USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 936 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 60 MET CE :methyl 159:sc= -5.26! (180deg=-5.64!) USER MOD Set 1.2: A 137 LYS NZ :NH3+ -156:sc= 0.509 (180deg=-0.591!) USER MOD Set 1.3: A 142 THR OG1 : rot -9:sc= -1.87! USER MOD Set 2.1: A 80 MET CE :methyl 170:sc= -1.57! (180deg=-1.7!) USER MOD Set 2.2: A 81 MET CE :methyl -124:sc= -0.809 (180deg=-2.72!) USER MOD Set 3.1: A 69 SER OG : rot 98:sc= 0.926 USER MOD Set 3.2: A 71 THR OG1 : rot 180:sc= 0.803 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.327 (180deg=-1.28) USER MOD Single : A 1 MET N :NH3+ -152:sc= 1.14 (180deg=1.01) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -1.29 K(o=-1.3,f=-0.019) USER MOD Single : A 13 THR OG1 : rot -160:sc= -1.79! USER MOD Single : A 16 GLN : amide:sc= -2.59! C(o=-2.6!,f=-10!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 21 LYS NZ :NH3+ -152:sc= -0.0912 (180deg=-0.722!) USER MOD Single : A 35 SER OG : rot -63:sc= 0.34 USER MOD Single : A 37 SER OG : rot -85:sc= 0.835 USER MOD Single : A 38 THR OG1 : rot -170:sc= 0.00168 USER MOD Single : A 39 LYS NZ :NH3+ -140:sc= 1.28 (180deg=0.228) USER MOD Single : A 43 LYS NZ :NH3+ -141:sc= 0.934 (180deg=0.148) USER MOD Single : A 45 MET CE :methyl -120:sc= -6.32! (180deg=-7.15!) USER MOD Single : A 47 MET CE :methyl -134:sc= -1.65 (180deg=-2.2!) USER MOD Single : A 50 GLN : amide:sc= -0.755 X(o=-0.75,f=-0.87) USER MOD Single : A 51 ASN : amide:sc= -0.373 K(o=-0.37,f=-2.6!) USER MOD Single : A 53 THR OG1 : rot -121:sc= -3.76! USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 84 SER OG : rot -129:sc= 1.22 USER MOD Single : A 85 MET CE :methyl 173:sc= -6.43! (180deg=-7.19!) USER MOD Single : A 86 LYS NZ :NH3+ -172:sc=-0.00987 (180deg=-0.0959) USER MOD Single : A 89 SER OG : rot 73:sc= 2.22 USER MOD Single : A 90 LYS NZ :NH3+ -165:sc= -2.01! (180deg=-2.48!) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 153 MET CE :methyl -109:sc= -10.4! (180deg=-14.5!) USER MOD Single : A 154 MET CE :methyl 140:sc= -1.71 (180deg=-3.01!) USER MOD Single : A 155 GLN : amide:sc= -0.0332 X(o=-0.033,f=-0.11) USER MOD Single : A 163 LYS NZ :NH3+ -154:sc= -0.11 (180deg=-0.493) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.415 -10.655 -9.997 1.00 0.00 N ATOM 2 CA MET A 1 -3.002 -10.188 -8.725 1.00 0.00 C ATOM 3 C MET A 1 -3.491 -11.370 -7.906 1.00 0.00 C ATOM 4 O MET A 1 -4.284 -12.177 -8.387 1.00 0.00 O ATOM 5 CB MET A 1 -4.178 -9.250 -8.999 1.00 0.00 C ATOM 6 CG MET A 1 -4.805 -8.669 -7.743 1.00 0.00 C ATOM 7 SD MET A 1 -6.356 -7.811 -8.074 1.00 0.00 S ATOM 8 CE MET A 1 -6.583 -6.913 -6.540 1.00 0.00 C ATOM 0 H1 MET A 1 -1.694 -9.977 -10.317 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.975 -11.586 -9.855 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.162 -10.731 -10.717 1.00 0.00 H new ATOM 0 HA MET A 1 -2.232 -9.654 -8.168 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.838 -8.433 -9.635 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.941 -9.793 -9.557 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.984 -9.471 -7.026 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.103 -7.977 -7.278 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.614 -6.567 -6.470 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.363 -7.569 -5.698 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.910 -6.056 -6.517 1.00 0.00 H new ATOM 20 N ASP A 2 -3.016 -11.476 -6.673 1.00 0.00 N ATOM 21 CA ASP A 2 -3.494 -12.508 -5.763 1.00 0.00 C ATOM 22 C ASP A 2 -4.960 -12.257 -5.453 1.00 0.00 C ATOM 23 O ASP A 2 -5.302 -11.286 -4.774 1.00 0.00 O ATOM 24 CB ASP A 2 -2.684 -12.526 -4.467 1.00 0.00 C ATOM 25 CG ASP A 2 -1.224 -12.866 -4.683 1.00 0.00 C ATOM 26 OD1 ASP A 2 -0.866 -14.060 -4.585 1.00 0.00 O ATOM 27 OD2 ASP A 2 -0.424 -11.942 -4.947 1.00 0.00 O1- ATOM 0 H ASP A 2 -2.302 -10.862 -6.280 1.00 0.00 H new ATOM 0 HA ASP A 2 -3.374 -13.479 -6.244 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -2.756 -11.550 -3.987 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -3.122 -13.252 -3.782 1.00 0.00 H new ATOM 32 N ASP A 3 -5.824 -13.126 -5.954 1.00 0.00 N ATOM 33 CA ASP A 3 -7.262 -12.906 -5.854 1.00 0.00 C ATOM 34 C ASP A 3 -7.776 -13.067 -4.437 1.00 0.00 C ATOM 35 O ASP A 3 -8.935 -12.786 -4.176 1.00 0.00 O ATOM 36 CB ASP A 3 -8.047 -13.816 -6.796 1.00 0.00 C ATOM 37 CG ASP A 3 -7.687 -15.272 -6.634 1.00 0.00 C ATOM 38 OD1 ASP A 3 -6.709 -15.718 -7.272 1.00 0.00 O ATOM 39 OD2 ASP A 3 -8.373 -15.977 -5.864 1.00 0.00 O1- ATOM 0 H ASP A 3 -5.558 -13.987 -6.432 1.00 0.00 H new ATOM 0 HA ASP A 3 -7.423 -11.871 -6.156 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -9.114 -13.687 -6.613 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -7.861 -13.513 -7.826 1.00 0.00 H new ATOM 44 N ILE A 4 -6.931 -13.511 -3.521 1.00 0.00 N ATOM 45 CA ILE A 4 -7.287 -13.462 -2.109 1.00 0.00 C ATOM 46 C ILE A 4 -7.505 -12.011 -1.711 1.00 0.00 C ATOM 47 O ILE A 4 -8.473 -11.662 -1.034 1.00 0.00 O ATOM 48 CB ILE A 4 -6.213 -14.079 -1.189 1.00 0.00 C ATOM 49 CG1 ILE A 4 -6.552 -13.776 0.275 1.00 0.00 C ATOM 50 CG2 ILE A 4 -4.840 -13.546 -1.547 1.00 0.00 C ATOM 51 CD1 ILE A 4 -5.511 -14.244 1.263 1.00 0.00 C ATOM 0 H ILE A 4 -6.011 -13.903 -3.722 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.193 -14.054 -1.983 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.200 -15.160 -1.329 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.687 -12.700 0.389 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.505 -14.245 0.520 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.094 -13.991 -0.889 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.609 -13.800 -2.581 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.828 -12.463 -1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.829 -13.990 2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.391 -15.324 1.181 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.560 -13.756 1.048 1.00 0.00 H new ATOM 63 N TYR A 5 -6.608 -11.164 -2.184 1.00 0.00 N ATOM 64 CA TYR A 5 -6.657 -9.766 -1.899 1.00 0.00 C ATOM 65 C TYR A 5 -7.663 -9.093 -2.813 1.00 0.00 C ATOM 66 O TYR A 5 -8.313 -8.125 -2.437 1.00 0.00 O ATOM 67 CB TYR A 5 -5.263 -9.181 -2.077 1.00 0.00 C ATOM 68 CG TYR A 5 -4.209 -9.865 -1.227 1.00 0.00 C ATOM 69 CD1 TYR A 5 -3.002 -10.264 -1.778 1.00 0.00 C ATOM 70 CD2 TYR A 5 -4.427 -10.126 0.120 1.00 0.00 C ATOM 71 CE1 TYR A 5 -2.040 -10.900 -1.020 1.00 0.00 C ATOM 72 CE2 TYR A 5 -3.472 -10.760 0.892 1.00 0.00 C ATOM 73 CZ TYR A 5 -2.277 -11.148 0.316 1.00 0.00 C ATOM 74 OH TYR A 5 -1.311 -11.768 1.082 1.00 0.00 O ATOM 0 H TYR A 5 -5.827 -11.441 -2.778 1.00 0.00 H new ATOM 0 HA TYR A 5 -6.978 -9.597 -0.871 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -4.977 -9.255 -3.126 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -5.288 -8.120 -1.828 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -2.810 -10.073 -2.823 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -5.361 -9.828 0.573 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -1.106 -11.202 -1.471 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -3.658 -10.951 1.939 1.00 0.00 H new ATOM 0 HH TYR A 5 -1.636 -11.867 2.001 1.00 0.00 H new ATOM 84 N LYS A 6 -7.794 -9.625 -4.020 1.00 0.00 N ATOM 85 CA LYS A 6 -8.826 -9.176 -4.940 1.00 0.00 C ATOM 86 C LYS A 6 -10.210 -9.470 -4.379 1.00 0.00 C ATOM 87 O LYS A 6 -11.132 -8.692 -4.570 1.00 0.00 O ATOM 88 CB LYS A 6 -8.675 -9.829 -6.293 1.00 0.00 C ATOM 89 CG LYS A 6 -9.467 -9.121 -7.378 1.00 0.00 C ATOM 90 CD LYS A 6 -9.816 -10.064 -8.510 1.00 0.00 C ATOM 91 CE LYS A 6 -10.588 -11.262 -7.996 1.00 0.00 C ATOM 92 NZ LYS A 6 -11.192 -12.041 -9.108 1.00 0.00 N1+ ATOM 0 H LYS A 6 -7.198 -10.368 -4.384 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.711 -8.099 -5.061 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.621 -9.843 -6.569 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.002 -10.867 -6.229 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.381 -8.707 -6.952 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.888 -8.283 -7.766 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.409 -9.537 -9.258 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.904 -10.399 -9.004 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.922 -11.905 -7.420 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.373 -10.926 -7.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.713 -12.853 -8.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.846 -11.434 -9.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.441 -12.382 -9.741 1.00 0.00 H new ATOM 106 N ALA A 7 -10.347 -10.594 -3.688 1.00 0.00 N ATOM 107 CA ALA A 7 -11.600 -10.947 -3.033 1.00 0.00 C ATOM 108 C ALA A 7 -11.891 -9.979 -1.901 1.00 0.00 C ATOM 109 O ALA A 7 -13.042 -9.635 -1.636 1.00 0.00 O ATOM 110 CB ALA A 7 -11.543 -12.368 -2.512 1.00 0.00 C ATOM 0 H ALA A 7 -9.602 -11.280 -3.566 1.00 0.00 H new ATOM 0 HA ALA A 7 -12.406 -10.881 -3.764 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -12.487 -12.615 -2.026 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -11.372 -13.053 -3.342 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.729 -12.459 -1.793 1.00 0.00 H new ATOM 116 N ALA A 8 -10.832 -9.541 -1.235 1.00 0.00 N ATOM 117 CA ALA A 8 -10.940 -8.478 -0.254 1.00 0.00 C ATOM 118 C ALA A 8 -11.444 -7.213 -0.928 1.00 0.00 C ATOM 119 O ALA A 8 -12.269 -6.488 -0.379 1.00 0.00 O ATOM 120 CB ALA A 8 -9.598 -8.229 0.403 1.00 0.00 C ATOM 0 H ALA A 8 -9.888 -9.908 -1.359 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.648 -8.776 0.519 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.695 -7.429 1.137 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.262 -9.139 0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.870 -7.940 -0.355 1.00 0.00 H new ATOM 126 N VAL A 9 -10.942 -6.979 -2.136 1.00 0.00 N ATOM 127 CA VAL A 9 -11.382 -5.868 -2.967 1.00 0.00 C ATOM 128 C VAL A 9 -12.833 -6.070 -3.396 1.00 0.00 C ATOM 129 O VAL A 9 -13.600 -5.117 -3.509 1.00 0.00 O ATOM 130 CB VAL A 9 -10.504 -5.737 -4.232 1.00 0.00 C ATOM 131 CG1 VAL A 9 -11.022 -4.640 -5.134 1.00 0.00 C ATOM 132 CG2 VAL A 9 -9.046 -5.481 -3.876 1.00 0.00 C ATOM 0 H VAL A 9 -10.218 -7.556 -2.565 1.00 0.00 H new ATOM 0 HA VAL A 9 -11.292 -4.958 -2.374 1.00 0.00 H new ATOM 0 HB VAL A 9 -10.559 -6.685 -4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.388 -4.566 -6.018 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -12.043 -4.871 -5.438 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -11.009 -3.691 -4.598 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -8.458 -5.394 -4.790 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -8.968 -4.556 -3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.667 -6.309 -3.278 1.00 0.00 H new ATOM 142 N GLU A 10 -13.197 -7.322 -3.636 1.00 0.00 N ATOM 143 CA GLU A 10 -14.555 -7.667 -4.018 1.00 0.00 C ATOM 144 C GLU A 10 -15.525 -7.348 -2.883 1.00 0.00 C ATOM 145 O GLU A 10 -16.707 -7.082 -3.110 1.00 0.00 O ATOM 146 CB GLU A 10 -14.634 -9.130 -4.430 1.00 0.00 C ATOM 147 CG GLU A 10 -13.805 -9.424 -5.668 1.00 0.00 C ATOM 148 CD GLU A 10 -14.311 -8.681 -6.891 1.00 0.00 C ATOM 149 OE1 GLU A 10 -14.016 -7.475 -7.038 1.00 0.00 O ATOM 150 OE2 GLU A 10 -15.011 -9.307 -7.715 1.00 0.00 O1- ATOM 0 H GLU A 10 -12.564 -8.119 -3.572 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.845 -7.065 -4.879 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -14.289 -9.756 -3.607 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.674 -9.396 -4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.767 -9.148 -5.481 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.819 -10.496 -5.865 1.00 0.00 H new ATOM 157 N GLN A 11 -15.010 -7.382 -1.657 1.00 0.00 N ATOM 158 CA GLN A 11 -15.750 -6.906 -0.498 1.00 0.00 C ATOM 159 C GLN A 11 -15.626 -5.399 -0.366 1.00 0.00 C ATOM 160 O GLN A 11 -16.590 -4.722 0.001 1.00 0.00 O ATOM 161 CB GLN A 11 -15.249 -7.553 0.775 1.00 0.00 C ATOM 162 CG GLN A 11 -15.915 -6.963 1.976 1.00 0.00 C ATOM 163 CD GLN A 11 -15.367 -7.486 3.287 1.00 0.00 C ATOM 164 OE1 GLN A 11 -16.087 -7.581 4.281 1.00 0.00 O ATOM 165 NE2 GLN A 11 -14.087 -7.826 3.303 1.00 0.00 N ATOM 0 H GLN A 11 -14.078 -7.737 -1.443 1.00 0.00 H new ATOM 0 HA GLN A 11 -16.795 -7.176 -0.647 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.439 -8.626 0.740 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.170 -7.422 0.853 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -15.801 -5.879 1.950 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -16.984 -7.172 1.929 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -13.524 -7.732 2.458 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -13.664 -8.182 4.161 1.00 0.00 H new ATOM 174 N LEU A 12 -14.435 -4.882 -0.652 1.00 0.00 N ATOM 175 CA LEU A 12 -14.196 -3.462 -0.613 1.00 0.00 C ATOM 176 C LEU A 12 -15.229 -2.746 -1.445 1.00 0.00 C ATOM 177 O LEU A 12 -15.537 -3.144 -2.570 1.00 0.00 O ATOM 178 CB LEU A 12 -12.804 -3.151 -1.142 1.00 0.00 C ATOM 179 CG LEU A 12 -11.647 -3.505 -0.224 1.00 0.00 C ATOM 180 CD1 LEU A 12 -10.329 -3.062 -0.831 1.00 0.00 C ATOM 181 CD2 LEU A 12 -11.866 -2.869 1.122 1.00 0.00 C ATOM 0 H LEU A 12 -13.621 -5.439 -0.914 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.267 -3.121 0.420 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.669 -3.681 -2.085 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.752 -2.085 -1.365 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.603 -4.587 -0.098 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.512 -3.324 -0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.184 -3.560 -1.790 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -10.342 -1.983 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.037 -3.122 1.783 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.922 -1.786 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.798 -3.238 1.551 1.00 0.00 H new ATOM 193 N THR A 13 -15.762 -1.692 -0.890 1.00 0.00 N ATOM 194 CA THR A 13 -16.759 -0.928 -1.579 1.00 0.00 C ATOM 195 C THR A 13 -16.043 0.014 -2.522 1.00 0.00 C ATOM 196 O THR A 13 -14.828 0.186 -2.394 1.00 0.00 O ATOM 197 CB THR A 13 -17.646 -0.145 -0.585 1.00 0.00 C ATOM 198 OG1 THR A 13 -16.969 1.039 -0.141 1.00 0.00 O ATOM 199 CG2 THR A 13 -17.976 -1.004 0.633 1.00 0.00 C ATOM 0 H THR A 13 -15.521 -1.344 0.038 1.00 0.00 H new ATOM 0 HA THR A 13 -17.421 -1.591 -2.136 1.00 0.00 H new ATOM 0 HB THR A 13 -18.567 0.126 -1.100 1.00 0.00 H new ATOM 0 HG1 THR A 13 -17.372 1.352 0.696 1.00 0.00 H new ATOM 0 HG21 THR A 13 -18.601 -0.435 1.321 1.00 0.00 H new ATOM 0 HG22 THR A 13 -18.510 -1.899 0.313 1.00 0.00 H new ATOM 0 HG23 THR A 13 -17.053 -1.292 1.136 1.00 0.00 H new ATOM 207 N GLU A 14 -16.743 0.596 -3.475 1.00 0.00 N ATOM 208 CA GLU A 14 -16.105 1.549 -4.360 1.00 0.00 C ATOM 209 C GLU A 14 -15.458 2.637 -3.527 1.00 0.00 C ATOM 210 O GLU A 14 -14.326 3.017 -3.776 1.00 0.00 O ATOM 211 CB GLU A 14 -17.104 2.174 -5.321 1.00 0.00 C ATOM 212 CG GLU A 14 -16.472 3.204 -6.233 1.00 0.00 C ATOM 213 CD GLU A 14 -17.468 3.874 -7.144 1.00 0.00 C ATOM 214 OE1 GLU A 14 -18.066 4.894 -6.734 1.00 0.00 O ATOM 215 OE2 GLU A 14 -17.655 3.392 -8.275 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.733 0.431 -3.655 1.00 0.00 H new ATOM 0 HA GLU A 14 -15.356 1.022 -4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -17.559 1.390 -5.926 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -17.906 2.643 -4.751 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -15.975 3.962 -5.627 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -15.702 2.723 -6.836 1.00 0.00 H new ATOM 222 N GLU A 15 -16.191 3.116 -2.528 1.00 0.00 N ATOM 223 CA GLU A 15 -15.660 4.073 -1.565 1.00 0.00 C ATOM 224 C GLU A 15 -14.370 3.561 -0.940 1.00 0.00 C ATOM 225 O GLU A 15 -13.386 4.284 -0.884 1.00 0.00 O ATOM 226 CB GLU A 15 -16.671 4.372 -0.450 1.00 0.00 C ATOM 227 CG GLU A 15 -17.943 5.049 -0.931 1.00 0.00 C ATOM 228 CD GLU A 15 -18.869 4.099 -1.655 1.00 0.00 C ATOM 229 OE1 GLU A 15 -19.637 3.383 -0.985 1.00 0.00 O ATOM 230 OE2 GLU A 15 -18.833 4.061 -2.901 1.00 0.00 O1- ATOM 0 H GLU A 15 -17.163 2.854 -2.364 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.458 4.993 -2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -16.935 3.438 0.047 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.195 5.007 0.297 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.466 5.480 -0.077 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.683 5.873 -1.595 1.00 0.00 H new ATOM 237 N GLN A 16 -14.383 2.323 -0.458 1.00 0.00 N ATOM 238 CA GLN A 16 -13.201 1.722 0.127 1.00 0.00 C ATOM 239 C GLN A 16 -12.036 1.689 -0.859 1.00 0.00 C ATOM 240 O GLN A 16 -10.943 2.166 -0.564 1.00 0.00 O ATOM 241 CB GLN A 16 -13.524 0.329 0.606 1.00 0.00 C ATOM 242 CG GLN A 16 -14.565 0.339 1.688 1.00 0.00 C ATOM 243 CD GLN A 16 -14.633 -0.961 2.459 1.00 0.00 C ATOM 244 OE1 GLN A 16 -15.348 -1.886 2.082 1.00 0.00 O ATOM 245 NE2 GLN A 16 -13.882 -1.041 3.545 1.00 0.00 N ATOM 0 H GLN A 16 -15.204 1.718 -0.463 1.00 0.00 H new ATOM 0 HA GLN A 16 -12.893 2.336 0.973 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -13.877 -0.271 -0.233 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.617 -0.147 0.979 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -14.353 1.154 2.380 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -15.540 0.543 1.244 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -13.302 -0.249 3.824 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -13.883 -1.894 4.104 1.00 0.00 H new ATOM 254 N LYS A 17 -12.281 1.111 -2.026 1.00 0.00 N ATOM 255 CA LYS A 17 -11.307 1.084 -3.104 1.00 0.00 C ATOM 256 C LYS A 17 -10.841 2.488 -3.469 1.00 0.00 C ATOM 257 O LYS A 17 -9.649 2.733 -3.640 1.00 0.00 O ATOM 258 CB LYS A 17 -11.937 0.405 -4.306 1.00 0.00 C ATOM 259 CG LYS A 17 -12.297 -1.035 -4.023 1.00 0.00 C ATOM 260 CD LYS A 17 -13.065 -1.649 -5.172 1.00 0.00 C ATOM 261 CE LYS A 17 -12.222 -1.614 -6.422 1.00 0.00 C ATOM 262 NZ LYS A 17 -12.845 -2.349 -7.555 1.00 0.00 N1+ ATOM 0 H LYS A 17 -13.161 0.648 -2.251 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.428 0.529 -2.777 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -12.833 0.951 -4.601 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.246 0.447 -5.148 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.389 -1.610 -3.842 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.895 -1.090 -3.113 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.336 -2.677 -4.933 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -13.995 -1.104 -5.333 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.056 -0.577 -6.714 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -11.244 -2.045 -6.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.225 -2.293 -8.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -12.980 -3.346 -7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.766 -1.923 -7.781 1.00 0.00 H new ATOM 276 N ASN A 18 -11.795 3.403 -3.583 1.00 0.00 N ATOM 277 CA ASN A 18 -11.514 4.813 -3.850 1.00 0.00 C ATOM 278 C ASN A 18 -10.657 5.400 -2.762 1.00 0.00 C ATOM 279 O ASN A 18 -9.758 6.185 -3.021 1.00 0.00 O ATOM 280 CB ASN A 18 -12.802 5.611 -3.904 1.00 0.00 C ATOM 281 CG ASN A 18 -12.568 7.104 -4.046 1.00 0.00 C ATOM 282 OD1 ASN A 18 -12.524 7.832 -3.057 1.00 0.00 O ATOM 283 ND2 ASN A 18 -12.401 7.570 -5.272 1.00 0.00 N ATOM 0 H ASN A 18 -12.789 3.191 -3.493 1.00 0.00 H new ATOM 0 HA ASN A 18 -10.995 4.865 -4.807 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -13.405 5.262 -4.742 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -13.378 5.423 -2.998 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -12.229 8.564 -5.421 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -12.444 6.935 -6.069 1.00 0.00 H new ATOM 290 N GLU A 19 -10.978 5.031 -1.542 1.00 0.00 N ATOM 291 CA GLU A 19 -10.273 5.516 -0.385 1.00 0.00 C ATOM 292 C GLU A 19 -8.805 5.132 -0.465 1.00 0.00 C ATOM 293 O GLU A 19 -7.914 5.943 -0.211 1.00 0.00 O ATOM 294 CB GLU A 19 -10.920 4.954 0.881 1.00 0.00 C ATOM 295 CG GLU A 19 -10.076 5.067 2.136 1.00 0.00 C ATOM 296 CD GLU A 19 -10.932 5.038 3.390 1.00 0.00 C ATOM 297 OE1 GLU A 19 -11.591 6.059 3.693 1.00 0.00 O ATOM 298 OE2 GLU A 19 -10.974 3.990 4.066 1.00 0.00 O1- ATOM 0 H GLU A 19 -11.737 4.385 -1.328 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.333 6.604 -0.353 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -11.865 5.471 1.049 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -11.157 3.903 0.714 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.357 4.248 2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.503 5.994 2.107 1.00 0.00 H new ATOM 305 N PHE A 20 -8.568 3.893 -0.846 1.00 0.00 N ATOM 306 CA PHE A 20 -7.222 3.400 -1.038 1.00 0.00 C ATOM 307 C PHE A 20 -6.615 3.986 -2.313 1.00 0.00 C ATOM 308 O PHE A 20 -5.405 4.108 -2.438 1.00 0.00 O ATOM 309 CB PHE A 20 -7.241 1.875 -1.090 1.00 0.00 C ATOM 310 CG PHE A 20 -7.775 1.240 0.171 1.00 0.00 C ATOM 311 CD1 PHE A 20 -8.639 0.161 0.104 1.00 0.00 C ATOM 312 CD2 PHE A 20 -7.413 1.718 1.423 1.00 0.00 C ATOM 313 CE1 PHE A 20 -9.129 -0.428 1.241 1.00 0.00 C ATOM 314 CE2 PHE A 20 -7.905 1.130 2.570 1.00 0.00 C ATOM 315 CZ PHE A 20 -8.762 0.053 2.481 1.00 0.00 C ATOM 0 H PHE A 20 -9.298 3.205 -1.030 1.00 0.00 H new ATOM 0 HA PHE A 20 -6.600 3.714 -0.200 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.850 1.555 -1.935 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.229 1.512 -1.271 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -8.933 -0.224 -0.861 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -6.739 2.559 1.500 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.803 -1.269 1.166 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.619 1.513 3.538 1.00 0.00 H new ATOM 0 HZ PHE A 20 -9.144 -0.412 3.378 1.00 0.00 H new ATOM 325 N LYS A 21 -7.467 4.359 -3.253 1.00 0.00 N ATOM 326 CA LYS A 21 -7.019 5.008 -4.481 1.00 0.00 C ATOM 327 C LYS A 21 -6.534 6.393 -4.107 1.00 0.00 C ATOM 328 O LYS A 21 -5.490 6.860 -4.546 1.00 0.00 O ATOM 329 CB LYS A 21 -8.183 5.154 -5.442 1.00 0.00 C ATOM 330 CG LYS A 21 -7.804 5.178 -6.922 1.00 0.00 C ATOM 331 CD LYS A 21 -6.511 5.923 -7.207 1.00 0.00 C ATOM 332 CE LYS A 21 -6.439 6.358 -8.663 1.00 0.00 C ATOM 333 NZ LYS A 21 -5.175 7.072 -8.977 1.00 0.00 N1+ ATOM 0 H LYS A 21 -8.476 4.225 -3.192 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.234 4.419 -4.954 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.878 4.331 -5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.716 6.075 -5.205 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -7.710 4.153 -7.281 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.612 5.641 -7.488 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -6.441 6.797 -6.559 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.660 5.283 -6.973 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.528 5.482 -9.306 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.286 7.007 -8.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.337 7.736 -9.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -4.856 7.598 -8.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.446 6.383 -9.252 1.00 0.00 H new ATOM 347 N ALA A 22 -7.354 7.041 -3.309 1.00 0.00 N ATOM 348 CA ALA A 22 -7.012 8.308 -2.680 1.00 0.00 C ATOM 349 C ALA A 22 -5.677 8.192 -1.964 1.00 0.00 C ATOM 350 O ALA A 22 -4.828 9.075 -2.053 1.00 0.00 O ATOM 351 CB ALA A 22 -8.101 8.716 -1.699 1.00 0.00 C ATOM 0 H ALA A 22 -8.287 6.704 -3.073 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.931 9.074 -3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.835 9.665 -1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.047 8.824 -2.230 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.203 7.951 -0.929 1.00 0.00 H new ATOM 357 N ALA A 23 -5.497 7.085 -1.257 1.00 0.00 N ATOM 358 CA ALA A 23 -4.248 6.813 -0.571 1.00 0.00 C ATOM 359 C ALA A 23 -3.115 6.645 -1.572 1.00 0.00 C ATOM 360 O ALA A 23 -2.028 7.174 -1.363 1.00 0.00 O ATOM 361 CB ALA A 23 -4.391 5.590 0.314 1.00 0.00 C ATOM 0 H ALA A 23 -6.205 6.360 -1.145 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.003 7.663 0.066 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.447 5.397 0.823 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.173 5.765 1.053 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.657 4.728 -0.297 1.00 0.00 H new ATOM 367 N PHE A 24 -3.385 5.910 -2.655 1.00 0.00 N ATOM 368 CA PHE A 24 -2.461 5.818 -3.787 1.00 0.00 C ATOM 369 C PHE A 24 -2.062 7.216 -4.230 1.00 0.00 C ATOM 370 O PHE A 24 -0.886 7.541 -4.357 1.00 0.00 O ATOM 371 CB PHE A 24 -3.122 5.121 -4.980 1.00 0.00 C ATOM 372 CG PHE A 24 -2.212 4.983 -6.175 1.00 0.00 C ATOM 373 CD1 PHE A 24 -0.968 4.369 -6.077 1.00 0.00 C ATOM 374 CD2 PHE A 24 -2.602 5.488 -7.404 1.00 0.00 C ATOM 375 CE1 PHE A 24 -0.144 4.266 -7.177 1.00 0.00 C ATOM 376 CE2 PHE A 24 -1.781 5.383 -8.506 1.00 0.00 C ATOM 377 CZ PHE A 24 -0.551 4.772 -8.392 1.00 0.00 C ATOM 0 H PHE A 24 -4.241 5.368 -2.771 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.592 5.245 -3.464 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.457 4.131 -4.672 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.010 5.682 -5.272 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -0.644 3.968 -5.128 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.563 5.971 -7.500 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.821 3.789 -7.086 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.101 5.779 -9.458 1.00 0.00 H new ATOM 0 HZ PHE A 24 0.094 4.690 -9.255 1.00 0.00 H new ATOM 387 N ASP A 25 -3.086 8.019 -4.461 1.00 0.00 N ATOM 388 CA ASP A 25 -2.945 9.387 -4.953 1.00 0.00 C ATOM 389 C ASP A 25 -1.972 10.202 -4.113 1.00 0.00 C ATOM 390 O ASP A 25 -1.012 10.772 -4.629 1.00 0.00 O ATOM 391 CB ASP A 25 -4.295 10.085 -4.939 1.00 0.00 C ATOM 392 CG ASP A 25 -4.358 11.222 -5.935 1.00 0.00 C ATOM 393 OD1 ASP A 25 -3.886 12.329 -5.611 1.00 0.00 O ATOM 394 OD2 ASP A 25 -4.870 11.009 -7.053 1.00 0.00 O1- ATOM 0 H ASP A 25 -4.055 7.739 -4.311 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.554 9.321 -5.968 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -5.079 9.362 -5.165 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.494 10.469 -3.938 1.00 0.00 H new ATOM 399 N ILE A 26 -2.238 10.261 -2.820 1.00 0.00 N ATOM 400 CA ILE A 26 -1.420 11.037 -1.897 1.00 0.00 C ATOM 401 C ILE A 26 -0.040 10.413 -1.768 1.00 0.00 C ATOM 402 O ILE A 26 0.969 11.115 -1.670 1.00 0.00 O ATOM 403 CB ILE A 26 -2.079 11.101 -0.514 1.00 0.00 C ATOM 404 CG1 ILE A 26 -3.551 11.432 -0.666 1.00 0.00 C ATOM 405 CG2 ILE A 26 -1.400 12.138 0.375 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.317 11.344 0.636 1.00 0.00 C ATOM 0 H ILE A 26 -3.021 9.777 -2.380 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.327 12.048 -2.293 1.00 0.00 H new ATOM 0 HB ILE A 26 -1.970 10.127 -0.037 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.651 12.439 -1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.998 10.751 -1.390 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.890 12.159 1.348 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.350 11.876 0.503 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.474 13.121 -0.090 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.364 11.592 0.460 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.246 10.331 1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.894 12.045 1.355 1.00 0.00 H new ATOM 418 N PHE A 27 -0.019 9.086 -1.767 1.00 0.00 N ATOM 419 CA PHE A 27 1.214 8.304 -1.704 1.00 0.00 C ATOM 420 C PHE A 27 2.158 8.729 -2.822 1.00 0.00 C ATOM 421 O PHE A 27 3.380 8.702 -2.671 1.00 0.00 O ATOM 422 CB PHE A 27 0.852 6.832 -1.870 1.00 0.00 C ATOM 423 CG PHE A 27 1.482 5.863 -0.911 1.00 0.00 C ATOM 424 CD1 PHE A 27 0.767 5.386 0.170 1.00 0.00 C ATOM 425 CD2 PHE A 27 2.764 5.387 -1.122 1.00 0.00 C ATOM 426 CE1 PHE A 27 1.317 4.450 1.026 1.00 0.00 C ATOM 427 CE2 PHE A 27 3.321 4.457 -0.267 1.00 0.00 C ATOM 428 CZ PHE A 27 2.595 3.986 0.806 1.00 0.00 C ATOM 0 H PHE A 27 -0.863 8.515 -1.810 1.00 0.00 H new ATOM 0 HA PHE A 27 1.712 8.467 -0.748 