USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 946 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 12 MET CE :methyl 172:sc= 0 (180deg=-0.0369) USER MOD Set 1.2: A 68 THR OG1 : rot 180:sc= 0.0493 USER MOD Set 2.1: A 37 THR OG1 : rot 140:sc= 0.0482 USER MOD Set 2.2: A 69 THR OG1 : rot 140:sc= 0.0989 USER MOD Set 3.1: A 25 SER OG : rot 103:sc= 0.788 USER MOD Set 3.2: A 90 ASN : amide:sc= 0.908 K(o=1.7,f=-0.14) USER MOD Single : A 1 GLY N :NH3+ -138:sc= 0.416 (180deg=-1.35!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot -110:sc= -0.0319 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.124 USER MOD Single : A 19 GLN : amide:sc= 0.419 K(o=0.42,f=-0.66) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -127:sc= 2.07 (180deg=1.7) USER MOD Single : A 29 SER OG : rot 180:sc= -0.0448 USER MOD Single : A 35 ASN : amide:sc= -0.724 K(o=-0.72,f=-5.4!) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0.0188 USER MOD Single : A 50 SER OG : rot -120:sc= -0.0101 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 130:sc= -0.347 USER MOD Single : A 67 SER OG : rot 26:sc= -0.0179 USER MOD Single : A 71 LYS NZ :NH3+ -145:sc= -0.477 (180deg=-2.54) USER MOD Single : A 78 SER OG : rot 9:sc= 0.00171 USER MOD Single : A 93 MET CE :methyl -166:sc= -0.577 (180deg=-1.56) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 98 THR OG1 : rot -32:sc= 0.325 USER MOD Single : A 100 TYR OH : rot -140:sc= 1.18 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc=-0.00647 K(o=-0.0065,f=-4.6!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -150:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.14) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 130:sc= 0 USER MOD Single : A 129 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 30.760 -13.103 -14.167 1.00 0.00 N ATOM 2 CA GLY A 1 31.825 -13.242 -15.165 1.00 0.00 C ATOM 3 C GLY A 1 31.501 -12.328 -16.326 1.00 0.00 C ATOM 4 O GLY A 1 30.797 -12.778 -17.224 1.00 0.00 O ATOM 0 H1 GLY A 1 31.178 -13.070 -13.215 1.00 0.00 H new ATOM 0 H2 GLY A 1 30.231 -12.225 -14.343 1.00 0.00 H new ATOM 0 H3 GLY A 1 30.114 -13.915 -14.233 1.00 0.00 H new ATOM 0 HA2 GLY A 1 32.790 -12.980 -14.731 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.898 -14.276 -15.503 1.00 0.00 H new ATOM 8 N ASP A 2 31.975 -11.074 -16.285 1.00 0.00 N ATOM 9 CA ASP A 2 31.183 -9.859 -16.545 1.00 0.00 C ATOM 10 C ASP A 2 30.330 -9.702 -15.298 1.00 0.00 C ATOM 11 O ASP A 2 29.517 -10.575 -14.991 1.00 0.00 O ATOM 12 CB ASP A 2 30.328 -9.829 -17.825 1.00 0.00 C ATOM 13 CG ASP A 2 29.302 -8.697 -17.746 1.00 0.00 C ATOM 14 OD1 ASP A 2 29.679 -7.538 -17.474 1.00 0.00 O ATOM 15 OD2 ASP A 2 28.095 -8.975 -17.947 1.00 0.00 O ATOM 0 H ASP A 2 32.949 -10.869 -16.063 1.00 0.00 H new ATOM 0 HA ASP A 2 31.866 -9.032 -16.741 1.00 0.00 H new ATOM 0 HB2 ASP A 2 30.968 -9.690 -18.696 1.00 0.00 H new ATOM 0 HB3 ASP A 2 29.818 -10.784 -17.954 1.00 0.00 H new ATOM 20 N ASP A 3 30.639 -8.702 -14.485 1.00 0.00 N ATOM 21 CA ASP A 3 30.295 -8.624 -13.088 1.00 0.00 C ATOM 22 C ASP A 3 29.993 -7.158 -12.844 1.00 0.00 C ATOM 23 O ASP A 3 30.434 -6.275 -13.586 1.00 0.00 O ATOM 24 CB ASP A 3 31.454 -9.143 -12.219 1.00 0.00 C ATOM 25 CG ASP A 3 31.634 -10.643 -12.424 1.00 0.00 C ATOM 26 OD1 ASP A 3 32.404 -11.048 -13.326 1.00 0.00 O ATOM 27 OD2 ASP A 3 30.880 -11.436 -11.809 1.00 0.00 O ATOM 0 H ASP A 3 31.162 -7.887 -14.806 1.00 0.00 H new ATOM 0 HA ASP A 3 29.439 -9.245 -12.825 1.00 0.00 H new ATOM 0 HB2 ASP A 3 32.375 -8.620 -12.478 1.00 0.00 H new ATOM 0 HB3 ASP A 3 31.253 -8.934 -11.168 1.00 0.00 H new ATOM 32 N ASP A 4 29.176 -6.924 -11.840 1.00 0.00 N ATOM 33 CA ASP A 4 28.387 -5.713 -11.645 1.00 0.00 C ATOM 34 C ASP A 4 28.301 -5.450 -10.143 1.00 0.00 C ATOM 35 O ASP A 4 28.407 -6.395 -9.358 1.00 0.00 O ATOM 36 CB ASP A 4 26.999 -5.989 -12.242 1.00 0.00 C ATOM 37 CG ASP A 4 26.106 -4.771 -12.458 1.00 0.00 C ATOM 38 OD1 ASP A 4 26.392 -3.649 -11.981 1.00 0.00 O ATOM 39 OD2 ASP A 4 25.080 -4.959 -13.157 1.00 0.00 O ATOM 0 H ASP A 4 29.032 -7.606 -11.095 1.00 0.00 H new ATOM 0 HA ASP A 4 28.824 -4.838 -12.126 1.00 0.00 H new ATOM 0 HB2 ASP A 4 27.132 -6.491 -13.200 1.00 0.00 H new ATOM 0 HB3 ASP A 4 26.476 -6.686 -11.587 1.00 0.00 H new ATOM 44 N GLU A 5 28.079 -4.208 -9.728 1.00 0.00 N ATOM 45 CA GLU A 5 27.934 -3.827 -8.331 1.00 0.00 C ATOM 46 C GLU A 5 27.149 -2.518 -8.325 1.00 0.00 C ATOM 47 O GLU A 5 27.730 -1.432 -8.438 1.00 0.00 O ATOM 48 CB GLU A 5 29.251 -3.732 -7.535 1.00 0.00 C ATOM 49 CG GLU A 5 28.879 -3.586 -6.043 1.00 0.00 C ATOM 50 CD GLU A 5 30.037 -3.252 -5.107 1.00 0.00 C ATOM 51 OE1 GLU A 5 30.763 -4.188 -4.698 1.00 0.00 O ATOM 52 OE2 GLU A 5 30.071 -2.095 -4.621 1.00 0.00 O ATOM 0 H GLU A 5 27.993 -3.420 -10.370 1.00 0.00 H new ATOM 0 HA GLU A 5 27.405 -4.619 -7.801 1.00 0.00 H new ATOM 0 HB2 GLU A 5 29.860 -4.622 -7.693 1.00 0.00 H new ATOM 0 HB3 GLU A 5 29.841 -2.878 -7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 5 28.123 -2.807 -5.950 1.00 0.00 H new ATOM 0 HG3 GLU A 5 28.421 -4.517 -5.708 1.00 0.00 H new ATOM 59 N PRO A 6 25.814 -2.584 -8.332 1.00 0.00 N ATOM 60 CA PRO A 6 25.015 -1.388 -8.182 1.00 0.00 C ATOM 61 C PRO A 6 25.247 -0.774 -6.789 1.00 0.00 C ATOM 62 O PRO A 6 25.535 -1.475 -5.807 1.00 0.00 O ATOM 63 CB PRO A 6 23.595 -1.868 -8.459 1.00 0.00 C ATOM 64 CG PRO A 6 23.594 -3.298 -7.929 1.00 0.00 C ATOM 65 CD PRO A 6 24.985 -3.783 -8.312 1.00 0.00 C ATOM 0 HA PRO A 6 25.265 -0.573 -8.861 1.00 0.00 H new ATOM 0 HB2 PRO A 6 22.856 -1.250 -7.949 1.00 0.00 H new ATOM 0 HB3 PRO A 6 23.360 -1.834 -9.523 1.00 0.00 H new ATOM 0 HG2 PRO A 6 23.433 -3.333 -6.852 1.00 0.00 H new ATOM 0 HG3 PRO A 6 22.811 -3.902 -8.388 1.00 0.00 H new ATOM 0 HD2 PRO A 6 25.361 -4.510 -7.592 1.00 0.00 H new ATOM 0 HD3 PRO A 6 24.977 -4.273 -9.286 1.00 0.00 H new ATOM 73 N GLY A 7 25.143 0.550 -6.678 1.00 0.00 N ATOM 74 CA GLY A 7 25.404 1.227 -5.422 1.00 0.00 C ATOM 75 C GLY A 7 25.660 2.718 -5.513 1.00 0.00 C ATOM 76 O GLY A 7 26.725 3.170 -5.085 1.00 0.00 O ATOM 0 H GLY A 7 24.880 1.168 -7.445 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.553 1.064 -4.760 1.00 0.00 H new ATOM 0 HA3 GLY A 7 26.268 0.758 -4.952 1.00 0.00 H new ATOM 80 N GLY A 8 24.671 3.476 -5.978 1.00 0.00 N ATOM 81 CA GLY A 8 24.636 4.919 -5.825 1.00 0.00 C ATOM 82 C GLY A 8 24.207 5.284 -4.403 1.00 0.00 C ATOM 83 O GLY A 8 25.012 5.228 -3.465 1.00 0.00 O ATOM 0 H GLY A 8 23.865 3.098 -6.476 1.00 0.00 H new ATOM 0 HA2 GLY A 8 25.619 5.339 -6.036 1.00 0.00 H new ATOM 0 HA3 GLY A 8 23.943 5.353 -6.546 1.00 0.00 H new ATOM 87 N LYS A 9 22.949 5.694 -4.225 1.00 0.00 N ATOM 88 CA LYS A 9 22.374 6.178 -2.977 1.00 0.00 C ATOM 89 C LYS A 9 20.852 6.122 -3.128 1.00 0.00 C ATOM 90 O LYS A 9 20.336 6.197 -4.247 1.00 0.00 O ATOM 91 CB LYS A 9 22.878 7.615 -2.740 1.00 0.00 C ATOM 92 CG LYS A 9 22.660 8.128 -1.309 1.00 0.00 C ATOM 93 CD LYS A 9 23.565 9.342 -1.061 1.00 0.00 C ATOM 94 CE LYS A 9 23.314 9.959 0.316 1.00 0.00 C ATOM 95 NZ LYS A 9 24.349 10.954 0.664 1.00 0.00 N ATOM 0 H LYS A 9 22.273 5.696 -4.989 1.00 0.00 H new ATOM 0 HA LYS A 9 22.666 5.574 -2.118 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.942 7.658 -2.972 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.373 8.285 -3.436 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.615 8.403 -1.165 1.00 0.00 H new ATOM 0 HG3 LYS A 9 22.884 7.340 -0.590 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.609 9.040 -1.140 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.390 10.091 -1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.333 10.434 0.329 1.00 0.00 H new ATOM 0 HE3 LYS A 9 23.297 9.172 1.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.147 11.351 1.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.282 10.495 0.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.348 11.717 -0.042 1.00 0.00 H new ATOM 109 N GLY A 10 20.145 6.005 -2.013 1.00 0.00 N ATOM 110 CA GLY A 10 18.688 5.962 -1.911 1.00 0.00 C ATOM 111 C GLY A 10 18.276 6.205 -0.458 1.00 0.00 C ATOM 112 O GLY A 10 18.964 6.961 0.237 1.00 0.00 O ATOM 0 H GLY A 10 20.596 5.933 -1.101 1.00 0.00 H new ATOM 0 HA2 GLY A 10 18.244 6.718 -2.558 1.00 0.00 H new ATOM 0 HA3 GLY A 10 18.317 4.995 -2.250 1.00 0.00 H new ATOM 116 N ALA A 11 17.184 5.597 0.018 1.00 0.00 N ATOM 117 CA ALA A 11 16.692 5.753 1.391 1.00 0.00 C ATOM 118 C ALA A 11 16.031 4.464 1.897 1.00 0.00 C ATOM 119 O ALA A 11 15.911 3.485 1.161 1.00 0.00 O ATOM 120 CB ALA A 11 15.691 6.920 1.445 1.00 0.00 C ATOM 0 H ALA A 11 16.609 4.973 -0.548 1.00 0.00 H new ATOM 0 HA ALA A 11 17.541 5.967 2.041 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.324 7.038 2.465 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.186 7.839 1.129 1.00 0.00 H new ATOM 0 HB3 ALA A 11 14.853 6.712 0.780 1.00 0.00 H new ATOM 126 N MET A 12 15.595 4.485 3.154 1.00 0.00 N ATOM 127 CA MET A 12 14.572 3.625 3.726 1.00 0.00 C ATOM 128 C MET A 12 13.218 4.296 3.554 1.00 0.00 C ATOM 129 O MET A 12 13.111 5.529 3.566 1.00 0.00 O ATOM 130 CB MET A 12 14.794 3.453 5.232 1.00 0.00 C ATOM 131 CG MET A 12 16.017 2.604 5.541 1.00 0.00 C ATOM 132 SD MET A 12 15.707 1.146 6.573 1.00 0.00 S ATOM 133 CE MET A 12 14.575 0.168 5.540 1.00 0.00 C ATOM 0 H MET A 12 15.971 5.143 3.837 1.00 0.00 H new ATOM 0 HA MET A 12 14.616 2.658 3.225 1.00 0.00 H new ATOM 0 HB2 MET A 12 14.909 4.433 5.695 1.00 0.00 H new ATOM 0 HB3 MET A 12 13.912 2.992 5.677 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.458 2.276 4.600 1.00 0.00 H new ATOM 0 HG3 MET A 12 16.757 3.230 6.039 1.00 0.00 H new ATOM 0 HE1 MET A 12 14.422 -0.811 5.994 1.00 0.00 H new ATOM 0 HE2 MET A 12 13.618 0.684 5.459 1.00 0.00 H new ATOM 0 HE3 MET A 12 15.005 0.044 4.546 1.00 0.00 H new ATOM 143 N TYR A 13 12.199 3.455 3.453 1.00 0.00 N ATOM 144 CA TYR A 13 10.806 3.757 3.317 1.00 0.00 C ATOM 145 C TYR A 13 9.972 2.564 3.789 1.00 0.00 C ATOM 146 O TYR A 13 10.258 1.402 3.472 1.00 0.00 O ATOM 147 CB TYR A 13 10.444 4.335 1.932 1.00 0.00 C ATOM 148 CG TYR A 13 11.305 4.104 0.681 1.00 0.00 C ATOM 149 CD1 TYR A 13 12.314 3.122 0.588 1.00 0.00 C ATOM 150 CD2 TYR A 13 11.162 5.015 -0.389 1.00 0.00 C ATOM 151 CE1 TYR A 13 13.286 3.208 -0.419 1.00 0.00 C ATOM 152 CE2 TYR A 13 12.056 5.010 -1.480 1.00 0.00 C ATOM 153 CZ TYR A 13 13.185 4.176 -1.435 1.00 0.00 C ATOM 154 OH TYR A 13 14.185 4.334 -2.338 1.00 0.00 O ATOM 0 H TYR A 13 12.358 2.447 3.467 1.00 0.00 H new ATOM 0 HA TYR A 13 10.547 4.583 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 13 9.446 3.967 1.694 1.00 0.00 H new ATOM 0 HB3 TYR A 13 10.364 5.415 2.058 1.00 0.00 H new ATOM 0 HD1 TYR A 13 12.338 2.304 1.293 1.00 0.00 H new ATOM 0 HD2 TYR A 13 10.352 5.729 -0.371 1.00 0.00 H new ATOM 0 HE1 TYR A 13 14.121 2.524 -0.415 1.00 0.00 H new ATOM 0 HE2 TYR A 13 11.875 5.639 -2.339 1.00 0.00 H new ATOM 0 HH TYR A 13 14.639 5.188 -2.178 1.00 0.00 H new ATOM 164 N GLU A 14 8.950 2.881 4.577 1.00 0.00 N ATOM 165 CA GLU A 14 7.864 2.032 5.020 1.00 0.00 C ATOM 166 C GLU A 14 6.596 2.796 4.661 1.00 0.00 C ATOM 167 O GLU A 14 6.526 4.013 4.862 1.00 0.00 O ATOM 168 CB GLU A 14 7.968 1.774 6.538 1.00 0.00 C ATOM 169 CG GLU A 14 6.800 0.947 7.107 1.00 0.00 C ATOM 170 CD GLU A 14 7.071 0.437 8.527 1.00 0.00 C ATOM 171 OE1 GLU A 14 7.870 -0.514 8.697 1.00 0.00 O ATOM 172 OE2 GLU A 14 6.469 0.965 9.487 1.00 0.00 O ATOM 0 H GLU A 14 8.858 3.825 4.952 1.00 0.00 H new ATOM 0 HA GLU A 14 7.880 1.049 4.548 1.00 0.00 H new ATOM 0 HB2 GLU A 14 8.904 1.256 6.746 1.00 0.00 H new ATOM 0 HB3 GLU A 14 8.011 2.731 7.058 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.897 1.557 7.111 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.608 0.098 6.451 1.00 0.00 H new ATOM 179 N VAL A 15 5.599 2.095 4.137 1.00 0.00 N ATOM 180 CA VAL A 15 4.243 2.591 4.015 1.00 0.00 C ATOM 181 C VAL A 15 3.409 1.794 5.010 1.00 0.00 C ATOM 182 O VAL A 15 3.675 0.613 5.269 1.00 0.00 O ATOM 183 CB VAL A 15 3.762 2.479 2.549 1.00 0.00 C ATOM 184 CG1 VAL A 15 3.631 1.020 2.082 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.430 3.202 2.297 1.00 0.00 C ATOM 0 H VAL A 15 5.717 1.147 3.779 1.00 0.00 H new ATOM 0 HA VAL A 15 4.155 3.651 4.253 1.00 0.00 H new ATOM 0 HB VAL A 15 4.540 2.972 1.966 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.290 0.999 1.047 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.600 0.526 2.156 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.910 0.500 2.712 1.00 0.00 H new ATOM 0 HG21 VAL A 15 2.146 3.087 1.251 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.656 2.771 2.933 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.542 4.261 2.528 1.00 0.00 H new ATOM 195 N THR A 16 2.358 2.415 5.525 1.00 0.00 N ATOM 196 CA THR A 16 1.310 1.708 6.215 1.00 0.00 C ATOM 197 C THR A 16 -0.008 2.032 5.541 1.00 0.00 C ATOM 198 O THR A 16 -0.136 3.045 4.851 1.00 0.00 O ATOM 199 CB THR A 16 1.332 2.051 7.714 1.00 0.00 C ATOM 200 OG1 THR A 16 1.290 3.442 7.961 1.00 0.00 O ATOM 201 CG2 THR A 16 2.566 1.500 8.429 1.00 0.00 C ATOM 0 H THR A 16 2.216 3.424 5.472 1.00 0.00 H new ATOM 0 HA THR A 16 1.459 0.630 6.156 1.00 0.00 H new ATOM 0 HB THR A 16 0.432 1.578 8.106 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.304 3.603 8.928 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.528 1.773 9.484 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.586 0.414 8.336 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.465 1.920 7.978 1.00 0.00 H new ATOM 209 N ILE A 17 -0.984 1.166 5.765 1.00 0.00 N ATOM 210 CA ILE A 17 -2.381 1.314 5.468 1.00 0.00 C ATOM 211 C ILE A 17 -3.115 0.972 6.761 1.00 0.00 C ATOM 212 O ILE A 17 -2.787 -0.019 7.423 1.00 0.00 O ATOM 213 CB ILE A 17 -2.748 0.406 4.268 1.00 0.00 C ATOM 214 CG1 ILE A 17 -4.250 0.408 3.954 1.00 0.00 C ATOM 215 CG2 ILE A 17 -2.376 -1.068 4.446 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.780 1.755 3.503 1.00 0.00 C ATOM 0 H ILE A 17 -0.790 0.264 6.199 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.662 2.321 5.160 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.162 0.847 3.462 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.450 -0.329 3.176 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.798 0.091 4.842 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.670 -1.627 3.558 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.299 -1.157 4.591 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.894 -1.471 5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.848 1.676 3.300 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.613 2.493 4.288 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.260 