43.013 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.712 -40.460 43.164 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.365 -40.408 44.979 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.723 -40.744 45.578 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.432 -39.124 45.784 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.705 -39.028 42.996 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.783 -37.676 43.696 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.318 -38.347 42.114 1.00 0.00 H new ATOM 938 N LEU A 60 -1.645 -40.689 42.120 1.00 0.00 N ATOM 939 CA LEU A 60 -1.489 -41.602 41.011 1.00 0.00 C ATOM 940 C LEU A 60 -0.479 -42.704 41.316 1.00 0.00 C ATOM 941 O LEU A 60 -0.676 -43.848 40.916 1.00 0.00 O ATOM 942 CB LEU A 60 -1.129 -40.848 39.738 1.00 0.00 C ATOM 943 CG LEU A 60 -2.209 -39.874 39.244 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.756 -39.155 37.995 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.523 -40.599 38.997 1.00 0.00 C ATOM 0 H LEU A 60 -1.302 -39.747 41.934 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.449 -42.093 40.851 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.208 -40.291 39.909 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.923 -41.571 38.949 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.372 -39.131 40.025 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.538 -38.471 37.665 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.848 -38.592 38.209 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.555 -39.883 37.209 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.271 -39.887 38.648 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.376 -41.371 38.242 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.865 -41.059 39.924 1.00 0.00 H new ATOM 957 N GLU A 61 0.610 -42.359 42.015 1.00 0.00 N ATOM 958 CA GLU A 61 1.608 -43.360 42.404 1.00 0.00 C ATOM 959 C GLU A 61 0.967 -44.459 43.239 1.00 0.00 C ATOM 960 O GLU A 61 1.280 -45.638 43.070 1.00 0.00 O ATOM 961 CB GLU A 61 2.755 -42.735 43.192 1.00 0.00 C ATOM 962 CG GLU A 61 3.654 -41.823 42.383 1.00 0.00 C ATOM 963 CD GLU A 61 4.754 -41.234 43.228 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.445 -40.618 44.267 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.941 -41.414 42.878 1.00 0.00 O ATOM 0 H GLU A 61 0.820 -41.408 42.319 1.00 0.00 H new ATOM 0 HA GLU A 61 2.010 -43.786 41.485 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.339 -42.168 44.025 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.361 -43.533 43.621 1.00 0.00 H new ATOM 0 HG2 GLU A 61 4.090 -42.382 41.556 1.00 0.00 H new ATOM 0 HG3 GLU A 61 3.060 -41.020 41.947 1.00 0.00 H new ATOM 972 N LYS A 62 0.061 -44.066 44.125 1.00 0.00 N ATOM 973 CA LYS A 62 -0.651 -45.017 44.966 1.00 0.00 C ATOM 974 C LYS A 62 -1.444 -45.983 44.094 1.00 0.00 C ATOM 975 O LYS A 62 -1.426 -47.194 44.303 1.00 0.00 O ATOM 976 CB LYS A 62 -1.602 -44.283 45.914 1.00 0.00 C ATOM 977 CG LYS A 62 -2.310 -45.193 46.894 1.00 0.00 C ATOM 978 CD LYS A 62 -3.257 -44.417 47.785 1.00 0.00 C ATOM 979 CE LYS A 62 -3.953 -45.337 48.771 1.00 0.00 C ATOM 980 NZ LYS A 62 -2.994 -45.979 49.706 1.00 0.00 N ATOM 0 H LYS A 62 -0.198 -43.092 44.279 1.00 0.00 H new ATOM 0 HA LYS A 62 0.076 -45.573 45.557 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.039 -43.533 46.470 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.347 -43.749 45.324 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.865 -45.956 46.348 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.574 -45.712 47.508 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.705 -43.649 48.326 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.000 -43.905 47.173 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.689 -44.768 49.340 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.498 -46.107 48.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.516 -46.418 50.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -2.451 -46.708 49.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.342 -45.261 50.082 1.00 0.00 H new ATOM 994 N ILE A 63 -2.121 -45.424 43.108 1.00 0.00 N ATOM 995 CA ILE A 63 -2.911 -46.199 42.167 1.00 0.00 C ATOM 996 C ILE A 63 -2.021 -47.115 41.349 1.00 0.00 C ATOM 997 O ILE A 63 -2.343 -48.285 41.135 1.00 0.00 O ATOM 998 CB ILE A 63 -3.688 -45.268 41.231 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.734 -44.510 42.028 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.330 -46.049 40.085 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.413 -43.436 41.248 1.00 0.00 C ATOM 0 H ILE A 63 -2.139 -44.419 42.936 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.616 -46.806 42.735 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.994 -44.554 40.786 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.483 -45.214 42.391 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.261 -44.068 42.905 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -4.875 -45.362 39.437 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.554 -46.553 39.509 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.020 -46.789 40.491 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.147 -42.936 41.880 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.674 -42.711 40.908 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.915 -43.875 40.386 1.00 0.00 H new ATOM 1013 N TRP A 64 -0.901 -46.581 40.897 1.00 0.00 N ATOM 1014 CA TRP A 64 0.052 -47.356 40.140 1.00 0.00 C ATOM 1015 C TRP A 64 0.540 -48.536 