USER MOD reduce.3.24.130724 H: found=0, std=0, add=1167, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1166 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 55 ASN : amide:sc= 0.0273 K(o=0.47,f=-3.2!) USER MOD Set 1.2: A 59 TYR OH : rot -32:sc= 0.285 USER MOD Set 1.3: A 76 LYS NZ :NH3+ 149:sc= 0.161 (180deg=0) USER MOD Set 2.1: A 43 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 45 ASN : amide:sc= -2.15 X(o=-2.1,f=-2.3) USER MOD Single : A 1 MET CE :methyl -157:sc= -0.151 (180deg=-1.09) USER MOD Single : A 1 MET N :NH3+ -166:sc= 0 (180deg=-0.327) USER MOD Single : A 3 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.057) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 0:sc= -1.68 USER MOD Single : A 23 SER OG : rot 179:sc= -1.04 USER MOD Single : A 27 TYR OH : rot 99:sc= 0.103 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0141) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -80:sc= -0.504 USER MOD Single : A 68 ASN : amide:sc= -0.268 X(o=-0.27,f=0) USER MOD Single : A 70 LYS NZ :NH3+ -114:sc= 0 (180deg=-0.179) USER MOD Single : A 81 LYS NZ :NH3+ -158:sc= 1.15 (180deg=0.32) USER MOD Single : A 86 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.3) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -106:sc= 0.0576 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -0.48 X(o=-0.48,f=-0.42) USER MOD Single : A 102 SER OG : rot -138:sc= 0.397 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -170:sc= -1.85 (180deg=-2.07) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= -0.047 X(o=-0.047,f=-0.49) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.161) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 143:sc= -0.0721 (180deg=-0.373) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 110.754 13.777 13.149 1.00 0.00 N ATOM 2 CA MET A 1 109.902 14.996 13.028 1.00 0.00 C ATOM 3 C MET A 1 110.653 16.218 13.566 1.00 0.00 C ATOM 4 O MET A 1 110.795 17.210 12.871 1.00 0.00 O ATOM 5 CB MET A 1 108.664 14.710 13.880 1.00 0.00 C ATOM 6 CG MET A 1 107.803 13.645 13.197 1.00 0.00 C ATOM 7 SD MET A 1 106.207 13.525 14.043 1.00 0.00 S ATOM 8 CE MET A 1 106.840 12.982 15.650 1.00 0.00 C ATOM 0 H1 MET A 1 110.346 13.010 12.577 1.00 0.00 H new ATOM 0 H2 MET A 1 111.714 13.989 12.809 1.00 0.00 H new ATOM 0 H3 MET A 1 110.797 13.481 14.145 1.00 0.00 H new ATOM 0 HA MET A 1 109.638 15.212 11.993 1.00 0.00 H new ATOM 0 HB2 MET A 1 108.963 14.369 14.871 1.00 0.00 H new ATOM 0 HB3 MET A 1 108.087 15.624 14.019 1.00 0.00 H new ATOM 0 HG2 MET A 1 107.652 13.902 12.148 1.00 0.00 H new ATOM 0 HG3 MET A 1 108.312 12.681 13.219 1.00 0.00 H new ATOM 0 HE1 MET A 1 106.052 12.463 16.195 1.00 0.00 H new ATOM 0 HE2 MET A 1 107.682 12.307 15.500 1.00 0.00 H new ATOM 0 HE3 MET A 1 107.168 13.849 16.224 1.00 0.00 H new ATOM 20 N VAL A 2 111.124 16.144 14.791 1.00 0.00 N ATOM 21 CA VAL A 2 111.872 17.294 15.403 1.00 0.00 C ATOM 22 C VAL A 2 113.234 17.429 14.708 1.00 0.00 C ATOM 23 O VAL A 2 113.682 18.529 14.434 1.00 0.00 O ATOM 24 CB VAL A 2 112.040 16.967 16.902 1.00 0.00 C ATOM 25 CG1 VAL A 2 112.762 18.111 17.623 1.00 0.00 C ATOM 26 CG2 VAL A 2 110.667 16.778 17.560 1.00 0.00 C ATOM 0 H VAL A 2 111.022 15.330 15.398 1.00 0.00 H new ATOM 0 HA VAL A 2 111.342 18.239 15.285 1.00 0.00 H new ATOM 0 HB VAL A 2 112.625 16.051 16.981 1.00 0.00 H new ATOM 0 HG11 VAL A 2 112.872 17.864 18.679 1.00 0.00 H new ATOM 0 HG12 VAL A 2 113.747 18.256 17.180 1.00 0.00 H new ATOM 0 HG13 VAL A 2 112.181 19.028 17.524 1.00 0.00 H new ATOM 0 HG21 VAL A 2 110.799 16.548 18.617 1.00 0.00 H new ATOM 0 HG22 VAL A 2 110.085 17.694 17.458 1.00 0.00 H new ATOM 0 HG23 VAL A 2 110.140 15.958 17.073 1.00 0.00 H new ATOM 36 N LYS A 3 113.878 16.318 14.430 1.00 0.00 N ATOM 37 CA LYS A 3 115.206 16.343 13.744 1.00 0.00 C ATOM 38 C LYS A 3 115.235 15.308 12.614 1.00 0.00 C ATOM 39 O LYS A 3 114.919 14.152 12.828 1.00 0.00 O ATOM 40 CB LYS A 3 116.220 15.981 14.832 1.00 0.00 C ATOM 41 CG LYS A 3 117.639 16.203 14.306 1.00 0.00 C ATOM 42 CD LYS A 3 118.652 15.771 15.368 1.00 0.00 C ATOM 43 CE LYS A 3 120.062 16.159 14.920 1.00 0.00 C ATOM 44 NZ LYS A 3 120.214 17.585 15.322 1.00 0.00 N ATOM 0 H LYS A 3 113.533 15.385 14.653 1.00 0.00 H new ATOM 0 HA LYS A 3 115.422 17.312 13.293 1.00 0.00 H new ATOM 0 HB2 LYS A 3 116.050 16.592 15.719 1.00 0.00 H new ATOM 0 HB3 LYS A 3 116.091 14.941 15.132 1.00 0.00 H new ATOM 0 HG2 LYS A 3 117.792 15.633 13.390 1.00 0.00 H new ATOM 0 HG3 LYS A 3 117.785 17.254 14.056 1.00 0.00 H new ATOM 0 HD2 LYS A 3 118.419 16.245 16.321 1.00 0.00 H new ATOM 0 HD3 LYS A 3 118.593 14.694 15.525 1.00 0.00 H new ATOM 0 HE2 LYS A 3 120.815 15.532 15.398 1.00 0.00 H new ATOM 0 HE3 LYS A 3 120.182 16.037 13.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 120.762 18.093 14.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 119.275 18.022 15.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 120.712 17.638 16.234 1.00 0.00 H new ATOM 58 N LEU A 4 115.612 15.727 11.428 1.00 0.00 N ATOM 59 CA LEU A 4 115.675 14.793 10.259 1.00 0.00 C ATOM 60 C LEU A 4 117.131 14.556 9.851 1.00 0.00 C ATOM 61 O LEU A 4 117.964 15.433 9.997 1.00 0.00 O ATOM 62 CB LEU A 4 114.919 15.502 9.131 1.00 0.00 C ATOM 63 CG LEU A 4 113.441 15.649 9.500 1.00 0.00 C ATOM 64 CD1 LEU A 4 112.761 16.600 8.514 1.00 0.00 C ATOM 65 CD2 LEU A 4 112.759 14.281 9.436 1.00 0.00 C ATOM 0 H LEU A 4 115.882 16.688 11.219 1.00 0.00 H new ATOM 0 HA LEU A 4 115.241 13.820 10.491 1.00 0.00 H new ATOM 0 HB2 LEU A 4 115.356 16.484 8.951 1.00 0.00 H new ATOM 0 HB3 LEU A 4 115.016 14.935 8.205 1.00 0.00 H new ATOM 0 HG LEU A 4 113.359 16.050 10.510 1.00 0.00 H new ATOM 0 HD11 LEU A 4 111.708 16.705 8.777 1.00 0.00 H new ATOM 0 HD12 LEU A 4 113.245 17.576 8.557 1.00 0.00 H new ATOM 0 HD13 LEU A 4 112.845 16.198 7.504 1.00 0.00 H new ATOM 0 HD21 LEU A 4 111.706 14.387 9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 4 112.842 13.880 8.426 1.00 0.00 H new ATOM 0 HD23 LEU A 4 113.242 13.601 10.138 1.00 0.00 H new ATOM 77 N MET A 5 117.429 13.382 9.346 1.00 0.00 N ATOM 78 CA MET A 5 118.817 13.062 8.892 1.00 0.00 C ATOM 79 C MET A 5 118.859 12.970 7.365 1.00 0.00 C ATOM 80 O MET A 5 117.917 12.502 6.751 1.00 0.00 O ATOM 81 CB MET A 5 119.137 11.704 9.516 1.00 0.00 C ATOM 82 CG MET A 5 120.648 11.463 9.466 1.00 0.00 C ATOM 83 SD MET A 5 121.451 12.384 10.800 1.00 0.00 S ATOM 84 CE MET A 5 121.696 10.991 11.928 1.00 0.00 C ATOM 0 H MET A 5 116.758 12.623 9.228 1.00 0.00 H new ATOM 0 HA MET A 5 119.536 13.826 9.189 1.00 0.00 H new ATOM 0 HB2 MET A 5 118.787 11.674 10.548 1.00 0.00 H new ATOM 0 HB3 MET A 5 118.614 10.913 8.979 1.00 0.00 H new ATOM 0 HG2 MET A 5 120.861 10.399 9.566 1.00 0.00 H new ATOM 0 HG3 MET A 5 121.046 11.779 8.501 1.00 0.00 H new ATOM 0 HE1 MET A 5 122.187 11.340 12.836 1.00 0.00 H new ATOM 0 HE2 MET A 5 120.730 10.555 12.183 1.00 0.00 H new ATOM 0 HE3 MET A 5 122.319 10.237 11.446 1.00 0.00 H new ATOM 94 N ILE A 6 119.941 13.409 6.765 1.00 0.00 N ATOM 95 CA ILE A 6 120.066 13.382 5.273 1.00 0.00 C ATOM 96 C ILE A 6 121.352 12.636 4.891 1.00 0.00 C ATOM 97 O ILE A 6 122.415 12.934 5.404 1.00 0.00 O ATOM 98 CB ILE A 6 120.126 14.859 4.825 1.00 0.00 C ATOM 99 CG1 ILE A 6 118.889 15.649 5.305 1.00 0.00 C ATOM 100 CG2 ILE A 6 