2.066 2.597 1.00 0.00 H new ATOM 228 N GLU A 18 -4.101 1.789 7.108 1.00 0.00 N ATOM 229 CA GLU A 18 -5.216 1.406 7.949 1.00 0.00 C ATOM 230 C GLU A 18 -6.446 1.400 7.041 1.00 0.00 C ATOM 231 O GLU A 18 -6.589 2.273 6.173 1.00 0.00 O ATOM 232 CB GLU A 18 -5.376 2.382 9.121 1.00 0.00 C ATOM 233 CG GLU A 18 -4.289 2.203 10.200 1.00 0.00 C ATOM 234 CD GLU A 18 -4.819 2.348 11.632 1.00 0.00 C ATOM 235 OE1 GLU A 18 -5.724 1.578 12.024 1.00 0.00 O ATOM 236 OE2 GLU A 18 -4.263 3.142 12.428 1.00 0.00 O ATOM 0 H GLU A 18 -4.144 2.761 6.802 1.00 0.00 H new ATOM 0 HA GLU A 18 -5.064 0.425 8.398 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.342 3.404 8.744 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.358 2.241 9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.835 1.219 10.087 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.501 2.938 10.036 1.00 0.00 H new ATOM 243 N GLN A 19 -7.304 0.396 7.210 1.00 0.00 N ATOM 244 CA GLN A 19 -8.498 0.151 6.415 1.00 0.00 C ATOM 245 C GLN A 19 -9.661 0.160 7.391 1.00 0.00 C ATOM 246 O GLN A 19 -9.671 -0.668 8.306 1.00 0.00 O ATOM 247 CB GLN A 19 -8.407 -1.211 5.705 1.00 0.00 C ATOM 248 CG GLN A 19 -7.113 -1.353 4.888 1.00 0.00 C ATOM 249 CD GLN A 19 -7.013 -2.596 4.009 1.00 0.00 C ATOM 250 OE1 GLN A 19 -6.117 -2.684 3.175 1.00 0.00 O ATOM 251 NE2 GLN A 19 -7.908 -3.554 4.139 1.00 0.00 N ATOM 0 H GLN A 19 -7.176 -0.302 7.943 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.619 0.908 5.640 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.457 -2.009 6.446 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.266 -1.334 5.046 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.009 -0.473 4.253 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.269 -1.350 5.577 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.648 -3.469 4.836 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.861 -4.380 3.543 1.00 0.00 H new ATOM 260 N SER A 20 -10.591 1.103 7.257 1.00 0.00 N ATOM 261 CA SER A 20 -11.651 1.296 8.238 1.00 0.00 C ATOM 262 C SER A 20 -12.960 1.694 7.558 1.00 0.00 C ATOM 263 O SER A 20 -12.990 1.975 6.358 1.00 0.00 O ATOM 264 CB SER A 20 -11.227 2.365 9.259 1.00 0.00 C ATOM 265 OG SER A 20 -9.906 2.180 9.745 1.00 0.00 O ATOM 0 H SER A 20 -10.629 1.750 6.470 1.00 0.00 H new ATOM 0 HA SER A 20 -11.819 0.353 8.758 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.303 3.350 8.798 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.922 2.352 10.099 1.00 0.00 H new ATOM 0 HG SER A 20 -9.692 2.888 10.388 1.00 0.00 H new ATOM 271 N GLY A 21 -14.036 1.729 8.346 1.00 0.00 N ATOM 272 CA GLY A 21 -15.403 1.761 7.858 1.00 0.00 C ATOM 273 C GLY A 21 -15.810 0.307 7.731 1.00 0.00 C ATOM 274 O GLY A 21 -16.112 -0.330 8.741 1.00 0.00 O ATOM 0 H GLY A 21 -13.972 1.736 9.364 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -16.056 2.294 8.549 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.467 2.274 6.898 1.00 0.00 H new ATOM 278 N ASP A 22 -15.677 -0.263 6.544 1.00 0.00 N ATOM 279 CA ASP A 22 -15.727 -1.696 6.283 1.00 0.00 C ATOM 280 C ASP A 22 -14.688 -2.002 5.203 1.00 0.00 C ATOM 281 O ASP A 22 -14.058 -1.086 4.679 1.00 0.00 O ATOM 282 CB ASP A 22 -17.150 -2.086 5.851 1.00 0.00 C ATOM 283 CG ASP A 22 -17.407 -3.599 5.871 1.00 0.00 C ATOM 284 OD1 ASP A 22 -16.527 -4.363 6.331 1.00 0.00 O ATOM 285 OD2 ASP A 22 -18.522 -4.042 5.495 1.00 0.00 O ATOM 0 H ASP A 22 -15.524 0.284 5.697 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.493 -2.280 7.173 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -17.867 -1.596 6.509 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.331 -1.709 4.845 1.00 0.00 H new ATOM 290 N PHE A 23 -14.444 -3.267 4.882 1.00 0.00 N ATOM 291 CA PHE A 23 -13.644 -3.673 3.730 1.00 0.00 C ATOM 292 C PHE A 23 -13.962 -5.104 3.280 1.00 0.00 C ATOM 293 O PHE A 23 -13.247 -5.635 2.429 1.00 0.00 O ATOM 294 CB PHE A 23 -12.146 -3.486 4.035 1.00 0.00 C ATOM 295 CG PHE A 23 -11.692 -3.963 5.402 1.00 0.00 C ATOM 296 CD1 PHE A 23 -11.318 -5.301 5.619 1.00 0.00 C ATOM 297 CD2 PHE A 23 -11.678 -3.051 6.473 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.895 -5.709 6.897 1.00 0.00 C ATOM 299 CE2 PHE A 23 -11.235 -3.455 7.742 1.00 0.00 C ATOM 300 CZ PHE A 23 -10.829 -4.782 7.951 1.00 0.00 C ATOM 0 H PHE A 23 -14.802 -4.054 5.423 1.00 0.00 H new ATOM 0 HA PHE A 23 -13.907 -3.028 2.892 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.570 -4.015 3.275 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.903 -2.428 3.940 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -11.355 -6.013 4.808 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -12.010 -2.035 6.318 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.620 -6.739 7.069 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -11.207 -2.746 8.556 1.00 0.00 H new ATOM 0 HZ PHE A 23 -10.466 -5.090 8.920 1.00 0.00 H new ATOM 310 N ARG A 24 -15.000 -5.745 3.833 1.00 0.00 N ATOM 311 CA ARG A 24 -15.312 -7.159 3.616 1.00 0.00 C ATOM 312 C ARG A 24 -15.455 -7.525 2.146 1.00 0.00 C ATOM 313 O ARG A 24 -14.967 -8.593 1.767 1.00 0.00 O ATOM 314 CB ARG A 24 -16.604 -7.537 4.351 1.00 0.00 C ATOM 315 CG ARG A 24 -16.411 -7.582 5.862 1.00 0.00 C ATOM 316 CD ARG A 24 -17.768 -7.465 6.553 1.00 0.00 C ATOM 317 NE ARG A 24 -17.596 -7.397 8.002 1.00 0.00 N ATOM 318 CZ ARG A 24 -18.581 -7.302 8.894 1.00 0.00 C ATOM 319 NH1 ARG A 24 -19.859 -7.217 8.520 1.00 0.00 N ATOM 320 NH2 ARG A 24 -18.261 -7.318 10.176 1.00 0.00 N ATOM 0 H ARG A 24 -15.660 -5.282 4.458 1.00 0.00 H new ATOM 0 HA ARG A 24 -14.465 -7.719 4.012 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -17.384 -6.816 4.107 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -16.949 -8.510 4.001 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.924 -8.514 6.149 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.758 -6.769 6.180 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -18.288 -6.574 6.200 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -18.391 -8.321 6.294 1.00 0.00 H new ATOM 0 HE ARG A 24 -16.642 -7.425 8.361 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -20.102 -7.224 7.529 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -20.593 -7.145 9.225 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -17.284 -7.401 10.457 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -18.991 -7.247 10.885 1.00 0.00 H new ATOM 334 N SER A 25 -16.113 -6.675 1.354 1.00 0.00 N ATOM 335 CA SER A 25 -16.416 -6.918 -0.055 1.00 0.00 C ATOM 336 C SER A 25 -15.953 -5.726 -0.898 1.00 0.00 C ATOM 337 O SER A 25 -16.719 -5.155 -1.672 1.00 0.00 O ATOM 338 CB SER A 25 -17.906 -7.224 -0.252 1.00 0.00 C ATOM 339 OG SER A 25 -18.393 -8.082 0.766 1.00 0.00 O ATOM 0 H SER A 25 -16.458 -5.775 1.686 1.00 0.00 H new ATOM 0 HA SER A 25 -15.870 -7.799 -0.392 1.00 0.00 H new ATOM 0 HB2 SER A 25 -18.474 -6.294 -0.250 1.00 0.00 H new ATOM 0 HB3 SER A 25 -18.059 -7.688 -1.226 1.00 0.00 H new ATOM 0 HG SER A 25 -18.911 -7.560 1.414 1.00 0.00 H new ATOM 345 N PHE A 26 -14.694 -5.331 -0.729 1.00 0.00 N ATOM 346 CA PHE A 26 -14.088 -4.179 -1.376 1.00 0.00 C ATOM 347 C PHE A 26 -12.878 -4.681 -2.138 1.00 0.00 C ATOM 348 O PHE A 26 -11.896 -5.089 -1.523 1.00 0.00 O ATOM 349 CB PHE A 26 -13.761 -3.114 -0.324 1.00 0.00 C ATOM 350 CG PHE A 26 -14.971 -2.265 -0.024 1.00 0.00 C ATOM 351 CD1 PHE A 26 -15.940 -2.736 0.874 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.188 -1.069 -0.734 1.00 0.00 C ATOM 353 CE1 PHE A 26 -17.141 -2.036 1.034 1.00 0.00 C ATOM 354 CE2 PHE A 26 -16.392 -0.362 -0.564 1.00 0.00 C ATOM 355 CZ PHE A 26 -17.378 -0.863 0.307 1.00 0.00 C ATOM 0 H PHE A 26 -14.047 -5.825 -0.114 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.759 -3.695 -2.086 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.413 -3.595 0.590 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -12.948 -2.482 -0.681 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.760 -3.637 1.441 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.431 -0.695 -1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -17.889 -2.402 1.722 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.559 0.561 -1.099 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.318 -0.342 0.415 1.00 0.00 H new ATOM 365 N ILE A 27 -12.987 -4.706 -3.465 1.00 0.00 N ATOM 366 CA ILE A 27 -12.061 -5.368 -4.380 1.00 0.00 C ATOM 367 C ILE A 27 -10.768 -4.546 -4.442 1.00 0.00 C ATOM 368 O ILE A 27 -10.620 -3.626 -5.255 1.00 0.00 O ATOM 369 CB ILE A 27 -12.726 -5.585 -5.762 1.00 0.00 C ATOM 370 CG1 ILE A 27 -14.082 -6.328 -5.641 1.00 0.00 C ATOM 371 CG2 ILE A 27 -11.765 -6.380 -6.665 1.00 0.00 C ATOM 372 CD1 ILE A 27 -14.934 -6.288 -6.908 1.00 0.00 C ATOM 0 H ILE A 27 -13.756 -4.246 -3.952 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.803 -6.364 -4.021 1.00 0.00 H new ATOM 0 HB ILE A 27 -12.931 -4.608 -6.200 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -13.891 -7.368 -5.378 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.651 -5.891 -4.820 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -12.227 -6.536 -7.640 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.837 -5.822 -6.789 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.550 -7.345 -6.207 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -15.864 -6.830 -6.738 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -15.159 -5.252 -7.163 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -14.388 -6.753 -7.729 1.00 0.00 H new ATOM 384 N LYS A 28 -9.838 -4.844 -3.540 1.00 0.00 N ATOM 385 CA LYS A 28 -8.668 -4.031 -3.233 1.00 0.00 C ATOM 386 C LYS A 28 -7.398 -4.744 -3.673 1.00 0.00 C ATOM 387 O LYS A 28 -7.135 -5.860 -3.234 1.00 0.00 O ATOM 388 CB LYS A 28 -8.646 -3.681 -1.732 1.00 0.00 C ATOM 389 CG LYS A 28 -8.864 -4.848 -0.750 1.00 0.00 C ATOM 390 CD LYS A 28 -9.536 -4.409 0.563 1.00 0.00 C ATOM 391 CE LYS A 28 -9.845 -5.624 1.443 1.00 0.00 C ATOM 392 NZ LYS A 28 -11.021 -6.380 0.981 1.00 0.00 N ATOM 0 H LYS A 28 -9.882 -5.695 -2.980 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.722 -3.095 -3.788 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.686 -3.218 -1.504 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.414 -2.930 -1.546 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.479 -5.610 -1.230 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.903 -5.310 -0.524 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.883 -3.721 1.100 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -10.457 -3.869 0.344 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.978 -6.284 1.460 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -10.012 -5.292 2.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.691 -6.495 1.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.483 -5.864 0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.721 -7.316 0.643 1.00 0.00 H new ATOM 406 N SER A 29 -6.586 -4.082 -4.486 1.00 0.00 N ATOM 407 CA SER A 29 -5.229 -4.494 -4.820 1.00 0.00 C ATOM 408 C SER A 29 -4.273 -3.330 -4.574 1.00 0.00 C ATOM 409 O SER A 29 -4.689 -2.171 -4.498 1.00 0.00 O ATOM 410 CB SER A 29 -5.170 -4.969 -6.277 1.00 0.00 C ATOM 411 OG SER A 29 -5.563 -6.326 -6.375 1.00 0.00 O ATOM 0 H SER A 29 -6.863 -3.215 -4.946 1.00 0.00 H new ATOM 0 HA SER A 29 -4.927 -5.328 -4.186 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.822 -4.350 -6.894 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.158 -4.849 -6.664 1.00 0.00 H new ATOM 0 HG SER A 29 -5.521 -6.612 -7.311 1.00 0.00 H new ATOM 417 N VAL A 30 -2.986 -3.649 -4.425 1.00 0.00 N ATOM 418 CA VAL A 30 -1.925 -2.685 -4.171 1.00 0.00 C ATOM 419 C VAL A 30 -0.712 -3.122 -4.988 1.00 0.00 C ATOM 420 O VAL A 30 -0.345 -4.296 -4.989 1.00 0.00 O ATOM 421 CB VAL A 30 -1.612 -2.610 -2.660 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.452 -1.649 -2.364 1.00 0.00 C ATOM 423 CG2 VAL A 30 -2.810 -2.113 -1.831 1.00 0.00 C ATOM 0 H VAL A 30 -2.649 -4.610 -4.480 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.225 -1.681 -4.470 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.356 -3.632 -2.380 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.264 -1.625 -1.291 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.444 -1.990 -2.882 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.712 -0.648 -2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.534 -2.080 -0.777 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.093 -1.114 -2.164 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.652 -2.792 -1.965 1.00 0.00 H new ATOM 433 N VAL A 31 -0.091 -2.171 -5.681 1.00 0.00 N ATOM 434 CA VAL A 31 1.199 -2.305 -6.340 1.00 0.00 C ATOM 435 C VAL A 31 2.275 -2.021 -5.290 1.00 0.00 C ATOM 436 O VAL A 31 2.149 -1.032 -4.567 1.00 0.00 O ATOM 437 CB VAL A 31 1.279 -1.269 -7.487 1.00 0.00 C ATOM 438 CG1 VAL A 31 2.547 -1.444 -8.334 1.00 0.00 C ATOM 439 CG2 VAL A 31 0.056 -1.314 -8.416 1.00 0.00 C ATOM 0 H VAL A 31 -0.496 -1.243 -5.802 1.00 0.00 H new ATOM 0 HA VAL A 31 1.338 -3.302 -6.759 1.00 0.00 H new ATOM 0 HB VAL A 31 1.305 -0.299 -6.991 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.561 -0.696 -9.127 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.427 -1.320 -7.702 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.555 -2.441 -8.775 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.168 -0.566 -9.201 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.023 -2.304 -8.866 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.846 -1.104 -7.841 1.00 0.00 H new ATOM 449 N VAL A 32 3.344 -2.822 -5.226 1.00 0.00 N ATOM 450 CA VAL A 32 4.543 -2.508 -4.448 1.00 0.00 C ATOM 451 C VAL A 32 5.748 -2.859 -5.317 1.00 0.00 C ATOM 452 O VAL A 32 5.845 -3.970 -5.849 1.00 0.00 O ATOM 453 CB VAL A 32 4.549 -3.254 -3.097 1.00 0.00 C ATOM 454 CG1 VAL A 32 5.742 -2.895 -2.199 1.00 0.00 C ATOM 455 CG2 VAL A 32 3.314 -2.916 -2.261 1.00 0.00 C ATOM 0 H VAL A 32 3.400 -3.714 -5.718 1.00 0.00 H new ATOM 0 HA VAL A 32 4.573 -1.449 -4.191 1.00 0.00 H new ATOM 0 HB VAL A 32 4.588 -4.305 -3.384 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.679 -3.458 -1.268 1.00 0.00 H new ATOM 0 HG12 VAL A 32 6.671 -3.145 -2.711 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.724 -1.827 -1.980 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.353 -3.460 -1.317 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.292 -1.845 -2.062 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.415 -3.202 -2.807 1.00 0.00 H new ATOM 465 N VAL A 33 6.671 -1.917 -5.469 1.00 0.00 N ATOM 466 CA VAL A 33 7.882 -2.014 -6.261 1.00 0.00 C ATOM 467 C VAL A 33 8.967 -1.358 -5.425 1.00 0.00 C ATOM 468 O VAL A 33 8.879 -0.162 -5.148 1.00 0.00 O ATOM 469 CB VAL A 33 7.728 -1.263 -7.597 1.00 0.00 C ATOM 470 CG1 VAL A 33 9.005 -1.373 -8.447 1.00 0.00 C ATOM 471 CG2 VAL A 33 6.529 -1.746 -8.418 1.00 0.00 C ATOM 0 H VAL A 33 6.584 -1.009 -5.012 1.00 0.00 H new ATOM 0 HA VAL A 33 8.114 -3.051 -6.502 1.00 0.00 H new ATOM 0 HB VAL A 33 7.552 -0.220 -7.333 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.866 -0.833 -9.384 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.844 -0.942 -7.901 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.211 -2.422 -8.660 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.473 -1.180 -9.348 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.647 -2.806 -8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.613 -1.597 -7.846 1.00 0.00 H new ATOM 481 N ALA A 34 9.998 -2.121 -5.076 1.00 0.00 N ATOM 482 CA ALA A 34 11.216 -1.581 -4.510 1.00 0.00 C ATOM 483 C ALA A 34 12.388 -2.029 -5.374 1.00 0.00 C ATOM 484 O ALA A 34 12.311 -3.060 -6.053 1.00 0.00 O ATOM 485 CB ALA A 34 11.352 -2.026 -3.055 1.00 0.00 C ATOM 0 H ALA A 34 10.006 -3.136 -5.181 1.00 0.00 H new ATOM 0 HA ALA A 34 11.197 -0.491 -4.504 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.270 -1.617 -2.634 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.498 -1.665 -2.483 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.385 -3.115 -3.009 1.00 0.00 H new ATOM 491 N ASN A 35 13.467 -1.257 -5.306 1.00 0.00 N ATOM 492 CA ASN A 35 14.677 -1.415 -6.100 1.00 0.00 C ATOM 493 C ASN A 35 15.872 -1.675 -5.172 1.00 0.00 C ATOM 494 O ASN A 35 16.195 -0.806 -4.360 1.00 0.00 O ATOM 495 CB ASN A 35 14.872 -0.126 -6.924 1.00 0.00 C ATOM 496 CG ASN A 35 16.120 -0.133 -7.796 1.00 0.00 C ATOM 497 OD1 ASN A 35 17.039 -0.914 -7.595 1.00 0.00 O ATOM 498 ND2 ASN A 35 16.199 0.750 -8.774 1.00 0.00 N ATOM 0 H ASN A 35 13.523 -0.466 -4.664 1.00 0.00 H new ATOM 0 HA ASN A 35 14.596 -2.266 -6.776 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.998 0.023 -7.559 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.921 0.724 -6.244 1.00 0.00 H new ATOM 0 HD21 ASN A 35 17.029 0.783 -9.366 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.430 1.400 -8.938 1.00 0.00 H new ATOM 505 N GLY A 36 16.543 -2.822 -5.311 1.00 0.00 N ATOM 506 CA GLY A 36 17.899 -3.063 -4.810 1.00 0.00 C ATOM 507 C GLY A 36 17.971 -3.866 -3.507 1.00 0.00 C ATOM 508 O GLY A 36 19.056 -4.240 -3.058 1.00 0.00 O ATOM 0 H GLY A 36 16.147 -3.631 -5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.466 -3.591 -5.577 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.390 -2.102 -4.655 1.00 0.00 H new ATOM 512 N THR A 37 16.827 -4.140 -2.893 1.00 0.00 N ATOM 513 CA THR A 37 16.670 -4.820 -1.615 1.00 0.00 C ATOM 514 C THR A 37 15.453 -5.756 -1.726 1.00 0.00 C ATOM 515 O THR A 37 15.017 -6.077 -2.844 1.00 0.00 O ATOM 516 CB THR A 37 16.644 -3.756 -0.503 1.00 0.00 C ATOM 517 OG1 THR A 37 16.698 -4.339 0.777 1.00 0.00 O ATOM 518 CG2 THR A 37 15.421 -2.858 -0.588 1.00 0.00 C ATOM 0 H THR A 37 15.929 -3.877 -3.300 1.00 0.00 H new ATOM 0 HA THR A 37 17.500 -5.473 -1.345 1.00 0.00 H new ATOM 0 HB THR A 37 17.533 -3.145 -0.658 1.00 0.00 H new ATOM 0 HG1 THR A 37 17.281 -3.805 1.356 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.451 -2.125 0.218 1.00 0.00 H new ATOM 0 HG22 THR A 37 15.415 -2.341 -1.548 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.519 -3.462 -0.496 1.00 0.00 H new ATOM 526 N GLN A 38 14.910 -6.245 -0.615 1.00 0.00 N ATOM 527 CA GLN A 38 13.691 -7.053 -0.582 1.00 0.00 C ATOM 528 C GLN A 38 12.655 -6.369 0.311 1.00 0.00 C ATOM 529 O GLN A 38 12.897 -5.271 0.819 1.00 0.00 O ATOM 530 CB GLN A 38 14.068 -8.504 -0.221 1.00 0.00 C ATOM 531 CG GLN A 38 14.419 -9.279 -1.503 1.00 0.00 C ATOM 532 CD GLN A 38 15.465 -10.362 -1.300 1.00 0.00 C ATOM 533 OE1 GLN A 38 16.661 -10.119 -1.457 1.00 0.00 O ATOM 534 NE2 GLN A 38 15.065 -11.596 -1.041 1.00 0.00 N ATOM 0 H GLN A 38 15.313 -6.088 0.309 1.00 0.00 H new ATOM 0 HA GLN A 38 13.202 -7.125 -1.554 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.916 -8.511 0.464 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.239 -8.989 0.294 1.00 0.00 H new ATOM 0 HG2 GLN A 38 13.512 -9.734 -1.901 1.00 0.00 H new ATOM 0 HG3 GLN A 38 14.779 -8.576 -2.254 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.073 -11.794 -0.911 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.749 -12.350 -0.971 1.00 0.00 H new ATOM 543 N LEU A 39 11.460 -6.950 0.411 1.00 0.00 N ATOM 544 CA LEU A 39 10.303 -6.379 1.103 1.00 0.00 C ATOM 545 C LEU A 39 9.991 -7.224 2.325 1.00 0.00 C ATOM 546 O LEU A 39 10.500 -8.332 2.454 1.00 0.00 O ATOM 547 CB LEU A 39 9.091 -6.333 0.145 1.00 0.00 C ATOM 548 CG LEU A 39 8.609 -4.946 -0.310 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.589 -4.361 0.665 1.00 0.00 C ATOM 550 CD2 LEU A 39 9.730 -3.947 -0.565 1.00 0.00 C ATOM 0 H LEU A 39 11.263 -7.862 -0.001 1.00 0.00 H new ATOM 0 HA LEU A 39 10.525 -5.361 1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.340 -6.913 -0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.256 -6.838 0.631 1.00 0.00 H new ATOM 0 HG LEU A 39 8.129 -5.118 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.270 -3.380 0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.725 -5.023 0.728 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.043 -4.262 1.651 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.304 -2.995 -0.882 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.303 -3.801 0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.387 -4.329 -1.347 1.00 0.00 H new ATOM 562 N LYS A 40 9.138 -6.715 3.207 1.00 0.00 N ATOM 563 CA LYS A 40 8.747 -7.376 4.443 1.00 0.00 C ATOM 564 C LYS A 40 7.248 -7.225 4.617 1.00 0.00 C ATOM 565 O LYS A 40 6.770 -6.098 4.775 1.00 0.00 O ATOM 566 CB LYS A 40 9.548 -6.763 5.593 1.00 0.00 C ATOM 567 CG LYS A 40 9.273 -7.443 6.936 1.00 0.00 C ATOM 568 CD LYS A 40 10.077 -6.758 8.046 1.00 0.00 C ATOM 569 CE LYS A 40 9.948 -7.583 9.326 1.00 0.00 C ATOM 570 NZ LYS A 40 10.574 -6.923 10.487 1.00 0.00 N ATOM 0 H LYS A 40 8.689 -5.808 3.077 1.00 0.00 H new ATOM 0 HA LYS A 40 8.966 -8.444 4.424 1.00 0.00 H new ATOM 0 HB2 LYS A 40 10.612 -6.833 5.367 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.308 -5.703 5.672 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.208 -7.396 7.165 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.541 -8.498 6.880 1.00 0.00 H new ATOM 0 HD2 LYS A 40 11.124 -6.672 7.756 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.708 -5.746 8.210 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.893 -7.759 9.537 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.409 -8.559 9.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.460 -7.522 11.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.587 -6.778 10.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.117 -6.003 10.651 1.00 0.00 H new ATOM 584 N ASP A 41 6.518 -8.334 4.559 1.00 0.00 N ATOM 585 CA ASP A 41 5.076 -8.357 4.817 1.00 0.00 C ATOM 586 C ASP A 41 4.840 -8.084 6.303 1.00 0.00 C ATOM 587 O ASP A 41 5.434 -8.736 7.165 1.00 0.00 O ATOM 588 CB ASP A 41 4.417 -9.685 4.409 1.00 0.00 C ATOM 589 CG ASP A 41 2.891 -9.525 4.303 1.00 0.00 C ATOM 590 OD1 ASP A 41 2.269 -9.016 5.267 1.00 0.00 O ATOM 591 OD2 ASP A 41 2.315 -9.843 3.238 1.00 0.00 O ATOM 0 H ASP A 41 6.909 -9.248 4.331 1.00 0.00 H new ATOM 0 HA ASP A 41 4.612 -7.584 4.204 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.820 -10.018 3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.657 -10.456 5.141 1.00 0.00 H new ATOM 596 N GLY A 42 3.998 -7.106 6.625 1.00 0.00 N ATOM 597 CA GLY A 42 3.680 -6.723 7.988 1.00 0.00 C ATOM 598 C GLY A 42 2.939 -7.798 8.773 1.00 0.00 C ATOM 599 O GLY A 42 3.016 -7.779 10.003 1.00 0.00 O ATOM 0 H GLY A 42 3.509 -6.548 5.925 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.604 -6.477 8.511 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.073 -5.818 7.969 1.00 0.00 H new ATOM 603 N ALA A 43 2.257 -8.742 8.115 1.00 0.00 N ATOM 604 CA ALA A 43 1.528 -9.803 8.797 1.00 0.00 C ATOM 605 C ALA A 43 2.472 -10.607 9.688 1.00 0.00 C ATOM 606 O ALA A 43 2.223 -10.777 10.882 1.00 0.00 O ATOM 607 CB ALA A 43 0.832 -10.715 7.782 1.00 0.00 C ATOM 0 H ALA A 43 2.198 -8.787 7.098 1.00 0.00 H new ATOM 0 HA ALA A 43 0.763 -9.350 9.427 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.293 -11.502 8.310 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.130 -10.129 7.188 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.577 -11.164 7.125 1.00 0.00 H new ATOM 613 N THR A 44 3.579 -11.072 9.123 1.00 0.00 N ATOM 614 CA THR A 44 4.372 -12.171 9.666 1.00 0.00 C ATOM 615 C THR A 44 5.872 -11.881 9.574 1.00 0.00 C ATOM 616 O THR A 44 6.671 -12.581 10.193 1.00 0.00 O ATOM 617 CB THR A 44 3.984 -13.460 8.909 1.00 0.00 C ATOM 618 OG1 THR A 44 3.605 -13.134 7.582 1.00 0.00 O ATOM 619 CG2 THR A 44 2.826 -14.182 9.599 1.00 0.00 C ATOM 0 H THR A 44 3.959 -10.689 8.257 1.00 0.00 H new ATOM 0 HA THR A 44 4.158 -12.295 10.728 1.00 0.00 H new ATOM 0 HB THR A 44 4.849 -14.123 8.903 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.360 -13.952 7.101 1.00 0.00 H new ATOM 0 HG21 THR A 44 2.577 -15.085 9.042 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.118 -14.451 10.614 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.957 -13.525 9.633 1.00 0.00 H new ATOM 627 N GLY A 45 6.278 -10.819 8.874 1.00 0.00 N ATOM 628 CA GLY A 45 7.670 -10.484 8.630 1.00 0.00 C ATOM 629 C GLY A 45 8.268 -11.278 7.469 1.00 0.00 C ATOM 630 O GLY A 45 9.490 -11.291 7.309 1.00 0.00 O ATOM 0 H GLY A 45 5.626 -10.156 8.454 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.752 -9.418 8.417 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.250 -10.674 9.533 1.00 0.00 H new ATOM 634 N GLU A 46 7.426 -11.940 6.675 1.00 0.00 N ATOM 635 CA GLU A 46 7.791 -12.702 5.491 1.00 0.00 C ATOM 636 C GLU A 46 8.572 -11.796 4.549 1.00 0.00 C ATOM 637 O GLU A 46 8.113 -10.698 4.219 1.00 0.00 O ATOM 638 CB GLU A 46 6.516 -13.240 4.825 1.00 0.00 C ATOM 639 CG GLU A 46 5.842 -14.323 5.679 1.00 0.00 C ATOM 640 CD GLU A 46 6.517 -15.676 5.511 1.00 0.00 C ATOM 641 OE1 GLU A 46 7.644 -15.861 6.021 1.00 0.00 O ATOM 642 OE2 GLU A 46 5.913 -16.570 4.874 1.00 0.00 O ATOM 0 H GLU A 46 6.422 -11.957 6.853 1.00 0.00 H new ATOM 0 HA GLU A 46 8.420 -13.552 5.755 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.818 -12.419 4.660 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.762 -13.650 3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.872 -14.030 6.728 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.791 -14.404 5.401 1.00 0.00 H new ATOM 649 N SER A 47 9.786 -12.210 4.188 1.00 0.00 N ATOM 650 CA SER A 47 10.650 -11.403 3.347 1.00 0.00 C ATOM 651 C SER A 47 10.198 -11.639 1.905 1.00 0.00 C ATOM 652 O SER A 47 10.451 -12.703 1.336 1.00 0.00 O ATOM 653 CB SER A 47 12.144 -11.707 3.580 1.00 0.00 C ATOM 654 OG SER A 47 12.387 -12.597 4.663 1.00 0.00 O ATOM 0 H SER A 47 10.189 -13.104 4.469 1.00 0.00 H new ATOM 0 HA SER A 47 10.560 -10.345 3.594 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.564 -12.134 2.670 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.671 -10.771 3.766 1.00 0.00 H new ATOM 0 HG SER A 47 13.351 -12.747 4.753 1.00 0.00 H new ATOM 660 N LEU A 48 9.492 -10.680 1.314 1.00 0.00 N ATOM 661 CA LEU A 48 8.941 -10.793 -0.033 1.00 0.00 C ATOM 662 C LEU A 48 10.000 -10.375 -1.054 1.00 0.00 C ATOM 663 O LEU A 48 10.998 -9.736 -0.705 1.00 0.00 O ATOM 664 CB LEU A 48 7.672 -9.939 -0.188 1.00 0.00 C ATOM 665 CG LEU A 48 6.583 -10.130 0.883 1.00 0.00 C ATOM 666 CD1 LEU A 48 5.381 -9.245 0.521 1.00 0.00 C ATOM 667 CD2 LEU A 48 6.149 -11.593 0.994 1.00 0.00 C ATOM 0 H LEU A 48 9.283 -9.789 1.764 1.00 0.00 H new ATOM 0 HA LEU A 48 8.661 -11.831 -0.210 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.965 -8.889 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.234 -10.153 -1.163 1.00 0.00 H new ATOM 0 HG LEU A 48 6.988 -9.841 1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.599 -9.369 1.271 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.694 -8.201 0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.996 -9.536 -0.456 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.379 -11.687 1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.750 -11.928 0.036 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.008 -12.208 1.265 1.00 0.00 H new ATOM 679 N ALA A 49 9.803 -10.734 -2.319 1.00 0.00 N ATOM 680 CA ALA A 49 10.693 -10.482 -3.440 1.00 0.00 C ATOM 681 C ALA A 49 9.925 -9.586 -4.400 1.00 0.00 C ATOM 682 O ALA A 49 8.875 -9.962 -4.930 1.00 0.00 O ATOM 683 CB ALA A 49 11.146 -11.798 -4.079 1.00 0.00 C ATOM 0 H ALA A 49 8.964 -11.240 -2.603 1.00 0.00 H new ATOM 0 HA ALA A 49 11.612 -9.985 -3.130 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.811 -11.586 -4.916 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.674 -12.399 -3.339 1.00 0.00 H new ATOM 0 HB3 ALA A 49 10.275 -12.347 -4.438 1.00 0.00 H new ATOM 689 N SER A 50 10.366 -8.341 -4.482 1.00 0.00 N ATOM 690 CA SER A 50 9.771 -7.254 -5.237 1.00 0.00 C ATOM 691 C SER A 50 10.181 -7.292 -6.716 1.00 0.00 C ATOM 692 O SER A 50 11.320 -7.668 -7.015 1.00 0.00 O ATOM 693 CB SER A 50 10.265 -5.957 -4.594 1.00 0.00 C ATOM 694 OG SER A 50 9.790 -5.878 -3.269 1.00 0.00 O ATOM 0 H SER A 50 11.208 -8.045 -3.988 1.00 0.00 H new ATOM 0 HA SER A 50 8.684 -7.335 -5.212 1.00 0.00 H new ATOM 0 HB2 SER A 50 11.355 -5.926 -4.603 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.917 -5.098 -5.168 1.00 0.00 H new ATOM 0 HG SER A 50 9.238 -5.075 -3.167 1.00 0.00 H new ATOM 700 N PRO A 51 9.343 -6.790 -7.641 1.00 0.00 N ATOM 701 CA PRO A 51 8.020 -6.210 -7.405 1.00 0.00 C ATOM 702 C PRO A 51 6.974 -7.291 -7.098 1.00 0.00 C ATOM 703 O PRO A 51 7.201 -8.473 -7.350 1.00 0.00 O ATOM 704 CB PRO A 51 7.693 -5.477 -8.710 1.00 0.00 C ATOM 705 CG PRO A 51 8.374 -6.338 -9.770 1.00 0.00 C ATOM 706 CD PRO A 51 9.647 -6.796 -9.065 1.00 0.00 C ATOM 0 HA PRO A 51 8.010 -5.548 -6.539 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.618 -5.409 -8.876 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.080 -4.458 -8.708 1.00 0.00 H new ATOM 0 HG2 PRO A 51 7.751 -7.181 -10.068 1.00 0.00 H new ATOM 0 HG3 PRO A 51 8.594 -5.769 -10.673 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.940 -7.792 -9.397 1.00 0.00 H new ATOM 0 HD3 PRO A 51 10.479 -6.128 -9.289 1.00 0.00 H new ATOM 714 N VAL A 52 5.823 -6.900 -6.547 1.00 0.00 N ATOM 715 CA VAL A 52 4.673 -7.776 -6.376 1.00 0.00 C ATOM 716 C