40.970 1.00 0.00 C ATOM 1016 O TRP A 64 0.718 -49.614 40.459 1.00 0.00 O ATOM 1017 CB TRP A 64 1.225 -46.493 39.658 1.00 0.00 C ATOM 1018 CG TRP A 64 2.286 -47.287 38.962 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.597 -47.393 39.310 1.00 0.00 C ATOM 1020 CD2 TRP A 64 2.114 -48.120 37.806 1.00 0.00 C ATOM 1021 NE1 TRP A 64 4.246 -48.221 38.430 1.00 0.00 N ATOM 1022 CE2 TRP A 64 3.363 -48.684 37.515 1.00 0.00 C ATOM 1023 CE3 TRP A 64 1.027 -48.443 36.992 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 3.561 -49.550 36.457 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 1.229 -49.305 35.937 1.00 0.00 C ATOM 1026 CH2 TRP A 64 2.490 -49.848 35.681 1.00 0.00 C ATOM 0 H TRP A 64 -0.632 -45.608 41.045 1.00 0.00 H new ATOM 0 HA TRP A 64 -0.448 -47.739 39.250 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.850 -45.725 38.981 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.665 -45.978 40.512 1.00 0.00 H new ATOM 0 HD1 TRP A 64 4.058 -46.899 40.153 1.00 0.00 H new ATOM 0 HE1 TRP A 64 5.239 -48.452 38.460 1.00 0.00 H new ATOM 0 HE3 TRP A 64 0.050 -48.026 37.185 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 4.534 -49.974 36.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.399 -49.565 35.297 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.615 -50.521 34.846 1.00 0.00 H new ATOM 1037 N THR A 65 0.715 -48.319 42.261 1.00 0.00 N ATOM 1038 CA THR A 65 1.142 -49.378 43.170 1.00 0.00 C ATOM 1039 C THR A 65 0.104 -50.529 43.196 1.00 0.00 C ATOM 1040 O THR A 65 0.423 -51.680 43.515 1.00 0.00 O ATOM 1041 CB THR A 65 1.343 -48.818 44.605 1.00 0.00 C ATOM 1042 OG1 THR A 65 2.191 -47.658 44.557 1.00 0.00 O ATOM 1043 CG2 THR A 65 1.974 -49.851 45.519 1.00 0.00 C ATOM 0 H THR A 65 0.568 -47.415 42.710 1.00 0.00 H new ATOM 0 HA THR A 65 2.092 -49.770 42.807 1.00 0.00 H new ATOM 0 HB THR A 65 0.362 -48.555 45.002 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.686 -46.898 44.199 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.101 -49.427 46.515 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.329 -50.728 45.577 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.947 -50.142 45.122 1.00 0.00 H new ATOM 1051 N MET A 66 -1.134 -50.201 42.859 1.00 0.00 N ATOM 1052 CA MET A 66 -2.217 -51.174 42.822 1.00 0.00 C ATOM 1053 C MET A 66 -2.258 -51.942 41.493 1.00 0.00 C ATOM 1054 O MET A 66 -2.441 -53.157 41.477 1.00 0.00 O ATOM 1055 CB MET A 66 -3.554 -50.457 43.035 1.00 0.00 C ATOM 1056 CG MET A 66 -3.751 -49.883 44.431 1.00 0.00 C ATOM 1057 SD MET A 66 -3.903 -51.158 45.695 1.00 0.00 S ATOM 1058 CE MET A 66 -5.518 -51.831 45.283 1.00 0.00 C ATOM 0 H MET A 66 -1.417 -49.255 42.604 1.00 0.00 H new ATOM 0 HA MET A 66 -2.040 -51.897 43.619 1.00 0.00 H new ATOM 0 HB2 MET A 66 -3.637 -49.648 42.309 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.363 -51.157 42.827 1.00 0.00 H new ATOM 0 HG2 MET A 66 -2.909 -49.235 44.675 1.00 0.00 H new ATOM 0 HG3 MET A 66 -4.646 -49.260 44.440 1.00 0.00 H new ATOM 0 HE1 MET A 66 -5.905 -52.393 46.133 1.00 0.00 H new ATOM 0 HE2 MET A 66 -6.202 -51.016 45.045 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.428 -52.492 44.421 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.074 -51.223 40.388 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.225 -51.807 39.046 1.00 0.00 C ATOM 1070 C ILE A 67 -0.881 -52.061 38.335 1.00 0.00 C ATOM 1071 O ILE A 67 -0.859 -52.430 37.165 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.123 -50.908 38.155 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.500 -49.515 37.996 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -4.514 -50.811 38.740 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.260 -48.624 37.044 1.00 0.00 C ATOM 0 H ILE A 67 -1.820 -50.235 40.389 1.00 0.00 H new ATOM 0 HA ILE A 67 -2.699 -52.778 39.193 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.198 -51.361 37.166 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.451 -49.033 38.973 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.475 -49.622 37.642 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.133 -50.177 38.104 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -4.954 -51.806 38.799 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.459 -50.379 39.739 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.765 -47.655 36.979 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.286 -49.085 36.057 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.278 -48.487 37.408 1.00 0.00 H new ATOM 1087 N GLU A 68 0.225 -51.890 39.053 1.00 0.00 N ATOM 1088 CA GLU A 68 1.577 -52.073 38.483 1.00 0.00 C ATOM 1089 C GLU A 68 1.833 -53.518 38.066 1.00 0.00 C ATOM 1090 O GLU A 68 2.847 -53.820 37.428 1.00 0.00 O ATOM 1091 CB GLU A 68 2.655 -51.638 39.486 1.00 0.00 C ATOM 1092 CG GLU A 68 2.614 -52.404 40.798 1.00 0.00 C ATOM 1093 CD GLU A 68 3.787 -52.099 41.712 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.904 -52.587 41.429 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.596 -51.400 42.730 1.00 0.00 O ATOM 0 H GLU A 68 0.222 -51.623 40.038 1.00 0.00 H new ATOM 0 HA GLU A 68 1.629 -51.445 37.593 1.00 0.00 H new ATOM 0 HB2 GLU A 68 3.636 -51.768 39.030 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.538 -50.574 39.693 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.686 -52.168 41.319 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.597 -53.473 40.586 1.00 0.00 H new ATOM 1102 N ASN A 69 0.943 -54.403 38.449 1.00 0.00 N ATOM 1103 CA ASN A 69 1.086 -55.810 38.151 1.00 0.00 