120.227 14.955 3.295 1.00 0.00 C ATOM 101 CD1 ILE A 6 117.579 15.050 4.770 1.00 0.00 C ATOM 0 H ILE A 6 120.752 13.789 7.253 1.00 0.00 H new ATOM 0 HA ILE A 6 119.233 12.869 4.792 1.00 0.00 H new ATOM 0 HB ILE A 6 121.015 15.298 5.278 1.00 0.00 H new ATOM 0 HG12 ILE A 6 118.865 15.658 6.395 1.00 0.00 H new ATOM 0 HG13 ILE A 6 118.973 16.686 4.980 1.00 0.00 H new ATOM 0 HG21 ILE A 6 120.268 16.003 2.998 1.00 0.00 H new ATOM 0 HG22 ILE A 6 121.130 14.446 2.957 1.00 0.00 H new ATOM 0 HG23 ILE A 6 119.354 14.484 2.842 1.00 0.00 H new ATOM 0 HD11 ILE A 6 116.735 15.637 5.133 1.00 0.00 H new ATOM 0 HD12 ILE A 6 117.590 15.066 3.680 1.00 0.00 H new ATOM 0 HD13 ILE A 6 117.481 14.021 5.117 1.00 0.00 H new ATOM 113 N ILE A 7 121.246 11.677 4.000 1.00 0.00 N ATOM 114 CA ILE A 7 122.453 10.931 3.516 1.00 0.00 C ATOM 115 C ILE A 7 122.446 10.917 1.981 1.00 0.00 C ATOM 116 O ILE A 7 121.392 10.919 1.369 1.00 0.00 O ATOM 117 CB ILE A 7 122.342 9.506 4.095 1.00 0.00 C ATOM 118 CG1 ILE A 7 122.292 9.555 5.629 1.00 0.00 C ATOM 119 CG2 ILE A 7 123.560 8.670 3.683 1.00 0.00 C ATOM 120 CD1 ILE A 7 121.843 8.198 6.176 1.00 0.00 C ATOM 0 H ILE A 7 120.365 11.376 3.583 1.00 0.00 H new ATOM 0 HA ILE A 7 123.387 11.393 3.836 1.00 0.00 H new ATOM 0 HB ILE A 7 121.429 9.056 3.706 1.00 0.00 H new ATOM 0 HG12 ILE A 7 123.274 9.811 6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 7 121.604 10.335 5.955 1.00 0.00 H new ATOM 0 HG21 ILE A 7 123.470 7.666 4.098 1.00 0.00 H new ATOM 0 HG22 ILE A 7 123.609 8.610 2.596 1.00 0.00 H new ATOM 0 HG23 ILE A 7 124.468 9.139 4.062 1.00 0.00 H new ATOM 0 HD11 ILE A 7 121.809 8.238 7.265 1.00 0.00 H new ATOM 0 HD12 ILE A 7 120.852 7.960 5.791 1.00 0.00 H new ATOM 0 HD13 ILE A 7 122.548 7.428 5.863 1.00 0.00 H new ATOM 132 N GLU A 8 123.610 10.903 1.374 1.00 0.00 N ATOM 133 CA GLU A 8 123.706 10.891 -0.120 1.00 0.00 C ATOM 134 C GLU A 8 124.109 9.498 -0.614 1.00 0.00 C ATOM 135 O GLU A 8 124.926 8.836 0.003 1.00 0.00 O ATOM 136 CB GLU A 8 124.794 11.913 -0.458 1.00 0.00 C ATOM 137 CG GLU A 8 124.307 13.320 -0.102 1.00 0.00 C ATOM 138 CD GLU A 8 125.364 14.350 -0.507 1.00 0.00 C ATOM 139 OE1 GLU A 8 125.892 14.232 -1.602 1.00 0.00 O ATOM 140 OE2 GLU A 8 125.629 15.239 0.284 1.00 0.00 O ATOM 0 H GLU A 8 124.508 10.899 1.857 1.00 0.00 H new ATOM 0 HA GLU A 8 122.756 11.135 -0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 8 125.706 11.683 0.092 1.00 0.00 H new ATOM 0 HB3 GLU A 8 125.040 11.860 -1.519 1.00 0.00 H new ATOM 0 HG2 GLU A 8 123.367 13.530 -0.612 1.00 0.00 H new ATOM 0 HG3 GLU A 8 124.111 13.387 0.968 1.00 0.00 H new ATOM 147 N GLY A 9 123.539 9.064 -1.716 1.00 0.00 N ATOM 148 CA GLY A 9 123.882 7.727 -2.293 1.00 0.00 C ATOM 149 C GLY A 9 124.064 7.855 -3.807 1.00 0.00 C ATOM 150 O GLY A 9 123.451 8.702 -4.432 1.00 0.00 O ATOM 0 H GLY A 9 122.842 9.588 -2.245 1.00 0.00 H new ATOM 0 HA2 GLY A 9 124.796 7.346 -1.837 1.00 0.00 H new ATOM 0 HA3 GLY A 9 123.092 7.010 -2.070 1.00 0.00 H new ATOM 154 N GLU A 10 124.898 7.020 -4.386 1.00 0.00 N ATOM 155 CA GLU A 10 125.150 7.074 -5.859 1.00 0.00 C ATOM 156 C GLU A 10 124.464 5.897 -6.559 1.00 0.00 C ATOM 157 O GLU A 10 124.433 4.798 -6.033 1.00 0.00 O ATOM 158 CB GLU A 10 126.669 6.977 -6.015 1.00 0.00 C ATOM 159 CG GLU A 10 127.054 7.282 -7.464 1.00 0.00 C ATOM 160 CD GLU A 10 128.554 7.049 -7.656 1.00 0.00 C ATOM 161 OE1 GLU A 10 129.044 6.035 -7.186 1.00 0.00 O ATOM 162 OE2 GLU A 10 129.189 7.889 -8.272 1.00 0.00 O ATOM 0 H GLU A 10 125.419 6.296 -3.892 1.00 0.00 H new ATOM 0 HA GLU A 10 124.755 7.986 -6.307 1.00 0.00 H new ATOM 0 HB2 GLU A 10 127.160 7.680 -5.342 1.00 0.00 H new ATOM 0 HB3 GLU A 10 127.011 5.979 -5.739 1.00 0.00 H new ATOM 0 HG2 GLU A 10 126.487 6.646 -8.143 1.00 0.00 H new ATOM 0 HG3 GLU A 10 126.802 8.314 -7.709 1.00 0.00 H new ATOM 169 N VAL A 11 123.921 6.130 -7.734 1.00 0.00 N ATOM 170 CA VAL A 11 123.245 5.038 -8.521 1.00 0.00 C ATOM 171 C VAL A 11 124.267 3.953 -8.891 1.00 0.00 C ATOM 172 O VAL A 11 125.250 4.237 -9.550 1.00 0.00 O ATOM 173 CB VAL A 11 122.683 5.694 -9.802 1.00 0.00 C ATOM 174 CG1 VAL A 11 121.884 4.669 -10.618 1.00 0.00 C ATOM 175 CG2 VAL A 11 121.753 6.864 -9.452 1.00 0.00 C ATOM 0 H VAL A 11 123.917 7.043 -8.189 1.00 0.00 H new ATOM 0 HA VAL A 11 122.450 4.569 -7.941 1.00 0.00 H new ATOM 0 HB VAL A 11 123.529 6.060 -10.384 1.00 0.00 H new ATOM 0 HG11 VAL A 11 121.494 5.145 -11.518 1.00 0.00 H new ATOM 0 HG12 VAL A 11 122.534 3.841 -10.898 1.00 0.00 H new ATOM 0 HG13 VAL A 11 121.055 4.293 -10.018 1.00 0.00 H new ATOM 0 HG21 VAL A 11 121.369 7.311 -10.369 1.00 0.00 H new ATOM 0 HG22 VAL A 11 120.921 6.500 -8.850 1.00 0.00 H new ATOM 0 HG23 VAL A 11 122.308 7.614 -8.888 1.00 0.00 H new ATOM 185 N VAL A 12 124.031 2.732 -8.470 1.00 0.00 N ATOM 186 CA VAL A 12 124.934 1.594 -8.840 1.00 0.00 C ATOM 187 C VAL A 12 124.118 0.446 -9.448 1.00 0.00 C ATOM 188 O VAL A 12 123.000 0.197 -9.033 1.00 0.00 O ATOM 189 CB VAL A 12 125.634 1.150 -7.541 1.00 0.00 C ATOM 190 CG1 VAL A 12 126.510 2.289 -7.015 1.00 0.00 C ATOM 191 CG2 VAL A 12 124.616 0.760 -6.459 1.00 0.00 C ATOM 0 H VAL A 12 123.241 2.473 -7.879 1.00 0.00 H new ATOM 0 HA VAL A 12 125.668 1.893 -9.588 1.00 0.00 H new ATOM 0 HB VAL A 12 126.245 0.277 -7.771 1.00 0.00 H new ATOM 0 HG11 VAL A 12 127.004 1.973 -6.096 1.00 0.00 H new ATOM 0 HG12 VAL A 12 127.261 2.545 -7.762 1.00 0.00 H new ATOM 0 HG13 VAL A 12 125.889 3.161 -6.812 1.00 0.00 H new ATOM 0 HG21 VAL A 12 125.144 0.452 -5.557 1.00 0.00 H new ATOM 0 HG22 VAL A 12 123.980 1.616 -6.233 1.00 0.00 H new ATOM 0 HG23 VAL A 12 124.001 -0.065 -6.819 1.00 0.00 H new ATOM 201 N SER A 13 124.679 -0.239 -10.420 1.00 0.00 N ATOM 202 CA SER A 13 123.965 -1.388 -11.065 1.00 0.00 C ATOM 203 C SER A 13 124.218 -2.675 -10.276 1.00 0.00 C ATOM 204 O SER A 13 125.338 -3.149 -10.208 1.00 0.00 O ATOM 205 CB SER A 13 124.552 -1.502 -12.474 1.00 0.00 C ATOM 206 OG SER A 13 124.196 -0.350 -13.226 1.00 0.00 O ATOM 0 H SER A 13 125.608 -0.049 -10.796 1.00 0.00 H new ATOM 0 HA SER A 13 122.887 -1.232 -11.092 1.00 0.00 H new ATOM 0 HB2 SER A 13 125.637 -1.595 -12.422 1.00 0.00 H new ATOM 0 HB3 SER A 13 124.178 -2.401 -12.965 1.00 0.00 H new ATOM 0 HG SER A 13 124.572 -0.419 -14.128 1.00 0.00 H new ATOM 212 N GLY A 14 123.183 -3.233 -9.688 1.00 0.00 N ATOM 213 CA GLY A 14 123.324 -4.500 -8.909 1.00 0.00 C ATOM 214 C GLY A 14 121.937 -5.042 -8.553 1.00 0.00 C ATOM 215 O GLY A 14 121.167 -4.377 -7.882 1.00 0.00 O ATOM 0 H GLY A 14 122.236 -2.856 -9.718 1.00 0.00 H new ATOM 0 HA2 GLY A 14 123.875 -5.238 -9.492 1.00 0.00 H new ATOM 0 HA3 GLY A 14 123.898 -4.318 -8.001 1.00 0.00 H new ATOM 219 N LEU A 15 121.627 -6.239 -9.000 1.00 0.00 N ATOM 220 CA LEU A 15 120.318 -6.877 -8.666 1.00 0.00 C ATOM 221 C LEU A 15 120.542 -8.066 -7.727 1.00 0.00 C ATOM 222 O LEU A 15 121.459 -8.844 -7.922 1.00 0.00 O ATOM 223 CB LEU A 15 119.749 -7.342 -10.008 1.00 0.00 C ATOM 224 CG LEU A 15 118.262 -7.666 -9.852 1.00 0.00 C ATOM 225 CD1 LEU A 15 117.452 -6.368 -9.823 1.00 0.00 C ATOM 226 CD2 LEU A 15 117.802 -8.526 -11.031 1.00 0.00 C ATOM 0 H LEU A 15 122.237 -6.805 -9.590 1.00 0.00 H new ATOM 0 HA LEU A 15 119.638 -6.194 -8.156 1.00 0.00 H new ATOM 0 HB2 LEU A 15 119.885 -6.565 -10.761 1.00 0.00 H new ATOM 0 HB3 LEU A 15 120.288 -8.222 -10.357 1.00 0.00 H new ATOM 0 HG LEU A 15 118.107 -8.210 -8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 15 116.393 -6.602 -9.712 1.00 0.00 H new ATOM 0 HD12 LEU A 15 117.778 -5.754 -8.983 1.00 0.00 H new ATOM 0 HD13 LEU A 15 117.607 -5.822 -10.753 1.00 0.00 H new ATOM 0 HD21 LEU A 15 116.743 -8.758 -10.921 1.00 0.00 H new ATOM 0 HD22 LEU A 15 117.960 -7.981 -11.962 1.00 0.00 H new ATOM 0 HD23 LEU A 15 118.376 -9.453 -11.051 1.00 0.00 H new ATOM 238 N GLY A 16 119.709 -8.203 -6.719 1.00 0.00 N ATOM 239 CA GLY A 16 119.915 -9.252 -5.673 1.00 0.00 C ATOM 240 C GLY A 16 119.761 -10.650 -6.280 1.00 0.00 C ATOM 241 O GLY A 16 120.508 -11.553 -5.947 1.00 0.00 O ATOM 0 H GLY A 16 118.883 -7.621 -6.578 1.00 0.00 H new ATOM 0 HA2 GLY A 16 120.907 -9.147 -5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 16 119.194 -9.117 -4.867 1.00 0.00 H new ATOM 245 N GLU A 17 118.801 -10.823 -7.160 1.00 0.00 N ATOM 246 CA GLU A 17 118.542 -12.162 -7.773 1.00 0.00 C ATOM 247 C GLU A 17 118.613 -12.073 -9.300 1.00 0.00 C ATOM 248 O GLU A 17 118.380 -11.023 -9.870 1.00 0.00 O ATOM 249 CB GLU A 17 117.128 -12.538 -7.325 1.00 0.00 C ATOM 250 CG GLU A 17 117.116 -12.787 -5.815 1.00 0.00 C ATOM 251 CD GLU A 17 115.734 -13.282 -5.381 1.00 0.00 C ATOM 252 OE1 GLU A 17 114.752 -12.723 -5.843 1.00 0.00 O ATOM 253 OE2 GLU A 17 115.681 -14.213 -4.594 1.00 0.00 O ATOM 0 H GLU A 17 118.179 -10.081 -7.482 1.00 0.00 H new ATOM 0 HA GLU A 17 119.279 -12.903 -7.465 1.00 0.00 H new ATOM 0 HB2 GLU A 17 116.431 -11.739 -7.577 1.00 0.00 H new ATOM 0 HB3 GLU A 17 116.794 -13.431 -7.853 1.00 0.00 H new ATOM 0 HG2 GLU A 17 117.875 -13.524 -5.553 1.00 0.00 H new ATOM 0 HG3 GLU A 17 117.367 -11.869 -5.284 1.00 0.00 H new ATOM 260 N GLY A 18 118.933 -13.170 -9.951 1.00 0.00 N ATOM 261 CA GLY A 18 118.996 -13.200 -11.445 1.00 0.00 C ATOM 262 C GLY A 18 117.590 -13.028 -12.028 1.00 0.00 C ATOM 263 O GLY A 18 117.423 -12.410 -13.066 1.00 0.00 O ATOM 0 H GLY A 18 119.156 -14.057 -9.500 1.00 0.00 H new ATOM 0 HA2 GLY A 18 119.649 -12.406 -11.806 1.00 0.00 H new ATOM 0 HA3 GLY A 18 119.426 -14.144 -11.781 1.00 0.00 H new ATOM 267 N ARG A 19 116.595 -13.571 -11.366 1.00 0.00 N ATOM 268 CA ARG A 19 115.181 -13.431 -11.833 1.00 0.00 C ATOM 269 C ARG A 19 114.384 -12.578 -10.841 1.00 0.00 C ATOM 270 O ARG A 19 114.605 -12.651 -9.646 1.00 0.00 O ATOM 271 CB ARG A 19 114.633 -14.859 -11.875 1.00 0.00 C ATOM 272 CG ARG A 19 115.334 -15.646 -12.984 1.00 0.00 C ATOM 273 CD ARG A 19 114.711 -17.041 -13.099 1.00 0.00 C ATOM 274 NE ARG A 19 115.038 -17.746 -11.814 1.00 0.00 N ATOM 275 CZ ARG A 19 114.311 -18.741 -11.342 1.00 0.00 C ATOM 276 NH1 ARG A 19 113.256 -19.218 -11.963 1.00 0.00 N ATOM 277 NH2 ARG A 19 114.663 -19.285 -10.209 1.00 0.00 N ATOM 0 H ARG A 19 116.707 -14.113 -10.509 1.00 0.00 H new ATOM 0 HA ARG A 19 115.111 -12.941 -12.804 1.00 0.00 H new ATOM 0 HB2 ARG A 19 114.790 -15.348 -10.913 1.00 0.00 H new ATOM 0 HB3 ARG A 19 113.558 -14.841 -12.052 1.00 0.00 H new ATOM 0 HG2 ARG A 19 115.242 -15.117 -13.933 1.00 0.00 H new ATOM 0 HG3 ARG A 19 116.399 -15.729 -12.767 1.00 0.00 H new ATOM 0 HD2 ARG A 19 113.633 -16.976 -13.245 1.00 0.00 H new ATOM 0 HD3 ARG A 19 115.117 -17.581 -13.955 1.00 0.00 H new ATOM 0 HE ARG A 19 115.855 -17.443 -11.284 1.00 0.00 H new ATOM 0 HH11 ARG A 19 112.964 -18.817 -12.854 1.00 0.00 H new ATOM 0 HH12 ARG A 19 112.729 -19.989 -11.554 1.00 0.00 H new ATOM 0 HH21 ARG A 19 115.483 -18.939 -9.710 1.00 0.00 H new ATOM 0 HH22 ARG A 19 114.118 -20.056 -9.822 1.00 0.00 H new ATOM 291 N TYR A 20 113.467 -11.779 -11.339 1.00 0.00 N ATOM 292 CA TYR A 20 112.678 -10.862 -10.460 1.00 0.00 C ATOM 293 C TYR A 20 111.177 -11.100 -10.654 1.00 0.00 C ATOM 294 O TYR A 20 110.684 -11.068 -11.767 1.00 0.00 O ATOM 295 CB TYR A 20 113.062 -9.454 -10.917 1.00 0.00 C ATOM 296 CG TYR A 20 112.517 -8.360 -10.030 1.00 0.00 C ATOM 297 CD1 TYR A 20 113.235 -7.968 -8.858 1.00 0.00 C ATOM 298 CD2 TYR A 20 111.285 -7.716 -10.363 1.00 0.00 C ATOM 299 CE1 TYR A 20 112.722 -6.931 -8.020 1.00 0.00 C ATOM 300 CE2 TYR A 20 110.772 -6.680 -9.524 1.00 0.00 C ATOM 301 CZ TYR A 20 111.490 -6.287 -8.353 1.00 0.00 C ATOM 302 OH TYR A 20 110.995 -5.285 -7.543 1.00 0.00 O ATOM 0 H TYR A 20 113.231 -11.725 -12.330 1.00 0.00 H new ATOM 0 HA TYR A 20 112.888 -11.021 -9.402 1.00 0.00 H new ATOM 0 HB2 TYR A 20 114.149 -9.376 -10.950 1.00 0.00 H new ATOM 0 HB3 TYR A 20 112.700 -9.300 -11.934 1.00 0.00 H new ATOM 0 HD1 TYR A 20 114.165 -8.456 -8.606 1.00 0.00 H new ATOM 0 HD2 TYR A 20 110.742 -8.013 -11.248 1.00 0.00 H new ATOM 0 HE1 TYR A 20 113.265 -6.634 -7.135 1.00 0.00 H new ATOM 0 HE2 TYR A 20 109.841 -6.194 -9.775 1.00 0.00 H new ATOM 0 HH TYR A 20 111.605 -5.142 -6.790 1.00 0.00 H new ATOM 312 N PHE A 21 110.464 -11.338 -9.575 1.00 0.00 N ATOM 313 CA PHE A 21 108.983 -11.532 -9.651 1.00 0.00 C ATOM 314 C PHE A 21 108.308 -10.935 -8.411 1.00 0.00 C ATOM 315 O PHE A 21 108.239 -11.570 -7.374 1.00 0.00 O ATOM 316 CB PHE A 21 108.783 -13.048 -9.699 1.00 0.00 C ATOM 317 CG PHE A 21 109.149 -13.663 -11.029 1.00 0.00 C ATOM 318 CD1 PHE A 21 108.250 -13.560 -12.135 1.00 0.00 C ATOM 319 CD2 PHE A 21 110.394 -14.348 -11.182 1.00 0.00 C ATOM 320 CE1 PHE A 21 108.594 -14.142 -13.394 1.00 0.00 C ATOM 321 CE2 PHE A 21 110.739 -14.931 -12.441 1.00 0.00 C ATOM 322 CZ PHE A 21 109.839 -14.828 -13.547 1.00 0.00 C ATOM 0 H PHE A 21 110.853 -11.406 -8.635 1.00 0.00 H new ATOM 0 HA PHE A 21 108.544 -11.038 -10.518 1.00 0.00 H new ATOM 0 HB2 PHE A 21 109.384 -13.511 -8.916 1.00 0.00 H new ATOM 0 HB3 PHE A 21 107.740 -13.276 -9.477 1.00 0.00 H new ATOM 0 HD1 PHE A 21 107.310 -13.042 -12.019 1.00 0.00 H new ATOM 0 HD2 PHE A 21 111.074 -14.425 -10.347 1.00 0.00 H new ATOM 0 HE1 PHE A 21 107.914 -14.064 -14.229 1.00 0.00 H new ATOM 0 HE2 PHE A 21 111.679 -15.449 -12.557 1.00 0.00 H new ATOM 0 HZ PHE A 21 110.100 -15.268 -14.498 1.00 0.00 H new ATOM 332 N LEU A 22 107.819 -9.720 -8.525 1.00 0.00 N ATOM 333 CA LEU A 22 107.144 -9.043 -7.372 1.00 0.00 C ATOM 334 C LEU A 22 105.609 -9.058 -7.520 1.00 0.00 C ATOM 335 O LEU A 22 104.917 -8.545 -6.661 1.00 0.00 O ATOM 336 CB LEU A 22 107.681 -7.605 -7.395 1.00 0.00 C ATOM 337 CG LEU A 22 107.723 -7.028 -5.971 1.00 0.00 C ATOM 338 CD1 LEU A 22 108.833 -5.974 -5.879 1.00 0.00 C ATOM 339 CD2 LEU A 22 106.373 -6.390 -5.610 1.00 0.00 C ATOM 0 H LEU A 22 107.860 -9.164 -9.379 1.00 0.00 H new ATOM 0 HA LEU A 22 107.352 -9.551 -6.430 1.00 0.00 H new ATOM 0 HB2 LEU A 22 108.680 -7.590 -7.830 1.00 0.00 H new ATOM 0 HB3 LEU A 22 107.048 -6.983 -8.028 1.00 0.00 H new ATOM 0 HG LEU A 22 107.926 -7.837 -5.269 1.00 0.00 H new ATOM 0 HD11 LEU A 22 108.863 -5.565 -4.869 1.00 0.00 H new ATOM 0 HD12 LEU A 22 109.793 -6.435 -6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 22 108.633 -5.172 -6.590 1.00 0.00 H new ATOM 0 HD21 LEU A 22 106.420 -5.986 -4.599 1.00 0.00 H new ATOM 0 HD22 LEU A 22 106.151 -5.586 -6.312 1.00 0.00 H new ATOM 0 HD23 LEU A 22 105.588 -7.144 -5.663 1.00 0.00 H new ATOM 351 N SER A 23 105.071 -9.636 -8.579 1.00 0.00 N ATOM 352 CA SER A 23 103.601 -9.530 -8.855 1.00 0.00 C ATOM 353 C SER A 23 102.833 -10.737 -8.293 1.00 0.00 C ATOM 354 O SER A 23 101.825 -11.138 -8.849 1.00 0.00 O ATOM 355 CB SER A 23 103.484 -9.479 -10.381 1.00 0.00 C