VAL A 52 3.404 -6.945 -6.279 1.00 0.00 C ATOM 717 O VAL A 52 3.447 -5.773 -5.882 1.00 0.00 O ATOM 718 CB VAL A 52 4.881 -8.661 -5.131 1.00 0.00 C ATOM 719 CG1 VAL A 52 4.549 -7.962 -3.816 1.00 0.00 C ATOM 720 CG2 VAL A 52 4.041 -9.931 -5.217 1.00 0.00 C ATOM 0 H VAL A 52 5.666 -5.952 -6.204 1.00 0.00 H new ATOM 0 HA VAL A 52 4.570 -8.434 -7.239 1.00 0.00 H new ATOM 0 HB VAL A 52 5.945 -8.896 -5.128 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.720 -8.648 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.186 -7.085 -3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.504 -7.653 -3.822 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.206 -10.538 -4.327 1.00 0.00 H new ATOM 0 HG22 VAL A 52 2.986 -9.666 -5.285 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.330 -10.499 -6.101 1.00 0.00 H new ATOM 730 N ILE A 53 2.280 -7.585 -6.578 1.00 0.00 N ATOM 731 CA ILE A 53 0.942 -7.053 -6.450 1.00 0.00 C ATOM 732 C ILE A 53 0.220 -7.901 -5.404 1.00 0.00 C ATOM 733 O ILE A 53 0.045 -9.110 -5.602 1.00 0.00 O ATOM 734 CB ILE A 53 0.234 -7.062 -7.818 1.00 0.00 C ATOM 735 CG1 ILE A 53 1.101 -6.535 -8.981 1.00 0.00 C ATOM 736 CG2 ILE A 53 -1.104 -6.304 -7.746 1.00 0.00 C ATOM 737 CD1 ILE A 53 1.655 -5.117 -8.827 1.00 0.00 C ATOM 0 H ILE A 53 2.285 -8.540 -6.935 1.00 0.00 H new ATOM 0 HA ILE A 53 0.949 -6.013 -6.123 1.00 0.00 H new ATOM 0 HB ILE A 53 0.044 -8.111 -8.045 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.940 -7.217 -9.118 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.507 -6.573 -9.894 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.586 -6.323 -8.723 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -1.753 -6.781 -7.012 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.921 -5.270 -7.452 1.00 0.00 H new ATOM 0 HD11 ILE A 53 2.247 -4.860 -9.706 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.829 -4.413 -8.727 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.284 -5.067 -7.939 1.00 0.00 H new ATOM 749 N LEU A 54 -0.164 -7.282 -4.287 1.00 0.00 N ATOM 750 CA LEU A 54 -1.116 -7.878 -3.361 1.00 0.00 C ATOM 751 C LEU A 54 -2.494 -7.842 -4.006 1.00 0.00 C ATOM 752 O LEU A 54 -2.873 -6.861 -4.661 1.00 0.00 O ATOM 753 CB LEU A 54 -1.209 -7.127 -2.021 1.00 0.00 C ATOM 754 CG LEU A 54 0.010 -7.204 -1.085 1.00 0.00 C ATOM 755 CD1 LEU A 54 -0.413 -6.751 0.318 1.00 0.00 C ATOM 756 CD2 LEU A 54 0.668 -8.585 -0.981 1.00 0.00 C ATOM 0 H LEU A 54 0.175 -6.362 -4.004 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.773 -8.891 -3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.404 -6.076 -2.236 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.075 -7.508 -1.480 1.00 0.00 H new ATOM 0 HG LEU A 54 0.762 -6.550 -1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.443 -6.802 0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.780 -5.726 0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.204 -7.404 0.688 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.516 -8.533 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.057 -9.306 -0.605 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.014 -8.898 -1.966 1.00 0.00 H new ATOM 768 N SER A 55 -3.274 -8.875 -3.724 1.00 0.00 N ATOM 769 CA SER A 55 -4.673 -8.950 -4.084 1.00 0.00 C ATOM 770 C SER A 55 -5.523 -8.812 -2.827 1.00 0.00 C ATOM 771 O SER A 55 -5.024 -8.784 -1.700 1.00 0.00 O ATOM 772 CB SER A 55 -4.950 -10.268 -4.812 1.00 0.00 C ATOM 773 OG SER A 55 -3.947 -10.550 -5.770 1.00 0.00 O ATOM 0 H SER A 55 -2.940 -9.701 -3.227 1.00 0.00 H new ATOM 0 HA SER A 55 -4.932 -8.136 -4.762 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.003 -11.081 -4.088 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.921 -10.216 -5.304 1.00 0.00 H new ATOM 0 HG SER A 55 -4.151 -11.398 -6.217 1.00 0.00 H new ATOM 779 N ASP A 56 -6.830 -8.798 -3.036 1.00 0.00 N ATOM 780 CA ASP A 56 -7.872 -8.641 -2.025 1.00 0.00 C ATOM 781 C ASP A 56 -7.811 -9.724 -0.940 1.00 0.00 C ATOM 782 O ASP A 56 -8.229 -9.507 0.197 1.00 0.00 O ATOM 783 CB ASP A 56 -9.195 -8.676 -2.788 1.00 0.00 C ATOM 784 CG ASP A 56 -10.377 -8.923 -1.874 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.734 -8.002 -1.115 1.00 0.00 O ATOM 786 OD2 ASP A 56 -10.984 -10.009 -1.997 1.00 0.00 O ATOM 0 H ASP A 56 -7.219 -8.902 -3.973 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.746 -7.704 -1.482 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.335 -7.731 -3.312 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.155 -9.458 -3.546 1.00 0.00 H new ATOM 791 N GLU A 57 -7.204 -10.862 -1.275 1.00 0.00 N ATOM 792 CA GLU A 57 -6.944 -11.986 -0.393 1.00 0.00 C ATOM 793 C GLU A 57 -5.946 -11.643 0.711 1.00 0.00 C ATOM 794 O GLU A 57 -5.997 -12.251 1.780 1.00 0.00 O ATOM 795 CB GLU A 57 -6.380 -13.130 -1.256 1.00 0.00 C ATOM 796 CG GLU A 57 -7.499 -13.969 -1.877 1.00 0.00 C ATOM 797 CD GLU A 57 -8.285 -14.691 -0.786 1.00 0.00 C ATOM 798 OE1 GLU A 57 -7.671 -15.425 0.015 1.00 0.00 O ATOM 799 OE2 GLU A 57 -9.525 -14.528 -0.699 1.00 0.00 O ATOM 0 H GLU A 57 -6.864 -11.028 -2.222 1.00 0.00 H new ATOM 0 HA GLU A 57 -7.874 -12.269 0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -5.753 -12.716 -2.046 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.742 -13.768 -0.644 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.167 -13.328 -2.453 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.076 -14.695 -2.572 1.00 0.00 H new ATOM 806 N GLU A 58 -5.053 -10.686 0.467 1.00 0.00 N ATOM 807 CA GLU A 58 -3.924 -10.336 1.326 1.00 0.00 C ATOM 808 C GLU A 58 -4.247 -9.086 2.153 1.00 0.00 C ATOM 809 O GLU A 58 -3.701 -8.855 3.233 1.00 0.00 O ATOM 810 CB GLU A 58 -2.700 -10.072 0.434 1.00 0.00 C ATOM 811 CG GLU A 58 -2.349 -11.265 -0.470 1.00 0.00 C ATOM 812 CD GLU A 58 -1.955 -12.483 0.365 1.00 0.00 C ATOM 813 OE1 GLU A 58 -0.932 -12.407 1.083 1.00 0.00 O ATOM 814 OE2 GLU A 58 -2.673 -13.508 0.303 1.00 0.00 O ATOM 0 H GLU A 58 -5.099 -10.108 -0.372 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.719 -11.155 2.015 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.891 -9.197 -0.187 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.842 -9.835 1.064 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.203 -11.512 -1.101 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.529 -10.994 -1.135 1.00 0.00 H new ATOM 821 N LEU A 59 -5.176 -8.284 1.637 1.00 0.00 N ATOM 822 CA LEU A 59 -5.608 -7.001 2.168 1.00 0.00 C ATOM 823 C LEU A 59 -6.891 -7.171 2.993 1.00 0.00 C ATOM 824 O LEU A 59 -7.572 -6.187 3.269 1.00 0.00 O ATOM 825 CB LEU A 59 -5.783 -6.039 0.979 1.00 0.00 C ATOM 826 CG LEU A 59 -4.445 -5.591 0.349 1.00 0.00 C ATOM 827 CD1 LEU A 59 -4.609 -5.317 -1.149 1.00 0.00 C ATOM 828 CD2 LEU A 59 -3.893 -4.320 1.010 1.00 0.00 C ATOM 0 H LEU A 59 -5.676 -8.532 0.783 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.867 -6.583 2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.391 -6.524 0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.332 -5.158 1.312 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.744 -6.410 0.509 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.653 -5.003 -1.568 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.945 -6.225 -1.650 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.346 -4.528 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.952 -4.042 0.535 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.611 -3.508 0.894 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.723 -4.506 2.071 1.00 0.00 H new ATOM 840 N ALA A 60 -7.250 -8.395 3.389 1.00 0.00 N ATOM 841 CA ALA A 60 -8.484 -8.741 4.096 1.00 0.00 C ATOM 842 C ALA A 60 -8.530 -8.264 5.562 1.00 0.00 C ATOM 843 O ALA A 60 -9.374 -8.735 6.331 1.00 0.00 O ATOM 844 CB ALA A 60 -8.668 -10.262 4.019 1.00 0.00 C ATOM 0 H ALA A 60 -6.660 -9.209 3.217 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.302 -8.215 3.604 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.583 -10.545 4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.736 -10.568 2.975 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.817 -10.756 4.487 1.00 0.00 H new ATOM 850 N VAL A 61 -7.636 -7.361 5.963 1.00 0.00 N ATOM 851 CA VAL A 61 -7.274 -7.038 7.337 1.00 0.00 C ATOM 852 C VAL A 61 -7.369 -5.530 7.590 1.00 0.00 C ATOM 853 O VAL A 61 -7.517 -4.728 6.671 1.00 0.00 O ATOM 854 CB VAL A 61 -5.848 -7.559 7.613 1.00 0.00 C ATOM 855 CG1 VAL A 61 -5.750 -9.083 7.637 1.00 0.00 C ATOM 856 CG2 VAL A 61 -4.840 -7.063 6.578 1.00 0.00 C ATOM 0 H VAL A 61 -7.113 -6.801 5.290 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.973 -7.522 8.019 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.613 -7.165 8.602 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.720 -9.378 7.836 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.398 -9.477 8.420 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.062 -9.483 6.672 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.852 -7.456 6.815 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -5.138 -7.405 5.587 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.810 -5.974 6.592 1.00 0.00 H new ATOM 866 N GLU A 62 -7.245 -5.127 8.852 1.00 0.00 N ATOM 867 CA GLU A 62 -7.295 -3.729 9.273 1.00 0.00 C ATOM 868 C GLU A 62 -5.991 -2.967 8.959 1.00 0.00 C ATOM 869 O GLU A 62 -5.987 -1.734 8.944 1.00 0.00 O ATOM 870 CB GLU A 62 -7.628 -3.708 10.775 1.00 0.00 C ATOM 871 CG GLU A 62 -6.405 -3.993 11.652 1.00 0.00 C ATOM 872 CD GLU A 62 -6.751 -4.345 13.098 1.00 0.00 C ATOM 873 OE1 GLU A 62 -7.054 -5.527 13.378 1.00 0.00 O ATOM 874 OE2 GLU A 62 -6.583 -3.484 13.991 1.00 0.00 O ATOM 0 H GLU A 62 -7.104 -5.776 9.626 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.067 -3.206 8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.041 -2.734 11.039 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.400 -4.449 10.983 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.839 -4.815 11.213 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.754 -3.119 11.647 1.00 0.00 H new ATOM 881 N LYS A 63 -4.875 -3.685 8.760 1.00 0.00 N ATOM 882 CA LYS A 63 -3.512 -3.144 8.689 1.00 0.00 C ATOM 883 C LYS A 63 -2.651 -4.014 7.773 1.00 0.00 C ATOM 884 O LYS A 63 -2.685 -5.235 7.912 1.00 0.00 O ATOM 885 CB LYS A 63 -2.919 -3.090 10.124 1.00 0.00 C ATOM 886 CG LYS A 63 -2.653 -1.651 10.608 1.00 0.00 C ATOM 887 CD LYS A 63 -1.256 -1.141 10.225 1.00 0.00 C ATOM 888 CE LYS A 63 -0.246 -0.988 11.371 1.00 0.00 C ATOM 889 NZ LYS A 63 -0.236 0.353 11.993 1.00 0.00 N ATOM 0 H LYS A 63 -4.900 -4.698 8.640 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.530 -2.137 8.273 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.606 -3.579 10.814 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.987 -3.655 10.148 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -3.406 -0.986 10.185 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.765 -1.611 11.692 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.834 -1.823 9.487 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.368 -0.173 9.737 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.468 -1.730 12.138 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.752 -1.209 10.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.470 0.376 12.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.005 1.067 11.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -1.177 0.561 12.385 1.00 0.00 H new ATOM 903 N VAL A 64 -1.880 -3.403 6.862 1.00 0.00 N ATOM 904 CA VAL A 64 -0.912 -4.119 6.015 1.00 0.00 C ATOM 905 C VAL A 64 0.379 -3.294 5.869 1.00 0.00 C ATOM 906 O VAL A 64 0.559 -2.547 4.904 1.00 0.00 O ATOM 907 CB VAL A 64 -1.485 -4.531 4.638 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.574 -5.576 3.986 1.00 0.00 C ATOM 909 CG2 VAL A 64 -2.870 -5.167 4.710 1.00 0.00 C ATOM 0 H VAL A 64 -1.909 -2.398 6.691 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.678 -5.055 6.522 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.549 -3.604 4.068 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.983 -5.862 3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.422 -5.156 3.849 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.512 -6.455 4.627 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.203 -5.428 3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.826 -6.067 5.323 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.572 -4.461 5.153 1.00 0.00 H new ATOM 919 N THR A 65 1.262 -3.386 6.853 1.00 0.00 N ATOM 920 CA THR A 65 2.514 -2.634 6.922 1.00 0.00 C ATOM 921 C THR A 65 3.511 -3.209 5.909 1.00 0.00 C ATOM 922 O THR A 65 3.689 -4.424 5.879 1.00 0.00 O ATOM 923 CB THR A 65 2.992 -2.728 8.381 1.00 0.00 C ATOM 924 OG1 THR A 65 1.956 -2.202 9.204 1.00 0.00 O ATOM 925 CG2 THR A 65 4.313 -2.000 8.652 1.00 0.00 C ATOM 0 H THR A 65 1.126 -4.005 7.652 1.00 0.00 H new ATOM 0 HA THR A 65 2.398 -1.583 6.656 1.00 0.00 H new ATOM 0 HB THR A 65 3.196 -3.775 8.605 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.760 -2.834 9.927 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.582 -2.113 9.702 1.00 0.00 H new ATOM 0 HG22 THR A 65 5.098 -2.427 8.028 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.200 -0.941 8.418 1.00 0.00 H new ATOM 933 N LEU A 66 4.153 -2.382 5.070 1.00 0.00 N ATOM 934 CA LEU A 66 5.188 -2.842 4.139 1.00 0.00 C ATOM 935 C LEU A 66 6.390 -1.920 4.237 1.00 0.00 C ATOM 936 O LEU A 66 6.268 -0.704 4.087 1.00 0.00 O ATOM 937 CB LEU A 66 4.729 -2.881 2.668 1.00 0.00 C ATOM 938 CG LEU A 66 3.839 -4.049 2.204 1.00 0.00 C ATOM 939 CD1 LEU A 66 4.358 -5.430 2.607 1.00 0.00 C ATOM 940 CD2 LEU A 66 2.401 -3.900 2.688 1.00 0.00 C ATOM 0 H LEU A 66 3.969 -1.380 5.020 1.00 0.00 H new ATOM 0 HA LEU A 66 5.430 -3.864 4.430 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.192 -1.955 2.464 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.622 -2.876 2.043 1.00 0.00 H new ATOM 0 HG LEU A 66 3.871 -3.991 1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.674 -6.196 2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.345 -5.588 2.173 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.425 -5.491 3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 66 1.810 -4.746 2.337 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.385 -3.873 3.778 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.979 -2.975 2.296 1.00 0.00 H new ATOM 952 N SER A 67 7.564 -2.513 4.406 1.00 0.00 N ATOM 953 CA SER A 67 8.854 -1.847 4.442 1.00 0.00 C ATOM 954 C SER A 67 9.868 -2.720 3.717 1.00 0.00 C ATOM 955 O SER A 67 9.601 -3.882 3.408 1.00 0.00 O ATOM 956 CB SER A 67 9.264 -1.622 5.900 1.00 0.00 C ATOM 957 OG SER