C ATOM 1104 C ASN A 69 0.459 -56.189 36.806 1.00 0.00 C ATOM 1105 O ASN A 69 1.121 -56.767 35.950 1.00 0.00 O ATOM 1106 CB ASN A 69 0.509 -56.677 39.293 1.00 0.00 C ATOM 1107 CG ASN A 69 -0.830 -56.171 39.835 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -1.599 -55.517 39.134 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -1.111 -56.469 41.087 1.00 0.00 N ATOM 0 H ASN A 69 0.101 -54.169 38.975 1.00 0.00 H new ATOM 0 HA ASN A 69 2.154 -56.010 38.070 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.382 -57.698 38.933 1.00 0.00 H new ATOM 0 HB3 ASN A 69 1.231 -56.714 40.109 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -1.989 -56.155 41.501 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -0.451 -57.014 41.642 1.00 0.00 H new ATOM 1116 N GLU A 70 -0.803 -55.843 36.615 1.00 0.00 N ATOM 1117 CA GLU A 70 -1.529 -56.236 35.409 1.00 0.00 C ATOM 1118 C GLU A 70 -1.515 -55.138 34.345 1.00 0.00 C ATOM 1119 O GLU A 70 -2.003 -55.338 33.226 1.00 0.00 O ATOM 1120 CB GLU A 70 -2.969 -56.597 35.767 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.087 -57.684 36.836 1.00 0.00 C ATOM 1122 CD GLU A 70 -2.608 -59.047 36.365 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -1.380 -59.232 36.174 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -3.457 -59.948 36.192 1.00 0.00 O ATOM 0 H GLU A 70 -1.350 -55.291 37.276 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.023 -57.105 34.988 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.482 -55.701 36.116 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -3.485 -56.929 34.866 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -2.510 -57.387 37.711 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.127 -57.762 37.152 1.00 0.00 H new ATOM 1131 N ALA A 71 -0.968 -53.990 34.686 1.00 0.00 N ATOM 1132 CA ALA A 71 -0.892 -52.883 33.752 1.00 0.00 C ATOM 1133 C ALA A 71 0.533 -52.394 33.626 1.00 0.00 C ATOM 1134 O ALA A 71 1.339 -52.570 34.541 1.00 0.00 O ATOM 1135 CB ALA A 71 -1.803 -51.747 34.192 1.00 0.00 C ATOM 0 H ALA A 71 -0.568 -53.798 35.605 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.226 -53.235 32.776 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.732 -50.926 33.478 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.833 -52.102 34.235 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.498 -51.398 35.178 1.00 0.00 H new ATOM 1141 N ASN A 72 0.852 -51.798 32.494 1.00 0.00 N ATOM 1142 CA ASN A 72 2.177 -51.259 32.265 1.00 0.00 C ATOM 1143 C ASN A 72 2.110 -49.745 32.106 1.00 0.00 C ATOM 1144 O ASN A 72 1.220 -49.220 31.422 1.00 0.00 O ATOM 1145 CB ASN A 72 2.860 -51.922 31.045 1.00 0.00 C ATOM 1146 CG ASN A 72 2.097 -51.765 29.739 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.205 -50.748 29.057 1.00 0.00 O ATOM 1148 ND2 ASN A 72 1.366 -52.795 29.360 1.00 0.00 N ATOM 0 H ASN A 72 0.206 -51.675 31.714 1.00 0.00 H new ATOM 0 HA ASN A 72 2.790 -51.488 33.136 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.856 -51.495 30.924 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.992 -52.984 31.250 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.865 -52.765 28.472 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.302 -53.621 29.955 1.00 0.00 H new ATOM 1155 N ARG A 73 3.023 -49.040 32.769 1.00 0.00 N ATOM 1156 CA ARG A 73 3.067 -47.615 32.712 1.00 0.00 C ATOM 1157 C ARG A 73 3.507 -47.114 31.338 1.00 0.00 C ATOM 1158 O ARG A 73 4.661 -47.287 30.944 1.00 0.00 O ATOM 1159 CB ARG A 73 3.984 -47.067 33.803 1.00 0.00 C ATOM 1160 CG ARG A 73 4.273 -45.597 33.640 1.00 0.00 C ATOM 1161 CD ARG A 73 5.050 -45.007 34.808 1.00 0.00 C ATOM 1162 NE ARG A 73 4.228 -44.869 36.016 1.00 0.00 N ATOM 1163 CZ ARG A 73 4.669 -44.351 37.170 1.00 0.00 C ATOM 1164 NH1 ARG A 73 5.943 -43.995 37.299 1.00 0.00 N ATOM 1165 NH2 ARG A 73 3.835 -44.194 38.192 1.00 0.00 N ATOM 0 H ARG A 73 3.745 -49.458 33.356 1.00 0.00 H new ATOM 0 HA ARG A 73 2.055 -47.247 32.883 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.524 -47.236 34.777 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.923 -47.620 33.794 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.839 -45.444 32.721 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.332 -45.058 33.528 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.909 -45.642 35.027 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.440 -44.030 34.524 1.00 0.00 H new ATOM 0 HE ARG A 73 3.260 -45.188 35.974 1.00 0.00 H new ATOM 0 HH11 ARG A 73 6.588 -44.116 36.518 1.00 0.00 H new ATOM 0 HH12 ARG A 73 6.276 -43.601 38.179 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.857 -44.468 38.099 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.173 -43.799 39.070 1.00 0.00 H new ATOM 1179 N ASP A 74 2.578 -46.509 30.612 1.00 0.00 N ATOM 1180 CA ASP A 74 2.876 -45.933 29.305 1.00 0.00 C ATOM 1181 C ASP A 74 3.714 -44.683 29.473 1.00 0.00 C ATOM 1182 O ASP A 74 4.733 -44.502 28.802 1.00 0.00 O ATOM 1183 CB ASP A 74 1.580 -45.602 28.567 1.00 0.00 C ATOM 1184 CG ASP A 74 1.812 -44.917 27.233 1.00 0.00 C ATOM 1185 OD1 ASP A 74 2.169 -45.607 26.258 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.612 -43.681 27.146 1.00 0.00 O ATOM 0 H ASP A 74 1.607 -46.403 30.906 1.00 0.00 H new ATOM 0 HA ASP A 74 3.436 -46.660 28.717 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.017 -46.521 28.404 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.965 -44.959 29.196 1.00 0.00 H new ATOM 1191 N LYS A 75 3.296 -43.837 30.396 1.00 0.00 N ATOM 1192 CA LYS A 75 4.009 -42.614 30.700 