ATOM 356 OG SER A 23 103.630 -8.136 -10.817 1.00 0.00 O ATOM 0 H SER A 23 105.595 -10.179 -9.265 1.00 0.00 H new ATOM 0 HA SER A 23 103.169 -8.651 -8.377 1.00 0.00 H new ATOM 0 HB2 SER A 23 104.249 -10.107 -10.837 1.00 0.00 H new ATOM 0 HB3 SER A 23 102.518 -9.873 -10.697 1.00 0.00 H new ATOM 0 HG SER A 23 103.573 -8.102 -11.795 1.00 0.00 H new ATOM 362 N LEU A 24 103.303 -11.308 -7.207 1.00 0.00 N ATOM 363 CA LEU A 24 102.524 -12.367 -6.489 1.00 0.00 C ATOM 364 C LEU A 24 101.599 -11.694 -5.461 1.00 0.00 C ATOM 365 O LEU A 24 102.025 -10.749 -4.822 1.00 0.00 O ATOM 366 CB LEU A 24 103.575 -13.246 -5.796 1.00 0.00 C ATOM 367 CG LEU A 24 103.072 -14.686 -5.674 1.00 0.00 C ATOM 368 CD1 LEU A 24 103.021 -15.337 -7.059 1.00 0.00 C ATOM 369 CD2 LEU A 24 104.024 -15.480 -4.779 1.00 0.00 C ATOM 0 H LEU A 24 104.203 -11.082 -6.784 1.00 0.00 H new ATOM 0 HA LEU A 24 101.898 -12.961 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 24 104.506 -13.226 -6.363 1.00 0.00 H new ATOM 0 HB3 LEU A 24 103.796 -12.847 -4.806 1.00 0.00 H new ATOM 0 HG LEU A 24 102.072 -14.682 -5.240 1.00 0.00 H new ATOM 0 HD11 LEU A 24 102.662 -16.362 -6.966 1.00 0.00 H new ATOM 0 HD12 LEU A 24 102.345 -14.773 -7.702 1.00 0.00 H new ATOM 0 HD13 LEU A 24 104.019 -15.340 -7.496 1.00 0.00 H new ATOM 0 HD21 LEU A 24 103.668 -16.507 -4.690 1.00 0.00 H new ATOM 0 HD22 LEU A 24 105.022 -15.478 -5.217 1.00 0.00 H new ATOM 0 HD23 LEU A 24 104.061 -15.022 -3.791 1.00 0.00 H new ATOM 381 N PRO A 25 100.371 -12.172 -5.311 1.00 0.00 N ATOM 382 CA PRO A 25 99.365 -11.468 -4.445 1.00 0.00 C ATOM 383 C PRO A 25 99.886 -11.116 -3.032 1.00 0.00 C ATOM 384 O PRO A 25 99.637 -10.008 -2.593 1.00 0.00 O ATOM 385 CB PRO A 25 98.204 -12.459 -4.379 1.00 0.00 C ATOM 386 CG PRO A 25 98.301 -13.186 -5.674 1.00 0.00 C ATOM 387 CD PRO A 25 99.771 -13.388 -5.902 1.00 0.00 C ATOM 0 HA PRO A 25 99.096 -10.497 -4.860 1.00 0.00 H new ATOM 0 HB2 PRO A 25 98.300 -13.135 -3.530 1.00 0.00 H new ATOM 0 HB3 PRO A 25 97.246 -11.950 -4.274 1.00 0.00 H new ATOM 0 HG2 PRO A 25 97.774 -14.139 -5.631 1.00 0.00 H new ATOM 0 HG3 PRO A 25 97.852 -12.610 -6.484 1.00 0.00 H new ATOM 0 HD2 PRO A 25 100.134 -14.294 -5.416 1.00 0.00 H new ATOM 0 HD3 PRO A 25 100.006 -13.479 -6.962 1.00 0.00 H new ATOM 395 N PRO A 26 100.586 -12.018 -2.346 1.00 0.00 N ATOM 396 CA PRO A 26 101.105 -11.696 -0.976 1.00 0.00 C ATOM 397 C PRO A 26 102.005 -10.450 -0.981 1.00 0.00 C ATOM 398 O PRO A 26 101.972 -9.666 -0.050 1.00 0.00 O ATOM 399 CB PRO A 26 101.901 -12.939 -0.567 1.00 0.00 C ATOM 400 CG PRO A 26 101.389 -14.031 -1.440 1.00 0.00 C ATOM 401 CD PRO A 26 100.967 -13.392 -2.730 1.00 0.00 C ATOM 0 HA PRO A 26 100.295 -11.466 -0.283 1.00 0.00 H new ATOM 0 HB2 PRO A 26 102.971 -12.787 -0.711 1.00 0.00 H new ATOM 0 HB3 PRO A 26 101.752 -13.174 0.487 1.00 0.00 H new ATOM 0 HG2 PRO A 26 102.161 -14.781 -1.614 1.00 0.00 H new ATOM 0 HG3 PRO A 26 100.549 -14.541 -0.968 1.00 0.00 H new ATOM 0 HD2 PRO A 26 101.778 -13.392 -3.458 1.00 0.00 H new ATOM 0 HD3 PRO A 26 100.131 -13.925 -3.184 1.00 0.00 H new ATOM 409 N TYR A 27 102.791 -10.273 -2.021 1.00 0.00 N ATOM 410 CA TYR A 27 103.749 -9.117 -2.077 1.00 0.00 C ATOM 411 C TYR A 27 102.985 -7.791 -2.147 1.00 0.00 C ATOM 412 O TYR A 27 103.303 -6.857 -1.434 1.00 0.00 O ATOM 413 CB TYR A 27 104.592 -9.307 -3.343 1.00 0.00 C ATOM 414 CG TYR A 27 105.676 -10.351 -3.208 1.00 0.00 C ATOM 415 CD1 TYR A 27 106.558 -10.332 -2.081 1.00 0.00 C ATOM 416 CD2 TYR A 27 105.821 -11.360 -4.209 1.00 0.00 C ATOM 417 CE1 TYR A 27 107.581 -11.322 -1.957 1.00 0.00 C ATOM 418 CE2 TYR A 27 106.845 -12.350 -4.086 1.00 0.00 C ATOM 419 CZ TYR A 27 107.725 -12.331 -2.960 1.00 0.00 C ATOM 420 OH TYR A 27 108.714 -13.287 -2.840 1.00 0.00 O ATOM 0 H TYR A 27 102.810 -10.883 -2.838 1.00 0.00 H new ATOM 0 HA TYR A 27 104.376 -9.087 -1.186 1.00 0.00 H new ATOM 0 HB2 TYR A 27 103.935 -9.585 -4.167 1.00 0.00 H new ATOM 0 HB3 TYR A 27 105.050 -8.354 -3.609 1.00 0.00 H new ATOM 0 HD1 TYR A 27 106.450 -9.569 -1.324 1.00 0.00 H new ATOM 0 HD2 TYR A 27 105.156 -11.375 -5.060 1.00 0.00 H new ATOM 0 HE1 TYR A 27 108.245 -11.308 -1.106 1.00 0.00 H new ATOM 0 HE2 TYR A 27 106.954 -13.112 -4.844 1.00 0.00 H new ATOM 0 HH TYR A 27 108.331 -14.110 -2.470 1.00 0.00 H new ATOM 430 N LYS A 28 101.985 -7.713 -2.998 1.00 0.00 N ATOM 431 CA LYS A 28 101.207 -6.437 -3.157 1.00 0.00 C ATOM 432 C LYS A 28 100.437 -6.119 -1.871 1.00 0.00 C ATOM 433 O LYS A 28 100.327 -4.967 -1.490 1.00 0.00 O ATOM 434 CB LYS A 28 100.233 -6.666 -4.318 1.00 0.00 C ATOM 435 CG LYS A 28 101.019 -6.859 -5.617 1.00 0.00 C ATOM 436 CD LYS A 28 100.055 -6.866 -6.805 1.00 0.00 C ATOM 437 CE LYS A 28 99.256 -8.171 -6.810 1.00 0.00 C ATOM 438 NZ LYS A 28 98.358 -8.068 -7.995 1.00 0.00 N ATOM 0 H LYS A 28 101.673 -8.481 -3.592 1.00 0.00 H new ATOM 0 HA LYS A 28 101.868 -5.594 -3.357 1.00 0.00 H new ATOM 0 HB2 LYS A 28 99.616 -7.543 -4.121 1.00 0.00 H new ATOM 0 HB3 LYS A 28 99.558 -5.816 -4.413 1.00 0.00 H new ATOM 0 HG2 LYS A 28 101.750 -6.059 -5.734 1.00 0.00 H new ATOM 0 HG3 LYS A 28 101.575 -7.796 -5.582 1.00 0.00 H new ATOM 0 HD2 LYS A 28 99.378 -6.014 -6.742 1.00 0.00 H new ATOM 0 HD3 LYS A 28 100.610 -6.764 -7.737 1.00 0.00 H new ATOM 0 HE2 LYS A 28 99.914 -9.037 -6.887 1.00 0.00 H new ATOM 0 HE3 LYS A 28 98.684 -8.287 -5.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 97.777 -8.928 -8.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 97.739 -7.239 -7.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 98.931 -7.965 -8.857 1.00 0.00 H new ATOM 452 N GLU A 29 99.916 -7.131 -1.211 1.00 0.00 N ATOM 453 CA GLU A 29 99.123 -6.908 0.045 1.00 0.00 C ATOM 454 C GLU A 29 100.021 -6.344 1.152 1.00 0.00 C ATOM 455 O GLU A 29 99.676 -5.362 1.785 1.00 0.00 O ATOM 456 CB GLU A 29 98.570 -8.278 0.455 1.00 0.00 C ATOM 457 CG GLU A 29 97.540 -8.104 1.574 1.00 0.00 C ATOM 458 CD GLU A 29 97.074 -9.477 2.061 1.00 0.00 C ATOM 459 OE1 GLU A 29 96.793 -10.318 1.222 1.00 0.00 O ATOM 460 OE2 GLU A 29 97.004 -9.664 3.264 1.00 0.00 O ATOM 0 H GLU A 29 100.007 -8.108 -1.491 1.00 0.00 H new ATOM 0 HA GLU A 29 98.320 -6.189 -0.119 1.00 0.00 H new ATOM 0 HB2 GLU A 29 98.110 -8.767 -0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 29 99.382 -8.923 0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 29 97.977 -7.543 2.400 1.00 0.00 H new ATOM 0 HG3 GLU A 29 96.689 -7.527 1.212 1.00 0.00 H new ATOM 467 N ILE A 30 101.162 -6.957 1.373 1.00 0.00 N ATOM 468 CA ILE A 30 102.058 -6.523 2.496 1.00 0.00 C ATOM 469 C ILE A 30 102.651 -5.139 2.193 1.00 0.00 C ATOM 470 O ILE A 30 102.777 -4.312 3.080 1.00 0.00 O ATOM 471 CB ILE A 30 103.137 -7.617 2.641 1.00 0.00 C ATOM 472 CG1 ILE A 30 104.016 -7.319 3.859 1.00 0.00 C ATOM 473 CG2 ILE A 30 104.024 -7.713 1.392 1.00 0.00 C ATOM 474 CD1 ILE A 30 104.808 -8.574 4.232 1.00 0.00 C ATOM 0 H ILE A 30 101.512 -7.741 0.823 1.00 0.00 H new ATOM 0 HA ILE A 30 101.519 -6.416 3.437 1.00 0.00 H new ATOM 0 HB ILE A 30 102.624 -8.570 2.768 1.00 0.00 H new ATOM 0 HG12 ILE A 30 104.698 -6.498 3.637 1.00 0.00 H new ATOM 0 HG13 ILE A 30 103.398 -7.002 4.699 1.00 0.00 H new ATOM 0 HG21 ILE A 30 104.770 -8.495 1.535 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.408 -7.954 0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.525 -6.759 1.227 1.00 0.00 H new ATOM 0 HD11 ILE A 30 105.435 -8.364 5.099 1.00 0.00 H new ATOM 0 HD12 ILE A 30 104.117 -9.383 4.471 1.00 0.00 H new ATOM 0 HD13 ILE A 30 105.437 -8.870 3.393 1.00 0.00 H new ATOM 486 N PHE A 31 103.001 -4.890 0.950 1.00 0.00 N ATOM 487 CA PHE A 31 103.589 -3.564 0.563 1.00 0.00 C ATOM 488 C PHE A 31 102.548 -2.451 0.724 1.00 0.00 C ATOM 489 O PHE A 31 102.841 -1.413 1.290 1.00 0.00 O ATOM 490 CB PHE A 31 104.026 -3.698 -0.904 1.00 0.00 C ATOM 491 CG PHE A 31 105.447 -4.184 -1.079 1.00 0.00 C ATOM 492 CD1 PHE A 31 106.512 -3.584 -0.334 1.00 0.00 C ATOM 493 CD2 PHE A 31 105.730 -5.243 -1.997 1.00 0.00 C ATOM 494 CE1 PHE A 31 107.854 -4.045 -0.506 1.00 0.00 C ATOM 495 CE2 PHE A 31 107.072 -5.704 -2.168 1.00 0.00 C ATOM 496 CZ PHE A 31 108.135 -5.104 -1.423 1.00 0.00 C ATOM 0 H PHE A 31 102.904 -5.554 0.182 1.00 0.00 H new ATOM 0 HA PHE A 31 104.434 -3.302 1.199 1.00 0.00 H new ATOM 0 HB2 PHE A 31 103.352 -4.387 -1.412 1.00 0.00 H new ATOM 0 HB3 PHE A 31 103.921 -2.730 -1.394 1.00 0.00 H new ATOM 0 HD1 PHE A 31 106.301 -2.782 0.358 1.00 0.00 H new ATOM 0 HD2 PHE A 31 104.928 -5.695 -2.562 1.00 0.00 H new ATOM 0 HE1 PHE A 31 108.656 -3.592 0.058 1.00 0.00 H new ATOM 0 HE2 PHE A 31 107.283 -6.506 -2.860 1.00 0.00 H new ATOM 0 HZ PHE A 31 109.149 -5.451 -1.553 1.00 0.00 H new ATOM 506 N LYS A 32 101.349 -2.666 0.232 1.00 0.00 N ATOM 507 CA LYS A 32 100.273 -1.624 0.339 1.00 0.00 C ATOM 508 C LYS A 32 99.872 -1.406 1.803 1.00 0.00 C ATOM 509 O LYS A 32 99.458 -0.320 2.168 1.00 0.00 O ATOM 510 CB LYS A 32 99.081 -2.148 -0.469 1.00 0.00 C ATOM 511 CG LYS A 32 98.049 -1.032 -0.641 1.00 0.00 C ATOM 512 CD LYS A 32 96.869 -1.550 -1.468 1.00 0.00 C ATOM 513 CE LYS A 32 95.874 -0.412 -1.706 1.00 0.00 C ATOM 514 NZ LYS A 32 95.033 -0.375 -0.476 1.00 0.00 N ATOM 0 H LYS A 32 101.067 -3.524 -0.242 1.00 0.00 H new ATOM 0 HA LYS A 32 100.620 -0.664 -0.044 1.00 0.00 H new ATOM 0 HB2 LYS A 32 99.416 -2.501 -1.444 1.00 0.00 H new ATOM 0 HB3 LYS A 32 98.630 -3.000 0.040 1.00 0.00 H new ATOM 0 HG2 LYS A 32 97.701 -0.690 0.334 1.00 0.00 H new ATOM 0 HG3 LYS A 32 98.505 -0.174 -1.136 1.00 0.00 H new ATOM 0 HD2 LYS A 32 97.224 -1.943 -2.421 1.00 0.00 H new ATOM 0 HD3 LYS A 32 96.379 -2.373 -0.947 1.00 0.00 H new ATOM 0 HE2 LYS A 32 96.388 0.536 -1.862 1.00 0.00 H new ATOM 0 HE3 LYS A 32 95.268 -0.596 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 94.252 0.299 -0.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 94.645 -1.322 -0.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 95.614 -0.075 0.333 1.00 0.00 H new ATOM 528 N LYS A 33 99.986 -2.424 2.625 1.00 0.00 N ATOM 529 CA LYS A 33 99.681 -2.268 4.086 1.00 0.00 C ATOM 530 C LYS A 33 100.731 -1.385 4.768 1.00 0.00 C ATOM 531 O LYS A 33 100.390 -0.559 5.597 1.00 0.00 O ATOM 532 CB LYS A 33 99.696 -3.678 4.686 1.00 0.00 C ATOM 533 CG LYS A 33 99.120 -3.638 6.103 1.00 0.00 C ATOM 534 CD LYS A 33 99.457 -4.941 6.830 1.00 0.00 C ATOM 535 CE LYS A 33 98.603 -6.078 6.266 1.00 0.00 C ATOM 536 NZ LYS A 33 98.580 -7.111 7.339 1.00 0.00 N ATOM 0 H LYS A 33 100.278 -3.360 2.346 1.00 0.00 H new ATOM 0 HA LYS A 33 98.714 -1.786 4.233 1.00 0.00 H new ATOM 0 HB2 LYS A 33 99.111 -4.355 4.064 1.00 0.00 H new ATOM 0 HB3 LYS A 33 100.715 -4.064 4.707 1.00 0.00 H new ATOM 0 HG2 LYS A 33 99.530 -2.788 6.649 1.00 0.00 H new ATOM 0 HG3 LYS A 33 98.039 -3.501 6.064 1.00 0.00 H new ATOM 0 HD2 LYS A 33 100.515 -5.173 6.710 1.00 0.00 H new ATOM 0 HD3 LYS A 33 99.274 -4.831 7.899 1.00 0.00 H new ATOM 0 HE2 LYS A 33 97.596 -5.735 6.027 1.00 0.00 H new ATOM 0 HE3 LYS A 33 99.032 -6.474 5.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 98.012 -7.924 7.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 99.551 -7.424 7.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 98.161 -6.707 8.201 1.00 0.00 H new ATOM 550 N ILE A 34 101.988 -1.556 4.424 1.00 0.00 N ATOM 551 CA ILE A 34 103.083 -0.802 5.119 1.00 0.00 C ATOM 552 C ILE A 34 103.189 0.610 4.524 1.00 0.00 C ATOM 553 O ILE A 34 103.425 1.565 5.242 1.00 0.00 O ATOM 554 CB ILE A 34 104.384 -1.601 4.898 1.00 0.00 C ATOM 555 CG1 ILE A 34 104.240 -3.028 5.443 1.00 0.00 C ATOM 556 CG2 ILE A 34 105.553 -0.929 5.630 1.00 0.00 C ATOM 557 CD1 ILE A 34 105.363 -3.901 4.879 1.00 0.00 C ATOM 0 H ILE A 34 102.303 -2.188 3.688 1.00 0.00 H new ATOM 0 HA ILE A 34 102.887 -0.693 6.186 1.00 0.00 H new ATOM 0 HB ILE A 34 104.577 -1.629 3.826 1.00 0.00 H new ATOM 0 HG12 ILE A 34 104.283 -3.020 6.532 1.00 0.00 H new ATOM 0 HG13 ILE A 34 103.270 -3.439 5.165 1.00 0.00 H new ATOM 0 HG21 ILE A 34 106.464 -1.504 5.465 1.00 0.00 H new ATOM 0 HG22 ILE A 34 105.688 0.083 5.248 1.00 0.00 H new ATOM 0 HG23 ILE A 34 105.338 -0.888 6.698 1.00 0.00 H new ATOM 0 HD11 ILE A 34 105.264 -4.916 5.264 1.00 0.00 H new ATOM 0 HD12 ILE A 34 105.299 -3.918 3.791 1.00 0.00 H new ATOM 0 HD13 ILE A 34 106.328 -3.492 5.179 1.00 0.00 H new ATOM 569 N LEU A 35 103.015 0.734 3.228 1.00 0.00 N ATOM 570 CA LEU A 35 103.213 2.049 2.541 1.00 0.00 C ATOM 571 C LEU A 35 101.876 2.711 2.187 1.00 0.00 C ATOM 572 O LEU A 35 101.804 3.923 2.080 1.00 0.00 O ATOM 573 CB LEU A 35 103.978 1.713 1.261 1.00 0.00 C ATOM 574 CG LEU A 35 105.382 1.212 1.604 1.00 0.00 C ATOM 575 CD1 LEU A 35 105.963 0.480 0.393 1.00 0.00 C ATOM 576 CD2 LEU A 35 106.275 2.403 1.959 1.00 0.00 C ATOM 0 H LEU A 35 102.741 -0.031 2.611 1.00 0.00 H new ATOM 0 HA LEU A 35 103.744 2.752 3.183 1.00 0.00 H new ATOM 0 HB2 LEU A 35 103.440 0.952 0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 35 104.044 2.596 0.625 1.00 0.00 H new ATOM 0 HG LEU A 35 105.333 0.532 2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 35 106.964 0.120 0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 35 105.324 -0.366 0.138 1.00 0.00 H new ATOM 0 HD13 LEU A 35 106.015 1.163 -0.455 1.00 0.00 H new ATOM 0 HD21 LEU A 35 107.276 2.047 2.204 1.00 0.00 H new ATOM 0 HD22 LEU A 35 106.329 3.083 1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 35 105.857 2.928 2.818 1.00 0.00 H new ATOM 588 N GLY A 36 100.833 1.931 2.010 1.00 0.00 N ATOM 589 CA GLY A 36 99.545 2.473 1.479 1.00 0.00 C ATOM 590 C GLY A 36 99.551 2.534 -0.057 1.00 0.00 C ATOM 591 O GLY A 36 98.692 3.179 -0.633 1.00 0.00 O ATOM 0 H GLY A 36 100.823 0.932 2.214 1.00 0.00 H new ATOM 0 HA2 GLY A 36 98.719 1.847 1.816 1.00 0.00 H new ATOM 0 HA3 GLY A 36 99.375 3.471 1.883 1.00 0.00 H new ATOM 595 N PHE A 37 100.491 1.888 -0.723 1.00 0.00 N ATOM 596 CA PHE A 37 100.415 1.741 -2.211 1.00 0.00 C ATOM 597 C PHE A 37 101.145 0.472 -2.666 1.00 0.00 C ATOM 598 O PHE A 37 101.899 -0.114 -1.908 1.00 0.00 O ATOM 599 CB PHE A 37 101.072 3.002 -2.787 1.00 0.00 C ATOM 600 CG PHE A 37 102.538 3.178 -2.446 1.00 0.00 C ATOM 601 CD1 PHE A 37 103.524 2.361 -3.082 1.00 0.00 C ATOM 602 CD2 PHE A 37 102.938 4.175 -1.502 1.00 0.00 C ATOM 603 CE1 PHE A 37 104.908 2.538 -2.773 1.00 0.00 C ATOM 604 CE2 PHE A 37 104.322 4.351 -1.191 1.00 0.00 C ATOM 605 CZ PHE A 37 105.307 3.533 -1.827 1.00 0.00 C ATOM 0 H PHE A 37 101.309 1.457 -0.292 1.00 0.00 H new ATOM 0 HA PHE A 37 99.386 1.641 -2.557 1.00 0.00 H new ATOM 0 HB2 PHE A 37 100.967 2.984 -3.872 1.00 0.00 H new ATOM 0 HB3 PHE A 37 100.525 3.874 -2.428 1.00 0.00 H new ATOM 0 HD1 PHE A 37 103.223 1.609 -3.797 1.00 0.00 H