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.231 6.738 -1.785 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.120 6.529 -2.882 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -0.234 5.749 0.349 1.00 0.00 H new ATOM 0 HD2 PHE A 27 3.335 5.747 -1.965 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.745 4.083 1.866 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.325 4.099 -0.439 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.027 3.255 1.473 1.00 0.00 H new ATOM 438 N VAL A 28 1.569 9.133 -3.941 1.00 0.00 N ATOM 439 CA VAL A 28 2.331 9.508 -5.114 1.00 0.00 C ATOM 440 C VAL A 28 2.217 11.006 -5.419 1.00 0.00 C ATOM 441 O VAL A 28 2.387 11.430 -6.566 1.00 0.00 O ATOM 442 CB VAL A 28 1.885 8.698 -6.347 1.00 0.00 C ATOM 443 CG1 VAL A 28 2.020 7.208 -6.081 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.459 9.045 -6.749 1.00 0.00 C ATOM 0 H VAL A 28 0.558 9.208 -4.056 1.00 0.00 H new ATOM 0 HA VAL A 28 3.374 9.282 -4.892 1.00 0.00 H new ATOM 0 HB VAL A 28 2.538 8.963 -7.178 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.701 6.651 -6.962 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.060 6.971 -5.859 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.396 6.932 -5.231 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.174 8.457 -7.622 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.217 8.820 -5.924 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.397 10.106 -6.990 1.00 0.00 H new ATOM 454 N LEU A 29 1.921 11.817 -4.415 1.00 0.00 N ATOM 455 CA LEU A 29 1.994 13.258 -4.603 1.00 0.00 C ATOM 456 C LEU A 29 3.458 13.657 -4.575 1.00 0.00 C ATOM 457 O LEU A 29 4.142 13.478 -3.565 1.00 0.00 O ATOM 458 CB LEU A 29 1.194 14.013 -3.534 1.00 0.00 C ATOM 459 CG LEU A 29 -0.316 13.802 -3.588 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.976 14.397 -2.357 1.00 0.00 C ATOM 461 CD2 LEU A 29 -0.910 14.418 -4.841 1.00 0.00 C ATOM 0 H LEU A 29 1.635 11.513 -3.484 1.00 0.00 H new ATOM 0 HA LEU A 29 1.548 13.525 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.553 13.709 -2.551 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.400 15.079 -3.633 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.504 12.729 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.053 14.239 -2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.581 13.914 -1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.768 15.466 -2.313 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.987 14.252 -4.852 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.708 15.489 -4.851 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.462 13.956 -5.721 1.00 0.00 H new ATOM 473 N GLY A 30 3.933 14.184 -5.687 1.00 0.00 N ATOM 474 CA GLY A 30 5.354 14.387 -5.848 1.00 0.00 C ATOM 475 C GLY A 30 6.002 13.221 -6.559 1.00 0.00 C ATOM 476 O GLY A 30 7.228 13.093 -6.566 1.00 0.00 O ATOM 0 H GLY A 30 3.362 14.475 -6.481 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.530 15.303 -6.413 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.817 14.521 -4.870 1.00 0.00 H new ATOM 480 N ALA A 31 5.182 12.363 -7.152 1.00 0.00 N ATOM 481 CA ALA A 31 5.696 11.199 -7.848 1.00 0.00 C ATOM 482 C ALA A 31 6.049 11.524 -9.282 1.00 0.00 C ATOM 483 O ALA A 31 5.385 12.322 -9.946 1.00 0.00 O ATOM 484 CB ALA A 31 4.707 10.050 -7.826 1.00 0.00 C ATOM 0 H ALA A 31 4.166 12.453 -7.163 1.00 0.00 H new ATOM 0 HA ALA A 31 6.599 10.896 -7.318 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.129 9.197 -8.357 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.500 9.768 -6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.781 10.358 -8.311 1.00 0.00 H new ATOM 490 N GLU A 32 7.106 10.882 -9.740 1.00 0.00 N ATOM 491 CA GLU A 32 7.618 11.086 -11.077 1.00 0.00 C ATOM 492 C GLU A 32 6.814 10.295 -12.099 1.00 0.00 C ATOM 493 O GLU A 32 6.544 10.773 -13.199 1.00 0.00 O ATOM 494 CB GLU A 32 9.077 10.659 -11.122 1.00 0.00 C ATOM 495 CG GLU A 32 9.939 11.350 -10.079 1.00 0.00 C ATOM 496 CD GLU A 32 11.362 10.843 -10.074 1.00 0.00 C ATOM 497 OE1 GLU A 32 11.685 9.958 -9.250 1.00 0.00 O ATOM 498 OE2 GLU A 32 12.167 11.324 -10.892 1.00 0.00 O1- ATOM 0 H GLU A 32 7.634 10.203 -9.192 1.00 0.00 H new ATOM 0 HA GLU A 32 7.532 12.143 -11.328 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.137 9.580 -10.976 1.00 0.00 H new ATOM 0 HB3 GLU A 32 9.479 10.870 -12.113 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.940 12.424 -10.267 1.00 0.00 H new ATOM 0 HG3 GLU A 32 9.500 11.200 -9.093 1.00 0.00 H new ATOM 505 N ASP A 33 6.443 9.077 -11.732 1.00 0.00 N ATOM 506 CA ASP A 33 5.721 8.192 -12.632 1.00 0.00 C ATOM 507 C ASP A 33 4.250 8.086 -12.256 1.00 0.00 C ATOM 508 O ASP A 33 3.425 7.635 -13.049 1.00 0.00 O ATOM 509 CB ASP A 33 6.354 6.806 -12.636 1.00 0.00 C ATOM 510 CG ASP A 33 7.642 6.754 -13.427 1.00 0.00 C ATOM 511 OD1 ASP A 33 7.579 6.492 -14.647 1.00 0.00 O ATOM 512 OD2 ASP A 33 8.725 6.968 -12.838 1.00 0.00 O1- ATOM 0 H ASP A 33 6.632 8.678 -10.812 1.00 0.00 H new ATOM 0 HA ASP A 33 5.784 8.621 -13.632 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.551 6.498 -11.609 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.647 6.089 -13.054 1.00 0.00 H new ATOM 517 N GLY A 34 3.929 8.499 -11.041 1.00 0.00 N ATOM 518 CA GLY A 34 2.561 8.422 -10.566 1.00 0.00 C ATOM 519 C GLY A 34 2.282 7.101 -9.887 1.00 0.00 C ATOM 520 O GLY A 34 1.192 6.877 -9.381 1.00 0.00 O ATOM 0 H GLY A 34 4.593 8.888 -10.371 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.371 9.238 -9.868 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.876 8.553 -11.404 1.00 0.00 H new ATOM 524 N SER A 35 3.278 6.227 -9.894 1.00 0.00 N ATOM 525 CA SER A 35 3.215 4.960 -9.177 1.00 0.00 C ATOM 526 C SER A 35 4.206 5.012 -8.040 1.00 0.00 C ATOM 527 O SER A 35 5.227 5.691 -8.136 1.00 0.00 O ATOM 528 CB SER A 35 3.562 3.788 -10.098 1.00 0.00 C ATOM 529 OG SER A 35 2.694 3.721 -11.218 1.00 0.00 O ATOM 0 H SER A 35 4.153 6.375 -10.397 1.00 0.00 H new ATOM 0 HA SER A 35 2.202 4.809 -8.805 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.591 3.889 -10.442 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.503 2.855 -9.537 1.00 0.00 H new ATOM 0 HG SER A 35 1.778 3.552 -10.913 1.00 0.00 H new ATOM 535 N ILE A 36 3.915 4.301 -6.977 1.00 0.00 N ATOM 536 CA ILE A 36 4.734 4.350 -5.786 1.00 0.00 C ATOM 537 C ILE A 36 6.087 3.721 -6.032 1.00 0.00 C ATOM 538 O ILE A 36 6.198 2.504 -6.148 1.00 0.00 O ATOM 539 CB ILE A 36 4.046 3.614 -4.625 1.00 0.00 C ATOM 540 CG1 ILE A 36 2.636 4.163 -4.423 1.00 0.00 C ATOM 541 CG2 ILE A 36 4.858 3.733 -3.341 1.00 0.00 C ATOM 542 CD1 ILE A 36 1.850 3.410 -3.382 1.00 0.00 C ATOM 0 H ILE A 36 3.111 3.677 -6.911 1.00 0.00 H new ATOM 0 HA ILE A 36 4.869 5.400 -5.525 1.00 0.00 H new ATOM 0 HB ILE A 36 3.980 2.556 -4.879 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.699 5.212 -4.133 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.099 4.126 -5.371 1.00 0.00 H new ATOM 0 HG21 ILE A 36 4.347 3.203 -2.537 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.845 3.297 -3.493 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.963 4.784 -3.073 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.857 3.850 -3.287 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.757 2.366 -3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.366 3.468 -2.424 1.00 0.00 H new ATOM 554 N SER A 37 7.108 4.551 -6.113 1.00 0.00 N ATOM 555 CA SER A 37 8.461 4.061 -6.127 1.00 0.00 C ATOM 556 C SER A 37 8.930 3.967 -4.686 1.00 0.00 C ATOM 557 O SER A 37 8.142 4.201 -3.767 1.00 0.00 O ATOM 558 CB SER A 37 9.376 4.985 -6.930 1.00 0.00 C ATOM 559 OG SER A 37 9.462 6.260 -6.324 1.00 0.00 O ATOM 0 H SER A 37 7.021 5.566 -6.170 1.00 0.00 H new ATOM 0 HA SER A 37 8.497 3.083 -6.607 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.370 4.545 -7.003 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.996 5.086 -7.947 1.00 0.00 H new ATOM 0 HG SER A 37 8.714 6.817 -6.626 1.00 0.00 H new ATOM 565 N THR A 38 10.180 3.648 -4.461 1.00 0.00 N ATOM 566 CA THR A 38 10.677 3.577 -3.107 1.00 0.00 C ATOM 567 C THR A 38 10.910 4.981 -2.557 1.00 0.00 C ATOM 568 O THR A 38 10.857 5.200 -1.347 1.00 0.00 O ATOM 569 CB THR A 38 11.950 2.734 -3.041 1.00 0.00 C ATOM 570 OG1 THR A 38 12.900 3.194 -4.013 1.00 0.00 O ATOM 571 CG2 THR A 38 11.606 1.283 -3.308 1.00 0.00 C ATOM 0 H THR A 38 10.865 3.436 -5.186 1.00 0.00 H new ATOM 0 HA THR A 38 9.928 3.089 -2.483 1.00 0.00 H new ATOM 0 HB THR A 38 12.390 2.829 -2.048 1.00 0.00 H new ATOM 0 HG1 THR A 38 13.642 2.556 -4.073 1.00 0.00 H new ATOM 0 HG21 THR A 38 12.513 0.680 -3.261 1.00 0.00 H new ATOM 0 HG22 THR A 38 10.898 0.933 -2.557 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.160 1.191 -4.298 1.00 0.00 H new ATOM 579 N LYS A 39 11.145 5.933 -3.462 1.00 0.00 N ATOM 580 CA LYS A 39 11.164 7.341 -3.099 1.00 0.00 C ATOM 581 C LYS A 39 9.815 7.717 -2.508 1.00 0.00 C ATOM 582 O LYS A 39 9.729 8.182 -1.376 1.00 0.00 O ATOM 583 CB LYS A 39 11.452 8.197 -4.325 1.00 0.00 C ATOM 584 CG LYS A 39 11.215 9.687 -4.129 1.00 0.00 C ATOM 585 CD LYS A 39 11.177 10.416 -5.463 1.00 0.00 C ATOM 586 CE LYS A 39 10.634 11.826 -5.313 1.00 0.00 C ATOM 587 NZ LYS A 39 9.292 11.829 -4.677 1.00 0.00 N1+ ATOM 0 H LYS A 39 11.324 5.749 -4.449 1.00 0.00 H new ATOM 0 HA LYS A 39 11.949 7.516 -2.364 1.00 0.00 H new ATOM 0 HB2 LYS A 39 12.489 8.044 -4.623 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.829 7.849 -5.149 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.275 9.842 -3.599 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.005 10.105 -3.505 1.00 0.00 H new ATOM 0 HD2 LYS A 39 12.181 10.455 -5.886 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.557 9.859 -6.165 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.323 12.420 -4.713 1.00 0.00 H new ATOM 0 HE3 LYS A 39 10.574 12.300 -6.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 8.688 12.536 -5.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 8.860 10.888 -4.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.386 12.066 -3.669 1.00 0.00 H new ATOM 601 N GLU A 40 8.770 7.487 -3.292 1.00 0.00 N ATOM 602 CA GLU A 40 7.395 7.647 -2.867 1.00 0.00 C ATOM 603 C GLU A 40 7.076 6.893 -1.584 1.00 0.00 C ATOM 604 O GLU A 40 6.543 7.464 -0.635 1.00 0.00 O ATOM 605 CB GLU A 40 6.500 7.154 -3.997 1.00 0.00 C ATOM 606 CG GLU A 40 6.162 8.252 -4.980 1.00 0.00 C ATOM 607 CD GLU A 40 7.341 8.667 -5.832 1.00 0.00 C ATOM 608 OE1 GLU A 40 7.953 9.713 -5.536 1.00 0.00 O ATOM 609 OE2 GLU A 40 7.660 7.949 -6.799 1.00 0.00 O1- ATOM 0 H GLU A 40 8.862 7.178 -4.260 1.00 0.00 H new ATOM 0 HA GLU A 40 7.222 8.701 -2.649 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.997 6.339 -4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.579 6.748 -3.578 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.353 7.915 -5.628 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.792 9.120 -4.434 1.00 0.00 H new ATOM 616 N LEU A 41 7.385 5.613 -1.570 1.00 0.00 N ATOM 617 CA LEU A 41 7.075 4.769 -0.432 1.00 0.00 C ATOM 618 C LEU A 41 7.773 5.246 0.836 1.00 0.00 C ATOM 619 O LEU A 41 7.131 5.465 1.859 1.00 0.00 O ATOM 620 CB LEU A 41 7.469 3.332 -0.723 1.00 0.00 C ATOM 621 CG LEU A 41 7.274 2.367 0.439 1.00 0.00 C ATOM 622 CD1 LEU A 41 5.907 2.546 1.027 1.00 0.00 C ATOM 623 CD2 LEU A 41 7.466 0.929 -0.004 1.00 0.00 C ATOM 0 H LEU A 41 7.853 5.131 -2.338 1.00 0.00 H new ATOM 0 HA LEU A 41 5.999 4.829 -0.265 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.888 2.976 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.517 3.311 -1.022 1.00 0.00 H new ATOM 0 HG LEU A 41 8.025 2.590 1.196 1.00 0.00 H new ATOM 0 HD11 LEU A 41 5.775 1.853 1.858 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.797 3.569 1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 41 5.154 2.347 0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.321 0.264 0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 41 6.741 0.688 -0.781 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.475 0.801 -0.396 1.00 0.00 H new ATOM 635 N GLY A 42 9.084 5.374 0.773 1.00 0.00 N ATOM 636 CA GLY A 42 9.836 5.854 1.930 1.00 0.00 C ATOM 637 C GLY A 42 9.422 7.262 2.348 1.00 0.00 C ATOM 638 O GLY A 42 9.428 7.585 3.536 1.00 0.00 O ATOM 0 H GLY A 42 9.648 5.158 -0.049 1.00 0.00 H new ATOM 0 HA2 GLY A 42 9.687 5.171 2.766 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.901 5.845 1.697 1.00 0.00 H new ATOM 642 N LYS A 43 9.058 8.093 1.365 1.00 0.00 N ATOM 643 CA LYS A 43 8.424 9.395 1.614 1.00 0.00 C ATOM 644 C LYS A 43 7.215 9.224 2.535 1.00 0.00 C ATOM 645 O LYS A 43 6.992 10.018 3.453 1.00 0.00 O ATOM 646 CB LYS A 43 7.999 10.010 0.270 1.00 0.00 C ATOM 647 CG LYS A 43 6.799 10.941 0.343 1.00 0.00 C ATOM 648 CD LYS A 43 5.971 10.862 -0.938 1.00 0.00 C ATOM 649 CE LYS A 43 4.636 11.579 -0.801 1.00 0.00 C ATOM 650 NZ LYS A 43 4.782 13.059 -0.802 1.00 0.00 N1+ ATOM 0 H LYS A 43 9.194 7.884 0.376 1.00 0.00 H new ATOM 0 HA LYS A 43 9.132 10.062 2.106 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.843 10.561 -0.144 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.773 9.203 -0.427 1.00 0.00 H new ATOM 0 HG2 LYS A 43 6.179 10.675 1.199 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.137 11.965 0.500 1.00 0.00 H new ATOM 0 HD2 LYS A 43 6.535 11.301 -1.761 1.00 0.00 H new ATOM 0 HD3 LYS A 43 5.796 9.817 -1.192 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.981 11.281 -1.620 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.152 11.265 0.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.122 13.473 -0.