1.00 0.00 C ATOM 1193 C LYS A 75 3.803 -42.254 32.159 1.00 0.00 C ATOM 1194 O LYS A 75 2.809 -42.658 32.776 1.00 0.00 O ATOM 1195 CB LYS A 75 3.546 -41.447 29.807 1.00 0.00 C ATOM 1196 CG LYS A 75 4.477 -40.238 29.883 1.00 0.00 C ATOM 1197 CD LYS A 75 4.057 -39.113 28.957 1.00 0.00 C ATOM 1198 CE LYS A 75 2.835 -38.382 29.485 1.00 0.00 C ATOM 1199 NZ LYS A 75 2.531 -37.176 28.681 1.00 0.00 N ATOM 0 H LYS A 75 2.454 -43.979 30.954 1.00 0.00 H new ATOM 0 HA LYS A 75 5.067 -42.785 30.504 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.485 -41.788 28.774 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.541 -41.145 30.103 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.502 -39.868 30.908 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.491 -40.550 29.632 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.881 -38.409 28.841 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.841 -39.516 27.968 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.976 -39.053 29.474 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.002 -38.095 30.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.691 -36.702 29.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.341 -36.525 28.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.347 -37.453 27.696 1.00 0.00 H new ATOM 1213 N GLU A 76 4.743 -41.516 32.707 1.00 0.00 N ATOM 1214 CA GLU A 76 4.671 -41.080 34.082 1.00 0.00 C ATOM 1215 C GLU A 76 3.644 -39.955 34.228 1.00 0.00 C ATOM 1216 O GLU A 76 3.341 -39.260 33.251 1.00 0.00 O ATOM 1217 CB GLU A 76 6.053 -40.628 34.547 1.00 0.00 C ATOM 1218 CG GLU A 76 7.070 -41.755 34.564 1.00 0.00 C ATOM 1219 CD GLU A 76 8.452 -41.287 34.932 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.710 -41.076 36.130 1.00 0.00 O ATOM 1221 OE2 GLU A 76 9.297 -41.139 34.026 1.00 0.00 O ATOM 0 H GLU A 76 5.578 -41.202 32.212 1.00 0.00 H new ATOM 0 HA GLU A 76 4.348 -41.910 34.710 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.410 -39.834 33.891 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.973 -40.203 35.547 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.749 -42.518 35.273 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.100 -42.226 33.581 1.00 0.00 H new ATOM 1228 N PRO A 77 3.085 -39.771 35.445 1.00 0.00 N ATOM 1229 CA PRO A 77 2.061 -38.748 35.707 1.00 0.00 C ATOM 1230 C PRO A 77 2.511 -37.352 35.296 1.00 0.00 C ATOM 1231 O PRO A 77 3.652 -36.952 35.536 1.00 0.00 O ATOM 1232 CB PRO A 77 1.855 -38.830 37.233 1.00 0.00 C ATOM 1233 CG PRO A 77 3.040 -39.582 37.740 1.00 0.00 C ATOM 1234 CD PRO A 77 3.400 -40.537 36.654 1.00 0.00 C ATOM 0 HA PRO A 77 1.152 -38.926 35.133 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.797 -37.837 37.678 1.00 0.00 H new ATOM 0 HB3 PRO A 77 0.926 -39.344 37.479 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.868 -38.908 37.960 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.804 -40.109 38.664 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.452 -40.819 36.693 1.00 0.00 H new ATOM 0 HD3 PRO A 77 2.820 -41.458 36.714 1.00 0.00 H new ATOM 1242 N ASN A 78 1.606 -36.621 34.676 1.00 0.00 N ATOM 1243 CA ASN A 78 1.897 -35.285 34.176 1.00 0.00 C ATOM 1244 C ASN A 78 0.849 -34.290 34.673 1.00 0.00 C ATOM 1245 O ASN A 78 -0.300 -34.655 34.886 1.00 0.00 O ATOM 1246 CB ASN A 78 1.914 -35.299 32.638 1.00 0.00 C ATOM 1247 CG ASN A 78 2.262 -33.953 32.030 1.00 0.00 C ATOM 1248 OD1 ASN A 78 3.050 -33.189 32.584 1.00 0.00 O ATOM 1249 ND2 ASN A 78 1.666 -33.650 30.892 1.00 0.00 N ATOM 0 H ASN A 78 0.650 -36.932 34.503 1.00 0.00 H new ATOM 0 HA ASN A 78 2.875 -34.977 34.546 1.00 0.00 H new ATOM 0 HB2 ASN A 78 2.635 -36.042 32.296 1.00 0.00 H new ATOM 0 HB3 ASN A 78 0.936 -35.613 32.273 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.853 -32.755 30.441 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.018 -34.311 30.464 1.00 0.00 H new ATOM 1256 N PHE A 79 1.257 -33.041 34.843 1.00 0.00 N ATOM 1257 CA PHE A 79 0.364 -31.991 35.310 1.00 0.00 C ATOM 1258 C PHE A 79 0.043 -31.011 34.183 1.00 0.00 C ATOM 1259 O PHE A 79 0.942 -30.383 33.615 1.00 0.00 O ATOM 1260 CB PHE A 79 0.996 -31.259 36.504 1.00 0.00 C ATOM 1261 CG PHE A 79 0.243 -30.038 36.961 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.890 -30.160 37.742 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.680 -28.768 36.615 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.576 -29.046 38.169 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.004 -27.649 37.041 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.132 -27.789 37.822 1.00 0.00 C ATOM 0 H PHE A 79 2.211 -32.728 34.662 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.572 -32.446 35.633 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.075 -31.955 37.339 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.011 -30.965 36.237 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.242 -31.142 38.021 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.565 -28.654 36.006 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.462 -29.157 38.776 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.343 -26.665 36.764 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.667 -26.914 38.161 1.00 0.00 H new ATOM 1276 N GLU A 80 -1.234 -30.882 33.873 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.698 -29.997 32.819 1.00 0.00 C ATOM 1278 C GLU A 80 -2.765 -29.043 33.365 1.00 0.00 C ATOM 1279 O GLU A 80 -3.883 -29.464 33.667 1.00 0.00 O ATOM 1280 CB GLU A 80 -2.283 -30.822 31.667 1.00 0.00 C ATOM 1281 CG