new ATOM 0 HD2 PHE A 37 102.194 4.795 -1.024 1.00 0.00 H new ATOM 0 HE1 PHE A 37 105.652 1.920 -3.254 1.00 0.00 H new ATOM 0 HE2 PHE A 37 104.624 5.102 -0.476 1.00 0.00 H new ATOM 0 HZ PHE A 37 106.353 3.667 -1.593 1.00 0.00 H new ATOM 615 N GLU A 38 100.920 0.059 -3.893 1.00 0.00 N ATOM 616 CA GLU A 38 101.653 -1.113 -4.465 1.00 0.00 C ATOM 617 C GLU A 38 102.858 -0.624 -5.289 1.00 0.00 C ATOM 618 O GLU A 38 102.646 -0.016 -6.322 1.00 0.00 O ATOM 619 CB GLU A 38 100.639 -1.815 -5.371 1.00 0.00 C ATOM 620 CG GLU A 38 99.590 -2.523 -4.513 1.00 0.00 C ATOM 621 CD GLU A 38 98.348 -2.811 -5.360 1.00 0.00 C ATOM 622 OE1 GLU A 38 97.884 -1.900 -6.025 1.00 0.00 O ATOM 623 OE2 GLU A 38 97.882 -3.938 -5.327 1.00 0.00 O ATOM 0 H GLU A 38 100.250 0.492 -4.529 1.00 0.00 H new ATOM 0 HA GLU A 38 102.037 -1.779 -3.692 1.00 0.00 H new ATOM 0 HB2 GLU A 38 100.158 -1.089 -6.027 1.00 0.00 H new ATOM 0 HB3 GLU A 38 101.146 -2.536 -6.012 1.00 0.00 H new ATOM 0 HG2 GLU A 38 99.997 -3.453 -4.117 1.00 0.00 H new ATOM 0 HG3 GLU A 38 99.324 -1.901 -3.658 1.00 0.00 H new ATOM 630 N PRO A 39 104.076 -0.887 -4.837 1.00 0.00 N ATOM 631 CA PRO A 39 105.282 -0.370 -5.557 1.00 0.00 C ATOM 632 C PRO A 39 105.427 -1.048 -6.923 1.00 0.00 C ATOM 633 O PRO A 39 104.871 -2.109 -7.149 1.00 0.00 O ATOM 634 CB PRO A 39 106.436 -0.751 -4.630 1.00 0.00 C ATOM 635 CG PRO A 39 105.929 -1.961 -3.927 1.00 0.00 C ATOM 636 CD PRO A 39 104.484 -1.672 -3.652 1.00 0.00 C ATOM 0 HA PRO A 39 105.237 0.700 -5.759 1.00 0.00 H new ATOM 0 HB2 PRO A 39 107.347 -0.963 -5.189 1.00 0.00 H new ATOM 0 HB3 PRO A 39 106.671 0.051 -3.930 1.00 0.00 H new ATOM 0 HG2 PRO A 39 106.043 -2.853 -4.544 1.00 0.00 H new ATOM 0 HG3 PRO A 39 106.479 -2.140 -3.003 1.00 0.00 H new ATOM 0 HD2 PRO A 39 103.900 -2.587 -3.552 1.00 0.00 H new ATOM 0 HD3 PRO A 39 104.353 -1.108 -2.728 1.00 0.00 H new ATOM 644 N TYR A 40 106.167 -0.436 -7.821 1.00 0.00 N ATOM 645 CA TYR A 40 106.363 -1.019 -9.190 1.00 0.00 C ATOM 646 C TYR A 40 107.321 -2.210 -9.119 1.00 0.00 C ATOM 647 O TYR A 40 108.018 -2.384 -8.133 1.00 0.00 O ATOM 648 CB TYR A 40 106.976 0.094 -10.046 1.00 0.00 C ATOM 649 CG TYR A 40 107.127 -0.279 -11.502 1.00 0.00 C ATOM 650 CD1 TYR A 40 106.067 -0.013 -12.423 1.00 0.00 C ATOM 651 CD2 TYR A 40 108.331 -0.900 -11.957 1.00 0.00 C ATOM 652 CE1 TYR A 40 106.212 -0.367 -13.801 1.00 0.00 C ATOM 653 CE2 TYR A 40 108.476 -1.254 -13.334 1.00 0.00 C ATOM 654 CZ TYR A 40 107.417 -0.987 -14.256 1.00 0.00 C ATOM 655 OH TYR A 40 107.556 -1.329 -15.586 1.00 0.00 O ATOM 0 H TYR A 40 106.647 0.450 -7.662 1.00 0.00 H new ATOM 0 HA TYR A 40 105.422 -1.373 -9.610 1.00 0.00 H new ATOM 0 HB2 TYR A 40 106.352 0.985 -9.970 1.00 0.00 H new ATOM 0 HB3 TYR A 40 107.955 0.355 -9.643 1.00 0.00 H new ATOM 0 HD1 TYR A 40 105.157 0.455 -12.078 1.00 0.00 H new ATOM 0 HD2 TYR A 40 109.131 -1.102 -11.260 1.00 0.00 H new ATOM 0 HE1 TYR A 40 105.411 -0.166 -14.498 1.00 0.00 H new ATOM 0 HE2 TYR A 40 109.386 -1.723 -13.678 1.00 0.00 H new ATOM 0 HH TYR A 40 108.434 -1.740 -15.728 1.00 0.00 H new ATOM 665 N GLU A 41 107.358 -3.018 -10.156 1.00 0.00 N ATOM 666 CA GLU A 41 108.285 -4.196 -10.171 1.00 0.00 C ATOM 667 C GLU A 41 109.702 -3.736 -10.545 1.00 0.00 C ATOM 668 O GLU A 41 110.138 -3.872 -11.676 1.00 0.00 O ATOM 669 CB GLU A 41 107.721 -5.156 -11.228 1.00 0.00 C ATOM 670 CG GLU A 41 106.366 -5.694 -10.763 1.00 0.00 C ATOM 671 CD GLU A 41 105.827 -6.679 -11.802 1.00 0.00 C ATOM 672 OE1 GLU A 41 105.128 -6.239 -12.700 1.00 0.00 O ATOM 673 OE2 GLU A 41 106.120 -7.857 -11.681 1.00 0.00 O ATOM 0 H GLU A 41 106.785 -2.911 -10.993 1.00 0.00 H new ATOM 0 HA GLU A 41 108.352 -4.682 -9.197 1.00 0.00 H new ATOM 0 HB2 GLU A 41 107.610 -4.639 -12.181 1.00 0.00 H new ATOM 0 HB3 GLU A 41 108.414 -5.981 -11.391 1.00 0.00 H new ATOM 0 HG2 GLU A 41 106.471 -6.188 -9.797 1.00 0.00 H new ATOM 0 HG3 GLU A 41 105.663 -4.872 -10.626 1.00 0.00 H new ATOM 680 N GLY A 42 110.412 -3.186 -9.585 1.00 0.00 N ATOM 681 CA GLY A 42 111.841 -2.801 -9.795 1.00 0.00 C ATOM 682 C GLY A 42 112.405 -2.210 -8.500 1.00 0.00 C ATOM 683 O GLY A 42 111.665 -1.954 -7.567 1.00 0.00 O ATOM 0 H GLY A 42 110.053 -2.986 -8.652 1.00 0.00 H new ATOM 0 HA2 GLY A 42 112.424 -3.672 -10.094 1.00 0.00 H new ATOM 0 HA3 GLY A 42 111.918 -2.074 -10.603 1.00 0.00 H new ATOM 687 N THR A 43 113.701 -1.997 -8.449 1.00 0.00 N ATOM 688 CA THR A 43 114.333 -1.363 -7.249 1.00 0.00 C ATOM 689 C THR A 43 115.390 -0.340 -7.672 1.00 0.00 C ATOM 690 O THR A 43 115.916 -0.401 -8.768 1.00 0.00 O ATOM 691 CB THR A 43 114.988 -2.498 -6.451 1.00 0.00 C ATOM 692 OG1 THR A 43 115.567 -3.454 -7.330 1.00 0.00 O ATOM 693 CG2 THR A 43 113.943 -3.175 -5.565 1.00 0.00 C ATOM 0 H THR A 43 114.352 -2.238 -9.196 1.00 0.00 H new ATOM 0 HA THR A 43 113.590 -0.834 -6.653 1.00 0.00 H new ATOM 0 HB THR A 43 115.776 -2.078 -5.826 1.00 0.00 H new ATOM 0 HG1 THR A 43 115.982 -4.171 -6.806 1.00 0.00 H new ATOM 0 HG21 THR A 43 114.412 -3.981 -5.000 1.00 0.00 H new ATOM 0 HG22 THR A 43 113.523 -2.444 -4.874 1.00 0.00 H new ATOM 0 HG23 THR A 43 113.148 -3.584 -6.188 1.00 0.00 H new ATOM 701 N LEU A 44 115.688 0.593 -6.798 1.00 0.00 N ATOM 702 CA LEU A 44 116.834 1.524 -7.012 1.00 0.00 C ATOM 703 C LEU A 44 117.938 1.181 -6.010 1.00 0.00 C ATOM 704 O LEU A 44 117.737 1.295 -4.813 1.00 0.00 O ATOM 705 CB LEU A 44 116.262 2.921 -6.745 1.00 0.00 C ATOM 706 CG LEU A 44 117.318 3.992 -7.036 1.00 0.00 C ATOM 707 CD1 LEU A 44 117.552 4.087 -8.545 1.00 0.00 C ATOM 708 CD2 LEU A 44 116.828 5.344 -6.513 1.00 0.00 C ATOM 0 H LEU A 44 115.174 0.748 -5.931 1.00 0.00 H new ATOM 0 HA LEU A 44 117.265 1.459 -8.011 1.00 0.00 H new ATOM 0 HB2 LEU A 44 115.384 3.087 -7.369 1.00 0.00 H new ATOM 0 HB3 LEU A 44 115.935 2.995 -5.708 1.00 0.00 H new ATOM 0 HG LEU A 44 118.251 3.723 -6.541 1.00 0.00 H new ATOM 0 HD11 LEU A 44 118.304 4.850 -8.749 1.00 0.00 H new ATOM 0 HD12 LEU A 44 117.900 3.125 -8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 44 116.619 4.355 -9.042 1.00 0.00 H new ATOM 0 HD21 LEU A 44 117.578 6.107 -6.719 1.00 0.00 H new ATOM 0 HD22 LEU A 44 115.894 5.609 -7.009 1.00 0.00 H new ATOM 0 HD23 LEU A 44 116.662 5.280 -5.438 1.00 0.00 H new ATOM 720 N ASN A 45 119.084 0.763 -6.494 1.00 0.00 N ATOM 721 CA ASN A 45 120.194 0.346 -5.586 1.00 0.00 C ATOM 722 C ASN A 45 121.198 1.491 -5.426 1.00 0.00 C ATOM 723 O ASN A 45 121.769 1.951 -6.399 1.00 0.00 O ATOM 724 CB ASN A 45 120.853 -0.847 -6.280 1.00 0.00 C ATOM 725 CG ASN A 45 119.984 -2.092 -6.096 1.00 0.00 C ATOM 726 OD1 ASN A 45 118.828 -2.102 -6.470 1.00 0.00 O ATOM 727 ND2 ASN A 45 120.497 -3.151 -5.532 1.00 0.00 N ATOM 0 H ASN A 45 119.297 0.693 -7.489 1.00 0.00 H new ATOM 0 HA ASN A 45 119.836 0.089 -4.589 1.00 0.00 H new ATOM 0 HB2 ASN A 45 120.984 -0.636 -7.341 1.00 0.00 H new ATOM 0 HB3 ASN A 45 121.846 -1.019 -5.864 1.00 0.00 H new ATOM 0 HD21 ASN A 45 119.928 -3.988 -5.405 1.00 0.00 H new ATOM 0 HD22 ASN A 45 121.467 -3.142 -5.218 1.00 0.00 H new ATOM 734 N LEU A 46 121.407 1.941 -4.210 1.00 0.00 N ATOM 735 CA LEU A 46 122.336 3.086 -3.958 1.00 0.00 C ATOM 736 C LEU A 46 123.480 2.660 -3.034 1.00 0.00 C ATOM 737 O LEU A 46 123.261 1.988 -2.042 1.00 0.00 O ATOM 738 CB LEU A 46 121.480 4.164 -3.292 1.00 0.00 C ATOM 739 CG LEU A 46 120.577 4.824 -4.337 1.00 