A 67 10.325 -0.685 6.035 1.00 0.00 O ATOM 0 H SER A 67 7.644 -3.523 4.528 1.00 0.00 H new ATOM 0 HA SER A 67 8.804 -0.877 3.948 1.00 0.00 H new ATOM 0 HB2 SER A 67 8.401 -1.271 6.465 1.00 0.00 H new ATOM 0 HB3 SER A 67 9.567 -2.573 6.339 1.00 0.00 H new ATOM 0 HG SER A 67 10.321 -0.074 5.269 1.00 0.00 H new ATOM 963 N THR A 68 11.032 -2.147 3.450 1.00 0.00 N ATOM 964 CA THR A 68 12.130 -2.818 2.794 1.00 0.00 C ATOM 965 C THR A 68 13.064 -3.439 3.830 1.00 0.00 C ATOM 966 O THR A 68 13.181 -2.956 4.957 1.00 0.00 O ATOM 967 CB THR A 68 12.859 -1.814 1.887 1.00 0.00 C ATOM 968 OG1 THR A 68 12.766 -0.467 2.347 1.00 0.00 O ATOM 969 CG2 THR A 68 12.253 -1.853 0.489 1.00 0.00 C ATOM 0 H THR A 68 11.238 -1.178 3.692 1.00 0.00 H new ATOM 0 HA THR A 68 11.757 -3.632 2.173 1.00 0.00 H new ATOM 0 HB THR A 68 13.908 -2.111 1.892 1.00 0.00 H new ATOM 0 HG1 THR A 68 13.249 0.123 1.731 1.00 0.00 H new ATOM 0 HG21 THR A 68 12.771 -1.140 -0.152 1.00 0.00 H new ATOM 0 HG22 THR A 68 12.357 -2.856 0.075 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.196 -1.591 0.543 1.00 0.00 H new ATOM 977 N THR A 69 13.770 -4.494 3.432 1.00 0.00 N ATOM 978 CA THR A 69 14.735 -5.207 4.259 1.00 0.00 C ATOM 979 C THR A 69 16.116 -4.525 4.255 1.00 0.00 C ATOM 980 O THR A 69 17.116 -5.104 4.683 1.00 0.00 O ATOM 981 CB THR A 69 14.785 -6.674 3.795 1.00 0.00 C ATOM 982 OG1 THR A 69 15.130 -6.757 2.428 1.00 0.00 O ATOM 983 CG2 THR A 69 13.439 -7.387 3.979 1.00 0.00 C ATOM 0 H THR A 69 13.682 -4.887 2.495 1.00 0.00 H new ATOM 0 HA THR A 69 14.416 -5.182 5.301 1.00 0.00 H new ATOM 0 HB THR A 69 15.539 -7.160 4.414 1.00 0.00 H new ATOM 0 HG1 THR A 69 15.745 -7.508 2.291 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.524 -8.419 3.638 1.00 0.00 H new ATOM 0 HG22 THR A 69 13.162 -7.375 5.033 1.00 0.00 H new ATOM 0 HG23 THR A 69 12.673 -6.874 3.397 1.00 0.00 H new ATOM 991 N GLY A 70 16.211 -3.302 3.731 1.00 0.00 N ATOM 992 CA GLY A 70 17.396 -2.456 3.752 1.00 0.00 C ATOM 993 C GLY A 70 17.132 -1.218 2.906 1.00 0.00 C ATOM 994 O GLY A 70 16.011 -1.030 2.438 1.00 0.00 O ATOM 0 H GLY A 70 15.424 -2.857 3.259 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.636 -2.169 4.776 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.256 -3.002 3.364 1.00 0.00 H new ATOM 998 N LYS A 71 18.142 -0.380 2.665 1.00 0.00 N ATOM 999 CA LYS A 71 17.993 0.771 1.774 1.00 0.00 C ATOM 1000 C LYS A 71 17.551 0.286 0.401 1.00 0.00 C ATOM 1001 O LYS A 71 18.123 -0.688 -0.099 1.00 0.00 O ATOM 1002 CB LYS A 71 19.336 1.494 1.649 1.00 0.00 C ATOM 1003 CG LYS A 71 19.206 2.914 1.092 1.00 0.00 C ATOM 1004 CD LYS A 71 20.441 3.299 0.274 1.00 0.00 C ATOM 1005 CE LYS A 71 20.302 2.845 -1.184 1.00 0.00 C ATOM 1006 NZ LYS A 71 20.579 1.406 -1.411 1.00 0.00 N ATOM 0 H LYS A 71 19.071 -0.477 3.074 1.00 0.00 H new ATOM 0 HA LYS A 71 17.248 1.455 2.180 1.00 0.00 H new ATOM 0 HB2 LYS A 71 19.811 1.537 2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 71 19.994 0.915 1.001 1.00 0.00 H new ATOM 0 HG2 LYS A 71 18.316 2.983 0.467 1.00 0.00 H new ATOM 0 HG3 LYS A 71 19.075 3.619 1.912 1.00 0.00 H new ATOM 0 HD2 LYS A 71 20.582 4.379 0.310 1.00 0.00 H new ATOM 0 HD3 LYS A 71 21.329 2.847 0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.290 3.065 -1.524 1.00 0.00 H new ATOM 0 HE3 LYS A 71 20.981 3.434 -1.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 21.038 1.283 -2.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 21.208 1.051 -0.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 19.686 0.874 -1.394 1.00 0.00 H new ATOM 1020 N ALA A 72 16.662 1.025 -0.251 1.00 0.00 N ATOM 1021 CA ALA A 72 16.255 0.799 -1.628 1.00 0.00 C ATOM 1022 C ALA A 72 16.478 2.083 -2.416 1.00 0.00 C ATOM 1023 O ALA A 72 16.958 3.079 -1.860 1.00 0.00 O ATOM 1024 CB ALA A 72 14.792 0.346 -1.698 1.00 0.00 C ATOM 0 H ALA A 72 16.192 1.821 0.179 1.00 0.00 H new ATOM 0 HA ALA A 72 16.855 0.000 -2.065 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.511 0.183 -2.738 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.672 -0.583 -1.140 1.00 0.00 H new ATOM 0 HB3 ALA A 72 14.152 1.115 -1.265 1.00 0.00 H new ATOM 1030 N ILE A 73 16.184 2.036 -3.716 1.00 0.00 N ATOM 1031 CA ILE A 73 16.339 3.166 -4.626 1.00 0.00 C ATOM 1032 C ILE A 73 14.982 3.613 -5.189 1.00 0.00 C ATOM 1033 O ILE A 73 14.896 4.690 -5.770 1.00 0.00 O ATOM 1034 CB ILE A 73 17.341 2.836 -5.759 1.00 0.00 C ATOM 1035 CG1 ILE A 73 18.409 1.765 -5.448 1.00 0.00 C ATOM 1036 CG2 ILE A 73 18.018 4.127 -6.244 1.00 0.00 C ATOM 1037 CD1 ILE A 73 19.361 2.074 -4.290 1.00 0.00 C ATOM 0 H ILE A 73 15.826 1.197 -4.171 1.00 0.00 H new ATOM 0 HA ILE A 73 16.749 4.000 -4.057 1.00 0.00 H new ATOM 0 HB ILE A 73 16.729 2.382 -6.538 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.899 0.826 -5.231 1.00 0.00 H new ATOM 0 HG13 ILE A 73 19.004 1.604 -6.347 1.00 0.00 H new ATOM 0 HG21 ILE A 73 18.723 3.891 -7.041 1.00 0.00 H new ATOM 0 HG22 ILE A 73 17.261 4.815 -6.620 1.00 0.00 H new ATOM 0 HG23 ILE A 73 18.551 4.592 -5.415 1.00 0.00 H new ATOM 0 HD11 ILE A 73 20.064 1.250 -4.168 1.00 0.00 H new ATOM 0 HD12 ILE A 73 19.910 2.991 -4.505 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.788 2.201 -3.372 1.00 0.00 H new ATOM 1049 N GLU A 74 13.914 2.830 -5.003 1.00 0.00 N ATOM 1050 CA GLU A 74 12.543 3.227 -5.293 1.00 0.00 C ATOM 1051 C GLU A 74 11.625 2.616 -4.245 1.00 0.00 C ATOM 1052 O GLU A 74 11.964 1.574 -3.675 1.00 0.00 O ATOM 1053 CB GLU A 74 12.105 2.770 -6.695 1.00 0.00 C ATOM 1054 CG GLU A 74 12.620 3.754 -7.749 1.00 0.00 C ATOM 1055 CD GLU A 74 11.993 3.578 -9.141 1.00 0.00 C ATOM 1056 OE1 GLU A 74 10.891 2.999 -9.289 1.00 0.00 O ATOM 1057 OE2 GLU A 74 12.695 3.886 -10.134 1.00 0.00 O ATOM 0 H GLU A 74 13.987 1.881 -4.637 1.00 0.00 H new ATOM 0 HA GLU A 74 12.483 4.315 -5.267 1.00 0.00 H new ATOM 0 HB2 GLU A 74 12.491 1.771 -6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 74 11.018 2.708 -6.744 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.429 4.770 -7.404 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.701 3.644 -7.834 1.00 0.00 H new ATOM 1064 N PHE A 75 10.458 3.228 -4.041 1.00 0.00 N ATOM 1065 CA PHE A 75 9.285 2.647 -3.410 1.00 0.00 C ATOM 1066 C PHE A 75 8.081 3.247 -4.130 1.00 0.00 C ATOM 1067 O PHE A 75 7.763 4.421 -3.929 1.00 0.00 O ATOM 1068 CB PHE A 75 9.270 2.928 -1.898 1.00 0.00 C ATOM 1069 CG PHE A 75 8.463 1.980 -1.027 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.652 0.589 -1.144 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.622 2.470 -0.007 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.009 -0.302 -0.271 1.00 0.00 C ATOM 1073 CE2 PHE A 75 7.007 1.576 0.881 1.00 0.00 C ATOM 1074 CZ PHE A 75 7.188 0.190 0.752 1.00 0.00 C ATOM 0 H PHE A 75 10.303 4.194 -4.329 1.00 0.00 H new ATOM 0 HA PHE A 75 9.276 1.560 -3.496 1.00 0.00 H new ATOM 0 HB2 PHE A 75 10.300 2.921 -1.542 1.00 0.00 H new ATOM 0 HB3 PHE A 75 8.887 3.937 -1.745 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.301 0.203 -1.916 1.00 0.00 H new ATOM 0 HD2 PHE A 75 7.452 3.532 0.090 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.147 -1.367 -0.388 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.385 1.959 1.676 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.699 -0.490 1.434 1.00 0.00 H new ATOM 1084 N ALA A 76 7.458 2.471 -5.016 1.00 0.00 N ATOM 1085 CA ALA A 76 6.275 2.885 -5.759 1.00 0.00 C ATOM 1086 C ALA A 76 5.103 2.060 -5.274 1.00 0.00 C ATOM 1087 O ALA A 76 5.161 0.830 -5.269 1.00 0.00 O ATOM 1088 CB ALA A 76 6.498 2.732 -7.265 1.00 0.00 C ATOM 0 H ALA A 76 7.767 1.525 -5.239 1.00 0.00 H new ATOM 0 HA ALA A 76 6.067 3.941 -5.584 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.602 3.047 -7.799 1.00 0.00 H new ATOM 0 HB2 ALA A 76 7.340 3.351 -7.573 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.711 1.689 -7.497 1.00 0.00 H new ATOM 1094 N VAL A 77 4.085 2.750 -4.795 1.00 0.00 N ATOM 1095 CA VAL A 77 2.923 2.246 -4.107 1.00 0.00 C ATOM 1096 C VAL A 77 1.680 2.904 -4.680 1.00 0.00 C ATOM 1097 O VAL A 77 1.577 4.126 -4.759 1.00 0.00 O ATOM 1098 CB VAL A 77 3.092 2.318 -2.571 1.00 0.00 C ATOM 1099 CG1 VAL A 77 3.528 0.943 -2.055 1.00 0.00 C ATOM 1100 CG2 VAL A 77 4.181 3.285 -2.053 1.00 0.00 C ATOM 0 H VAL A 77 4.053 3.765 -4.888 1.00 0.00 H new ATOM 0 HA VAL A 77 2.798 1.178 -4.285 1.00 0.00 H new ATOM 0 HB VAL A 77 2.123 2.669 -2.217 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.650 0.983 -0.973 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.769 0.202 -2.308 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.475 0.665 -2.517 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.209 3.252 -0.964 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.151 2.987 -2.450 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.952 4.299 -2.379 1.00 0.00 H new ATOM 1110 N SER A 78 0.767 2.077 -5.178 1.00 0.00 N ATOM 1111 CA SER A 78 -0.367 2.524 -5.961 1.00 0.00 C ATOM 1112 C SER A 78 -1.536 1.594 -5.689 1.00 0.00 C ATOM 1113 O SER A 78 -1.328 0.413 -5.393 1.00 0.00 O ATOM 1114 CB SER A 78 0.024 2.457 -7.436 1.00 0.00 C ATOM 1115 OG SER A 78 -0.774 3.283 -8.246 1.00 0.00 O ATOM 0 H SER A 78 0.799 1.066 -5.045 1.00 0.00 H new ATOM 0 HA SER A 78 -0.651 3.544 -5.701 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.069 2.748 -7.544 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.057 1.427 -7.783 1.00 0.00 H new ATOM 0 HG SER A 78 -1.338 3.850 -7.680 1.00 0.00 H new ATOM 1121 N GLY A 79 -2.753 2.098 -5.842 1.00 0.00 N ATOM 1122 CA GLY A 79 -3.957 1.295 -5.796 1.00 0.00 C ATOM 1123 C GLY A 79 -5.185 2.186 -5.752 1.00 0.00 C ATOM 1124 O GLY A 79 -5.103 3.415 -5.771 1.00 0.00 O ATOM 0 H GLY A 79 -2.929 3.090 -6.003 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.002 0.645 -6.670 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -3.937 0.648 -4.919 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.336 1.548 -5.646 1.00 0.00 N ATOM 1129 CA GLY A 80 -7.602 2.163 -5.321 1.00 0.00 C ATOM 1130 C GLY A 80 -8.518 1.036 -4.872 1.00 0.00 C ATOM 1131 O GLY A 80 -8.133 -0.135 -4.906 1.00 0.00 O ATOM 0 H GLY A 80 -6.413 0.541 -5.791 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.483 2.906 -4.532 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.017 2.681 -6.186 1.00 0.00 H new ATOM 1135 N VAL A 81 -9.727 1.369 -4.449 1.00 0.00 N ATOM 1136 CA VAL A 81 -10.780 0.392 -4.263 1.00 0.00 C ATOM 1137 C VAL A 81 -12.097 1.140 -4.362 1.00 0.00 C ATOM 1138 O VAL A 81 -12.150 2.337 -4.089 1.00 0.00 O ATOM 1139 CB VAL A 81 -10.601 -0.356 -2.925 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -10.580 0.554 -1.689 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -11.633 -1.466 -2.772 1.00 0.00 C ATOM 0 H VAL A 81 -10.003 2.325 -4.226 1.00 0.00 H new ATOM 0 HA VAL A 81 -10.752 -0.384 -5.028 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.607 -0.801 -2.974 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -10.451 -0.053 -0.793 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -9.754 1.261 -1.771 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -11.520 1.101 -1.624 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -11.482 -1.975 -1.820 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -12.635 -1.038 -2.799 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -11.522 -2.181 -3.587 1.00 0.00 H new ATOM 1151 N VAL A 82 -13.154 0.427 -4.710 1.00 0.00 N ATOM 1152 CA VAL A 82 -14.531 0.872 -4.643 1.00 0.00 C ATOM 1153 C VAL A 82 -15.375 -0.307 -4.172 1.00 0.00 C ATOM 1154 O VAL A 82 -14.883 -1.438 -4.066 1.00 0.00 O ATOM 1155 CB VAL A 82 -15.010 1.427 -6.006 1.00 0.00 C ATOM 1156 CG1 VAL A 82 -14.853 2.947 -6.043 1.00 0.00 C ATOM 1157 CG2 VAL A 82 -14.298 0.806 -7.217 1.00 0.00 C ATOM 0 H VAL A 82 -13.068 -0.526 -5.064 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.631 1.697 -3.937 1.00 0.00 H new ATOM 0 HB VAL A 82 -16.061 1.149 -6.088 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -15.193 3.325 -7.007 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -15.449 3.394 -5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -13.804 3.208 -5.901 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.689 1.247 -8.134 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.228 1.000 -7.149 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.472 -0.270 -7.229 1.00 0.00 H new ATOM 1167 N ASP A 83 -16.650 -0.027 -3.915 1.00 0.00 N ATOM 1168 CA ASP A 83 -17.692 -1.029 -3.856 1.00 0.00 C ATOM 1169 C ASP A 83 -17.631 -1.774 -5.185 1.00 0.00 C ATOM 1170 O ASP A 83 -17.422 -1.163 -6.240 1.00 0.00 O ATOM 1171 CB ASP A 83 -19.055 -0.332 -3.664 1.00 0.00 C ATOM 1172 CG ASP A 83 -19.858 -0.978 -2.539 1.00 0.00 C ATOM 1173 OD1 ASP A 83 -19.959 -2.222 -2.546 1.00 0.00 O ATOM 1174 OD2 ASP A 83 -20.305 -0.201 -1.652 1.00 0.00 O ATOM 0 H ASP A 83 -16.986 0.920 -3.740 1.00 0.00 H new ATOM 0 HA ASP A 83 -17.562 -1.721 -3.024 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -18.897 0.723 -3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.624 -0.380 -4.593 1.00 0.00 H new ATOM 1179 N GLY A 84 -17.729 -3.092 -5.148 1.00 0.00 N ATOM 1180 CA GLY A 84 -17.889 -3.899 -6.349 1.00 0.00 C ATOM 1181 C GLY A 84 -19.301 -4.440 -6.446 1.00 0.00 C ATOM 1182 O GLY A 84 -19.684 -4.938 -7.505 1.00 0.00 O ATOM 0 H GLY A 84 -17.700 -3.635 -4.285 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -17.663 -3.298 -7.230 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -17.178 -4.725 -6.336 1.00 0.00 H new ATOM 1186 N GLU A 85 -20.072 -4.339 -5.363 1.00 0.00 N ATOM 1187 CA GLU A 85 -21.428 -4.846 -5.331 1.00 0.00 C ATOM 1188 C GLU A 85 -22.369 -3.708 -5.707 1.00 0.00 C ATOM 1189 O GLU A 85 -22.005 -2.534 -5.685 1.00 0.00 O ATOM 1190 CB GLU A 85 -21.742 -5.427 -3.941 1.00 0.00 C ATOM 1191 CG GLU A 85 -20.927 -6.697 -3.621 1.00 0.00 C ATOM 1192 CD GLU A 85 -21.195 -7.891 -4.551 1.00 0.00 C ATOM 1193 OE1 GLU A 85 -22.223 -7.914 -5.267 1.00 0.00 O ATOM 1194 OE2 GLU A 85 -20.362 -8.826 -4.577 1.00 0.00 O ATOM 0 H GLU A 85 -19.769 -3.904 -4.492 1.00 0.00 H new ATOM 0 HA GLU A 85 -21.558 -5.658 -6.047 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -21.539 -4.671 -3.183 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -22.805 -5.660 -3.882 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -19.866 -6.451 -3.667 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -21.140 -6.999 -2.596 1.00 0.00 H new ATOM 1201 N ASP A 86 -23.588 -4.070 -6.086 1.00 0.00 N ATOM 1202 CA ASP A 86 -24.691 -3.155 -6.350 1.00 0.00 C ATOM 1203 C ASP A 86 -25.953 -4.007 -6.239 1.00 0.00 C ATOM 1204 O ASP A 86 -26.559 -4.397 -7.241 1.00 0.00 O ATOM 1205 CB ASP A 86 -24.537 -2.508 -7.733 1.00 0.00 C ATOM 1206 CG ASP A 86 -25.697 -1.565 -8.050 1.00 0.00 C ATOM 1207 OD1 ASP A 86 -26.180 -0.863 -7.136 1.00 0.00 O ATOM 1208 OD2 ASP A 86 -26.102 -1.508 -9.237 1.00 0.00 O ATOM 0 H ASP A 86 -23.845 -5.047 -6.223 1.00 0.00 H new ATOM 0 HA ASP A 86 -24.724 -2.324 -5.646 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -23.598 -1.956 -7.774 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -24.482 -3.286 -8.494 1.00 0.00 H new ATOM 1213 N GLY A 87 -26.230 -4.478 -5.022 1.00 0.00 N ATOM 1214 CA GLY A 87 -27.237 -5.510 -4.792 1.00 0.00 C ATOM 1215 C GLY A 87 -27.116 -6.264 -3.465 1.00 0.00 C ATOM 1216 O GLY A 87 -28.090 -6.903 -3.045 1.00 0.00 O ATOM 0 H GLY A 87 -25.764 -4.156 -4.174 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -28.223 -5.048 -4.839 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -27.185 -6.232 -5.607 1.00 0.00 H new ATOM 1220 N VAL A 88 -26.000 -6.159 -2.743 1.00 0.00 N ATOM 1221 CA VAL A 88 -25.894 -6.568 -1.345 1.00 0.00 C ATOM 1222 C VAL A 88 -25.451 -5.352 -0.545 1.00 0.00 C ATOM 1223 O VAL A 88 -24.606 -4.582 -0.999 1.00 0.00 O ATOM 1224 CB VAL A 88 -25.026 -7.831 -1.166 1.00 0.00 C ATOM 1225 CG1 VAL A 88 -23.640 -7.701 -1.789 1.00 0.00 C ATOM 1226 CG2 VAL A 88 -24.865 -8.210 0.314 1.00 0.00 C ATOM 0 H VAL A 88 -25.131 -5.781 -3.121 1.00 0.00 H new ATOM 0 HA VAL A 88 -26.860 -6.890 -0.955 1.00 0.00 H new ATOM 0 HB VAL A 88 -25.566 -8.618 -1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -23.081 -8.623 -1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -23.738 -7.518 -2.859 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -23.109 -6.869 -1.326 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -24.247 -9.104 0.395 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -24.388 -7.389 0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -25.845 -8.406 0.748 1.00 0.00 H new ATOM 1236 N VAL A 89 -26.080 -5.145 0.609 1.00 0.00 N ATOM 1237 CA VAL A 89 -25.768 -4.072 1.533 1.00 0.00 C ATOM 1238 C VAL A 89 -24.376 -4.324 2.113 1.00 0.00 C ATOM 1239 O VAL A 89 -24.139 -5.364 2.733 1.00 0.00 O ATOM 1240 CB VAL A 89 -26.894 -3.968 2.586 1.00 0.00 C ATOM 1241 CG1 VAL A 89 -27.224 -5.278 3.322 1.00 0.00 C ATOM 1242 CG2 VAL A 89 -26.601 -2.868 3.609 1.00 0.00 C ATOM 0 H VAL A 89 -26.843 -5.740 0.931 1.00 0.00 H new ATOM 0 HA VAL A 89 -25.729 -3.100 1.041 1.00 0.00 H new ATOM 0 HB VAL A 89 -27.779 -3.717 2.002 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -28.026 -5.101 4.039 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -27.542 -6.030 2.600 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -26.338 -5.632 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -27.412 -2.821 4.335 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -25.666 -3.089 4.123 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -26.516 -1.909 3.098 1.00 0.00 H new ATOM 1252 N ASN A 90 -23.435 -3.408 1.902 1.00 0.00 N ATOM 1253 CA ASN A 90 -22.116 -3.412 2.532 1.00 0.00 C ATOM 1254 C ASN A 90 -21.812 -1.963 2.893 1.00 0.00 C ATOM 1255 O ASN A 90 -22.110 -1.058 2.105 1.00 0.00 O ATOM 1256 CB ASN A 90 -21.037 -3.974 1.586 1.00 0.00 C ATOM 1257 CG ASN A 90 -20.740 -5.461 1.770 1.00 0.00 C ATOM 1258 OD1 ASN A 90 -19.591 -5.855 1.947 1.00 0.00 O ATOM 1259 ND2 ASN A 90 -21.729 -6.333 1.740 1.00 0.00 N ATOM 0 H ASN A 90 -23.572 -2.619 1.270 1.00 0.00 H new ATOM 0 HA ASN A 90 -22.113 -4.054 3.413 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -21.352 -3.805 0.556 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -20.115 -3.412 1.734 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -21.536 -7.327 1.863 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -22.686 -6.013 1.593 1.00 0.00 H new ATOM 1266 N GLU A 91 -21.246 -1.734 4.078 1.00 0.00 N ATOM 1267 CA GLU A 91 -20.881 -0.385 4.505 1.00 0.00 C ATOM 1268 C GLU A 91 -19.682 0.120 3.691 1.00 0.00 C ATOM 1269 O GLU A 91 -18.898 -0.692 3.204 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.553 -0.350 6.009 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.791 -0.096 6.881 1.00 0.00 C ATOM 1272 CD GLU A 91 -21.496 0.899 8.005 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -21.467 2.123 7.743 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -21.346 0.491 9.180 1.00 0.00 O ATOM 0 H GLU A 91 -21.031 -2.464 4.757 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.734 0.270 4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -20.098 -1.297 6.299 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.815 0.430 6.197 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.601 0.286 6.260 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.134 -1.038 7.309 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.517 1.444 3.541 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.401 2.033 2.815 1.00 0.00 C ATOM 1283 C PRO A 92 -17.145 2.193 3.683 1.00 0.00 C ATOM 1284 O PRO A 92 -17.109 1.747 4.832 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.951 3.366 2.330 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.858 3.797 3.478 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.463 2.477 3.944 1.00 0.00 C ATOM 0 HA PRO A 92 -18.060 1.400 1.996 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -18.156 4.090 2.149 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.503 3.260 1.396 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -19.298 4.288 4.273 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -20.624 4.499 3.147 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.610 2.473 5.024 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -21.440 2.312 3.489 1.00 0.00 H new ATOM 1295 N MET A 93 -16.081 2.802 3.137 1.00 0.00 N ATOM 1296 CA MET A 93 -14.746 2.632 3.683 1.00 0.00 C ATOM 1297 C MET A 93 -13.865 3.863 3.512 1.00 0.00 C ATOM 1298 O MET A 93 -14.255 4.856 2.888 1.00 0.00 O ATOM 1299 CB MET A 93 -14.099 1.387 3.056 1.00 0.00 C ATOM 1300 CG MET A 93 -13.513 1.544 1.646 1.00 0.00 C ATOM 1301 SD MET A 93 -12.580 0.085 1.095 1.00 0.00 S ATOM 1302 CE MET A 93 -11.262 0.018 2.339 1.00 0.00 C ATOM 0 H MET A 93 -16.129 3.412 2.321 1.00 0.00 H new ATOM 0 HA MET A 93 -14.842 2.494 4.760 1.00 0.00 H new ATOM 0 HB2 MET A 93 -13.302 1.049 3.719 1.00 0.00 H new ATOM 0 HB3 MET A 93 -14.847 0.595 3.026 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.322 1.737 0.942 1.00 0.00 H new ATOM 0 HG3 MET A 93 -12.858 2.415 1.626 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.477 -0.659 2.002 1.00 0.00 H new ATOM 0 HE2 MET A 93 -10.845 1.015 2.481 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.671 -0.342 3.283 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.659 3.769 4.073 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.548 4.682 3.886 1.00 0.00 C ATOM 1314 C GLN A 94 -10.254 3.866 3.846 1.00 0.00 C ATOM 1315 O GLN A 94 -10.160 2.778 4.427 1.00 0.00 O ATOM 1316 CB GLN A 94 -11.490 5.685 5.051 1.00 0.00 C ATOM 1317 CG GLN A 94 -12.713 6.610 5.099 1.00 0.00 C ATOM 1318 CD GLN A 94 -12.678 7.552 6.302 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -11.664 8.178 6.613 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -13.796 7.697 6.996 1.00 0.00 N ATOM 0 H GLN A 94 -12.425 3.005 4.707 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.675 5.235 2.955 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -11.416 5.139 5.991 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -10.587 6.288 4.961 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -12.759 7.197 4.182 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.621 6.008 5.138 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -14.632 7.175 6.732 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -13.822 8.331 7.795 1.00 0.00 H new ATOM 1329 N TRP A 95 -9.227 4.443 3.230 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.831 4.050 3.358 1.00 0.00 C ATOM 1331 C TRP A 95 -7.123 5.236 3.994 1.00 0.00 C ATOM 1332 O TRP A 95 -7.150 6.319 3.406 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.219 3.783 1.969 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.459 2.460 1.306 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.098 1.390 1.833 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -6.956 2.020 0.005 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.054 0.343 0.933 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.374 0.679 -0.214 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -6.155 2.602 -1.001 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -7.043 -0.033 -1.376 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -5.798 1.889 -2.162 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -6.239 0.570 -2.351 1.00 0.00 C ATOM 0 H TRP A 95 -9.353 5.234 2.599 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.731 3.140 3.950 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -7.584 4.558 1.295 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.141 3.916 2.055 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -8.569 1.359 2.805 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -8.476 -0.571 1.099 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.808 3.617 -0.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -7.406 -1.040 -1.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -5.181 2.361 -2.912 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -5.961 0.025 -3.241 1.00 0.00 H new ATOM 1353 N VAL A 96 -6.469 5.072 5.146 1.00 0.00 N ATOM 1354 CA VAL A 96 -5.569 6.100 5.662 1.00 0.00 C ATOM 1355 C VAL A 96 -4.168 5.513 5.707 1.00 0.00 C ATOM 1356 O VAL A 96 -3.843 4.629 6.508 1.00 0.00 O ATOM 1357 CB VAL A 96 -6.112 6.789 6.928 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -6.397 5.852 8.104 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -5.150 7.903 7.362 1.00 0.00 C ATOM 0 H VAL A 96 -6.546 4.242 5.734 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.506 6.960 4.995 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.083 7.197 6.647 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.775 6.431 8.947 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.141 5.113 7.808 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.478 5.344 8.396 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.536 8.389 8.258 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.170 7.475 7.575 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.059 8.637 6.562 1.00 0.00 H new ATOM 1369 N VAL A 97 -3.360 5.928 4.736 1.00 0.00 N ATOM 1370 CA VAL A 97 -2.004 5.470 4.570 1.00 0.00 C ATOM 1371 C VAL A 97 -1.072 6.489 5.200 1.00 0.00 C ATOM 1372 O VAL A 97 -1.482 7.567 5.638 1.00 0.00 O ATOM 1373 CB VAL A 97 -1.706 5.215 3.084 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -2.565 4.070 2.548 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -1.879 6.457 2.205 1.00 0.00 C ATOM 0 H VAL A 97 -3.646 6.608 4.032 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.850 4.517 5.076 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.653 4.939 3.033 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -2.338 3.907 1.495 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -2.352 3.161 3.110 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.619 4.325 2.656 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.652 6.204 1.169 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.907 6.812 2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.201 7.240 2.544 1.00 0.00 H new ATOM 1385 N THR A 98 0.190 6.120 5.339 1.00 0.00 N ATOM 1386 CA THR A 98 1.200 6.965 5.939 1.00 0.00 C ATOM 1387 C THR A 98 2.537 6.481 5.388 1.00 0.00 C ATOM 1388 O THR A 98 2.675 5.287 5.109 1.00 0.00 O ATOM 1389 CB THR A 98 1.101 6.836 7.472 1.00 0.00 C ATOM 1390 OG1 THR A 98 -0.248 6.883 7.926 1.00 0.00 O ATOM 1391 CG2 THR A 98 1.847 7.943 8.195 1.00 0.00 C ATOM 0 H THR A 98 0.543 5.213 5.033 1.00 0.00 H new ATOM 0 HA THR A 98 1.077 8.022 5.704 1.00 0.00 H new ATOM 0 HB THR A 98 1.549 5.869 7.700 1.00 0.00 H new ATOM 0 HG1 THR A 98 -0.773 7.459 7.332 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.746 7.807 9.272 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.902 7.909 7.922 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.429 8.909 7.911 1.00 0.00 H new ATOM 1399 N VAL A 99 3.503 7.380 5.208 1.00 0.00 N ATOM 1400 CA VAL A 99 4.837 7.032 4.722 1.00 0.00 C ATOM 1401 C VAL A 99 5.853 7.471 5.768 1.00 0.00 C ATOM 1402 O VAL A 99 5.813 8.607 6.256 1.00 0.00 O ATOM 1403 CB VAL A 99 5.107 7.624 3.325 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.448 7.131 2.755 1.00 0.00 C ATOM 1405 CG2 VAL A 99 3.993 7.230 2.341 1.00 0.00 C ATOM 0 H VAL A 99 3.382 8.375 5.396 1.00 0.00 H new ATOM 0 HA VAL A 99 4.920 5.953 4.588 1.00 0.00 H new ATOM 0 HB VAL A 99 5.138 8.707 3.442 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.607 7.568 1.769 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.258 7.431 3.420 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.431 6.044 2.672 1.00 0.00 H new ATOM 0 HG21 VAL A 99 4.204 7.659 1.361 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.947 6.144 2.259 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.037 7.607 2.704 1.00 0.00 H new ATOM 1415 N TYR A 100 6.769 6.565 6.097 1.00 0.00 N ATOM 1416 CA TYR A 100 7.845 6.753 7.047 1.00 0.00 C ATOM 1417 C TYR A 100 9.152 6.566 6.291 1.00 0.00 C ATOM 1418 O TYR A 100 9.396 5.499 5.735 1.00 0.00 O ATOM 1419 CB TYR A 100 7.711 5.766 8.212 1.00 0.00 C ATOM 1420 CG TYR A 100 6.451 5.943 9.037 1.00 0.00 C ATOM 1421 CD1 TYR A 100 5.251 5.316 8.643 1.00 0.00 C ATOM 1422 CD2 TYR A 100 6.476 6.759 10.184 1.00 0.00 C ATOM 1423 CE1 TYR A 100 4.068 5.533 9.371 1.00 0.00 C ATOM 1424 CE2 TYR A 100 5.293 6.980 10.911 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.083 6.396 10.489 1.00 0.00 C ATOM 1426 OH TYR A 100 2.932 6.720 11.134 1.00 0.00 O ATOM 0 H TYR A 100 6.775 5.633 5.683 1.00 0.00 H new ATOM 0 HA TYR A 100 7.813 7.751 7.484 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.733 4.750 7.817 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.577 5.873 8.865 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.241 4.667 7.780 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.401 7.214 10.505 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.152 5.042 9.077 1.00 0.00 H new ATOM 0 HE2 TYR A 100 5.312 7.599 11.796 1.00 0.00 H new ATOM 0 HH TYR A 100 2.953 7.667 11.384 1.00 0.00 H new ATOM 1436 N LYS A 101 9.963 7.620 6.221 1.00 0.00 N ATOM 1437 CA LYS A 101 11.322 7.632 5.697 1.00 0.00 C ATOM 1438 C LYS A 101 12.257 6.964 6.726 1.00 0.00 C ATOM 1439 O LYS A 101 11.788 6.326 7.670 1.00 0.00 O ATOM 1440 CB LYS A 101 11.670 9.110 5.416 1.00 0.00 C ATOM 1441 CG LYS A 101 12.672 9.314 4.271 1.00 0.00 C ATOM 1442 CD LYS A 101 12.010 9.541 2.904 1.00 0.00 C ATOM 1443 CE LYS A 101 13.057 9.997 1.879 1.00 0.00 C ATOM 1444 NZ LYS A 101 12.485 10.258 0.539 1.00 0.00 N ATOM 0 H LYS A 101 9.669 8.540 6.548 1.00 0.00 H new ATOM 0 HA LYS A 101 11.433 7.067 4.772 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.752 9.649 5.181 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.078 9.555 6.324 1.00 0.00 H new ATOM 0 HG2 LYS A 101 13.307 10.169 4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 101 13.322 8.441 4.209 1.00 0.00 H new ATOM 0 HD2 LYS A 101 11.534 8.621 2.565 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.225 10.292 2.992 1.00 0.00 H new ATOM 0 HE2 LYS A 101 13.542 10.903 2.243 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.830 9.233 1.