GLU A 80 -2.761 -29.988 30.487 1.00 0.00 C ATOM 1282 CD GLU A 80 -3.454 -30.819 29.426 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -2.792 -31.674 28.795 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -4.673 -30.627 29.227 1.00 0.00 O ATOM 0 H GLU A 80 -1.981 -31.390 34.346 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.854 -29.413 32.451 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.528 -31.526 31.318 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.119 -31.412 32.044 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.445 -29.219 30.845 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.909 -29.474 30.041 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.408 -27.768 33.505 1.00 0.00 N ATOM 1292 CA GLY A 81 -3.350 -26.763 33.990 1.00 0.00 C ATOM 1293 C GLY A 81 -3.706 -26.940 35.451 1.00 0.00 C ATOM 1294 O GLY A 81 -3.209 -26.220 36.306 1.00 0.00 O ATOM 0 H GLY A 81 -1.478 -27.408 33.291 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.922 -25.771 33.844 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.260 -26.808 33.392 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.594 -27.878 35.722 1.00 0.00 N ATOM 1299 CA ARG A 82 -5.002 -28.188 37.083 1.00 0.00 C ATOM 1300 C ARG A 82 -5.331 -29.670 37.220 1.00 0.00 C ATOM 1301 O ARG A 82 -5.881 -30.107 38.235 1.00 0.00 O ATOM 1302 CB ARG A 82 -6.201 -27.324 37.535 1.00 0.00 C ATOM 1303 CG ARG A 82 -7.504 -27.568 36.778 1.00 0.00 C ATOM 1304 CD ARG A 82 -7.479 -26.936 35.401 1.00 0.00 C ATOM 1305 NE ARG A 82 -7.381 -25.481 35.469 1.00 0.00 N ATOM 1306 CZ ARG A 82 -7.101 -24.689 34.431 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -6.869 -25.211 33.231 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -7.055 -23.374 34.596 1.00 0.00 N ATOM 0 H ARG A 82 -5.052 -28.446 35.009 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.162 -27.952 37.737 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.377 -27.503 38.596 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.930 -26.273 37.430 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.674 -28.640 36.683 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -8.339 -27.162 37.350 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.634 -27.330 34.836 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.383 -27.214 34.858 1.00 0.00 H new ATOM 0 HE ARG A 82 -7.538 -25.038 36.374 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.904 -26.222 33.099 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -6.656 -24.601 32.442 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.233 -22.969 35.515 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.841 -22.768 33.804 1.00 0.00 H new ATOM 1322 N TYR A 83 -5.001 -30.437 36.193 1.00 0.00 N ATOM 1323 CA TYR A 83 -5.233 -31.868 36.205 1.00 0.00 C ATOM 1324 C TYR A 83 -3.926 -32.617 36.107 1.00 0.00 C ATOM 1325 O TYR A 83 -3.027 -32.224 35.373 1.00 0.00 O ATOM 1326 CB TYR A 83 -6.139 -32.306 35.045 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.573 -31.830 35.132 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.943 -30.577 34.667 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.561 -32.650 35.669 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.255 -30.154 34.735 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.873 -32.231 35.742 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.216 -30.984 35.274 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.527 -30.563 35.339 1.00 0.00 O ATOM 0 H TYR A 83 -4.569 -30.088 35.337 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.729 -32.102 37.147 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.708 -31.943 34.112 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -6.137 -33.395 34.995 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.194 -29.923 34.246 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -8.296 -33.631 36.035 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.528 -29.176 34.367 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.627 -32.879 36.164 1.00 0.00 H new ATOM 0 HH TYR A 83 -12.077 -31.266 35.745 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.828 -33.684 36.845 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.678 -34.555 36.786 1.00 0.00 C ATOM 1345 C VAL A 84 -3.147 -35.877 36.198 1.00 0.00 C ATOM 1346 O VAL A 84 -4.167 -36.410 36.626 1.00 0.00 O ATOM 1347 CB VAL A 84 -2.059 -34.780 38.195 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.953 -35.818 38.152 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.529 -33.479 38.763 1.00 0.00 C ATOM 0 H VAL A 84 -4.543 -33.981 37.509 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.901 -34.103 36.170 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.851 -35.151 38.846 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.541 -35.952 39.152 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.357 -36.766 37.796 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.165 -35.483 37.477 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.101 -33.660 39.749 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.760 -33.079 38.101 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.344 -32.760 38.848 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.448 -36.380 35.201 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.894 -37.591 34.537 1.00 0.00 C ATOM 1361 C ASN A 85 -1.785 -38.609 34.339 1.00 0.00 C ATOM 1362 O ASN A 85 -0.630 -38.256 34.091 1.00 0.00 O ATOM 1363 CB ASN A 85 -3.571 -37.264 33.191 1.00 0.00 