0.00 C ATOM 740 CD1 LEU A 46 119.530 5.688 -3.633 1.00 0.00 C ATOM 741 CD2 LEU A 46 121.422 5.706 -5.260 1.00 0.00 C ATOM 0 H LEU A 46 120.967 1.558 -3.373 1.00 0.00 H new ATOM 0 HA LEU A 46 122.795 3.445 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 46 120.874 3.723 -2.500 1.00 0.00 H new ATOM 0 HB3 LEU A 46 122.120 4.913 -2.825 1.00 0.00 H new ATOM 0 HG LEU A 46 120.080 4.052 -4.924 1.00 0.00 H new ATOM 0 HD11 LEU A 46 118.887 6.158 -4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 46 118.927 5.064 -2.974 1.00 0.00 H new ATOM 0 HD13 LEU A 46 120.029 6.459 -3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 46 120.778 6.176 -6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 46 121.919 6.477 -4.672 1.00 0.00 H new ATOM 0 HD23 LEU A 46 122.171 5.094 -5.763 1.00 0.00 H new ATOM 753 N LYS A 47 124.688 3.052 -3.368 1.00 0.00 N ATOM 754 CA LYS A 47 125.858 2.817 -2.470 1.00 0.00 C ATOM 755 C LYS A 47 126.114 4.073 -1.632 1.00 0.00 C ATOM 756 O LYS A 47 126.125 5.171 -2.160 1.00 0.00 O ATOM 757 CB LYS A 47 127.037 2.544 -3.411 1.00 0.00 C ATOM 758 CG LYS A 47 128.263 2.117 -2.601 1.00 0.00 C ATOM 759 CD LYS A 47 129.476 2.019 -3.528 1.00 0.00 C ATOM 760 CE LYS A 47 130.670 1.458 -2.753 1.00 0.00 C ATOM 761 NZ LYS A 47 131.792 1.447 -3.731 1.00 0.00 N ATOM 0 H LYS A 47 124.913 3.532 -4.239 1.00 0.00 H new ATOM 0 HA LYS A 47 125.700 1.989 -1.779 1.00 0.00 H new ATOM 0 HB2 LYS A 47 126.771 1.763 -4.124 1.00 0.00 H new ATOM 0 HB3 LYS A 47 127.266 3.439 -3.990 1.00 0.00 H new ATOM 0 HG2 LYS A 47 128.456 2.837 -1.806 1.00 0.00 H new ATOM 0 HG3 LYS A 47 128.079 1.155 -2.122 1.00 0.00 H new ATOM 0 HD2 LYS A 47 129.246 1.376 -4.377 1.00 0.00 H new ATOM 0 HD3 LYS A 47 129.720 3.003 -3.930 1.00 0.00 H new ATOM 0 HE2 LYS A 47 130.906 2.078 -1.888 1.00 0.00 H new ATOM 0 HE3 LYS A 47 130.462 0.455 -2.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 132.648 1.074 -3.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 131.541 0.843 -4.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 131.972 2.416 -4.064 1.00 0.00 H new ATOM 775 N LEU A 48 126.314 3.907 -0.345 1.00 0.00 N ATOM 776 CA LEU A 48 126.515 5.076 0.564 1.00 0.00 C ATOM 777 C LEU A 48 127.956 5.115 1.075 1.00 0.00 C ATOM 778 O LEU A 48 128.656 4.117 1.038 1.00 0.00 O ATOM 779 CB LEU A 48 125.560 4.861 1.740 1.00 0.00 C ATOM 780 CG LEU A 48 124.107 4.913 1.265 1.00 0.00 C ATOM 781 CD1 LEU A 48 123.191 4.443 2.396 1.00 0.00 C ATOM 782 CD2 LEU A 48 123.742 6.350 0.884 1.00 0.00 C ATOM 0 H LEU A 48 126.346 2.998 0.117 1.00 0.00 H new ATOM 0 HA LEU A 48 126.323 6.016 0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 48 125.762 3.898 2.209 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.729 5.626 2.498 1.00 0.00 H new ATOM 0 HG LEU A 48 123.985 4.266 0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 48 122.154 4.478 2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 48 123.449 3.421 2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 48 123.316 5.095 3.261 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.706 6.385 0.546 1.00 0.00 H new ATOM 0 HD22 LEU A 48 123.862 6.998 1.752 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.397 6.691 0.083 1.00 0.00 H new ATOM 794 N ASP A 49 128.389 6.262 1.544 1.00 0.00 N ATOM 795 CA ASP A 49 129.714 6.361 2.237 1.00 0.00 C ATOM 796 C ASP A 49 129.590 6.104 3.752 1.00 0.00 C ATOM 797 O ASP A 49 130.522 6.373 4.489 1.00 0.00 O ATOM 798 CB ASP A 49 130.232 7.783 1.954 1.00 0.00 C ATOM 799 CG ASP A 49 129.283 8.854 2.511 1.00 0.00 C ATOM 800 OD1 ASP A 49 128.121 8.840 2.140 1.00 0.00 O ATOM 801 OD2 ASP A 49 129.738 9.669 3.296 1.00 0.00 O ATOM 0 H ASP A 49 127.876 7.141 1.476 1.00 0.00 H new ATOM 0 HA ASP A 49 130.404 5.602 1.867 1.00 0.00 H new ATOM 0 HB2 ASP A 49 131.220 7.906 2.398 1.00 0.00 H new ATOM 0 HB3 ASP A 49 130.346 7.922 0.879 1.00 0.00 H new ATOM 806 N ARG A 50 128.465 5.593 4.215 1.00 0.00 N ATOM 807 CA ARG A 50 128.263 5.355 5.677 1.00 0.00 C ATOM 808 C ARG A 50 127.405 4.102 5.877 1.00 0.00 C ATOM 809 O ARG A 50 126.472 3.869 5.128 1.00 0.00 O ATOM 810 CB ARG A 50 127.521 6.591 6.192 1.00 0.00 C ATOM 811 CG ARG A 50 128.421 7.825 6.097 1.00 0.00 C ATOM 812 CD ARG A 50 127.724 9.014 6.764 1.00 0.00 C ATOM 813 NE ARG A 50 127.665 8.689 8.229 1.00 0.00 N ATOM 814 CZ ARG A 50 126.761 9.206 9.038 1.00 0.00 C ATOM 815 NH1 ARG A 50 125.854 10.070 8.644 1.00 0.00 N ATOM 816 NH2 ARG A 50 126.778 8.852 10.295 1.00 0.00 N ATOM 0 H ARG A 50 127.673 5.330 3.629 1.00 0.00 H new ATOM 0 HA ARG A 50 129.204 5.201 6.205 1.00 0.00 H new ATOM 0 HB2 ARG A 50 126.613 6.748 5.610 1.00 0.00 H new ATOM 0 HB3 ARG A 50 127.213 6.435 7.226 1.00 0.00 H new ATOM 0 HG2 ARG A 50 129.377 7.630 6.583 1.00 0.00 H new ATOM 0 HG3 ARG A 50 128.635 8.053 5.053 1.00 0.00 H new ATOM 0 HD2 ARG A 50 128.276 9.938 6.591 1.00 0.00 H new ATOM 0 HD3 ARG A 50 126.724 9.159 6.356 1.00 0.00 H new ATOM 0 HE ARG A 50 128.353 8.042 8.614 1.00 0.00 H new ATOM 0 HH11 ARG A 50 125.826 10.372 7.670 1.00 0.00 H new ATOM 0 HH12 ARG A 50 125.177 10.439 9.312 1.00 0.00 H new ATOM 0 HH21 ARG A 50 127.479 8.191 10.629 1.00 0.00 H new ATOM 0 HH22 ARG A 50 126.090 9.237 10.943 1.00 0.00 H new ATOM 830 N GLU A 51 127.717 3.306 6.877 1.00 0.00 N ATOM 831 CA GLU A 51 126.905 2.075 7.171 1.00 0.00 C ATOM 832 C GLU A 51 125.469 2.453 7.561 1.00 0.00 C ATOM 833 O GLU A 51 125.248 3.485 8.171 1.00 0.00 O ATOM 834 CB GLU A 51 127.614 1.338 8.322 1.00 0.00 C ATOM 835 CG GLU A 51 127.746 2.230 9.564 1.00 0.00 C ATOM 836 CD GLU A 51 128.131 1.371 10.771 1.00 0.00 C ATOM 837 OE1 GLU A 51 127.297 0.601 11.215 1.00 0.00 O ATOM 838 OE2 GLU A 51 129.255 1.499 11.230 1.00 0.00 O ATOM 0 H GLU A 51 128.505 3.457 7.507 1.00 0.00 H new ATOM 0 HA GLU A 51 126.834 1.435 6.291 1.00 0.00 H new ATOM 0 HB2 GLU A 51 127.056 0.437 8.577 1.00 0.00 H new ATOM 0 HB3 GLU A 51 128.604 1.018 7.996 1.00 0.00 H new ATOM 0 HG2 GLU A 51 128.501 2.998 9.395 1.00 0.00 H new ATOM 0 HG3 GLU A 51 126.805 2.745 9.756 1.00 0.00 H new ATOM 845 N PHE A 52 124.512 1.624 7.213 1.00 0.00 N ATOM 846 CA PHE A 52 123.081 1.916 7.536 1.00 0.00 C ATOM 847 C PHE A 52 122.407 0.689 8.157 1.00 0.00 C ATOM 848 O PHE A 52 122.613 -0.426 7.712 1.00 0.00 O ATOM 849 CB PHE A 52 122.432 2.267 6.195 1.00 0.00 C ATOM 850 CG PHE A 52 120.988 2.695 6.321 1.00 0.00 C ATOM 851 CD1 PHE A 52 120.668 4.059 6.608 1.00 0.00 C ATOM 852 CD2 PHE A 52 119.943 1.734 6.159 1.00 0.00 C ATOM 853 CE1 PHE A 52 119.303 4.460 6.734 1.00 0.00 C ATOM 854 CE2 PHE A 52 118.577 2.136 6.284 1.00 0.00 C ATOM 855 CZ PHE A 52 118.257 3.500 6.572 1.00 0.00 C ATOM 0 H PHE A 52 124.665 0.748 6.713 1.00 0.00 H new ATOM 0 HA PHE A 52 122.983 2.725 8.260 1.00 0.00 H new ATOM 0 HB2 PHE A 52 123.001 3.068 5.723 1.00 0.00 H new ATOM 0 HB3 PHE A 52 122.491 1.402 5.534 1.00 0.00 H new ATOM 0 HD1 PHE A 52 121.458 4.785 6.729 1.00 0.00 H new ATOM 0 HD2 PHE A 52 120.185 0.704 5.942 1.00 0.00 H new ATOM 0 HE1 PHE A 52 119.061 5.490 6.952 1.00 0.00 H new ATOM 0 HE2 PHE A 52 117.787 1.410 6.161 1.00 0.00 H new ATOM 0 HZ PHE A 52 117.225 3.804 6.667 1.00 0.00 H new ATOM 865 N ASP A 53 121.608 0.902 9.178 1.00 0.00 N ATOM 866 CA ASP A 53 120.814 -0.206 9.790 1.00 0.00 C ATOM 867 C ASP A 53 119.395 0.283 10.104 1.00 0.00 C ATOM 868 O