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 13.241 10.562 -0.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 12.046 9.389 0.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 11.766 11.007 0.608 1.00 0.00 H new ATOM 1458 N ASN A 102 13.577 7.148 6.585 1.00 0.00 N ATOM 1459 CA ASN A 102 14.650 6.740 7.500 1.00 0.00 C ATOM 1460 C ASN A 102 14.429 7.429 8.863 1.00 0.00 C ATOM 1461 O ASN A 102 15.031 8.467 9.159 1.00 0.00 O ATOM 1462 CB ASN A 102 16.087 7.049 6.974 1.00 0.00 C ATOM 1463 CG ASN A 102 16.302 7.113 5.470 1.00 0.00 C ATOM 1464 OD1 ASN A 102 16.874 6.213 4.871 1.00 0.00 O ATOM 1465 ND2 ASN A 102 15.889 8.188 4.816 1.00 0.00 N ATOM 0 H ASN A 102 13.950 7.623 5.763 1.00 0.00 H new ATOM 0 HA ASN A 102 14.595 5.655 7.591 1.00 0.00 H new ATOM 0 HB2 ASN A 102 16.398 8.005 7.396 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.759 6.290 7.375 1.00 0.00 H new ATOM 0 HD21 ASN A 102 16.048 8.266 3.811 1.00 0.00 H new ATOM 0 HD22 ASN A 102 15.412 8.938 5.317 1.00 0.00 H new ATOM 1472 N GLY A 103 13.532 6.894 9.679 1.00 0.00 N ATOM 1473 CA GLY A 103 13.294 7.312 11.059 1.00 0.00 C ATOM 1474 C GLY A 103 12.549 8.640 11.190 1.00 0.00 C ATOM 1475 O GLY A 103 12.857 9.433 12.090 1.00 0.00 O ATOM 0 H GLY A 103 12.925 6.127 9.390 1.00 0.00 H new ATOM 0 HA2 GLY A 103 12.723 6.536 11.569 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.252 7.393 11.573 1.00 0.00 H new ATOM 1479 N LYS A 104 11.587 8.916 10.301 1.00 0.00 N ATOM 1480 CA LYS A 104 10.582 9.960 10.490 1.00 0.00 C ATOM 1481 C LYS A 104 9.358 9.656 9.630 1.00 0.00 C ATOM 1482 O LYS A 104 9.498 9.043 8.576 1.00 0.00 O ATOM 1483 CB LYS A 104 11.156 11.345 10.117 1.00 0.00 C ATOM 1484 CG LYS A 104 11.112 12.318 11.302 1.00 0.00 C ATOM 1485 CD LYS A 104 9.663 12.653 11.657 1.00 0.00 C ATOM 1486 CE LYS A 104 9.529 13.685 12.773 1.00 0.00 C ATOM 1487 NZ LYS A 104 8.104 13.988 12.997 1.00 0.00 N ATOM 0 H LYS A 104 11.487 8.412 9.420 1.00 0.00 H new ATOM 0 HA LYS A 104 10.292 9.979 11.541 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.186 11.232 9.777 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.589 11.761 9.284 1.00 0.00 H new ATOM 0 HG2 LYS A 104 11.612 11.876 12.164 1.00 0.00 H new ATOM 0 HG3 LYS A 104 11.653 13.231 11.053 1.00 0.00 H new ATOM 0 HD2 LYS A 104 9.157 13.026 10.767 1.00 0.00 H new ATOM 0 HD3 LYS A 104 9.150 11.739 11.956 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.979 13.304 13.690 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.067 14.595 12.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.014 14.691 13.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.688 14.368 12.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.603 13.118 13.269 1.00 0.00 H new ATOM 1501 N GLU A 105 8.180 10.116 10.045 1.00 0.00 N ATOM 1502 CA GLU A 105 6.976 10.166 9.220 1.00 0.00 C ATOM 1503 C GLU A 105 7.101 11.369 8.285 1.00 0.00 C ATOM 1504 O GLU A 105 7.559 12.423 8.728 1.00 0.00 O ATOM 1505 CB GLU A 105 5.755 10.336 10.135 1.00 0.00 C ATOM 1506 CG GLU A 105 4.454 9.957 9.422 1.00 0.00 C ATOM 1507 CD GLU A 105 3.246 10.254 10.309 1.00 0.00 C ATOM 1508 OE1 GLU A 105 2.816 11.431 10.300 1.00 0.00 O ATOM 1509 OE2 GLU A 105 2.769 9.342 11.025 1.00 0.00 O ATOM 0 H GLU A 105 8.033 10.473 10.989 1.00 0.00 H new ATOM 0 HA GLU A 105 6.859 9.252 8.638 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.877 9.716 11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.696 11.370 10.474 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.371 10.512 8.488 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.470 8.898 9.164 1.00 0.00 H new ATOM 1516 N ILE A 106 6.680 11.236 7.025 1.00 0.00 N ATOM 1517 CA ILE A 106 6.764 12.307 6.034 1.00 0.00 C ATOM 1518 C ILE A 106 5.450 12.539 5.279 1.00 0.00 C ATOM 1519 O ILE A 106 5.302 13.587 4.650 1.00 0.00 O ATOM 1520 CB ILE A 106 7.912 12.024 5.042 1.00 0.00 C ATOM 1521 CG1 ILE A 106 7.748 10.675 4.300 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.283 12.097 5.738 1.00 0.00 C ATOM 1523 CD1 ILE A 106 8.177 10.779 2.837 1.00 0.00 C ATOM 0 H ILE A 106 6.269 10.376 6.663 1.00 0.00 H new ATOM 0 HA ILE A 106 6.969 13.226 6.583 1.00 0.00 H new ATOM 0 HB ILE A 106 7.862 12.809 4.287 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.342 9.910 4.800 1.00 0.00 H new ATOM 0 HG13 ILE A 106 6.707 10.355 4.352 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.071 11.893 5.013 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.425 13.093 6.158 1.00 0.00 H new ATOM 0 HG23 ILE A 106 9.325 11.357 6.537 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.047 9.812 2.350 1.00 0.00 H new ATOM 0 HD12 ILE A 106 7.565 11.525 2.331 1.00 0.00 H new ATOM 0 HD13 ILE A 106 9.225 11.073 2.785 1.00 0.00 H new ATOM 1535 N GLU A 107 4.501 11.603 5.291 1.00 0.00 N ATOM 1536 CA GLU A 107 3.272 11.701 4.503 1.00 0.00 C ATOM 1537 C GLU A 107 2.173 10.983 5.280 1.00 0.00 C ATOM 1538 O GLU A 107 2.480 9.980 5.926 1.00 0.00 O ATOM 1539 CB GLU A 107 3.503 11.052 3.125 1.00 0.00 C ATOM 1540 CG GLU A 107 2.606 11.605 2.015 1.00 0.00 C ATOM 1541 CD GLU A 107 1.128 11.526 2.329 1.00 0.00 C ATOM 1542 OE1 GLU A 107 0.620 10.395 2.427 1.00 0.00 O ATOM 1543 OE2 GLU A 107 0.518 12.595 2.583 1.00 0.00 O ATOM 0 H GLU A 107 4.563 10.752 5.850 1.00 0.00 H new ATOM 0 HA GLU A 107 2.981 12.738 4.337 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.545 11.193 2.839 1.00 0.00 H new ATOM 0 HB3 GLU A 107 3.338 9.978 3.209 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.873 12.645 1.829 1.00 0.00 H new ATOM 0 HG3 GLU A 107 2.802 11.056 1.094 1.00 0.00 H new ATOM 1550 N LYS A 108 0.925 11.471 5.238 1.00 0.00 N ATOM 1551 CA LYS A 108 -0.180 10.935 6.023 1.00 0.00 C ATOM 1552 C LYS A 108 -1.555 11.054 5.329 1.00 0.00 C ATOM 1553 O LYS A 108 -2.541 11.430 5.968 1.00 0.00 O ATOM 1554 CB LYS A 108 -0.125 11.631 7.403 1.00 0.00 C ATOM 1555 CG LYS A 108 -0.811 10.880 8.553 1.00 0.00 C ATOM 1556 CD LYS A 108 -0.581 11.618 9.883 1.00 0.00 C ATOM 1557 CE LYS A 108 -0.697 10.679 11.090 1.00 0.00 C ATOM 1558 NZ LYS A 108 -1.994 10.785 11.788 1.00 0.00 N ATOM 0 H LYS A 108 0.658 12.259 4.648 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.064 9.857 6.138 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.920 11.789 7.669 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -0.583 12.616 7.312 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -1.880 10.796 8.356 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.419 9.865 8.619 1.00 0.00 H new ATOM 0 HD2 LYS A 108 0.407 12.078 9.876 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -1.308 12.425 9.980 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.554 9.651 10.757 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.106 10.901 11.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -2.010 10.126 12.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -2.124 11.757 12.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.763 10.546 11.130 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.638 10.835 4.012 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.879 11.071 3.255 1.00 0.00 C ATOM 1574 C LYS A 109 -3.930 9.991 3.527 1.00 0.00 C ATOM 1575 O LYS A 109 -3.628 8.808 3.693 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.604 11.253 1.746 1.00 0.00 C ATOM 1577 CG LYS A 109 -2.010 10.019 1.037 1.00 0.00 C ATOM 1578 CD LYS A 109 -2.965 9.261 0.102 1.00 0.00 C ATOM 1579 CE LYS A 109 -2.655 9.462 -1.388 1.00 0.00 C ATOM 1580 NZ LYS A 109 -2.817 10.858 -1.829 1.00 0.00 N ATOM 0 H LYS A 109 -0.861 10.494 3.445 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.299 12.011 3.614 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.538 11.522 1.252 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.921 12.092 1.615 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.143 10.338 0.459 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.649 9.326 1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.918 8.197 0.334 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.987 9.586 0.299 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.633 9.141 -1.587 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.311 8.822 -1.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.594 10.930 -2.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.799 11.161 -1.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -2.173 11.470 -1.288 1.00 0.00 H new ATOM 1594 N SER A 110 -5.197 10.382 3.467 1.00 0.00 N ATOM 1595 CA SER A 110 -6.371 9.573 3.629 1.00 0.00 C ATOM 1596 C SER A 110 -7.234 9.684 2.371 1.00 0.00 C ATOM 1597 O SER A 110 -7.190 10.698 1.672 1.00 0.00 O ATOM 1598 CB SER A 110 -7.087 10.090 4.876 1.00 0.00 C ATOM 1599 OG SER A 110 -7.279 11.498 4.896 1.00 0.00 O ATOM 0 H SER A 110 -5.436 11.357 3.288 1.00 0.00 H new ATOM 0 HA SER A 110 -6.138 8.516 3.758 1.00 0.00 H new ATOM 0 HB2 SER A 110 -8.058 9.601 4.953 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.514 9.800 5.757 1.00 0.00 H new ATOM 0 HG SER A 110 -7.743 11.753 5.720 1.00 0.00 H new ATOM 1605 N LEU A 111 -8.027 8.651 2.088 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.916 8.564 0.936 1.00 0.00 C ATOM 1607 C LEU A 111 -10.303 8.107 1.400 1.00 0.00 C ATOM 1608 O LEU A 111 -10.468 7.674 2.545 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.398 7.560 -0.102 1.00 0.00 C ATOM 1610 CG LEU A 111 -6.915 7.543 -0.484 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.709 6.373 -1.450 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -6.453 8.828 -1.161 1.00 0.00 C ATOM 0 H LEU A 111 -8.067 7.821 2.680 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.963 9.551 0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.650 6.563 0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.966 7.720 -1.018 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.328 7.443 0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.661 6.326 -1.747 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.988 5.441 -0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.330 6.517 -2.334 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.394 8.750 -1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.026 8.984 -2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.609 9.671 -0.487 1.00 0.00 H new ATOM 1624 N VAL A 112 -11.298 8.159 0.509 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.677 7.753 0.776 1.00 0.00 C ATOM 1626 C VAL A 112 -13.264 7.162 -0.508 1.00 0.00 C ATOM 1627 O VAL A 112 -12.971 7.668 -1.599 1.00 0.00 O ATOM 1628 CB VAL A 112 -13.520 8.981 1.208 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -14.865 8.546 1.808 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -12.812 9.897 2.218 1.00 0.00 C ATOM 0 H VAL A 112 -11.160 8.495 -0.444 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.694 7.015 1.578 1.00 0.00 H new ATOM 0 HB VAL A 112 -13.673 9.551 0.292 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.435 9.428 2.102 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.429 7.981 1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -14.688 7.920 2.683 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -13.465 10.733 2.471 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -12.579 9.332 3.121 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -11.889 10.277 1.780 1.00 0.00 H new ATOM 1640 N PHE A 113 -14.152 6.173 -0.399 1.00 0.00 N ATOM 1641 CA PHE A 113 -15.195 5.909 -1.387 1.00 0.00 C ATOM 1642 C PHE A 113 -16.461 5.553 -0.626 1.00 0.00 C ATOM 1643 O PHE A 113 -16.383 4.935 0.440 1.00 0.00 O ATOM 1644 CB PHE A 113 -14.804 4.787 -2.361 1.00 0.00 C ATOM 1645 CG PHE A 113 -14.064 5.313 -3.574 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -14.755 5.982 -4.603 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -12.674 5.168 -3.663 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -14.053 6.509 -5.702 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -11.964 5.732 -4.734 1.00 0.00 C ATOM 1650 CZ PHE A 113 -12.653 6.408 -5.752 1.00 0.00 C ATOM 0 H PHE A 113 -14.166 5.525 0.389 1.00 0.00 H new ATOM 0 HA PHE A 113 -15.348 6.796 -2.002 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -14.178 4.060 -1.843 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -15.702 4.261 -2.685 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -15.828 6.091 -4.548 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -12.144 4.617 -2.900 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -14.590 6.991 -6.506 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.888 5.646 -4.775 1.00 0.00 H new ATOM 0 HZ PHE A 113 -12.108 6.850 -6.573 1.00 0.00 H new ATOM 1660 N ARG A 114 -17.616 5.956 -1.161 1.00 0.00 N ATOM 1661 CA ARG A 114 -18.915 5.570 -0.637 1.00 0.00 C ATOM 1662 C ARG A 114 -19.800 5.324 -1.836 1.00 0.00 C ATOM 1663 O ARG A 114 -20.279 6.277 -2.450 1.00 0.00 O ATOM 1664 CB ARG A 114 -19.529 6.660 0.256 1.00 0.00 C ATOM 1665 CG ARG A 114 -18.729 6.951 1.525 1.00 0.00 C ATOM 1666 CD ARG A 114 -19.225 8.221 2.216 1.00 0.00 C ATOM 1667 NE ARG A 114 -18.444 8.493 3.436 1.00 0.00 N ATOM 1668 CZ ARG A 114 -17.951 9.673 3.831 1.00 0.00 C ATOM 1669 NH1 ARG A 114 -18.056 10.759 3.078 1.00 0.00 N ATOM 1670 NH2 ARG A 114 -17.348 9.771 5.012 1.00 0.00 N ATOM 0 H ARG A 114 -17.669 6.565 -1.978 1.00 0.00 H new ATOM 0 HA ARG A 114 -18.815 4.683 -0.011 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -19.620 7.580 -0.322 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -20.538 6.359 0.537 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -18.810 6.107 2.210 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -17.674 7.059 