C ATOM 1364 CG ASN A 85 -2.641 -36.595 32.189 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -1.952 -37.265 31.419 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -2.624 -35.268 32.184 1.00 0.00 N ATOM 0 H ASN A 85 -1.584 -35.979 34.836 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.624 -38.050 35.203 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.959 -38.185 32.756 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.426 -36.612 33.372 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -2.026 -34.768 31.526 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -3.209 -34.748 32.838 1.00 0.00 H new ATOM 1373 N MET A 86 -2.154 -39.875 34.478 1.00 0.00 N ATOM 1374 CA MET A 86 -1.254 -40.995 34.245 1.00 0.00 C ATOM 1375 C MET A 86 -1.920 -41.958 33.274 1.00 0.00 C ATOM 1376 O MET A 86 -3.119 -42.239 33.394 1.00 0.00 O ATOM 1377 CB MET A 86 -0.921 -41.718 35.564 1.00 0.00 C ATOM 1378 CG MET A 86 0.055 -42.880 35.405 1.00 0.00 C ATOM 1379 SD MET A 86 0.436 -43.702 36.973 1.00 0.00 S ATOM 1380 CE MET A 86 -1.162 -44.416 37.380 1.00 0.00 C ATOM 0 H MET A 86 -3.094 -40.155 34.758 1.00 0.00 H new ATOM 0 HA MET A 86 -0.319 -40.624 33.824 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.501 -40.997 36.265 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.845 -42.091 36.005 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.366 -43.608 34.712 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.979 -42.513 34.959 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.033 -45.462 37.660 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.603 -43.869 38.213 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.821 -44.351 36.514 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.164 -42.445 32.310 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.708 -43.343 31.307 1.00 0.00 C ATOM 1392 C LEU A 87 -1.140 -44.747 31.505 1.00 0.00 C ATOM 1393 O LEU A 87 0.080 -44.936 31.579 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.383 -42.803 29.896 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.159 -43.405 28.692 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.702 -44.812 28.370 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.659 -43.386 28.941 1.00 0.00 C ATOM 0 H LEU A 87 -0.172 -42.235 32.199 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.792 -43.398 31.412 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.556 -41.727 29.901 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.318 -42.954 29.717 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.939 -42.776 27.829 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.271 -45.194 27.522 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.641 -44.802 28.120 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.865 -45.454 29.235 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.176 -43.813 28.082 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.888 -43.973 29.831 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.990 -42.358 29.089 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.026 -45.719 31.600 1.00 0.00 N ATOM 1410 CA VAL A 88 -1.631 -47.106 31.789 1.00 0.00 C ATOM 1411 C VAL A 88 -2.126 -47.976 30.649 1.00 0.00 C ATOM 1412 O VAL A 88 -3.279 -47.865 30.220 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.145 -47.682 33.132 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.446 -47.012 34.302 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -3.666 -47.534 33.248 1.00 0.00 C ATOM 0 H VAL A 88 -3.034 -45.574 31.549 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.541 -47.116 31.806 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.911 -48.746 33.156 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.820 -47.430 35.237 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.372 -47.185 34.231 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.644 -45.940 34.279 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.000 -47.946 34.200 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.934 -46.479 33.196 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.147 -48.071 32.431 1.00 0.00 H new ATOM 1425 N THR A 89 -1.255 -48.817 30.149 1.00 0.00 N ATOM 1426 CA THR A 89 -1.598 -49.718 29.078 1.00 0.00 C ATOM 1427 C THR A 89 -1.837 -51.116 29.638 1.00 0.00 C ATOM 1428 O THR A 89 -1.094 -51.584 30.503 1.00 0.00 O ATOM 1429 CB THR A 89 -0.479 -49.767 28.018 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.113 -48.433 27.638 1.00 0.00 O ATOM 1431 CG2 THR A 89 -0.908 -50.529 26.783 1.00 0.00 C ATOM 0 H THR A 89 -0.291 -48.896 30.472 1.00 0.00 H new ATOM 0 HA THR A 89 -2.508 -49.353 28.601 1.00 0.00 H new ATOM 0 HB THR A 89 0.372 -50.284 28.462 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.741 -48.101 26.963 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.092 -50.540 26.061 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.164 -51.552 27.058 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.778 -50.044 26.340 1.00 0.00 H new ATOM 1439 N PRO A 90 -2.893 -51.783 29.179 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.220 -53.140 29.613 1.00 0.00 C ATOM 1441 C PRO A 90 -2.189 -54.133 29.096 1.00 0.00 C ATOM 1442 O PRO A 90 -1.664 -53.972 27.988 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.581 -53.374 28.949 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.510 -52.546 27.727 1.00 0.00 C ATOM 1445 CD PRO A 90 -3.846 -51.289 28.172 1.00 0.00 C ATOM 0 HA PRO A 90 -3.233 -53.265 30.696 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.738 -54.427 28.713 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.402 -53.067 29.596 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.938 -53.042 26.943 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.502 -52.350 27.321 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.343 -50.781 27.349 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.557 -50.581 28.597 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.876 -55.143 29.880 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.915 -56.124 29.443 1.00 0.00 C ATOM 1455 C LYS A 91 -1.582 -57.206 28.619 1.00 0.00 C ATOM 1456 O LYS A 91 -2.053 -58.211 29.156 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.184 -56.745 30.617 1.00 0.00 C ATOM 1458 CG LYS A 91 0.674 -55.775 31.382 1.00 0.00 C ATOM 1459 CD LYS A 91 1.489 -56.494 32.422 1.00 0.00 C ATOM 1460 CE LYS A 91 2.389 -55.543 33.169 1.00 0.00 C ATOM 1461 NZ LYS A 91 3.540 -56.254 33.756 1.00 0.00 N ATOM 0 H LYS A 91 -2.268 -55.302 30.808 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.185 -55.607 28.820 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -0.915 -57.183 31.297 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.442 -57.560 30.253 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.335 -55.247 30.695 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.045 -55.024 31.860 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.824 -56.996 33.125 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.091 -57.267 31.944 1.00 0.00 H new ATOM 0 HE2 LYS A 91 2.744 -54.766 32.492 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.824 -55.046 33.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 4.220 -55.563 34.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.211 -56.870 34.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.002 -56.831 33.024 1.00 0.00 H new ATOM 1475 N LYS A 92 -1.664 -56.984 27.324 1.00 0.00 N ATOM 1476 CA LYS A 92 -2.241 -57.967 26.438 1.00 0.00 C ATOM 1477 C LYS A 92 -1.201 -59.024 26.090 1.00 0.00 C ATOM 1478 O LYS A 92 -1.470 -60.227 26.160 1.00 0.00 O ATOM 1479 CB LYS A 92 -2.788 -57.298 25.172 1.00 0.00 C ATOM 1480 CG LYS A 92 -3.559 -58.241 24.269 1.00 0.00 C ATOM 1481 CD LYS A 92 -4.132 -57.512 23.069 1.00 0.00 C ATOM 1482 CE LYS A 92 -4.922 -58.452 22.170 1.00 0.00 C ATOM 1483 NZ LYS A 92 -6.123 -59.002 22.855 1.00 0.00 N ATOM 0 H LYS A 92 -1.339 -56.133 26.865 1.00 0.00 H new ATOM 0 HA LYS A 92 -3.075 -58.453 26.944 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.438 -56.472 25.460 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.958 -56.869 24.611 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -2.902 -59.042 23.930 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -4.367 -58.708 24.833 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -4.778 -56.703 23.408 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.323 -57.056 22.499 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.230 -57.919 21.270 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.280 -59.273 21.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.737 -59.468 22.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -5.827 -59.694 23.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -6.645 -58.229 23.314 1.00 0.00 H new ATOM 1497 N ALA A 93 -0.003 -58.560 25.741 1.00 0.00 N ATOM 1498 CA ALA A 93 1.106 -59.433 25.387 1.00 0.00 C ATOM 1499 C ALA A 93 2.414 -58.649 25.346 1.00 0.00 C ATOM 1500 O ALA A 93 2.881 -58.254 24.275 1.00 0.00 O ATOM 1501 CB ALA A 93 0.850 -60.112 24.043 1.00 0.00 C ATOM 0 H ALA A 93 0.223 -57.566 25.697 1.00 0.00 H new ATOM 0 HA ALA A 93 1.189 -60.205 26.152 1.00 0.00 H new ATOM 0 HB1 ALA A 93 1.691 -60.760 23.797 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.061 -60.707 24.104 1.00 0.00 H new ATOM 0 HB3 ALA A 93 0.737 -59.354 23.268 1.00 0.00 H new ATOM 1507 N GLU A 94 2.990 -58.400 26.510 1.00 0.00 N ATOM 1508 CA GLU A 94 4.236 -57.653 26.594 1.00 0.00 C ATOM 1509 C GLU A 94 5.438 -58.588 26.628 1.00 0.00 C ATOM 1510 O GLU A 94 5.380 -59.680 27.204 1.00 0.00 O ATOM 1511 CB GLU A 94 4.253 -56.731 27.823 1.00 0.00 C ATOM 1512 CG GLU A 94 4.127 -57.454 29.159 1.00 0.00 C ATOM 1513 CD GLU A 94 4.187 -56.505 30.338 1.00 0.00 C ATOM 1514 OE1 GLU A 94 3.644 -55.386 30.228 1.00 0.00 O ATOM 1515 OE2 GLU A 94 4.741 -56.888 31.399 1.00 0.00 O ATOM 0 H GLU A 94 2.616 -58.703 27.409 1.00 0.00 H new ATOM 0 HA GLU A 94 4.302 -57.035 25.698 1.00 0.00 H new ATOM 0 HB2 GLU A 94 5.181 -56.160 27.820 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.437 -56.014 27.734 1.00 0.00 H new ATOM 0 HG2 GLU A 94 3.185 -58.002 29.185 1.00 0.00 H new ATOM 0 HG3 GLU A 94 4.926 -58.190 29.247 1.00 0.00 H new ATOM 1522 N GLY A 95 6.520 -58.165 25.998 1.00 0.00 N ATOM 1523 CA GLY A 95 7.732 -58.952 26.000 1.00 0.00 C ATOM 1524 C GLY A 95 8.654 -58.532 27.117 1.00 0.00 C ATOM 1525 O GLY A 95 9.760 -59.062 27.265 1.00 0.00 O ATOM 0 H GLY A 95 6.581 -57.287 25.483 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.483 -60.008 26.108 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.242 -58.841 25.043 1.00 0.00 H new ATOM 1529 N HIS A 96 8.197 -57.572 27.899 1.00 0.00 N ATOM 1530 CA HIS A 96 8.960 -57.053 29.013 1.00 0.00 C ATOM 1531 C HIS A 96 9.002 -58.069 30.137 1.00 0.00 C ATOM 1532 O HIS A 96 7.979 -58.662 30.491 1.00 0.00 O ATOM 1533 CB HIS A 96 8.339 -55.745 29.523 1.00 0.00 C ATOM 1534 CG HIS A 96 8.372 -54.624 28.530 1.00 0.00 C ATOM 1535 ND1 HIS A 96 7.395 -54.436 27.573 1.00 0.00 