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 5.757 13.312 -0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 4.570 13.428 -1.751 1.00 0.00 H new ATOM 664 N VAL A 44 6.457 8.164 2.290 1.00 0.00 N ATOM 665 CA VAL A 44 5.286 7.834 3.094 1.00 0.00 C ATOM 666 C VAL A 44 5.686 7.230 4.427 1.00 0.00 C ATOM 667 O VAL A 44 5.119 7.563 5.453 1.00 0.00 O ATOM 668 CB VAL A 44 4.373 6.841 2.353 1.00 0.00 C ATOM 669 CG1 VAL A 44 3.359 6.218 3.306 1.00 0.00 C ATOM 670 CG2 VAL A 44 3.676 7.534 1.199 1.00 0.00 C ATOM 0 H VAL A 44 6.635 7.508 1.529 1.00 0.00 H new ATOM 0 HA VAL A 44 4.747 8.765 3.270 1.00 0.00 H new ATOM 0 HB VAL A 44 4.990 6.036 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.726 5.520 2.758 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.884 5.686 4.099 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.741 7.002 3.743 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.033 6.822 0.682 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.073 8.358 1.580 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.421 7.921 0.504 1.00 0.00 H new ATOM 680 N MET A 45 6.649 6.327 4.396 1.00 0.00 N ATOM 681 CA MET A 45 7.156 5.694 5.606 1.00 0.00 C ATOM 682 C MET A 45 7.643 6.724 6.610 1.00 0.00 C ATOM 683 O MET A 45 7.512 6.528 7.810 1.00 0.00 O ATOM 684 CB MET A 45 8.276 4.749 5.247 1.00 0.00 C ATOM 685 CG MET A 45 7.771 3.462 4.638 1.00 0.00 C ATOM 686 SD MET A 45 7.208 2.292 5.881 1.00 0.00 S ATOM 687 CE MET A 45 6.647 0.979 4.812 1.00 0.00 C ATOM 0 H MET A 45 7.101 6.011 3.538 1.00 0.00 H new ATOM 0 HA MET A 45 6.341 5.139 6.071 1.00 0.00 H new ATOM 0 HB2 MET A 45 8.951 5.240 4.545 1.00 0.00 H new ATOM 0 HB3 MET A 45 8.856 4.521 6.141 1.00 0.00 H new ATOM 0 HG2 MET A 45 6.952 3.684 3.954 1.00 0.00 H new ATOM 0 HG3 MET A 45 8.566 3.006 4.047 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.585 0.800 4.982 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.805 1.264 3.772 1.00 0.00 H new ATOM 0 HE3 MET A 45 7.207 0.069 5.028 1.00 0.00 H new ATOM 697 N ARG A 46 8.205 7.816 6.112 1.00 0.00 N ATOM 698 CA ARG A 46 8.566 8.949 6.956 1.00 0.00 C ATOM 699 C ARG A 46 7.326 9.533 7.602 1.00 0.00 C ATOM 700 O ARG A 46 7.275 9.775 8.806 1.00 0.00 O ATOM 701 CB ARG A 46 9.247 10.015 6.129 1.00 0.00 C ATOM 702 CG ARG A 46 10.614 9.603 5.634 1.00 0.00 C ATOM 703 CD ARG A 46 11.232 10.691 4.808 1.00 0.00 C ATOM 704 NE ARG A 46 11.504 11.876 5.619 1.00 0.00 N ATOM 705 CZ ARG A 46 11.390 13.134 5.193 1.00 0.00 C ATOM 706 NH1 ARG A 46 11.051 13.397 3.935 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 11.633 14.133 6.031 1.00 0.00 N ATOM 0 H ARG A 46 8.422 7.943 5.123 1.00 0.00 H new ATOM 0 HA ARG A 46 9.248 8.601 7.732 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.617 10.260 5.274 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.342 10.923 6.725 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.259 9.374 6.482 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.532 8.692 5.041 1.00 0.00 H new ATOM 0 HD2 ARG A 46 12.159 10.331 4.362 1.00 0.00 H new ATOM 0 HD3 ARG A 46 10.564 10.953 3.988 1.00 0.00 H new ATOM 0 HE ARG A 46 11.803 11.730 6.583 1.00 0.00 H new ATOM 0 HH11 ARG A 46 10.875 12.632 3.284 1.00 0.00 H new ATOM 0 HH12 ARG A 46 10.967 14.364 3.621 1.00 0.00 H new ATOM 0 HH21 ARG A 46 11.905 13.936 6.994 1.00 0.00 H new ATOM 0 HH22 ARG A 46 11.548 15.098 5.712 1.00 0.00 H new ATOM 721 N MET A 47 6.329 9.738 6.767 1.00 0.00 N ATOM 722 CA MET A 47 5.017 10.173 7.176 1.00 0.00 C ATOM 723 C MET A 47 4.362 9.153 8.112 1.00 0.00 C ATOM 724 O MET A 47 3.403 9.452 8.823 1.00 0.00 O ATOM 725 CB MET A 47 4.207 10.379 5.903 1.00 0.00 C ATOM 726 CG MET A 47 4.377 11.759 5.300 1.00 0.00 C ATOM 727 SD MET A 47 2.827 12.516 4.777 1.00 0.00 S ATOM 728 CE MET A 47 2.348 11.433 3.442 1.00 0.00 C ATOM 0 H MET A 47 6.415 9.602 5.760 1.00 0.00 H new ATOM 0 HA MET A 47 5.072 11.102 7.743 1.00 0.00 H new ATOM 0 HB2 MET A 47 4.502 9.630 5.168 1.00 0.00 H new ATOM 0 HB3 MET A 47 3.152 10.213 6.121 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.860 12.408 6.030 1.00 0.00 H new ATOM 0 HG3 MET A 47 5.046 11.691 4.442 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.032 12.029 2.586 1.00 0.00 H new ATOM 0 HE2 MET A 47 3.196 10.810 3.157 1.00 0.00 H new ATOM 0 HE3 MET A 47 1.524 10.798 3.766 1.00 0.00 H new ATOM 738 N LEU A 48 4.913 7.954 8.106 1.00 0.00 N ATOM 739 CA LEU A 48 4.434 6.853 8.900 1.00 0.00 C ATOM 740 C LEU A 48 5.256 6.671 10.179 1.00 0.00 C ATOM 741 O LEU A 48 4.900 5.875 11.044 1.00 0.00 O ATOM 742 CB LEU A 48 4.510 5.621 8.029 1.00 0.00 C ATOM 743 CG LEU A 48 3.343 5.415 7.059 1.00 0.00 C ATOM 744 CD1 LEU A 48 3.543 4.137 6.256 1.00 0.00 C ATOM 745 CD2 LEU A 48 2.009 5.363 7.788 1.00 0.00 C ATOM 0 H LEU A 48 5.724 7.719 7.534 1.00 0.00 H new ATOM 0 HA LEU A 48 3.411 7.042 9.226 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.434 5.664 7.452 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.579 4.746 8.676 1.00 0.00 H new ATOM 0 HG LEU A 48 3.324 6.269 6.382 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.706 4.003 5.571 1.00 0.00 H new ATOM 0 HD12 LEU A 48 4.470 4.206 5.687 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.596 3.286 6.934 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.205 5.216 7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.015 4.536 8.498 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.850 6.300 8.322 1.00 0.00 H new ATOM 757 N GLY A 49 6.355 7.408 10.290 1.00 0.00 N ATOM 758 CA GLY A 49 7.177 7.345 11.476 1.00 0.00 C ATOM 759 C GLY A 49 8.480 6.588 11.267 1.00 0.00 C ATOM 760 O GLY A 49 9.382 6.655 12.104 1.00 0.00 O ATOM 0 H GLY A 49 6.690 8.051 9.573 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.403 8.359 11.807 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.612 6.867 12.276 1.00 0.00 H new ATOM 764 N GLN A 50 8.587 5.869 10.157 1.00 0.00 N ATOM 765 CA GLN A 50 9.785 5.108 9.847 1.00 0.00 C ATOM 766 C GLN A 50 10.661 5.870 8.858 1.00 0.00 C ATOM 767 O GLN A 50 10.388 7.026 8.527 1.00 0.00 O ATOM 768 CB GLN A 50 9.429 3.751 9.223 1.00 0.00 C ATOM 769 CG GLN A 50 8.655 2.780 10.117 1.00 0.00 C ATOM 770 CD GLN A 50 7.237 3.214 10.430 1.00 0.00 C ATOM 771 OE1 GLN A 50 6.984 3.850 11.451 1.00 0.00 O ATOM 772 NE2 GLN A 50 6.302 2.883 9.550 1.00 0.00 N ATOM 0 H GLN A 50 7.852 5.798 9.454 1.00 0.00 H new ATOM 0 HA GLN A 50 10.321 4.953 10.783 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.841 3.931 8.323 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.353 3.265 8.908 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.625 1.804 9.633 1.00 0.00 H new ATOM 0 HG3 GLN A 50 9.199 2.655 11.053 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.552 2.354 8.714 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.332 3.157 9.709 1.00 0.00 H new ATOM 781 N ASN A 51 11.728 5.220 8.412 1.00 0.00 N ATOM 782 CA ASN A 51 12.512 5.695 7.277 1.00 0.00 C ATOM 783 C ASN A 51 13.319 4.537 6.673 1.00 0.00 C ATOM 784 O ASN A 51 14.547 4.567 6.633 1.00 0.00 O ATOM 785 CB ASN A 51 13.427 6.874 7.667 1.00 0.00 C ATOM 786 CG ASN A 51 14.484 6.533 8.712 1.00 0.00 C ATOM 787 OD1 ASN A 51 14.290 5.664 9.564 1.00 0.00 O ATOM 788 ND2 ASN A 51 15.607 7.236 8.660 1.00 0.00 N ATOM 0 H ASN A 51 12.074 4.353 8.823 1.00 0.00 H new ATOM 0 HA ASN A 51 11.822 6.069 6.521 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.926 7.243 6.771 1.00 0.00 H new ATOM 0 HB3 ASN A 51 12.809 7.688 8.046 1.00 0.00 H new ATOM 0 HD21 ASN A 51 16.347 7.066 9.341 1.00 0.00 H new ATOM 0 HD22 ASN A 51 15.731 7.947 7.939 1.00 0.00 H new ATOM 795 N PRO A 52 12.620 3.491 6.187 1.00 0.00 N ATOM 796 CA PRO A 52 13.256 2.305 5.605 1.00 0.00 C ATOM 797 C PRO A 52 13.979 2.624 4.306 1.00 0.00 C ATOM 798 O PRO A 52 13.770 3.678 3.704 1.00 0.00 O ATOM 799 CB PRO A 52 12.087 1.353 5.367 1.00 0.00 C ATOM 800 CG PRO A 52 10.903 2.238 5.251 1.00 0.00 C ATOM 801 CD PRO A 52 11.159 3.396 6.151 1.00 0.00 C ATOM 0 HA PRO A 52 14.024 1.886 6.255 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.233 0.765 4.461 1.00 0.00 H new ATOM 0 HB3 PRO A 52 11.976 0.648 6.191 1.00 0.00 H new ATOM 0 HG2 PRO A 52 10.764 2.569 4.222 1.00 0.00 H new ATOM 0 HG3 PRO A 52 9.994 1.712 5.543 1.00 0.00 H new ATOM 0 HD2 PRO A 52 10.708 4.310 5.766 1.00 0.00 H new ATOM 0 HD3 PRO A 52 10.744 3.230 7.145 1.00 0.00 H new ATOM 809 N THR A 53 14.818 1.704 3.869 1.00 0.00 N ATOM 810 CA THR A 53 15.690 1.951 2.733 1.00 0.00 C ATOM 811 C THR A 53 15.015 1.532 1.445 1.00 0.00 C ATOM 812 O THR A 53 14.096 0.722 1.481 1.00 0.00 O ATOM 813 CB THR A 53 17.030 1.195 2.876 1.00 0.00 C ATOM 814 OG1 THR A 53 16.793 -0.191 3.119 1.00 0.00 O ATOM 815 CG2 THR A 53 17.855 1.769 4.010 1.00 0.00 C ATOM 0 H THR A 53 14.915 0.777 4.283 1.00 0.00 H new ATOM 0 HA THR A 53 15.895 3.021 2.707 1.00 0.00 H new ATOM 0 HB THR A 53 17.582 1.312 1.943 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.204 -0.449 3.971 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.793 1.221 4.091 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.065 2.820 3.811 1.00 0.00 H new ATOM 0 HG23 THR A 53 17.301 1.680 4.944 1.00 0.00 H new ATOM 823 N PRO A 54 15.434 2.076 0.290 1.00 0.00 N ATOM 824 CA PRO A 54 14.928 1.630 -1.007 1.00 0.00 C ATOM 825 C PRO A 54 15.006 0.111 -1.138 1.00 0.00 C ATOM 826 O PRO A 54 14.179 -0.509 -1.802 1.00 0.00 O ATOM 827 CB PRO A 54 15.841 2.323 -2.029 1.00 0.00 C ATOM 828 CG PRO A 54 16.929 2.973 -1.241 1.00 0.00 C ATOM 829 CD PRO A 54 16.397 3.175 0.149 1.00 0.00 C ATOM 0 HA PRO A 54 13.878 1.883 -1.151 1.00 0.00 H new ATOM 0 HB2 PRO A 54 16.250 1.602 -2.737 1.00 0.00 H new ATOM 0 HB3 PRO A 54 15.287 3.061 -2.609 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.822 2.348 -1.226 1.00 0.00 H new ATOM 0 HG3 PRO A 54 17.214 3.925 -1.688 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.188 3.119 0.897 1.00 0.00 H new ATOM 0 HD3 PRO A 54 15.920 4.148 0.262 1.00 0.00 H new ATOM 837 N GLU A 55 15.992 -0.477 -0.461 1.00 0.00 N ATOM 838 CA GLU A 55 16.117 -1.923 -0.369 1.00 0.00 C ATOM 839 C GLU A 55 14.870 -2.519 0.269 1.00 0.00 C ATOM 840 O GLU A 55 14.210 -3.378 -0.305 1.00 0.00 O ATOM 841 CB GLU A 55 17.309 -2.258 0.504 1.00 0.00 C ATOM 842 CG GLU A 55 17.777 -3.664 0.354 1.00 0.00 C ATOM 843 CD GLU A 55 18.627 -4.121 1.520 1.00 0.00 C ATOM 844 OE1 GLU A 55 19.843 -3.847 1.505 1.00 0.00 O ATOM 845 OE2 GLU A 55 18.089 -4.744 2.459 1.00 0.00 O1- ATOM 0 H GLU A 55 16.721 0.036 0.035 1.00 0.00 H new ATOM 0 HA GLU A 55 16.244 -2.333 -1.371 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.129 -1.582 0.261 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.047 -2.080 1.547 1.00 0.00 H new ATOM 0 HG2 GLU A 55 16.914 -4.322 0.258 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.351 -3.756 -0.568 1.00 0.00 H new ATOM 852 N GLU A 56 14.556 -2.015 1.450 1.00 0.00 N ATOM 853 CA GLU A 56 13.378 -2.392 2.198 1.00 0.00 C ATOM 854 C GLU A 56 12.101 -2.110 1.419 1.00 0.00 C ATOM 855 O GLU A 56 11.224 -2.961 1.276 1.00 0.00 O ATOM 856 CB GLU A 56 13.389 -1.578 3.483 1.00 0.00 C ATOM 857 CG GLU A 56 14.653 -1.788 4.283 1.00 0.00 C ATOM 858 CD GLU A 56 14.646 -1.092 5.624 1.00 0.00 C ATOM 859 OE1 GLU A 56 15.465 -0.174 5.812 1.00 0.00 O ATOM 860 OE2 GLU A 56 13.838 -1.459 6.499 1.00 0.00 O1- ATOM 0 H GLU A 56 15.129 -1.316 1.923 1.00 0.00 H new ATOM 0 HA GLU A 56 13.396 -3.463 2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.286 -0.520 3.241 1.00 0.00 H new ATOM 0 HB3 GLU A 56 12.527 -1.851 4.091 1.00 0.00 H new ATOM 0 HG2 GLU A 56 14.800 -2.857 4.439 1.00 0.00 H new ATOM 0 HG3 GLU A 56 15.503 -1.430 3.702 1.00 0.00 H new ATOM 867 N LEU A 57 12.031 -0.906 0.902 1.00 0.00 N ATOM 868 CA LEU A 57 10.843 -0.383 0.284 1.00 0.00 C ATOM 869 C LEU A 57 10.496 -1.089 -1.011 1.00 0.00 C ATOM 870 O LEU A 57 9.326 -1.199 -1.370 1.00 0.00 O ATOM 871 CB LEU A 57 11.087 1.093 0.055 1.00 0.00 C ATOM 872 CG LEU A 57 11.347 1.847 1.342 1.00 0.00 C ATOM 873 CD1 LEU A 57 11.781 3.276 1.083 1.00 0.00 C ATOM 874 CD2 LEU A 57 10.113 1.789 2.217 1.00 0.00 C ATOM 0 H LEU A 57 12.815 -0.253 0.901 1.00 0.00 H new ATOM 0 HA LEU A 57 9.985 -0.548 0.936 1.00 0.00 H new ATOM 0 HB2 LEU A 57 11.939 1.217 -0.613 1.00 0.00 H new ATOM 0 HB3 LEU A 57 10.222 1.527 -0.447 1.00 0.00 H new ATOM 0 HG LEU A 57 12.174 1.367 1.865 1.00 0.00 H new ATOM 0 HD11 LEU A 57 11.957 3.781 2.033 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.700 3.277 0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.999 3.800 0.533 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.299 2.331 3.144 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.273 2.244 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.878 0.750 2.446 1.00 0.00 H new ATOM 886 N GLN A 58 11.495 -1.597 -1.701 1.00 0.00 N ATOM 887 CA GLN A 58 11.261 -2.143 -3.020 1.00 0.00 C ATOM 888 C GLN A 58 10.581 -3.490 -2.911 1.00 0.00 C ATOM 889 O GLN A 58 9.844 -3.896 -3.799 1.00 0.00 O ATOM 890 CB GLN A 58 12.559 -2.284 -3.793 1.00 0.00 C ATOM 891 CG GLN A 58 12.341 -2.509 -5.271 1.00 0.00 C ATOM 892 CD GLN A 58 13.613 -2.884 -5.992 1.00 0.00 C ATOM 893 OE1 GLN A 58 14.705 -2.461 -5.614 1.00 0.00 O ATOM 894 NE2 GLN A 58 13.484 -3.688 -7.029 1.00 0.00 N ATOM 0 H GLN A 58 12.461 -1.643 -1.377 1.00 0.00 H new ATOM 0 HA GLN A 58 10.614 -1.452 -3.561 1.00 0.00 H new ATOM 0 HB2 GLN A 58 13.160 -1.385 -3.652 1.00 0.00 H new ATOM 0 HB3 GLN A 58 13.131 -3.117 -3.384 1.00 0.00 H new ATOM 0 HG2 GLN A 58 11.602 -3.298 -5.410 1.00 0.00 H new ATOM 0 HG3 GLN A 58 11.928 -1.604 -5.716 1.00 0.00 H new ATOM 0 HE21 GLN A 58 12.559 -4.015 -7.309 1.00 0.00 H new ATOM 0 HE22 GLN A 58 14.309 -3.983 -7.552 1.00 0.00 H new ATOM 903 N GLU A 59 10.818 -4.160 -1.801 1.00 0.00 N ATOM 904 CA GLU A 59 10.265 -5.481 -1.573 1.00 0.00 C ATOM 905 C GLU A 59 8.839 -5.368 -1.080 1.00 0.00 C ATOM 906 O GLU A 59 7.985 -6.176 -1.429 1.00 0.00 O ATOM 907 CB GLU A 59 11.098 -6.216 -0.565 1.00 0.00 C ATOM 908 CG GLU A 59 12.561 -5.832 -0.622 1.00 0.00 C ATOM 909 CD GLU A 59 13.443 -6.969 -1.071 1.00 0.00 C ATOM 910 OE1 GLU A 59 13.862 -7.782 -0.224 1.00 0.00 O ATOM 911 OE2 GLU A 59 13.725 -7.055 -2.283 1.00 0.00 O1- ATOM 0 H GLU A 59 11.395 -3.808 -1.037 1.00 0.00 H new ATOM 0 HA GLU A 59 10.271 -6.035 -2.512 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.713 -6.014 0.434 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.002 -7.289 -0.733 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.685 -4.990 -1.303 1.00 0.00 H new ATOM 0 HG3 GLU A 59 12.883 -5.495 0.363 1.00 0.00 H new ATOM 918 N MET A 60 8.596 -4.350 -0.269 1.00 0.00 N ATOM 919 CA MET A 60 7.252 -4.054 0.204 1.00 0.00 C ATOM 920 C MET A 60 6.381 -3.602 -0.962 1.00 0.00 C ATOM 921 O MET A 60 5.197 -3.925 -1.037 1.00 0.00 O ATOM 922 CB MET A 60 7.297 -2.986 1.280 1.00 0.00 C ATOM 923 CG MET A 60 6.033 -2.935 2.106 1.00 0.00 C ATOM 924 SD MET A 60 6.359 -2.811 3.871 1.00 0.00 S ATOM 925 CE MET A 60 4.786 -3.356 4.511 1.00 0.00 C ATOM 0 H MET A 60 9.314 -3.713 0.076 1.00 0.00 H new ATOM 0 HA MET A 60 6.820 -4.957 0.635 1.00 0.00 H new ATOM 0 HB2 MET A 60 8.147 -3.173 1.936 1.00 0.00 H new ATOM 0 HB3 MET A 60 7.461 -2.014 0.815 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.433 -2.081 1.791 1.00 0.00 H new ATOM 0 HG3 MET A 60 5.441 -3.830 1.912 1.00 0.00 H new ATOM 0 HE1 MET A 60 4.910 -3.697 5.539 1.00 0.00 H new ATOM 0 HE2 MET A 60 4.077 -2.529 4.486 1.00 0.00 H new ATOM 0 HE3 MET A 60 4.409 -4.176 3.900 1.00 0.00 H new ATOM 935 N ILE A 61 6.991 -2.854 -1.870 1.00 0.00 N ATOM 936 CA ILE A 61 6.373 -2.528 -3.144 1.00 0.00 C ATOM 937 C ILE A 61 6.197 -3.803 -3.961 1.00 0.00 C ATOM 938 O ILE A 61 5.100 -4.111 -4.416 1.00 0.00 O ATOM 939 CB ILE A 61 7.234 -1.486 -3.910 1.00 0.00 C ATOM 940 CG1 ILE A 61 6.833 -0.076 -3.499 1.00 0.00 C ATOM 941 CG2 ILE A 61 7.137 -1.648 -5.420 1.00 0.00 C ATOM 942 CD1 ILE A 61 7.824 0.986 -3.906 1.00 0.00 C ATOM 0 H ILE A 61 7.923 -2.459 -1.744 1.00 0.00 H new ATOM 0 HA ILE A 61 5.392 -2.085 -2.971 1.00 0.00 H new ATOM 0 HB ILE A 61 8.275 -1.662 -3.639 1.00 0.00 H new ATOM 0 HG12 ILE A 61 5.864 0.158 -3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.707 -0.046 -2.417 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.757 -0.896 -5.907 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.484 -2.642 -5.702 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.101 -1.522 -5.734 1.00 0.00 H new ATOM 0 HD11 ILE A 61 7.467 1.962 -3.577 1.00 0.00 H new ATOM 0 HD12 ILE A 61 8.790 0.779 -3.445 1.00 0.00 H new ATOM 0 HD13 ILE A 61 7.933 0.986 -4.991 1.00 0.00 H new ATOM 954 N ASP A 62 7.275 -4.566 -4.077 1.00 0.00 N ATOM 955 CA ASP A 62 7.296 -5.793 -4.872 1.00 0.00 C ATOM 956 C ASP A 62 6.228 -6.769 -4.427 1.00 0.00 C ATOM 957 O ASP A 62 5.689 -7.525 -5.231 1.00 0.00 O ATOM 958 CB ASP A 62 8.633 -6.476 -4.737 1.00 0.00 C ATOM 959 CG ASP A 62 8.852 -7.548 -5.781 1.00 0.00 C ATOM 960 OD1 ASP A 62 8.479 -8.713 -5.530 1.00 0.00 O ATOM 961 OD2 ASP A 62 9.391 -7.231 -6.860 1.00 0.00 O1- ATOM 0 H ASP A 62 8.163 -4.354 -3.623 1.00 0.00 H new ATOM 0 HA ASP A 62 7.110 -5.504 -5.906 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.426 -5.732 -4.815 1.00 0.00 H new ATOM 0 HB3 ASP A 62 8.710 -6.921 -3.745 1.00 0.00 H new ATOM 966 N GLU A 63 5.956 -6.744 -3.133 1.00 0.00 N ATOM 967 CA GLU A 63 4.938 -7.580 -2.519 1.00 0.00 C ATOM 968 C GLU A 63 3.663 -7.586 -3.332 1.00 0.00 C ATOM 969 O GLU A 63 3.092 -8.634 -3.630 1.00 0.00 O ATOM 970 CB GLU A 63 4.614 -7.035 -1.145 1.00 0.00 C ATOM 971 CG GLU A 63 5.203 -7.838 -0.013 1.00 0.00 C ATOM 972 CD GLU A 63 4.606 -7.450 1.319 1.00 0.00 C ATOM 973 OE1 GLU A 63 5.188 -6.607 2.028 1.00 0.00 O ATOM 974 OE2 GLU A 63 3.520 -7.970 1.656 1.00 0.00 O1- ATOM 0 H GLU A 63 6.441 -6.136 -2.472 1.00 0.00 H new ATOM 0 HA GLU A 63 5.327 -8.596 -2.462 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.977 -6.010 -1.077 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.531 -6.998 -1.026 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.032 -8.899 -0.193 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.282 -7.689 0.015 1.00 0.00 H new ATOM 981 N VAL A 64 3.229 -6.403 -3.690 1.00 0.00 N ATOM 982 CA VAL A 64 1.992 -6.247 -4.405 1.00 0.00 C ATOM 983 C VAL A 64 2.244 -5.801 -5.842 1.00 0.00 C ATOM 984 O VAL A 64 1.365 -5.902 -6.693 1.00 0.00 O ATOM 985 CB VAL A 64 1.075 -5.268 -3.662 1.00 0.00 C ATOM 986 CG1 VAL A 64 0.665 -5.865 -2.336 1.00 0.00 C ATOM 987 CG2 VAL A 64 1.761 -3.940 -3.413 1.00 0.00 C ATOM 0 H VAL A 64 3.720 -5.530 -3.495 1.00 0.00 H new ATOM 0 HA VAL A 64 1.489 -7.213 -4.452 1.00 0.00 H new ATOM 0 HB VAL A 64 0.200 -5.092 -4.288 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.013 -5.168 -1.809 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.133 -6.801 -2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.553 -6.058 -1.734 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.080 -3.272 -2.885 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.654 -4.100 -2.809 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.042 -3.492 -4.366 1.00 0.00 H new ATOM 997 N ASP A 65 3.463 -5.333 -6.102 1.00 0.00 N ATOM 998 CA ASP A 65 3.904 -5.002 -7.457 1.00 0.00 C ATOM 999 C ASP A 65 3.939 -6.274 -8.290 1.00 0.00 C ATOM 1000 O ASP A 65 4.811 -7.127 -8.106 1.00 0.00 O ATOM 1001 CB ASP A 65 5.307 -4.373 -7.429 1.00 0.00 C ATOM 1002 CG ASP A 65 5.771 -3.841 -8.781 1.00 0.00 C ATOM 1003 OD1 ASP A 65 6.749 -3.062 -8.816 1.00 0.00 O ATOM 1004 OD2 ASP A 65 5.180 -4.208 -9.816 1.00 0.00 O1- ATOM 0 H ASP A 65 4.170 -5.173 -5.384 1.00 0.00 H new ATOM 0 HA ASP A 65 3.208 -4.285 -7.892 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.315 -3.557 -6.706 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.022 -5.117 -7.077 1.00 0.00 H new ATOM 1009 N GLU A 66 2.988 -6.397 -9.200 1.00 0.00 N ATOM 1010 CA GLU A 66 2.848 -7.599 -10.000 1.00 0.00 C ATOM 1011 C GLU A 66 4.047 -7.813 -10.913 1.00 0.00 C ATOM 1012 O GLU A 66 4.502 -8.941 -11.087 1.00 0.00 O ATOM 1013 CB GLU A 66 1.563 -7.552 -10.817 1.00 0.00 C ATOM 1014 CG GLU A 66 0.316 -7.585 -9.969 1.00 0.00 C ATOM 1015 CD GLU A 66 -0.954 -7.505 -10.789 1.00 0.00 C ATOM 1016 OE1 GLU A 66 -1.471 -8.563 -11.194 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -1.438 -6.385 -11.034 1.00 0.00 O1- ATOM 0 H GLU A 66 2.298 -5.674 -9.403 1.00 0.00 H new ATOM 0 HA GLU A 66 2.800 -8.444 -9.313 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.558 -6.646 -11.423 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.548 -8.396 -11.506 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.306 -8.503 -9.381 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.340 -6.755 -9.263 1.00 0.00 H new ATOM 1024 N ASP A 67 4.582 -6.737 -11.475 1.00 0.00 N ATOM 1025 CA ASP A 67 5.667 -6.862 -12.438 1.00 0.00 C ATOM 1026 C ASP A 67 7.033 -6.725 -11.782 1.00 0.00 C ATOM 1027 O ASP A 67 8.060 -6.952 -12.422 1.00 0.00 O ATOM 1028 CB ASP A 67 5.526 -5.817 -13.543 1.00 0.00 C ATOM 1029 CG ASP A 67 4.497 -6.203 -14.585 1.00 0.00 C ATOM 1030 OD1 ASP A 67 3.388 -5.624 -14.579 1.00 0.00 O ATOM 1031 OD2 ASP A 67 4.793 -7.084 -15.418 1.00 0.00 O1- ATOM 0 H ASP A 67 4.287 -5.780 -11.284 1.00 0.00 H new ATOM 0 HA ASP A 67 5.597 -7.862 -12.867 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.247 -4.861 -13.100 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.492 -5.674 -14.028 1.00 0.00 H new ATOM 1036 N GLY A 68 7.048 -6.358 -10.507 1.00 0.00 N ATOM 1037 CA GLY A 68 8.304 -6.268 -9.784 1.00 0.00 C ATOM 1038 C GLY A 68 9.121 -5.070 -10.225 1.00 0.00 C ATOM 1039 O GLY A 68 10.339 -5.040 -10.063 1.00 0.00 O ATOM 0 H GLY A 68 6.219 -6.122 -9.962 1.00 0.00 H new ATOM 0 HA2 GLY A 68 8.104 -6.198 -8.715 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.881 -7.179 -9.942 1.00 0.00 H new ATOM 1043 N SER A 69 8.433 -4.074 -10.763 1.00 0.00 N ATOM 1044 CA SER A 69 9.067 -2.929 -11.406 1.00 0.00 C ATOM 1045 C SER A 69 9.705 -1.966 -10.413 1.00 0.00 C ATOM 1046 O SER A 69 10.399 -1.025 -10.797 1.00 0.00 O ATOM 1047 CB SER A 69 8.024 -2.193 -12.232 1.00 0.00 C ATOM 1048 OG SER A 69 6.921 -1.795 -11.425 1.00 0.00 O ATOM 0 H SER A 69 7.414 -4.036 -10.767 1.00 0.00 H new ATOM 0 HA SER A 69 9.872 -3.308 -12.036 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.475 -1.316 -12.696 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.675 -2.836 -13.040 1.00 0.00 H new ATOM 0 HG SER A 69 7.031 -0.858 -11.160 1.00 0.00 H new ATOM 1054 N GLY A 70 9.468 -2.206 -9.146 1.00 0.00 N ATOM 1055 CA GLY A 70 9.943 -1.299 -8.123 1.00 0.00 C ATOM 1056 C GLY A 70 8.989 -0.145 -7.941 1.00 0.00 C ATOM 1057 O GLY A 70 9.337 0.881 -7.354 1.00 0.00 O ATOM 0 H GLY A 70 8.953 -3.015 -8.798 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.056 -1.835 -7.180 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.929 -0.922 -8.395 1.00 0.00 H new ATOM 1061 N THR A 71 7.777 -0.327 -8.449 1.00 0.00 N ATOM 1062 CA THR A 71 6.738 0.676 -8.354 1.00 0.00 C ATOM 1063 C THR A 71 5.371 0.049 -8.219 1.00 0.00 C ATOM 1064 O THR A 71 4.976 -0.826 -8.989 1.00 0.00 O ATOM 1065 CB THR A 71 6.737 1.618 -9.564 1.00 0.00 C ATOM 1066 OG1 THR A 71 7.258 0.946 -10.722 1.00 0.00 O ATOM 1067 CG2 THR A 71 7.544 2.866 -9.276 1.00 0.00 C ATOM 0 H THR A 71 7.492 -1.176 -8.937 1.00 0.00 H new ATOM 0 HA THR A 71 6.958 1.255 -7.457 1.00 0.00 H new ATOM 0 HB THR A 71 5.707 1.914 -9.763 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.250 1.559 -11.487 1.00 0.00 H new ATOM 0 HG21 THR A 71 7.529 3.519 -10.149 1.00 0.00 H new ATOM 0 HG22 THR A 71 7.112 3.390 -8.423 1.00 0.00 H new ATOM 0 HG23 THR A 71 8.573 2.589 -9.048 1.00 0.00 H new ATOM 1075 N VAL A 72 4.648 0.542 -7.254 1.00 0.00 N ATOM 1076 CA VAL A 72 3.335 0.063 -6.959 1.00 0.00 C ATOM 1077 C VAL A 72 2.307 1.055 -7.464 1.00 0.00 C ATOM 1078 O VAL A 72 2.306 2.221 -7.080 1.00 0.00 O ATOM 1079 CB VAL A 72 3.200 -0.186 -5.443 1.00 0.00 C ATOM 1080 CG1 VAL A 72 1.845 0.233 -4.918 1.00 0.00 C ATOM 1081 CG2 VAL A 72 3.436 -1.652 -5.149 1.00 0.00 C ATOM 0 H VAL A 72 4.961 1.297 -6.644 1.00 0.00 H new ATOM 0 HA VAL A 72 3.160 -0.886 -7.466 1.00 0.00 H new ATOM 0 HB VAL A 72 3.949 0.422 -4.936 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.794 0.040 -3.846 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.697 1.297 -5.102 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.066 -0.335 -5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.341 -1.828 -4.078 1.00 0.00 H new ATOM 0 HG22 VAL A 72 2.700 -2.253 -5.683 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.438 -1.932 -5.475 1.00 0.00 H new ATOM 1091 N ASP A 73 1.474 0.604 -8.368 1.00 0.00 N ATOM 1092 CA ASP A 73 0.416 1.441 -8.880 1.00 0.00 C ATOM 1093 C ASP A 73 -0.870 1.085 -8.137 1.00 0.00 C ATOM 1094 O ASP A 73 -0.819 0.360 -7.146 1.00 0.00 O ATOM 1095 CB ASP A 73 0.311 1.281 -10.401 1.00 0.00 C ATOM 1096 CG ASP A 73 -0.652 2.244 -11.067 1.00 0.00 C ATOM 1097 OD1 ASP A 73 -1.841 1.896 -11.213 1.00 0.00 O ATOM 1098 OD2 ASP A 73 -0.218 3.345 -11.460 1.00 0.00 O1- ATOM 0 H ASP A 73 1.507 -0.335 -8.764 1.00 0.00 H new ATOM 0 HA ASP A 73 0.620 2.498 -8.706 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.301 1.416 -10.837 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -0.000 0.261 -10.626 1.00 0.00 H new ATOM 1103 N PHE A 74 -2.001 1.577 -8.603 1.00 0.00 N ATOM 1104 CA PHE A 74 -3.244 1.517 -7.832 1.00 0.00 C ATOM 1105 C PHE A 74 -3.612 0.094 -7.408 1.00 0.00 C ATOM 1106 O PHE A 74 -3.763 -0.171 -6.220 1.00 0.00 O ATOM 1107 CB PHE A 74 -4.400 2.144 -8.613 1.00 0.00 C ATOM 1108 CG PHE A 74 -5.735 2.011 -7.930 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -5.850 2.112 -6.546 1.00 0.00 C ATOM 1110 CD2 PHE A 74 -6.878 1.787 -8.679 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -7.081 1.987 -5.935 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -8.110 1.664 -8.070 1.00 0.00 C ATOM 1113 CZ PHE A 74 -8.212 1.763 -6.698 1.00 0.00 C ATOM 0 H PHE A 74 -2.093 2.026 -9.514 1.00 0.00 H new ATOM 0 HA PHE A 74 -3.068 2.091 -6.922 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -4.188 3.201 -8.773 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.457 1.678 -9.597 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -4.969 2.289 -5.946 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -6.804 1.708 -9.754 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.161 2.064 -4.861 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -8.993 1.490 -8.667 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.175 1.666 -6.220 1.00 0.00 H new ATOM 1123 N ASP A 75 -3.755 -0.810 -8.364 1.00 0.00 N ATOM 1124 CA ASP A 75 -4.256 -2.151 -8.065 1.00 0.00 C ATOM 1125 C ASP A 75 -3.274 -2.910 -7.176 1.00 0.00 C ATOM 1126 O ASP A 75 -3.683 -3.566 -6.219 1.00 0.00 O ATOM 1127 CB ASP A 75 -4.513 -2.913 -9.360 1.00 0.00 C ATOM 1128 CG ASP A 75 -5.442 -4.093 -9.178 1.00 0.00 C ATOM 1129 OD1 ASP A 75 -6.649 -3.869 -8.932 1.00 0.00 O ATOM 1130 OD2 ASP A 75 -4.990 -5.243 -9.327 1.00 0.00 O1- ATOM 0 H ASP A 75 -3.535 -0.647 -9.346 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.197 -2.059 -7.522 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.939 -2.232 -10.097 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.563 -3.264 -9.763 1.00 0.00 H new ATOM 1135 N GLU A 76 -1.980 -2.812 -7.490 1.00 0.00 N ATOM 1136 CA GLU A 76 -0.935 -3.302 -6.614 1.00 0.00 C ATOM 1137 C GLU A 76 -1.110 -2.779 -5.198 1.00 0.00 C ATOM 1138 O GLU A 76 -1.208 -3.544 -4.237 1.00 0.00 O ATOM 1139 CB GLU A 76 0.387 -2.850 -7.153 1.00 0.00 C ATOM 1140 CG GLU A 76 0.627 -3.327 -8.559 1.00 0.00 C ATOM 1141 CD GLU A 76 0.261 -2.309 -9.612 1.00 0.00 C ATOM 1142 OE1 GLU A 76 1.187 -1.700 -10.187 1.00 0.00 O ATOM 1143 OE2 GLU A 76 -0.943 -2.108 -9.866 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.638 -2.392 -8.354 1.00 0.00 H new ATOM 0 HA GLU A 76 -0.986 -4.390 -6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.433 -1.761 -7.129 1.00 0.00 H new ATOM 0 HB3 GLU A 76 1.184 -3.217 -6.507 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.679 -3.591 -8.670 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.051 -4.237 -8.729 1.00 0.00 H new ATOM 1150 N PHE A 77 -1.183 -1.463 -5.089 1.00 0.00 N ATOM 1151 CA PHE A 77 -1.324 -0.796 -3.810 1.00 0.00 C ATOM 1152 C PHE A 77 -2.581 -1.250 -3.093 1.00 0.00 C ATOM 1153 O PHE A 77 -2.565 -1.499 -1.890 1.00 0.00 O ATOM 1154 CB PHE A 77 -1.368 0.706 -4.031 1.00 0.00 C ATOM 1155 CG PHE A 77 -1.590 1.487 -2.793 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -2.844 1.936 -2.515 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -0.553 1.778 -1.926 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -3.090 2.681 -1.382 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -0.783 2.517 -0.788 1.00 0.00 C ATOM 1160 CZ PHE A 77 -2.055 2.972 -0.515 1.00 0.00 C ATOM 0 H PHE A 77 -1.146 -0.828 -5.887 