1.275 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -19.146 9.066 1.533 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -20.279 8.114 2.470 1.00 0.00 H new ATOM 0 HE ARG A 114 -18.259 7.696 4.045 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -18.522 10.708 2.172 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -17.671 11.645 3.405 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -17.263 8.950 5.611 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -16.970 10.667 5.319 1.00 0.00 H new ATOM 1684 N ASP A 115 -20.026 4.053 -2.126 1.00 0.00 N ATOM 1685 CA ASP A 115 -20.890 3.572 -3.211 1.00 0.00 C ATOM 1686 C ASP A 115 -20.420 4.097 -4.577 1.00 0.00 C ATOM 1687 O ASP A 115 -19.378 4.752 -4.714 1.00 0.00 O ATOM 1688 CB ASP A 115 -22.331 3.998 -2.846 1.00 0.00 C ATOM 1689 CG ASP A 115 -23.498 3.229 -3.458 1.00 0.00 C ATOM 1690 OD1 ASP A 115 -23.398 2.666 -4.565 1.00 0.00 O ATOM 1691 OD2 ASP A 115 -24.562 3.255 -2.797 1.00 0.00 O ATOM 0 H ASP A 115 -19.600 3.293 -1.596 1.00 0.00 H new ATOM 0 HA ASP A 115 -20.847 2.487 -3.310 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -22.429 3.940 -1.762 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -22.446 5.047 -3.120 1.00 0.00 H new ATOM 1696 N GLY A 116 -21.181 3.790 -5.616 1.00 0.00 N ATOM 1697 CA GLY A 116 -21.187 4.455 -6.899 1.00 0.00 C ATOM 1698 C GLY A 116 -21.256 3.436 -7.997 1.00 0.00 C ATOM 1699 O GLY A 116 -22.239 3.449 -8.731 1.00 0.00 O ATOM 0 H GLY A 116 -21.850 3.021 -5.578 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -22.039 5.132 -6.964 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -20.288 5.062 -7.009 1.00 0.00 H new ATOM 1703 N LYS A 117 -20.222 2.603 -8.104 1.00 0.00 N ATOM 1704 CA LYS A 117 -20.106 1.392 -8.881 1.00 0.00 C ATOM 1705 C LYS A 117 -18.667 0.893 -8.768 1.00 0.00 C ATOM 1706 O LYS A 117 -17.784 1.634 -8.312 1.00 0.00 O ATOM 1707 CB LYS A 117 -20.488 1.663 -10.343 1.00 0.00 C ATOM 1708 CG LYS A 117 -21.879 1.083 -10.646 1.00 0.00 C ATOM 1709 CD LYS A 117 -21.857 -0.444 -10.854 1.00 0.00 C ATOM 1710 CE LYS A 117 -21.421 -0.827 -12.275 1.00 0.00 C ATOM 1711 NZ LYS A 117 -22.563 -0.907 -13.208 1.00 0.00 N ATOM 0 H LYS A 117 -19.360 2.789 -7.591 1.00 0.00 H new ATOM 0 HA LYS A 117 -20.786 0.628 -8.504 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -20.484 2.736 -10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -19.748 1.218 -11.008 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -22.555 1.324 -9.825 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -22.280 1.561 -11.540 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -21.178 -0.898 -10.132 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -22.849 -0.850 -10.658 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -20.704 -0.093 -12.643 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -20.908 -1.788 -12.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -22.220 -1.168 -14.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -23.236 -1.626 -12.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -23.038 0.017 -13.255 1.00 0.00 H new ATOM 1725 N GLU A 118 -18.456 -0.326 -9.255 1.00 0.00 N ATOM 1726 CA GLU A 118 -17.171 -0.838 -9.703 1.00 0.00 C ATOM 1727 C GLU A 118 -16.577 0.061 -10.782 1.00 0.00 C ATOM 1728 O GLU A 118 -17.291 0.556 -11.649 1.00 0.00 O ATOM 1729 CB GLU A 118 -17.325 -2.260 -10.279 1.00 0.00 C ATOM 1730 CG GLU A 118 -18.549 -2.363 -11.211 1.00 0.00 C ATOM 1731 CD GLU A 118 -18.388 -3.168 -12.500 1.00 0.00 C ATOM 1732 OE1 GLU A 118 -17.280 -3.245 -13.073 1.00 0.00 O ATOM 1733 OE2 GLU A 118 -19.452 -3.574 -13.022 1.00 0.00 O ATOM 0 H GLU A 118 -19.207 -1.009 -9.351 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.507 -0.860 -8.839 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -16.424 -2.530 -10.829 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -17.427 -2.975 -9.463 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -19.369 -2.800 -10.642 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -18.852 -1.352 -11.482 1.00 0.00 H new ATOM 1740 N ILE A 119 -15.260 0.228 -10.712 1.00 0.00 N ATOM 1741 CA ILE A 119 -14.355 0.906 -11.627 1.00 0.00 C ATOM 1742 C ILE A 119 -12.944 0.451 -11.217 1.00 0.00 C ATOM 1743 O ILE A 119 -12.783 -0.389 -10.325 1.00 0.00 O ATOM 1744 CB ILE A 119 -14.544 2.449 -11.638 1.00 0.00 C ATOM 1745 CG1 ILE A 119 -14.775 3.071 -10.252 1.00 0.00 C ATOM 1746 CG2 ILE A 119 -15.673 2.899 -12.574 1.00 0.00 C ATOM 1747 CD1 ILE A 119 -13.480 3.239 -9.472 1.00 0.00 C ATOM 0 H ILE A 119 -14.744 -0.154 -9.919 1.00 0.00 H new ATOM 0 HA ILE A 119 -14.558 0.637 -12.664 1.00 0.00 H new ATOM 0 HB ILE A 119 -13.588 2.817 -12.012 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -15.256 4.042 -10.368 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -15.460 2.442 -9.683 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.761 3.985 -12.542 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -15.449 2.583 -13.593 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -16.613 2.450 -12.253 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -13.696 3.682 -8.500 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -13.011 2.265 -9.331 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -12.804 3.890 -10.026 1.00 0.00 H new ATOM 1759 N SER A 120 -11.924 1.054 -11.819 1.00 0.00 N ATOM 1760 CA SER A 120 -10.603 1.172 -11.219 1.00 0.00 C ATOM 1761 C SER A 120 -10.357 2.660 -10.969 1.00 0.00 C ATOM 1762 O SER A 120 -10.993 3.524 -11.588 1.00 0.00 O ATOM 1763 CB SER A 120 -9.525 0.508 -12.087 1.00 0.00 C ATOM 1764 OG SER A 120 -9.583 0.924 -13.438 1.00 0.00 O ATOM 0 H SER A 120 -11.993 1.477 -12.744 1.00 0.00 H new ATOM 0 HA SER A 120 -10.551 0.637 -10.271 1.00 0.00 H new ATOM 0 HB2 SER A 120 -8.541 0.742 -11.680 1.00 0.00 H new ATOM 0 HB3 SER A 120 -9.641 -0.575 -12.039 1.00 0.00 H new ATOM 0 HG SER A 120 -8.877 0.476 -13.949 1.00 0.00 H new ATOM 1770 N THR A 121 -9.472 2.963 -10.030 1.00 0.00 N ATOM 1771 CA THR A 121 -9.143 4.315 -9.626 1.00 0.00 C ATOM 1772 C THR A 121 -7.717 4.269 -9.096 1.00 0.00 C ATOM 1773 O THR A 121 -7.255 3.239 -8.597 1.00 0.00 O ATOM 1774 CB THR A 121 -10.201 4.823 -8.624 1.00 0.00 C ATOM 1775 OG1 THR A 121 -10.022 6.187 -8.319 1.00 0.00 O ATOM 1776 CG2 THR A 121 -10.276 4.016 -7.322 1.00 0.00 C ATOM 0 H THR A 121 -8.951 2.253 -9.516 1.00 0.00 H new ATOM 0 HA THR A 121 -9.171 5.036 -10.443 1.00 0.00 H new ATOM 0 HB THR A 121 -11.150 4.683 -9.141 1.00 0.00 H new ATOM 0 HG1 THR A 121 -10.336 6.362 -7.407 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.044 4.440 -6.675 1.00 0.00 H new ATOM 0 HG22 THR A 121 -10.525 2.980 -7.550 1.00 0.00 H new ATOM 0 HG23 THR A 121 -9.312 4.054 -6.814 1.00 0.00 H new ATOM 1784 N ASP A 122 -7.001 5.374 -9.226 1.00 0.00 N ATOM 1785 CA ASP A 122 -5.563 5.480 -8.992 1.00 0.00 C ATOM 1786 C ASP A 122 -5.342 6.431 -7.810 1.00 0.00 C ATOM 1787 O ASP A 122 -4.404 7.225 -7.763 1.00 0.00 O ATOM 1788 CB ASP A 122 -4.917 5.918 -10.312 1.00 0.00 C ATOM 1789 CG ASP A 122 -3.517 5.357 -10.522 1.00 0.00 C ATOM 1790 OD1 ASP A 122 -3.399 4.120 -10.688 1.00 0.00 O ATOM 1791 OD2 ASP A 122 -2.579 6.149 -10.759 1.00 0.00 O ATOM 0 H ASP A 122 -7.420 6.260 -9.509 1.00 0.00 H new ATOM 0 HA ASP A 122 -5.090 4.539 -8.710 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -5.553 5.604 -11.140 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.871 7.007 -10.341 1.00 0.00 H new ATOM 1796 N ASP A 123 -6.326 6.429 -6.909 1.00 0.00 N ATOM 1797 CA ASP A 123 -6.539 7.359 -5.807 1.00 0.00 C ATOM 1798 C ASP A 123 -5.376 7.323 -4.814 1.00 0.00 C ATOM 1799 O ASP A 123 -4.960 8.356 -4.283 1.00 0.00 O ATOM 1800 CB ASP A 123 -7.861 6.965 -5.131 1.00 0.00 C ATOM 1801 CG ASP A 123 -8.499 8.076 -4.290 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -8.047 9.240 -4.302 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -9.533 7.802 -3.633 1.00 0.00 O ATOM 0 H ASP A 123 -7.054 5.715 -6.937 1.00 0.00 H new ATOM 0 HA ASP A 123 -6.590 8.382 -6.178 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -8.570 6.656 -5.899 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.685 6.099 -4.493 1.00 0.00 H new ATOM 1808 N LEU A 124 -4.808 6.131 -4.597 1.00 0.00 N ATOM 1809 CA LEU A 124 -3.501 5.960 -3.992 1.00 0.00 C ATOM 1810 C LEU A 124 -2.507 5.972 -5.140 1.00 0.00 C ATOM 1811 O LEU A 124 -2.477 5.074 -5.981 1.00 0.00 O ATOM 1812 CB LEU A 124 -3.405 4.631 -3.245 1.00 0.00 C ATOM 1813 CG LEU A 124 -2.314 4.547 -2.161 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -2.539 3.301 -1.297 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -0.906 4.413 -2.744 1.00 0.00 C ATOM 0 H LEU A 124 -5.259 5.250 -4.844 1.00 0.00 H new ATOM 0 HA LEU A 124 -3.306 6.750 -3.266 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.369 4.427 -2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.229 3.839 -3.973 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.385 5.473 -1.590 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -1.765 3.245 -0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -3.518 3.360 -0.821 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.494 2.411 -1.924 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -0.180 4.358 -1.933 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.846 3.506 -3.346 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.687 5.279 -3.369 1.00 0.00 H new ATOM 1827 N ASN A 125 -1.665 6.983 -5.128 1.00 0.00 N ATOM 1828 CA ASN A 125 -0.487 7.132 -5.917 1.00 0.00 C ATOM 1829 C ASN A 125 0.540 7.731 -4.969 1.00 0.00 C ATOM 1830 O ASN A 125 0.338 8.826 -4.435 1.00 0.00 O ATOM 1831 CB ASN A 125 -0.776 8.002 -7.136 1.00 0.00 C ATOM 1832 CG ASN A 125 -1.172 9.444 -6.850 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -2.293 9.743 -6.450 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -0.287 10.397 -7.082 1.00 0.00 N ATOM 0 H ASN A 125 -1.810 7.782 -4.511 1.00 0.00 H new ATOM 0 HA ASN A 125 -0.116 6.194 -6.329 1.00 0.00 H new ATOM 0 HB2 ASN A 125 0.110 8.009 -7.771 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -1.576 7.534 -7.710 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.537 11.374 -6.929 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.647 10.156 -7.415 1.00 0.00 H new ATOM 1841 N LEU A 126 1.580 6.966 -4.657 1.00 0.00 N ATOM 1842 CA LEU A 126 2.656 7.300 -3.741 1.00 0.00 C ATOM 1843 C LEU A 126 3.925 6.779 -4.401 1.00 0.00 C ATOM 1844 O LEU A 126 4.078 5.577 -4.595 1.00 0.00 O ATOM 1845 CB LEU A 126 2.460 6.616 -2.374 1.00 0.00 C ATOM 1846 CG LEU A 126 1.313 7.113 -1.480 1.00 0.00 C ATOM 1847 CD1 LEU A 126 1.325 6.299 -0.183 1.00 0.00 C ATOM 1848 CD2 LEU A 126 1.419 8.596 -1.126 1.00 0.00 C ATOM 0 H LEU A 126 1.698 6.038 -5.065 1.00 0.00 H new ATOM 0 HA LEU A 126 2.693 8.373 -3.554 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.309 5.551 -2.551 1.00 0.00 H new ATOM 0 HB3 LEU A 126 3.389 6.717 -1.813 1.00 0.00 H new ATOM 0 HG LEU A 126 0.386 6.983 -2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.517 6.637 0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.187 5.243 -0.415 1.00 0.00 H new ATOM 0 HD13 LEU A 126 2.280 6.437 0.324 1.00 0.00 H new ATOM 0 HD21 LEU A 126 0.578 8.880 -0.493 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.352 8.777 -0.592 1.00 0.00 H new ATOM 0 HD23 LEU A 126 1.403 9.190 -2.040 1.00 0.00 H new ATOM 1860 N TYR A 127 4.834 7.668 -4.771 1.00 0.00 N ATOM 1861 CA TYR A 127 6.092 7.297 -5.390 1.00 0.00 C ATOM 1862 C TYR A 127 7.199 8.088 -4.711 1.00 0.00 C ATOM 1863 O TYR A 127 7.084 9.309 -4.551 1.00 0.00 O ATOM 1864 CB TYR A 127 6.017 7.538 -6.899 1.00 0.00 C ATOM 1865 CG TYR A 127 7.362 7.419 -7.577 1.00 0.00 C ATOM 1866 CD1 TYR A 127 7.891 6.153 -7.874 1.00 0.00 C ATOM 1867 CD2 TYR A 127 8.104 8.576 -7.863 1.00 0.00 C ATOM 1868 CE1 TYR A 127 9.157 6.038 -8.472 1.00 0.00 C ATOM 1869 CE2 TYR A 127 9.366 8.470 -8.464 1.00 0.00 C ATOM 1870 CZ TYR A 127 9.888 7.201 -8.792 1.00 0.00 C ATOM 1871 OH TYR A 127 11.065 7.113 -9.463 1.00 0.00 O ATOM 0 H TYR A 127 4.716 8.674 -4.648 1.00 0.00 H new ATOM 0 HA TYR A 127 6.306 6.236 -5.262 1.00 0.00 H new ATOM 0 HB2 TYR A 127 5.326 6.821 -7.343 1.00 0.00 H new ATOM 0 HB3 TYR A 127 5.608 8.531 -7.084 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.323 5.264 -7.642 1.00 0.00 H new ATOM 0 HD2 TYR A 127 7.702 9.549 -7.620 1.00 0.00 H new ATOM 0 HE1 TYR A 127 9.569 5.063 -8.686 1.00 0.00 H new ATOM 0 HE2 TYR A 127 9.939 9.360 -8.676 1.00 0.00 H new ATOM 0 HH TYR A 127 11.432 8.012 -9.600 1.00 0.00 H new ATOM 1881 N TYR A 128 8.243 7.381 -4.288 1.00 0.00 N ATOM 1882 CA TYR A 128 9.435 7.929 -3.667 1.00 0.00 C ATOM 1883 C TYR A 128 10.646 7.152 -4.172 1.00 0.00 C ATOM 1884 O TYR A 128 10.521 6.035 -4.681 1.00 0.00 O ATOM 1885 CB TYR A 128 9.312 7.824 -2.142 1.00 0.00 C ATOM 1886 CG TYR A 128 8.221 8.695 -1.554 1.00 0.00 C ATOM 1887 CD1 TYR A 128 8.431 10.081 -1.414 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.982 8.130 -1.192 1.00 0.00 C ATOM 1889 CE1 TYR A 128 7.407 10.904 -0.914 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.953 8.949 -0.698 1.00 0.00 C ATOM 1891 CZ TYR A 128 6.161 10.337 -0.562 1.00 0.00 C ATOM 1892 OH TYR A 128 5.138 11.121 -0.136 1.00 0.00 O ATOM 0 H TYR A 128 8.278 6.365 -4.375 1.00 0.00 H new ATOM 0 HA TYR A 128 9.553 8.981 -3.926 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.119 6.785 -1.873 1.00 0.00 H new ATOM 0 HB3 TYR A 128 10.265 8.098 -1.690 1.00 0.00 H new ATOM 0 HD1 TYR A 128 9.381 10.512 -1.692 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.823 7.067 -1.294 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.572 11.965 -0.799 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.003 8.516 -0.422 1.00 0.00 H new ATOM 0 HH TYR A 128 4.327 10.903 -0.641 1.00 0.00 H new ATOM 1902 N ASN A 129 11.836 7.723 -3.990 1.00 0.00 N ATOM 1903 CA ASN A 129 13.092 7.190 -4.507 1.00 0.00 C ATOM 1904 C ASN A 129 14.241 7.497 -3.569 1.00 0.00 C ATOM 1905 O ASN A 129 13.960 7.664 -2.363 1.00 0.00 O ATOM 1906 CB ASN A 129 13.332 7.732 -5.918 1.00 0.00 C ATOM 1907 CG ASN A 129 13.755 9.193 -5.957 1.00 0.00 C ATOM 1908 OD1 ASN A 129 13.370 10.027 -5.130 1.00 0.00 O ATOM 1909 ND2 ASN A 129 14.498 9.557 -6.977 1.00 0.00 N ATOM 0 H ASN A 129 11.954 8.590 -3.466 1.00 0.00 H new ATOM 0 HA ASN A 129 13.028 6.104 -4.568 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.100 7.129 -6.402 1.00 0.00 H new ATOM 0 HB3 ASN A 129 12.419 7.613 -6.502 1.00 0.00 H new ATOM 0 HD21 ASN A 129 14.762 10.535 -7.092 1.00 0.00 H new ATOM 0 HD22 ASN A 129 14.811 8.861 -7.654 1.00 0.00 H new TER 1916 ASN A 129