N ATOM 1536 CD2 HIS A 96 9.267 -53.626 28.348 1.00 0.00 C ATOM 1537 CE1 HIS A 96 7.690 -53.372 26.845 1.00 0.00 C ATOM 1538 NE2 HIS A 96 8.819 -52.867 27.297 1.00 0.00 N ATOM 0 H HIS A 96 7.285 -57.131 27.778 1.00 0.00 H new ATOM 0 HA HIS A 96 9.976 -56.854 28.672 1.00 0.00 H new ATOM 0 HB2 HIS A 96 7.304 -55.934 29.808 1.00 0.00 H new ATOM 0 HB3 HIS A 96 8.866 -55.433 30.425 1.00 0.00 H new ATOM 0 HD2 HIS A 96 10.166 -53.458 28.923 1.00 0.00 H new ATOM 0 HE1 HIS A 96 7.106 -52.985 26.023 1.00 0.00 H new ATOM 0 HE2 HIS A 96 9.287 -52.041 26.924 1.00 0.00 H new ATOM 1546 N HIS A 97 10.178 -58.286 30.679 1.00 0.00 N ATOM 1547 CA HIS A 97 10.333 -59.204 31.786 1.00 0.00 C ATOM 1548 C HIS A 97 9.934 -58.531 33.073 1.00 0.00 C ATOM 1549 O HIS A 97 10.306 -57.383 33.324 1.00 0.00 O ATOM 1550 CB HIS A 97 11.763 -59.736 31.871 1.00 0.00 C ATOM 1551 CG HIS A 97 12.080 -60.763 30.832 1.00 0.00 C ATOM 1552 ND1 HIS A 97 11.968 -62.116 31.056 1.00 0.00 N ATOM 1553 CD2 HIS A 97 12.489 -60.633 29.548 1.00 0.00 C ATOM 1554 CE1 HIS A 97 12.296 -62.772 29.961 1.00 0.00 C ATOM 1555 NE2 HIS A 97 12.614 -61.896 29.032 1.00 0.00 N ATOM 0 H HIS A 97 11.042 -57.840 30.372 1.00 0.00 H new ATOM 0 HA HIS A 97 9.677 -60.058 31.617 1.00 0.00 H new ATOM 0 HB2 HIS A 97 12.459 -58.903 31.771 1.00 0.00 H new ATOM 0 HB3 HIS A 97 11.923 -60.168 32.859 1.00 0.00 H new ATOM 0 HD2 HIS A 97 12.681 -59.706 29.027 1.00 0.00 H new ATOM 0 HE1 HIS A 97 12.303 -63.846 29.846 1.00 0.00 H new ATOM 0 HE2 HIS A 97 12.906 -62.121 28.081 1.00 0.00 H new ATOM 1563 N HIS A 98 9.165 -59.230 33.871 1.00 0.00 N ATOM 1564 CA HIS A 98 8.681 -58.698 35.132 1.00 0.00 C ATOM 1565 C HIS A 98 9.848 -58.472 36.081 1.00 0.00 C ATOM 1566 O HIS A 98 10.191 -57.335 36.402 1.00 0.00 O ATOM 1567 CB HIS A 98 7.673 -59.665 35.744 1.00 0.00 C ATOM 1568 CG HIS A 98 6.518 -59.971 34.841 1.00 0.00 C ATOM 1569 ND1 HIS A 98 6.548 -60.982 33.903 1.00 0.00 N ATOM 1570 CD2 HIS A 98 5.303 -59.393 34.723 1.00 0.00 C ATOM 1571 CE1 HIS A 98 5.402 -61.008 33.248 1.00 0.00 C ATOM 1572 NE2 HIS A 98 4.630 -60.059 33.726 1.00 0.00 N ATOM 0 H HIS A 98 8.855 -60.181 33.671 1.00 0.00 H new ATOM 0 HA HIS A 98 8.188 -57.742 34.956 1.00 0.00 H new ATOM 0 HB2 HIS A 98 8.181 -60.595 35.999 1.00 0.00 H new ATOM 0 HB3 HIS A 98 7.295 -59.243 36.675 1.00 0.00 H new ATOM 0 HD2 HIS A 98 4.930 -58.562 35.304 1.00 0.00 H new ATOM 0 HE1 HIS A 98 5.143 -61.693 32.454 1.00 0.00 H new ATOM 0 HE2 HIS A 98 3.683 -59.850 33.409 1.00 0.00 H new ATOM 1580 N HIS A 99 10.460 -59.561 36.508 1.00 0.00 N ATOM 1581 CA HIS A 99 11.640 -59.513 37.348 1.00 0.00 C ATOM 1582 C HIS A 99 12.310 -60.871 37.317 1.00 0.00 C ATOM 1583 O HIS A 99 12.231 -61.653 38.266 1.00 0.00 O ATOM 1584 CB HIS A 99 11.301 -59.091 38.785 1.00 0.00 C ATOM 1585 CG HIS A 99 12.503 -58.671 39.583 1.00 0.00 C ATOM 1586 ND1 HIS A 99 12.943 -59.335 40.710 1.00 0.00 N ATOM 1587 CD2 HIS A 99 13.355 -57.632 39.408 1.00 0.00 C ATOM 1588 CE1 HIS A 99 14.015 -58.718 41.190 1.00 0.00 C ATOM 1589 NE2 HIS A 99 14.281 -57.688 40.418 1.00 0.00 N ATOM 0 H HIS A 99 10.151 -60.506 36.281 1.00 0.00 H new ATOM 0 HA HIS A 99 12.324 -58.758 36.961 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.588 -58.267 38.755 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.809 -59.920 39.293 1.00 0.00 H new ATOM 0 HD2 HIS A 99 13.313 -56.896 38.619 1.00 0.00 H new ATOM 0 HE1 HIS A 99 14.574 -59.012 42.066 1.00 0.00 H new ATOM 0 HE2 HIS A 99 15.053 -57.035 40.549 1.00 0.00 H new ATOM 1597 N HIS A 100 12.931 -61.149 36.198 1.00 0.00 N ATOM 1598 CA HIS A 100 13.569 -62.421 35.948 1.00 0.00 C ATOM 1599 C HIS A 100 15.073 -62.283 36.062 1.00 0.00 C ATOM 1600 O HIS A 100 15.603 -61.173 36.041 1.00 0.00 O ATOM 1601 CB HIS A 100 13.198 -62.930 34.551 1.00 0.00 C ATOM 1602 CG HIS A 100 11.746 -63.259 34.380 1.00 0.00 C ATOM 1603 ND1 HIS A 100 10.764 -62.298 34.197 1.00 0.00 N ATOM 1604 CD2 HIS A 100 11.107 -64.447 34.357 1.00 0.00 C ATOM 1605 CE1 HIS A 100 9.593 -62.894 34.074 1.00 0.00 C ATOM 1606 NE2 HIS A 100 9.775 -64.189 34.165 1.00 0.00 N ATOM 0 H HIS A 100 13.010 -60.490 35.423 1.00 0.00 H new ATOM 0 HA HIS A 100 13.222 -63.138 36.692 1.00 0.00 H new ATOM 0 HB2 HIS A 100 13.476 -62.175 33.816 1.00 0.00 H new ATOM 0 HB3 HIS A 100 13.788 -63.820 34.333 1.00 0.00 H new ATOM 0 HD2 HIS A 100 11.561 -65.421 34.469 1.00 0.00 H new ATOM 0 HE1 HIS A 100 8.645 -62.399 33.924 1.00 0.00 H new ATOM 0 HE2 HIS A 100 9.040 -64.894 34.103 1.00 0.00 H new ATOM 1614 N HIS A 101 15.750 -63.399 36.193 1.00 0.00 N ATOM 1615 CA HIS A 101 17.194 -63.395 36.322 1.00 0.00 C ATOM 1616 C HIS A 101 17.832 -64.003 35.089 1.00 0.00 C ATOM 1617 O HIS A 101 18.163 -63.249 34.155 1.00 0.00 O ATOM 1618 CB HIS A 101 17.623 -64.167 37.566 1.00 0.00 C ATOM 1619 CG HIS A 101 17.052 -63.630 38.838 1.00 0.00 C ATOM 1620 ND1 HIS A 101 15.949 -64.178 39.456 1.00 0.00 N ATOM 1621 CD2 HIS A 101 17.439 -62.596 39.618 1.00 0.00 C ATOM 1622 CE1 HIS A 101 15.685 -63.505 40.558 1.00 0.00 C ATOM 1623 NE2 HIS A 101 16.574 -62.540 40.680 1.00 0.00 N ATOM 1624 OXT HIS A 101 17.988 -65.241 35.044 1.00 0.00 O ATOM 0 H HIS A 101 15.325 -64.326 36.213 1.00 0.00 H new ATOM 0 HA HIS A 101 17.528 -62.362 36.421 1.00 0.00 H new ATOM 0 HB2 HIS A 101 17.324 -65.209 37.456 1.00 0.00 H new ATOM 0 HB3 HIS A 101 18.711 -64.153 37.633 1.00 0.00 H new ATOM 0 HD2 HIS A 101 18.275 -61.936 39.438 1.00 0.00 H new ATOM 0 HE1 HIS A 101 14.877 -63.710 41.245 1.00 0.00 H new ATOM 0 HE2 HIS A 101 16.612 -61.862 41.441 1.00 0.00 H new TER 1632 HIS A 101