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.469 -1.054 -3.186 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.430 1.024 -4.487 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.162 0.936 -4.742 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.655 1.706 -3.190 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.444 1.423 -2.143 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.088 3.036 -1.173 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.029 2.739 -0.112 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.242 3.555 0.375 1.00 0.00 H new ATOM 1170 N LEU A 78 -3.665 -1.351 -3.837 1.00 0.00 N ATOM 1171 CA LEU A 78 -4.925 -1.787 -3.291 1.00 0.00 C ATOM 1172 C LEU A 78 -4.800 -3.192 -2.727 1.00 0.00 C ATOM 1173 O LEU A 78 -5.327 -3.471 -1.659 1.00 0.00 O ATOM 1174 CB LEU A 78 -5.996 -1.709 -4.368 1.00 0.00 C ATOM 1175 CG LEU A 78 -7.427 -1.929 -3.898 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -7.640 -1.365 -2.512 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -8.355 -1.230 -4.844 1.00 0.00 C ATOM 0 H LEU A 78 -3.692 -1.133 -4.833 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.215 -1.132 -2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -5.936 -0.730 -4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -5.768 -2.449 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.623 -3.001 -3.873 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.671 -1.537 -2.204 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.965 -1.856 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.438 -0.294 -2.520 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.385 -1.379 -4.520 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.128 -0.164 -4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.228 -1.638 -5.847 1.00 0.00 H new ATOM 1189 N VAL A 79 -4.087 -4.063 -3.432 1.00 0.00 N ATOM 1190 CA VAL A 79 -3.742 -5.371 -2.882 1.00 0.00 C ATOM 1191 C VAL A 79 -3.048 -5.197 -1.540 1.00 0.00 C ATOM 1192 O VAL A 79 -3.433 -5.812 -0.545 1.00 0.00 O ATOM 1193 CB VAL A 79 -2.798 -6.164 -3.812 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -2.227 -7.377 -3.098 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -3.520 -6.601 -5.064 1.00 0.00 C ATOM 0 H VAL A 79 -3.739 -3.891 -4.375 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.673 -5.927 -2.774 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.977 -5.503 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.565 -7.919 -3.774 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.665 -7.053 -2.222 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -3.041 -8.031 -2.785 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.835 -7.158 -5.704 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.363 -7.237 -4.795 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -3.884 -5.724 -5.599 1.00 0.00 H new ATOM 1205 N MET A 80 -2.032 -4.340 -1.521 1.00 0.00 N ATOM 1206 CA MET A 80 -1.254 -4.096 -0.313 1.00 0.00 C ATOM 1207 C MET A 80 -2.147 -3.611 0.804 1.00 0.00 C ATOM 1208 O MET A 80 -1.976 -3.987 1.963 1.00 0.00 O ATOM 1209 CB MET A 80 -0.145 -3.082 -0.565 1.00 0.00 C ATOM 1210 CG MET A 80 0.707 -2.836 0.662 1.00 0.00 C ATOM 1211 SD MET A 80 2.300 -2.071 0.302 1.00 0.00 S ATOM 1212 CE MET A 80 1.821 -0.368 0.034 1.00 0.00 C ATOM 0 H MET A 80 -1.728 -3.801 -2.332 1.00 0.00 H new ATOM 0 HA MET A 80 -0.796 -5.041 -0.020 1.00 0.00 H new ATOM 0 HB2 MET A 80 0.489 -3.436 -1.378 1.00 0.00 H new ATOM 0 HB3 MET A 80 -0.586 -2.140 -0.892 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.156 -2.198 1.353 1.00 0.00 H new ATOM 0 HG3 MET A 80 0.877 -3.785 1.171 1.00 0.00 H new ATOM 0 HE1 MET A 80 2.713 0.256 -0.022 1.00 0.00 H new ATOM 0 HE2 MET A 80 1.263 -0.289 -0.899 1.00 0.00 H new ATOM 0 HE3 MET A 80 1.195 -0.032 0.860 1.00 0.00 H new ATOM 1222 N MET A 81 -3.109 -2.792 0.436 1.00 0.00 N ATOM 1223 CA MET A 81 -4.036 -2.232 1.361 1.00 0.00 C ATOM 1224 C MET A 81 -4.861 -3.300 2.066 1.00 0.00 C ATOM 1225 O MET A 81 -5.028 -3.243 3.279 1.00 0.00 O ATOM 1226 CB MET A 81 -4.906 -1.246 0.606 1.00 0.00 C ATOM 1227 CG MET A 81 -4.216 0.083 0.366 1.00 0.00 C ATOM 1228 SD MET A 81 -3.498 0.774 1.870 1.00 0.00 S ATOM 1229 CE MET A 81 -1.814 0.163 1.761 1.00 0.00 C ATOM 0 H MET A 81 -3.260 -2.501 -0.530 1.00 0.00 H new ATOM 0 HA MET A 81 -3.497 -1.716 2.155 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.192 -1.680 -0.352 1.00 0.00 H new ATOM 0 HB3 MET A 81 -5.826 -1.077 1.166 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.432 -0.049 -0.379 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.934 0.791 -0.048 1.00 0.00 H new ATOM 0 HE1 MET A 81 -1.571 -0.398 2.663 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.719 -0.488 0.892 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.128 1.004 1.661 1.00 0.00 H new ATOM 1239 N VAL A 82 -5.351 -4.289 1.319 1.00 0.00 N ATOM 1240 CA VAL A 82 -6.125 -5.374 1.923 1.00 0.00 C ATOM 1241 C VAL A 82 -5.222 -6.260 2.788 1.00 0.00 C ATOM 1242 O VAL A 82 -5.671 -6.863 3.767 1.00 0.00 O ATOM 1243 CB VAL A 82 -6.868 -6.261 0.885 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -6.747 -5.720 -0.526 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -6.383 -7.694 0.945 1.00 0.00 C ATOM 0 H VAL A 82 -5.229 -4.362 0.309 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.885 -4.890 2.536 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.924 -6.238 1.154 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.282 -6.374 -1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.176 -4.719 -0.570 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -5.696 -5.677 -0.810 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.920 -8.291 0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.315 -7.726 0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.564 -8.098 1.941 1.00 0.00 H new ATOM 1255 N ARG A 83 -3.950 -6.331 2.420 1.00 0.00 N ATOM 1256 CA ARG A 83 -2.996 -7.169 3.132 1.00 0.00 C ATOM 1257 C ARG A 83 -2.766 -6.620 4.534 1.00 0.00 C ATOM 1258 O ARG A 83 -2.676 -7.376 5.498 1.00 0.00 O ATOM 1259 CB ARG A 83 -1.681 -7.263 2.344 1.00 0.00 C ATOM 1260 CG ARG A 83 -1.871 -7.864 0.962 1.00 0.00 C ATOM 1261 CD ARG A 83 -0.620 -7.785 0.098 1.00 0.00 C ATOM 1262 NE ARG A 83 0.469 -8.631 0.587 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.307 -9.298 -0.213 1.00 0.00 C ATOM 1264 NH1 ARG A 83 1.166 -9.237 -1.532 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 83 2.290 -10.018 0.305 1.00 0.00 N ATOM 0 H ARG A 83 -3.555 -5.818 1.632 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.401 -8.177 3.226 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.248 -6.268 2.247 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.968 -7.868 2.904 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -2.169 -8.907 1.064 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.687 -7.347 0.457 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -0.871 -8.078 -0.921 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -0.278 -6.751 0.057 1.00 0.00 H new ATOM 0 HE ARG A 83 0.596 -8.717 1.595 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.415 -8.679 -1.939 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.808 -9.748 -2.138 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.409 -10.065 1.317 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.928 -10.526 -0.308 1.00 0.00 H new ATOM 1279 N SER A 84 -2.676 -5.305 4.635 1.00 0.00 N ATOM 1280 CA SER A 84 -2.574 -4.639 5.926 1.00 0.00 C ATOM 1281 C SER A 84 -3.957 -4.500 6.582 1.00 0.00 C ATOM 1282 O SER A 84 -4.073 -4.152 7.761 1.00 0.00 O ATOM 1283 CB SER A 84 -1.923 -3.272 5.736 1.00 0.00 C ATOM 1284 OG SER A 84 -0.675 -3.392 5.066 1.00 0.00 O ATOM 0 H SER A 84 -2.671 -4.673 3.835 1.00 0.00 H new ATOM 0 HA SER A 84 -1.955 -5.241 6.591 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.587 -2.625 5.163 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.775 -2.797 6.706 1.00 0.00 H new ATOM 0 HG SER A 84 0.015 -2.916 5.573 1.00 0.00 H new ATOM 1290 N MET A 85 -4.996 -4.751 5.795 1.00 0.00 N ATOM 1291 CA MET A 85 -6.372 -4.668 6.230 1.00 0.00 C ATOM 1292 C MET A 85 -6.778 -5.858 7.095 1.00 0.00 C ATOM 1293 O MET A 85 -7.109 -5.689 8.269 1.00 0.00 O ATOM 1294 CB MET A 85 -7.239 -4.637 4.986 1.00 0.00 C ATOM 1295 CG MET A 85 -7.734 -3.267 4.585 1.00 0.00 C ATOM 1296 SD MET A 85 -9.430 -3.301 3.966 1.00 0.00 S ATOM 1297 CE MET A 85 -9.246 -4.390 2.557 1.00 0.00 C ATOM 0 H MET A 85 -4.896 -5.023 4.817 1.00 0.00 H new ATOM 0 HA MET A 85 -6.497 -3.772 6.838 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.672 -5.059 4.156 1.00 0.00 H new ATOM 0 HB3 MET A 85 -8.100 -5.285 5.146 1.00 0.00 H new ATOM 0 HG2 MET A 85 -7.677 -2.598 5.443 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.078 -2.857 3.817 1.00 0.00 H new ATOM 0 HE1 MET A 85 -10.228 -4.613 2.139 1.00 0.00 H new ATOM 0 HE2 MET A 85 -8.631 -3.904 1.800 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.767 -5.317 2.874 1.00 0.00 H new ATOM 1307 N LYS A 86 -6.751 -7.056 6.504 1.00 0.00 N ATOM 1308 CA LYS A 86 -7.254 -8.261 7.171 1.00 0.00 C ATOM 1309 C LYS A 86 -6.487 -8.521 8.458 1.00 0.00 C ATOM 1310 O LYS A 86 -7.054 -8.939 9.466 1.00 0.00 O ATOM 1311 CB LYS A 86 -7.121 -9.494 6.265 1.00 0.00 C ATOM 1312 CG LYS A 86 -8.326 -10.423 6.317 1.00 0.00 C ATOM 1313 CD LYS A 86 -9.571 -9.757 5.753 1.00 0.00 C ATOM 1314 CE LYS A 86 -10.795 -10.652 5.882 1.00 0.00 C ATOM 1315 NZ LYS A 86 -10.649 -11.921 5.119 1.00 0.00 N1+ ATOM 0 H LYS A 86 -6.386 -7.218 5.565 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.307 -8.090 7.395 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.971 -9.164 5.237 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.230 -10.052 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -8.111 -11.331 5.753 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.509 -10.725 7.348 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.750 -8.818 6.276 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -9.409 -9.511 4.704 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.966 -10.881 6.934 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -11.674 -10.115 5.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.553 -12.435 5.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.378 -11.707 4.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.914 -12.509 5.561 1.00 0.00 H new ATOM 1329 N ASP A 87 -5.199 -8.251 8.406 1.00 0.00 N ATOM 1330 CA ASP A 87 -4.293 -8.534 9.501 1.00 0.00 C ATOM 1331 C ASP A 87 -3.123 -7.570 9.418 1.00 0.00 C ATOM 1332 O ASP A 87 -2.970 -6.893 8.404 1.00 0.00 O ATOM 1333 CB ASP A 87 -3.813 -9.989 9.399 1.00 0.00 C ATOM 1334 CG ASP A 87 -2.758 -10.356 10.417 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -1.605 -10.620 10.007 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -3.065 -10.382 11.622 1.00 0.00 O1- ATOM 0 H ASP A 87 -4.747 -7.826 7.596 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.794 -8.406 10.460 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.669 -10.653 9.521 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -3.415 -10.161 8.399 1.00 0.00 H new ATOM 1341 N ASP A 88 -2.303 -7.491 10.457 1.00 0.00 N ATOM 1342 CA ASP A 88 -1.140 -6.615 10.416 1.00 0.00 C ATOM 1343 C ASP A 88 -0.161 -7.094 9.352 1.00 0.00 C ATOM 1344 O ASP A 88 0.672 -6.326 8.865 1.00 0.00 O ATOM 1345 CB ASP A 88 -0.435 -6.534 11.776 1.00 0.00 C ATOM 1346 CG ASP A 88 0.302 -7.804 12.160 1.00 0.00 C ATOM 1347 OD1 ASP A 88 1.459 -7.986 11.718 1.00 0.00 O ATOM 1348 OD2 ASP A 88 -0.253 -8.613 12.931 1.00 0.00 O1- ATOM 0 H ASP A 88 -2.418 -8.014 11.325 1.00 0.00 H new ATOM 0 HA ASP A 88 -1.492 -5.614 10.165 1.00 0.00 H new ATOM 0 HB2 ASP A 88 0.273 -5.705 11.759 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -1.174 -6.307 12.545 1.00 0.00 H new ATOM 1353 N SER A 89 -0.261 -8.367 8.996 1.00 0.00 N ATOM 1354 CA SER A 89 0.596 -8.921 7.976 1.00 0.00 C ATOM 1355 C SER A 89 -0.185 -9.714 6.926 1.00 0.00 C ATOM 1356 O SER A 89 0.164 -9.697 5.746 1.00 0.00 O ATOM 1357 CB SER A 89 1.663 -9.793 8.613 1.00 0.00 C ATOM 1358 OG SER A 89 2.468 -9.048 9.518 1.00 0.00 O ATOM 0 H SER A 89 -0.926 -9.027 9.400 1.00 0.00 H new ATOM 0 HA SER A 89 1.069 -8.087 7.458 1.00 0.00 H new ATOM 0 HB2 SER A 89 1.191 -10.622 9.141 1.00 0.00 H new ATOM 0 HB3 SER A 89 2.292 -10.227 7.836 1.00 0.00 H new ATOM 0 HG SER A 89 1.951 -8.846 10.326 1.00 0.00 H new ATOM 1364 N LYS A 90 -1.232 -10.409 7.369 1.00 0.00 N ATOM 1365 CA LYS A 90 -2.037 -11.283 6.505 1.00 0.00 C ATOM 1366 C LYS A 90 -1.235 -12.513 6.103 1.00 0.00 C ATOM 1367 O LYS A 90 -1.417 -13.591 6.661 1.00 0.00 O ATOM 1368 CB LYS A 90 -2.534 -10.552 5.248 1.00 0.00 C ATOM 1369 CG LYS A 90 -4.045 -10.376 5.186 1.00 0.00 C ATOM 1370 CD LYS A 90 -4.788 -11.708 5.245 1.00 0.00 C ATOM 1371 CE LYS A 90 -4.427 -12.613 4.099 1.00 0.00 C ATOM 1372 NZ LYS A 90 -4.919 -13.999 4.321 1.00 0.00 N1+ ATOM 0 H LYS A 90 -1.549 -10.384 8.338 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.911 -11.589 7.080 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.063 -9.570 5.202 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.207 -11.104 4.367 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.369 -9.745 6.014 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -4.310 -9.855 4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.559 -12.208 6.186 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -5.862 -11.523 5.235 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.851 -12.219 3.176 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.345 -12.626 3.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.447 -14.645 3.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.707 -14.290 5.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.947 -14.032 4.165 1.00 0.00 H new ATOM 1386 N GLY A 136 -0.336 -12.325 5.151 1.00 0.00 N ATOM 1387 CA GLY A 136 0.518 -13.396 4.688 1.00 0.00 C ATOM 1388 C GLY A 136 1.828 -12.850 4.178 1.00 0.00 C ATOM 1389 O GLY A 136 2.292 -13.216 3.099 1.00 0.00 O ATOM 0 H GLY A 136 -0.181 -11.432 4.683 1.00 0.00 H new ATOM 0 HA2 GLY A 136 0.703 -14.098 5.501 1.00 0.00 H new ATOM 0 HA3 GLY A 136 0.016 -13.951 3.895 1.00 0.00 H new ATOM 1393 N LYS A 137 2.412 -11.947 4.954 1.00 0.00 N ATOM 1394 CA LYS A 137 3.658 -11.299 4.575 1.00 0.00 C ATOM 1395 C LYS A 137 4.854 -12.084 5.088 1.00 0.00 C ATOM 1396 O LYS A 137 5.164 -13.162 4.568 1.00 0.00 O ATOM 1397 CB LYS A 137 3.709 -9.873 5.119 1.00 0.00 C ATOM 1398 CG LYS A 137 2.726 -8.918 4.460 1.00 0.00 C ATOM 1399 CD LYS A 137 2.689 -7.576 5.177 1.00 0.00 C ATOM 1400 CE LYS A 137 1.917 -6.532 4.388 1.00 0.00 C ATOM 1401 NZ LYS A 137 2.671 -6.084 3.187 1.00 0.00 N1+ ATOM 0 H LYS A 137 2.039 -11.646 5.855 1.00 0.00 H new ATOM 0 HA LYS A 137 3.699 -11.267 3.486 1.00 0.00 H new ATOM 0 HB2 LYS A 137 3.511 -9.898 6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 137 4.719 -9.483 4.990 1.00 0.00 H new ATOM 0 HG2 LYS A 137 3.006 -8.767 3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 137 1.730 -9.361 4.462 1.00 0.00 H new ATOM 0 HD2 LYS A 137 2.231 -7.701 6.158 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.708 -7.225 5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 137 0.956 -6.944 4.082 1.00 0.00 H new ATOM 0 HE3 LYS A 137 1.707 -5.674 5.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.348 -5.135 2.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 3.687 -6.053 3.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 2.506 -6.749 2.405 1.00 0.00 H new ATOM 1415 N PHE A 138 5.500 -11.552 6.133 1.00 0.00 N ATOM 1416 CA PHE A 138 6.697 -12.155 6.702 1.00 0.00 C ATOM 1417 C PHE A 138 7.753 -12.310 5.600 1.00 0.00 C ATOM 1418 O PHE A 138 7.670 -11.628 4.577 1.00 0.00 O ATOM 1419 CB PHE A 138 6.313 -13.496 7.345 1.00 0.00 C ATOM 1420 CG PHE A 138 7.368 -14.109 8.223 1.00 0.00 C ATOM 1421 CD1 PHE A 138 7.777 -15.415 8.021 1.00 0.00 C ATOM 1422 CD2 PHE A 138 7.950 -13.378 9.247 1.00 0.00 C ATOM 1423 CE1 PHE A 138 8.744 -15.986 8.825 1.00 0.00 C ATOM 1424 CE2 PHE A 138 8.919 -13.943 10.053 1.00 0.00 C ATOM 1425 CZ PHE A 138 9.315 -15.249 9.842 1.00 0.00 C ATOM 0 H PHE A 138 5.204 -10.695 6.601 1.00 0.00 H new ATOM 0 HA PHE A 138 7.129 -11.525 7.479 1.00 0.00 H new ATOM 0 HB2 PHE A 138 5.409 -13.352 7.937 1.00 0.00 H new ATOM 0 HB3 PHE A 138 6.066 -14.203 6.553 1.00 0.00 H new ATOM 0 HD1 PHE A 138 7.335 -15.995 7.225 1.00 0.00 H new ATOM 0 HD2 PHE A 138 7.643 -12.357 9.416 1.00 0.00 H new ATOM 0 HE1 PHE A 138 9.053 -17.007 8.658 1.00 0.00 H new ATOM 0 HE2 PHE A 138 9.366 -13.364 10.847 1.00 0.00 H new ATOM 0 HZ PHE A 138 10.071 -15.693 10.473 1.00 0.00 H new ATOM 1435 N LYS A 139 8.752 -13.163 5.814 1.00 0.00 N ATOM 1436 CA LYS A 139 9.739 -13.478 4.781 1.00 0.00 C ATOM 1437 C LYS A 139 10.482 -12.246 4.277 1.00 0.00 C ATOM 1438 O LYS A 139 10.542 -11.215 4.943 1.00 0.00 O ATOM 1439 CB LYS A 139 9.047 -14.156 3.599 1.00 0.00 C ATOM 1440 CG LYS A 139 8.622 -15.583 3.874 1.00 0.00 C ATOM 1441 CD LYS A 139 8.065 -16.232 2.623 1.00 0.00 C ATOM 1442 CE LYS A 139 6.760 -15.580 2.210 1.00 0.00 C ATOM 1443 NZ LYS A 139 6.229 -16.140 0.942 1.00 0.00 N1+ ATOM 0 H LYS A 139 8.901 -13.651 6.697 1.00 0.00 H new ATOM 0 HA LYS A 139 10.473 -14.143 5.237 1.00 0.00 H new ATOM 0 HB2 LYS A 139 8.169 -13.573 3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 139 9.720 -14.146 2.742 1.00 0.00 H new ATOM 0 HG2 LYS A 139 9.474 -16.157 4.238 1.00 0.00 H new ATOM 0 HG3 LYS A 139 7.869 -15.597 4.662 1.00 0.00 H new ATOM 0 HD2 LYS A 139 8.789 -16.150 1.813 1.00 0.00 H new ATOM 0 HD3 LYS A 139 7.905 -17.295 2.801 1.00 0.00 H new ATOM 0 HE2 LYS A 139 6.023 -15.714 3.001 1.00 0.00 H new ATOM 0 HE3 LYS A 139 6.913 -14.507 2.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 5.337 -15.664 0.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 6.920 -15.989 0.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 6.058 -17.159 1.057 1.00 0.00 H new ATOM 1457 N ARG A 140 11.074 -12.398 3.106 1.00 0.00 N ATOM 1458 CA ARG A 140 11.712 -11.303 2.393 1.00 0.00 C ATOM 1459 C ARG A 140 10.761 -10.118 2.145 1.00 0.00 C ATOM 1460 O ARG A 140 11.131 -8.984 2.431 1.00 0.00 O ATOM 1461 CB ARG A 140 12.248 -11.820 1.067 1.00 0.00 C ATOM 1462 CG ARG A 140 13.422 -12.768 1.212 1.00 0.00 C ATOM 1463 CD ARG A 140 13.872 -13.283 -0.136 1.00 0.00 C ATOM 1464 NE ARG A 140 14.807 -14.399 -0.015 1.00 0.00 N ATOM 1465 CZ ARG A 140 15.044 -15.281 -0.984 1.00 0.00 C ATOM 1466 NH1 ARG A 140 14.429 -15.166 -2.157 1.00 0.00 N1+ ATOM 1467 NH2 ARG A 140 15.898 -16.277 -0.782 1.00 0.00 N ATOM 0 H ARG A 140 11.127 -13.292 2.618 1.00 0.00 H new ATOM 0 HA ARG A 140 12.523 -10.930 3.018 1.00 0.00 H new ATOM 0 HB2 ARG A 140 11.445 -12.329 0.534 1.00 0.00 H new ATOM 0 HB3 ARG A 140 12.551 -10.972 0.452 1.00 0.00 H new ATOM 0 HG2 ARG A 140 14.249 -12.256 1.704 1.00 0.00 H new ATOM 0 HG3 ARG A 140 13.141 -13.606 1.850 1.00 0.00 H new ATOM 0 HD2 ARG A 140 13.002 -13.600 -0.711 1.00 0.00 H new ATOM 0 HD3 ARG A 140 14.344 -12.474 -0.693 1.00 0.00 H new ATOM 0 HE ARG A 140 15.309 -14.509 0.866 1.00 0.00 H new ATOM 0 HH11 ARG A 140 13.774 -14.401 -2.316 1.00 0.00 H new ATOM 0 HH12 ARG A 140 14.612 -15.843 -2.898 1.00 0.00 H new ATOM 0 HH21 ARG A 140 16.373 -16.367 0.116 1.00 0.00 H new ATOM 0 HH22 ARG A 140 16.079 -16.952 -1.525 1.00 0.00 H new ATOM 1481 N PRO A 141 9.539 -10.366 1.596 1.00 0.00 N ATOM 1482 CA PRO A 141 8.555 -9.320 1.265 1.00 0.00 C ATOM 1483 C PRO A 141 8.469 -8.181 2.294 1.00 0.00 C ATOM 1484 O PRO A 141 8.759 -7.028 1.969 1.00 0.00 O ATOM 1485 CB PRO A 141 7.224 -10.094 1.193 1.00 0.00 C ATOM 1486 CG PRO A 141 7.544 -11.510 1.540 1.00 0.00 C ATOM 1487 CD PRO A 141 8.997 -11.682 1.247 1.00 0.00 C ATOM 0 HA PRO A 141 8.829 -8.807 0.343 1.00 0.00 H new ATOM 0 HB2 PRO A 141 6.494 -9.679 1.888 1.00 0.00 H new ATOM 0 HB3 PRO A 141 6.788 -10.027 0.196 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.330 -11.713 2.589 1.00 0.00 H new ATOM 0 HG3 PRO A 141 6.942 -12.202 0.952 1.00 0.00 H new ATOM 0 HD2 PRO A 141 9.442 -12.478 1.845 1.00 0.00 H new ATOM 0 HD3 PRO A 141 9.175 -11.932 0.201 1.00 0.00 H new ATOM 1495 N THR A 142 8.070 -8.489 3.524 1.00 0.00 N ATOM 1496 CA THR A 142 8.013 -7.469 4.563 1.00 0.00 C ATOM 1497 C THR A 142 9.226 -7.576 5.469 1.00 0.00 C ATOM 1498 O THR A 142 9.429 -8.581 6.160 1.00 0.00 O ATOM 1499 CB THR A 142 6.730 -7.557 5.405 1.00 0.00 C ATOM 1500 OG1 THR A 142 5.586 -7.348 4.570 1.00 0.00 O ATOM 1501 CG2 THR A 142 6.739 -6.515 6.517 1.00 0.00 C ATOM 0 H THR A 142 7.786 -9.422 3.822 1.00 0.00 H new ATOM 0 HA THR A 142 8.009 -6.503 4.059 1.00 0.00 H new ATOM 0 HB THR A 142 6.684 -8.549 5.854 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.879 -7.056 3.681 1.00 0.00 H new ATOM 0 HG21 THR A 142 5.821 -6.596 7.099 1.00 0.00 H new ATOM 0 HG22 THR A 142 7.597 -6.684 7.167 1.00 0.00 H new ATOM 0 HG23 THR A 142 6.805 -5.518 6.081 1.00 0.00 H new ATOM 1509 N LEU A 143 10.018 -6.523 5.472 1.00 0.00 N ATOM 1510 CA LEU A 143 11.297 -6.526 6.148 1.00 0.00 C ATOM 1511 C LEU A 143 11.171 -6.012 7.579 1.00 0.00 C ATOM 1512 O LEU A 143 10.104 -5.575 8.011 1.00 0.00 O ATOM 1513 CB LEU A 143 12.302 -5.690 5.359 1.00 0.00 C ATOM 1514 CG LEU A 143 12.703 -6.250 3.992 1.00 0.00 C ATOM 1515 CD1 LEU A 143 11.709 -5.835 2.915 1.00 0.00 C ATOM 1516 CD2 LEU A 143 14.105 -5.793 3.639 1.00 0.00 C ATOM 0 H LEU A 143 9.793 -5.644 5.007 1.00 0.00 H new ATOM 0 HA LEU A 143 11.655 -7.554 6.201 1.00 0.00 H new ATOM 0 HB2 LEU A 143 11.884 -4.694 5.215 1.00 0.00 H new ATOM 0 HB3 LEU A 143 13.203 -5.574 5.962 1.00 0.00 H new ATOM 0 HG LEU A 143 12.691 -7.339 4.046 1.00 0.00 H new ATOM 0 HD11 LEU A 143 12.020 -6.247 1.955 1.00 0.00 H new ATOM 0 HD12 LEU A 143 10.719 -6.213 3.169 1.00 0.00 H new ATOM 0 HD13 LEU A 143 11.677 -4.747 2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 143 14.384 -6.195 2.665 1.00 0.00 H new ATOM 0 HD22 LEU A 143 14.135 -4.704 3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 143 14.805 -6.151 4.394 1.00 0.00 H new ATOM 1528 N ARG A 144 12.281 -6.056 8.302 1.00 0.00 N ATOM 1529 CA ARG A 144 12.287 -5.828 9.744 1.00 0.00 C ATOM 1530 C ARG A 144 12.457 -4.349 10.112 1.00 0.00 C ATOM 1531 O ARG A 144 13.392 -3.994 10.833 1.00 0.00 O ATOM 1532 CB ARG A 144 13.407 -6.654 10.377 1.00 0.00 C ATOM 1533 CG ARG A 144 13.202 -8.156 10.257 1.00 0.00 C ATOM 1534 CD ARG A 144 14.441 -8.922 10.687 1.00 0.00 C ATOM 1535 NE ARG A 144 15.569 -8.703 9.777 1.00 0.00 N ATOM 1536 CZ ARG A 144 16.831 -9.026 10.062 1.00 0.00 C ATOM 1537 NH1 ARG A 144 17.130 -9.568 11.235 1.00 0.00 N1+ ATOM 1538 NH2 ARG A 144 17.793 -8.811 9.171 1.00 0.00 N ATOM 0 H ARG A 144 13.202 -6.250 7.909 1.00 0.00 H new ATOM 0 HA ARG A 144 11.316 -6.138 10.130 1.00 0.00 H new ATOM 0 HB2 ARG A 144 14.353 -6.387 9.907 1.00 0.00 H new ATOM 0 HB3 ARG A 144 13.489 -6.391 11.432 1.00 0.00 H new ATOM 0 HG2 ARG A 144 12.354 -8.459 10.871 1.00 0.00 H new ATOM 0 HG3 ARG A 144 12.956 -8.410 9.226 1.00 0.00 H new ATOM 0 HD2 ARG A 144 14.724 -8.616 11.694 1.00 0.00 H new ATOM 0 HD3 ARG A 144 14.212 -9.987 10.729 1.00 0.00 H new ATOM 0 HE ARG A 144 15.377 -8.277 8.870 1.00 0.00 H new ATOM 0 HH11 ARG A 144 16.394 -9.738 11.921 1.00 0.00 H new ATOM 0 HH12 ARG A 144 18.096 -9.815 11.452 1.00 0.00 H new ATOM 0 HH21 ARG A 144 17.567 -8.398 8.266 1.00 0.00 H new ATOM 0 HH22 ARG A 144 18.757 -9.059 9.392 1.00 0.00 H new ATOM 1552 N ARG A 145 11.544 -3.504 9.620 1.00 0.00 N ATOM 1553 CA ARG A 145 11.515 -2.069 9.952 1.00 0.00 C ATOM 1554 C ARG A 145 10.491 -1.365 9.077 1.00 0.00 C ATOM 1555 O ARG A 145 9.561 -0.719 9.559 1.00 0.00 O ATOM 1556 CB ARG A 145 12.895 -1.418 9.763 1.00 0.00 C ATOM 1557 CG ARG A 145 12.956 0.034 10.206 1.00 0.00 C ATOM 1558 CD ARG A 145 12.931 0.984 9.022 1.00 0.00 C ATOM 1559 NE ARG A 145 14.170 0.929 8.248 1.00 0.00 N ATOM 1560 CZ ARG A 145 15.162 1.818 8.366 1.00 0.00 C ATOM 1561 NH1 ARG A 145 15.104 2.769 9.290 1.00 0.00 N1+ ATOM 1562 NH2 ARG A 145 16.212 1.748 7.560 1.00 0.00 N ATOM 0 H ARG A 145 10.803 -3.792 8.981 1.00 0.00 H new ATOM 0 HA ARG A 145 11.238 -1.970 11.002 1.00 0.00 H new ATOM 0 HB2 ARG A 145 13.635 -1.990 10.322 1.00 0.00 H new ATOM 0 HB3 ARG A 145 13.174 -1.479 8.711 1.00 0.00 H new ATOM 0 HG2 ARG A 145 12.114 0.250 10.863 1.00 0.00 H new ATOM 0 HG3 ARG A 145 13.864 0.200 10.786 1.00 0.00 H new ATOM 0 HD2 ARG A 145 12.089 0.736 8.376 1.00 0.00 H new ATOM 0 HD3 ARG A 145 12.771 2.002 9.377 1.00 0.00 H new ATOM 0 HE ARG A 145 14.285 0.168 7.579 1.00 0.00 H new ATOM 0 HH11 ARG A 145 14.300 2.825 9.915 1.00 0.00 H new ATOM 0 HH12 ARG A 145 15.864 3.444 9.375 1.00 0.00 H new ATOM 0 HH21 ARG A 145 16.263 1.017 6.851 1.00 0.00 H new ATOM 0 HH22 ARG A 145 16.969 2.425 7.649 1.00 0.00 H new ATOM 1576 N VAL A 146 10.714 -1.482 7.789 1.00 0.00 N ATOM 1577 CA VAL A 146 9.792 -1.041 6.767 1.00 0.00 C ATOM 1578 C VAL A 146 8.430 -1.732 6.936 1.00 0.00 C ATOM 1579 O VAL A 146 8.299 -2.938 6.717 1.00 0.00 O ATOM 1580 CB VAL A 146 10.437 -1.377 5.412 1.00 0.00 C ATOM 1581 CG1 VAL A 146 11.078 -2.727 5.478 1.00 0.00 C ATOM 1582 CG2 VAL A 146 9.485 -1.343 4.261 1.00 0.00 C ATOM 0 H VAL A 146 11.565 -1.898 7.412 1.00 0.00 H new ATOM 0 HA VAL A 146 9.604 0.030 6.837 1.00 0.00 H new ATOM 0 HB VAL A 146 11.177 -0.598 5.230 1.00 0.00 H new ATOM 0 HG11 VAL A 146 11.534 -2.961 4.516 1.00 0.00 H new ATOM 0 HG12 VAL A 146 11.845 -2.728 6.253 1.00 0.00 H new ATOM 0 HG13 VAL A 146 10.323 -3.477 5.714 1.00 0.00 H new ATOM 0 HG21 VAL A 146 10.016 -1.591 3.342 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.688 -2.068 4.426 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.055 -0.345 4.174 1.00 0.00 H new ATOM 1592 N ARG A 147 7.429 -0.973 7.365 1.00 0.00 N ATOM 1593 CA ARG A 147 6.126 -1.548 7.656 1.00 0.00 C ATOM 1594 C ARG A 147 4.980 -0.602 7.301 1.00 0.00 C ATOM 1595 O ARG A 147 4.994 0.579 7.649 1.00 0.00 O ATOM 1596 CB ARG A 147 6.043 -1.931 9.132 1.00 0.00 C ATOM 1597 CG ARG A 147 4.748 -2.630 9.485 1.00 0.00 C ATOM 1598 CD ARG A 147 4.613 -3.940 8.725 1.00 0.00 C ATOM 1599 NE ARG A 147 5.437 -4.996 9.309 1.00 0.00 N ATOM 1600 CZ ARG A 147 5.023 -6.245 9.526 1.00 0.00 C ATOM 1601 NH1 ARG A 147 3.780 -6.606 9.216 1.00 0.00 N1+ ATOM 1602 NH2 ARG A 147 5.856 -7.125 10.066 1.00 0.00 N ATOM 0 H ARG A 147 7.495 0.033 7.517 1.00 0.00 H new ATOM 0 HA ARG A 147 6.019 -2.437 7.035 1.00 0.00 H new ATOM 0 HB2 ARG A 147 6.881 -2.582 9.381 1.00 0.00 H new ATOM 0 HB3 ARG A 147 6.144 -1.033 9.742 1.00 0.00 H new ATOM 0 HG2 ARG A 147 4.715 -2.822 10.557 1.00 0.00 H new ATOM 0 HG3 ARG A 147 3.904 -1.981 9.251 1.00 0.00 H new ATOM 0 HD2 ARG A 147 3.569 -4.253 8.724 1.00 0.00 H new ATOM 0 HD3 ARG A 147 4.901 -3.788 7.685 1.00 0.00 H new ATOM 0 HE ARG A 147 6.395 -4.762 9.569 1.00 0.00 H new ATOM 0 HH11 ARG A 147 3.138 -5.926 8.810 1.00 0.00 H new ATOM 0 HH12 ARG A 147 3.470 -7.563 9.385 1.00 0.00 H new ATOM 0 HH21 ARG A 147 6.805 -6.844 10.312 1.00 0.00 H new ATOM 0 HH22 ARG A 147 5.547 -8.082 10.235 1.00 0.00 H new ATOM 1616 N ILE A 148 3.999 -1.146 6.591 1.00 0.00 N ATOM 1617 CA ILE A 148 2.767 -0.439 6.266 1.00 0.00 C ATOM 1618 C ILE A 148 1.586 -1.083 6.977 1.00 0.00 C ATOM 1619 O ILE A 148 1.218 -2.224 6.686 1.00 0.00 O ATOM 1620 CB ILE A 148 2.504 -0.420 4.750 1.00 0.00 C ATOM 1621 CG1 ILE A 148 3.341 0.653 4.094 1.00 0.00 C ATOM 1622 CG2 ILE A 148 1.041 -0.173 4.433 1.00 0.00 C ATOM 1623 CD1 ILE A 148 3.919 0.221 2.781 1.00 0.00 C ATOM 0 H ILE A 148 4.037 -2.096 6.222 1.00 0.00 H new ATOM 0 HA ILE A 148 2.884 0.590 6.605 1.00 0.00 H new ATOM 0 HB ILE A 148 2.777 -1.401 4.360 1.00 0.00 H new ATOM 0 HG12 ILE A 148 2.728 1.541 3.941 1.00 0.00 H new ATOM 0 HG13 ILE A 148 4.151 0.936 4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.899 -0.167 3.352 1.00 0.00 H new ATOM 0 HG22 ILE A 148 0.434 -0.964 4.875 1.00 0.00 H new ATOM 0 HG23 ILE A 148 0.737 0.790 4.844 1.00 0.00 H new ATOM 0 HD11 ILE A 148 4.510 1.034 2.358 1.00 0.00 H new ATOM 0 HD12 ILE A 148 4.556 -0.650 2.933 1.00 0.00 H new ATOM 0 HD13 ILE A 148 3.112 -0.035 2.095 1.00 0.00 H new ATOM 1635 N SER A 149 1.027 -0.369 7.933 1.00 0.00 N ATOM 1636 CA SER A 149 -0.210 -0.779 8.569 1.00 0.00 C ATOM 1637 C SER A 149 -1.367 -0.009 7.949 1.00 0.00 C ATOM 1638 O SER A 149 -1.226 1.183 7.716 1.00 0.00 O ATOM 1639 CB SER A 149 -0.133 -0.532 10.076 1.00 0.00 C ATOM 1640 OG SER A 149 0.839 -1.369 10.680 1.00 0.00 O ATOM 0 H SER A 149 1.413 0.505 8.289 1.00 0.00 H new ATOM 0 HA SER A 149 -0.371 -1.846 8.412 1.00 0.00 H new ATOM 0 HB2 SER A 149 0.114 0.513 10.265 1.00 0.00 H new ATOM 0 HB3 SER A 149 -1.108 -0.716 10.528 1.00 0.00 H new ATOM 0 HG SER A 149 0.871 -1.191 11.643 1.00 0.00 H new ATOM 1646 N ALA A 150 -2.482 -0.672 7.660 1.00 0.00 N ATOM 1647 CA ALA A 150 -3.580 -0.032 6.932 1.00 0.00 C ATOM 1648 C ALA A 150 -4.018 1.239 7.634 1.00 0.00 C ATOM 1649 O ALA A 150 -3.952 2.324 7.060 1.00 0.00 O ATOM 1650 CB ALA A 150 -4.762 -0.977 6.770 1.00 0.00 C ATOM 0 H ALA A 150 -2.652 -1.645 7.915 1.00 0.00 H new ATOM 0 HA ALA A 150 -3.212 0.224 5.938 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -5.560 -0.472 6.226 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -4.448 -1.861 6.215 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -5.126 -1.276 7.753 1.00 0.00 H new ATOM 1656 N ASP A 151 -4.421 1.087 8.889 1.00 0.00 N ATOM 1657 CA ASP A 151 -4.871 2.203 9.713 1.00 0.00 C ATOM 1658 C ASP A 151 -3.836 3.319 9.714 1.00 0.00 C ATOM 1659 O ASP A 151 -4.158 4.477 9.466 1.00 0.00 O ATOM 1660 CB ASP A 151 -5.113 1.722 11.146 1.00 0.00 C ATOM 1661 CG ASP A 151 -5.988 0.486 11.207 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -7.191 0.616 11.509 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -5.475 -0.629 10.950 1.00 0.00 O1- ATOM 0 H ASP A 151 -4.445 0.185 9.365 1.00 0.00 H new ATOM 0 HA ASP A 151 -5.801 2.591 9.297 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -4.155 1.508 11.620 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -5.581 2.522 11.720 1.00 0.00 H new ATOM 1668 N ALA A 152 -2.589 2.945 9.966 1.00 0.00 N ATOM 1669 CA ALA A 152 -1.478 3.891 9.991 1.00 0.00 C ATOM 1670 C ALA A 152 -1.315 4.591 8.645 1.00 0.00 C ATOM 1671 O ALA A 152 -1.208 5.816 8.572 1.00 0.00 O ATOM 1672 CB ALA A 152 -0.200 3.157 10.366 1.00 0.00 C ATOM 0 H ALA A 152 -2.318 1.981 10.159 1.00 0.00 H new ATOM 0 HA ALA A 152 -1.690 4.658 10.736 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.632 3.861 10.385 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -0.316 2.705 11.351 1.00 0.00 H new ATOM 0 HB3 ALA A 152 0.001 2.378 9.631 1.00 0.00 H new ATOM 1678 N MET A 153 -1.307 3.796 7.586 1.00 0.00 N ATOM 1679 CA MET A 153 -1.157 4.291 6.225 1.00 0.00 C ATOM 1680 C MET A 153 -2.270 5.292 5.908 1.00 0.00 C ATOM 1681 O MET A 153 -2.002 6.399 5.432 1.00 0.00 O ATOM 1682 CB MET A 153 -1.159 3.081 5.268 1.00 0.00 C ATOM 1683 CG MET A 153 -0.640 3.346 3.860 1.00 0.00 C ATOM 1684 SD MET A 153 -1.923 3.892 2.713 1.00 0.00 S ATOM 1685 CE MET A 153 -1.597 5.640 2.692 1.00 0.00 C ATOM 0 H MET A 153 -1.405 2.783 7.647 1.00 0.00 H new ATOM 0 HA MET A 153 -0.214 4.824 6.103 1.00 0.00 H new ATOM 0 HB2 MET A 153 -0.557 2.289 5.713 1.00 0.00 H new ATOM 0 HB3 MET A 153 -2.179 2.703 5.194 1.00 0.00 H new ATOM 0 HG2 MET A 153 0.142 4.104 3.906 1.00 0.00 H new ATOM 0 HG3 MET A 153 -0.180 2.436 3.473 1.00 0.00 H new ATOM 0 HE1 MET A 153 -2.395 6.165 3.217 1.00 0.00 H new ATOM 0 HE2 MET A 153 -0.646 5.839 3.186 1.00 0.00 H new ATOM 0 HE3 MET A 153 -1.550 5.989 1.660 1.00 0.00 H new ATOM 1695 N MET A 154 -3.504 4.924 6.238 1.00 0.00 N ATOM 1696 CA MET A 154 -4.661 5.791 6.020 1.00 0.00 C ATOM 1697 C MET A 154 -4.483 7.136 6.718 1.00 0.00 C ATOM 1698 O MET A 154 -4.956 8.164 6.242 1.00 0.00 O ATOM 1699 CB MET A 154 -5.934 5.111 6.532 1.00 0.00 C ATOM 1700 CG MET A 154 -6.230 3.749 5.920 1.00 0.00 C ATOM 1701 SD MET A 154 -6.844 3.825 4.235 1.00 0.00 S ATOM 1702 CE MET A 154 -5.294 3.877 3.351 1.00 0.00 C ATOM 0 H MET A 154 -3.731 4.024 6.661 1.00 0.00 H new ATOM 0 HA MET A 154 -4.748 5.968 4.948 1.00 0.00 H new ATOM 0 HB2 MET A 154 -5.857 4.997 7.613 1.00 0.00 H new ATOM 0 HB3 MET A 154 -6.781 5.770 6.341 1.00 0.00 H new ATOM 0 HG2 MET A 154 -5.321 3.148 5.938 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.964 3.235 6.541 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.364 3.258 2.457 1.00 0.00 H new ATOM 0 HE2 MET A 154 -5.073 4.905 3.064 1.00 0.00 H new ATOM 0 HE3 MET A 154 -4.497 3.500 3.992 1.00 0.00 H new ATOM 1712 N GLN A 155 -3.785 7.125 7.835 1.00 0.00 N ATOM 1713 CA GLN A 155 -3.584 8.330 8.618 1.00 0.00 C ATOM 1714 C GLN A 155 -2.528 9.240 8.007 1.00 0.00 C ATOM 1715 O GLN A 155 -2.726 10.449 7.898 1.00 0.00 O ATOM 1716 CB GLN A 155 -3.203 7.949 10.024 1.00 0.00 C ATOM 1717 CG GLN A 155 -4.310 7.182 10.705 1.00 0.00 C ATOM 1718 CD GLN A 155 -5.496 8.053 11.066 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -6.434 8.198 10.282 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -5.464 8.641 12.252 1.00 0.00 N ATOM 0 H GLN A 155 -3.345 6.291 8.224 1.00 0.00 H new ATOM 0 HA GLN A 155 -4.518 8.891 8.626 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -2.297 7.344 10.006 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -2.975 8.848 10.597 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.643 6.377 10.050 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.919 6.716 11.610 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -4.668 8.495 12.872 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -6.236 9.240 12.545 1.00 0.00 H new ATOM 1729 N ALA A 156 -1.415 8.651 7.596 1.00 0.00 N ATOM 1730 CA ALA A 156 -0.288 9.420 7.089 1.00 0.00 C ATOM 1731 C ALA A 156 -0.627 10.137 5.789 1.00 0.00 C ATOM 1732 O ALA A 156 -0.342 11.324 5.640 1.00 0.00 O ATOM 1733 CB ALA A 156 0.918 8.519 6.899 1.00 0.00 C ATOM 0 H ALA A 156 -1.268 7.642 7.604 1.00 0.00 H new ATOM 0 HA ALA A 156 -0.051 10.184 7.829 1.00 0.00 H new ATOM 0 HB1 ALA A 156 1.754 9.106 6.519 1.00 0.00 H new ATOM 0 HB2 ALA A 156 1.192 8.072 7.855 1.00 0.00 H new ATOM 0 HB3 ALA A 156 0.675 7.731 6.186 1.00 0.00 H new ATOM 1739 N LEU A 157 -1.228 9.424 4.848 1.00 0.00 N ATOM 1740 CA LEU A 157 -1.567 10.030 3.567 1.00 0.00 C ATOM 1741 C LEU A 157 -2.908 10.718 3.619 1.00 0.00 C ATOM 1742 O LEU A 157 -3.004 11.936 3.487 1.00 0.00 O ATOM 1743 CB LEU A 157 -1.621 9.024 2.448 1.00 0.00 C ATOM 1744 CG LEU A 157 -0.284 8.490 1.950 1.00 0.00 C ATOM 1745 CD1 LEU A 157 0.488 9.568 1.262 1.00 0.00 C ATOM 1746 CD2 LEU A 157 0.564 7.913 3.043 1.00 0.00 C ATOM 0 H LEU A 157 -1.488 8.442 4.943 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.773 10.750 3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.225 8.179 2.778 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.142 9.478 1.605 1.00 0.00 H new ATOM 0 HG LEU A 157 -0.524 7.686 1.254 1.00 0.00 H new ATOM 0 HD11 LEU A 157 1.440 9.168 0.913 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -0.084 9.938 0.411 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.672 10.386 1.959 1.00 0.00 H new ATOM 0 HD21 LEU A 157 1.502 7.550 2.623 1.00 0.00 H new ATOM 0 HD22 LEU A 157 0.773 8.683 3.786 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.035 7.086 3.516 1.00 0.00 H new ATOM 1758 N LEU A 158 -3.942 9.913 3.829 1.00 0.00 N ATOM 1759 CA LEU A 158 -5.307 10.365 3.647 1.00 0.00 C ATOM 1760 C LEU A 158 -5.636 11.489 4.599 1.00 0.00 C ATOM 1761 O LEU A 158 -6.158 12.498 4.154 1.00 0.00 O ATOM 1762 CB LEU A 158 -6.288 9.210 3.828 1.00 0.00 C ATOM 1763 CG LEU A 158 -6.150 8.082 2.825 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -7.102 6.955 3.169 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.414 8.578 1.415 1.00 0.00 C ATOM 0 H LEU A 158 -3.856 8.941 4.126 1.00 0.00 H new ATOM 0 HA LEU A 158 -5.401 10.742 2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.162 8.801 4.830 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.303 9.604 3.770 1.00 0.00 H new ATOM 0 HG LEU A 158 -5.127 7.708 2.871 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -6.993 6.151 2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -6.872 6.576 4.165 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.127 7.326 3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.309 7.751 0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -7.425 8.980 1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -5.697 9.360 1.164 1.00 0.00 H new ATOM 1777 N GLY A 159 -5.305 11.300 5.887 1.00 0.00 N ATOM 1778 CA GLY A 159 -5.480 12.337 6.909 1.00 0.00 C ATOM 1779 C GLY A 159 -6.700 13.215 6.696 1.00 0.00 C ATOM 1780 O GLY A 159 -7.792 12.890 7.155 1.00 0.00 O ATOM 0 H GLY A 159 -4.912 10.429 6.244 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -5.554 11.860 7.886 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -4.591 12.967 6.929 1.00 0.00 H new ATOM 1784 N ALA A 160 -6.494 14.310 5.973 1.00 0.00 N ATOM 1785 CA ALA A 160 -7.550 15.244 5.589 1.00 0.00 C ATOM 1786 C ALA A 160 -8.786 14.527 5.057 1.00 0.00 C ATOM 1787 O ALA A 160 -9.916 14.830 5.441 1.00 0.00 O ATOM 1788 CB ALA A 160 -7.014 16.164 4.509 1.00 0.00 C ATOM 0 H ALA A 160 -5.572 14.580 5.630 1.00 0.00 H new ATOM 0 HA ALA A 160 -7.845 15.803 6.477 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -7.792 16.868 4.212 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -6.155 16.714 4.893 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -6.710 15.573 3.645 1.00 0.00 H new ATOM 1794 N ARG A 161 -8.556 13.573 4.175 1.00 0.00 N ATOM 1795 CA ARG A 161 -9.634 12.880 3.498 1.00 0.00 C ATOM 1796 C ARG A 161 -9.981 11.584 4.228 1.00 0.00 C ATOM 1797 O ARG A 161 -10.965 10.919 3.907 1.00 0.00 O ATOM 1798 CB ARG A 161 -9.222 12.619 2.036 1.00 0.00 C ATOM 1799 CG ARG A 161 -10.303 11.972 1.171 1.00 0.00 C ATOM 1800 CD ARG A 161 -10.146 10.459 1.094 1.00 0.00 C ATOM 1801 NE ARG A 161 -11.290 9.808 0.454 1.00 0.00 N ATOM 1802 CZ ARG A 161 -11.940 8.769 0.980 1.00 0.00 C ATOM 1803 NH1 ARG A 161 -11.608 8.314 2.180 1.00 0.00 N1+ ATOM 1804 NH2 ARG A 161 -12.937 8.202 0.316 1.00 0.00 N ATOM 0 H ARG A 161 -7.623 13.259 3.909 1.00 0.00 H new ATOM 0 HA ARG A 161 -10.532 13.498 3.502 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -8.931 13.566 1.581 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -8.340 11.978 2.031 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -11.285 12.214 1.578 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -10.262 12.392 0.166 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -9.239 10.219 0.540 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -10.020 10.058 2.100 1.00 0.00 H new ATOM 0 HE ARG A 161 -11.608 10.169 -0.445 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -10.854 8.759 2.703 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -12.107 7.519 2.580 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -13.209 8.560 -0.600 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -13.432 7.407 0.721 1.00 0.00 H new ATOM 1818 N ALA A 162 -9.186 11.242 5.231 1.00 0.00 N ATOM 1819 CA ALA A 162 -9.377 9.990 5.951 1.00 0.00 C ATOM 1820 C ALA A 162 -10.557 10.077 6.907 1.00 0.00 C ATOM 1821 O ALA A 162 -11.645 9.585 6.599 1.00 0.00 O ATOM 1822 CB ALA A 162 -8.123 9.597 6.714 1.00 0.00 C ATOM 0 H ALA A 162 -8.407 11.810 5.564 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.588 9.221 5.208 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -8.297 8.659 7.241 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.296 9.473 6.015 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -7.876 10.377 7.434 1.00 0.00 H new ATOM 1828 N LYS A 163 -10.333 10.710 8.064 1.00 0.00 N ATOM 1829 CA LYS A 163 -11.339 10.775 9.125 1.00 0.00 C ATOM 1830 C LYS A 163 -11.898 9.381 9.395 1.00 0.00 C ATOM 1831 O LYS A 163 -13.108 9.185 9.506 1.00 0.00 O ATOM 1832 CB LYS A 163 -12.465 11.757 8.770 1.00 0.00 C ATOM 1833 CG LYS A 163 -12.169 13.215 9.121 1.00 0.00 C ATOM 1834 CD LYS A 163 -11.100 13.832 8.230 1.00 0.00 C ATOM 1835 CE LYS A 163 -9.786 14.035 8.969 1.00 0.00 C ATOM 1836 NZ LYS A 163 -9.914 14.977 10.108 1.00 0.00 N1+ ATOM 0 H LYS A 163 -9.459 11.186 8.288 1.00 0.00 H new ATOM 0 HA LYS A 163 -10.860 11.145 10.031 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -12.667 11.688 7.701 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -13.374 11.450 9.287 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -13.086 13.798 9.036 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -11.848 13.275 10.161 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.934 13.189 7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -11.454 14.791 7.851 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.427 13.073 9.336 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -9.036 14.411 8.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -8.993 15.421 10.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -10.611 15.712 9.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -10.228 14.459 10.953 1.00 0.00 H new ATOM 1850 N GLY A 164 -10.989 8.414 9.489 1.00 0.00 N ATOM 1851 CA GLY A 164 -11.372 7.021 9.593 1.00 0.00 C ATOM 1852 C GLY A 164 -11.915 6.653 10.955 1.00 0.00 C ATOM 1853 O GLY A 164 -11.878 7.456 11.891 1.00 0.00 O ATOM 0 H GLY A 164 -9.982 8.577 9.495 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -12.126 6.801 8.837 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -10.507 6.396 9.373 1.00 0.00 H new ATOM 1857 N HIS A 165 -12.415 5.431 11.060 1.00 0.00 N ATOM 1858 CA HIS A 165 -13.010 4.935 12.292 1.00 0.00 C ATOM 1859 C HIS A 165 -11.923 4.468 13.255 1.00 0.00 C ATOM 1860 O HIS A 165 -11.301 3.421 12.988 1.00 0.00 O ATOM 1861 CB HIS A 165 -13.986 3.791 11.977 1.00 0.00 C ATOM 1862 CG HIS A 165 -14.672 3.214 13.179 1.00 0.00 C ATOM 1863 ND1 HIS A 165 -15.606 3.903 13.919 1.00 0.00 N ATOM 1864 CD2 HIS A 165 -14.583 1.985 13.743 1.00 0.00 C ATOM 1865 CE1 HIS A 165 -16.053 3.129 14.890 1.00 0.00 C ATOM 1866 NE2 HIS A 165 -15.453 1.957 14.803 1.00 0.00 N ATOM 1867 OXT HIS A 165 -11.703 5.147 14.277 1.00 0.00 O ATOM 0 H HIS A 165 -12.420 4.756 10.295 1.00 0.00 H new ATOM 0 HA HIS A 165 -13.563 5.743 12.770 1.00 0.00 H new ATOM 0 HB2 HIS A 165 -14.742 4.156 11.282 1.00 0.00 H new ATOM 0 HB3 HIS A 165 -13.442 2.996 11.467 1.00 0.00 H new ATOM 0 HD2 HIS A 165 -13.945 1.177 13.418 1.00 0.00 H new ATOM 0 HE1 HIS A 165 -16.787 3.408 15.632 1.00 0.00 H new ATOM 0 HE2 HIS A 165 -15.610 1.162 15.422 1.00 0.00 H new TER 1876 HIS A 165