ASP A 53 119.224 1.285 10.776 1.00 0.00 O ATOM 869 CB ASP A 53 121.556 -0.566 11.079 1.00 0.00 C ATOM 870 CG ASP A 53 122.911 -1.192 10.736 1.00 0.00 C ATOM 871 OD1 ASP A 53 122.947 -2.032 9.853 1.00 0.00 O ATOM 872 OD2 ASP A 53 123.887 -0.819 11.365 1.00 0.00 O ATOM 0 H ASP A 53 121.473 1.812 9.618 1.00 0.00 H new ATOM 0 HA ASP A 53 120.719 -1.065 9.126 1.00 0.00 H new ATOM 0 HB2 ASP A 53 121.700 0.326 11.688 1.00 0.00 H new ATOM 0 HB3 ASP A 53 120.962 -1.263 11.670 1.00 0.00 H new ATOM 877 N ILE A 54 118.394 -0.421 9.623 1.00 0.00 N ATOM 878 CA ILE A 54 116.969 -0.010 9.874 1.00 0.00 C ATOM 879 C ILE A 54 116.628 -0.056 11.377 1.00 0.00 C ATOM 880 O ILE A 54 115.705 0.612 11.810 1.00 0.00 O ATOM 881 CB ILE A 54 116.093 -0.973 9.045 1.00 0.00 C ATOM 882 CG1 ILE A 54 114.621 -0.554 9.147 1.00 0.00 C ATOM 883 CG2 ILE A 54 116.256 -2.421 9.525 1.00 0.00 C ATOM 884 CD1 ILE A 54 113.795 -1.284 8.087 1.00 0.00 C ATOM 0 H ILE A 54 118.502 -1.267 9.064 1.00 0.00 H new ATOM 0 HA ILE A 54 116.792 1.022 9.572 1.00 0.00 H new ATOM 0 HB ILE A 54 116.417 -0.920 8.006 1.00 0.00 H new ATOM 0 HG12 ILE A 54 114.237 -0.784 10.141 1.00 0.00 H new ATOM 0 HG13 ILE A 54 114.531 0.524 9.012 1.00 0.00 H new ATOM 0 HG21 ILE A 54 115.627 -3.077 8.923 1.00 0.00 H new ATOM 0 HG22 ILE A 54 117.298 -2.723 9.423 1.00 0.00 H new ATOM 0 HG23 ILE A 54 115.958 -2.493 10.571 1.00 0.00 H new ATOM 0 HD11 ILE A 54 112.751 -0.981 8.167 1.00 0.00 H new ATOM 0 HD12 ILE A 54 114.171 -1.032 7.095 1.00 0.00 H new ATOM 0 HD13 ILE A 54 113.873 -2.360 8.242 1.00 0.00 H new ATOM 896 N ASN A 55 117.356 -0.828 12.157 1.00 0.00 N ATOM 897 CA ASN A 55 117.058 -0.942 13.625 1.00 0.00 C ATOM 898 C ASN A 55 117.500 0.307 14.407 1.00 0.00 C ATOM 899 O ASN A 55 117.306 0.362 15.609 1.00 0.00 O ATOM 900 CB ASN A 55 117.826 -2.172 14.123 1.00 0.00 C ATOM 901 CG ASN A 55 117.264 -3.433 13.464 1.00 0.00 C ATOM 902 OD1 ASN A 55 116.071 -3.551 13.268 1.00 0.00 O ATOM 903 ND2 ASN A 55 118.081 -4.387 13.108 1.00 0.00 N ATOM 0 H ASN A 55 118.147 -1.386 11.837 1.00 0.00 H new ATOM 0 HA ASN A 55 115.983 -1.035 13.782 1.00 0.00 H new ATOM 0 HB2 ASN A 55 118.886 -2.070 13.890 1.00 0.00 H new ATOM 0 HB3 ASN A 55 117.744 -2.249 15.207 1.00 0.00 H new ATOM 0 HD21 ASN A 55 117.718 -5.231 12.665 1.00 0.00 H new ATOM 0 HD22 ASN A 55 119.083 -4.288 13.272 1.00 0.00 H new ATOM 910 N LYS A 56 118.083 1.294 13.755 1.00 0.00 N ATOM 911 CA LYS A 56 118.353 2.606 14.427 1.00 0.00 C ATOM 912 C LYS A 56 117.181 3.585 14.243 1.00 0.00 C ATOM 913 O LYS A 56 117.118 4.586 14.936 1.00 0.00 O ATOM 914 CB LYS A 56 119.623 3.154 13.771 1.00 0.00 C ATOM 915 CG LYS A 56 120.812 2.260 14.132 1.00 0.00 C ATOM 916 CD LYS A 56 122.099 2.870 13.573 1.00 0.00 C ATOM 917 CE LYS A 56 123.270 1.920 13.833 1.00 0.00 C ATOM 918 NZ LYS A 56 124.297 2.288 12.818 1.00 0.00 N ATOM 0 H LYS A 56 118.383 1.243 12.782 1.00 0.00 H new ATOM 0 HA LYS A 56 118.474 2.478 15.503 1.00 0.00 H new ATOM 0 HB2 LYS A 56 119.499 3.192 12.689 1.00 0.00 H new ATOM 0 HB3 LYS A 56 119.807 4.175 14.107 1.00 0.00 H new ATOM 0 HG2 LYS A 56 120.887 2.156 15.214 1.00 0.00 H new ATOM 0 HG3 LYS A 56 120.665 1.260 13.725 1.00 0.00 H new ATOM 0 HD2 LYS A 56 121.994 3.050 12.503 1.00 0.00 H new ATOM 0 HD3 LYS A 56 122.290 3.836 14.041 1.00 0.00 H new ATOM 0 HE2 LYS A 56 123.656 2.037 14.846 1.00 0.00 H new ATOM 0 HE3 LYS A 56 122.965 0.879 13.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 125.132 1.679 12.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 123.903 2.160 11.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 124.573 3.282 12.948 1.00 0.00 H new ATOM 932 N PHE A 57 116.268 3.315 13.332 1.00 0.00 N ATOM 933 CA PHE A 57 115.040 4.156 13.188 1.00 0.00 C ATOM 934 C PHE A 57 113.800 3.302 13.472 1.00 0.00 C ATOM 935 O PHE A 57 113.912 2.106 13.674 1.00 0.00 O ATOM 936 CB PHE A 57 115.024 4.651 11.737 1.00 0.00 C ATOM 937 CG PHE A 57 116.277 5.389 11.319 1.00 0.00 C ATOM 938 CD1 PHE A 57 116.371 6.803 11.499 1.00 0.00 C ATOM 939 CD2 PHE A 57 117.370 4.666 10.749 1.00 0.00 C ATOM 940 CE1 PHE A 57 117.558 7.495 11.108 1.00 0.00 C ATOM 941 CE2 PHE A 57 118.558 5.359 10.356 1.00 0.00 C ATOM 942 CZ PHE A 57 118.652 6.773 10.536 1.00 0.00 C ATOM 0 H PHE A 57 116.327 2.536 12.676 1.00 0.00 H new ATOM 0 HA PHE A 57 115.038 4.993 13.886 1.00 0.00 H new ATOM 0 HB2 PHE A 57 114.881 3.797 11.075 1.00 0.00 H new ATOM 0 HB3 PHE A 57 114.166 5.308 11.599 1.00 0.00 H new ATOM 0 HD1 PHE A 57 115.545 7.349 11.931 1.00 0.00 H new ATOM 0 HD2 PHE A 57 117.299 3.597 10.615 1.00 0.00 H new ATOM 0 HE1 PHE A 57 117.629 8.564 11.244 1.00 0.00 H new ATOM 0 HE2 PHE A 57 119.384 4.813 9.923 1.00 0.00 H new ATOM 0 HZ PHE A 57 119.549 7.297 10.240 1.00 0.00 H new ATOM 952 N LYS A 58 112.636 3.912 13.484 1.00 0.00 N ATOM 953 CA LYS A 58 111.380 3.168 13.818 1.00 0.00 C ATOM 954 C LYS A 58 110.750 2.602 12.541 1.00 0.00 C ATOM 955 O LYS A 58 110.143 3.328 11.773 1.00 0.00 O ATOM 956 CB LYS A 58 110.450 4.196 14.468 1.00 0.00 C ATOM 957 CG LYS A 58 111.033 4.637 15.813 1.00 0.00 C ATOM 958 CD LYS A 58 109.997 5.468 16.575 1.00 0.00 C ATOM 959 CE LYS A 58 109.851 6.839 15.912 1.00 0.00 C ATOM 960 NZ LYS A 58 108.714 7.490 16.621 1.00 0.00 N ATOM 0 H LYS A 58 112.503 4.901 13.275 1.00 0.00 H new ATOM 0 HA LYS A 58 111.570 2.326 14.484 1.00 0.00 H new ATOM 0 HB2 LYS A 58 110.329 5.058 13.812 1.00 0.00 H new ATOM 0 HB3 LYS A 58 109.459 3.765 14.613 1.00 0.00 H new ATOM 0 HG2 LYS A 58 111.318 3.764 16.401 1.00 0.00 H new ATOM 0 HG3 LYS A 58 111.938 5.223 15.654 1.00 0.00 H new ATOM 0 HD2 LYS A 58 109.037 4.952 16.583 1.00 0.00 H new ATOM 0 HD3 LYS A 58 110.304 5.586 17.614 1.00 0.00 H new ATOM 0 HE2 LYS A 58 110.765 7.425 16.011 1.00 0.00 H new ATOM 0 HE3 LYS A 58 109.648 6.742 14.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 108.552 8.437 16.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 107.856 6.914 16.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 108.939 7.575 17.633 1.00 0.00 H new ATOM 974 N TYR A 59 110.897 1.314 12.324 1.00 0.00 N ATOM 975 CA TYR A 59 110.335 0.660 11.102 1.00 0.00 C ATOM 976 C TYR A 59 109.163 -0.260 11.474 1.00 0.00 C ATOM 977 O TYR A 59 108.821 -0.387 12.637 1.00 0.00 O ATOM 978 CB TYR A 59 111.511 -0.124 10.499 1.00 0.00 C ATOM 979 CG TYR A 59 111.999 -1.291 11.335 1.00 0.00 C ATOM 980 CD1 TYR A 59 112.998 -1.092 12.339 1.00 0.00 C ATOM 981 CD2 TYR A 59 111.452 -2.593 11.123 1.00 0.00 C ATOM 982 CE1 TYR A 59 113.447 -2.195 13.130 1.00 0.00 C ATOM 983 CE2 TYR A 59 111.902 -3.696 11.912 1.00 0.00 C ATOM 984 CZ TYR A 59 112.899 -3.498 12.916 1.00 0.00 C ATOM 985 OH TYR A 59 113.333 -4.562 13.680 1.00 0.00 O ATOM 0 H TYR A 59 111.391 0.681 12.954 1.00 0.00 H new ATOM 0 HA TYR A 59 109.931 1.379 10.389 1.00 0.00 H new ATOM 0 HB2 TYR A 59 111.215 -0.498 9.519 1.00 0.00 H new ATOM 0 HB3 TYR A 59 112.343 0.563 10.340 1.00 0.00 H new ATOM 0 HD1 TYR A 59 113.413 -0.108 12.500 1.00 0.00 H new ATOM 0 HD2 TYR A 59 110.697 -2.744 10.365 1.00 0.00 H new ATOM 0 HE1 TYR A 59 114.200 -2.044 13.889 1.00 0.00 H new ATOM 0 HE2 TYR A 59 111.488 -4.680 11.749 1.00 0.00 H new ATOM 0 HH TYR A 59 114.275 -4.432 13.917 1.00 0.00 H new ATOM 995 N ILE A 60 108.562 -0.890 10.492 1.00 0.00 N ATOM 996 CA ILE A 60 107.488 -1.898 10.755 1.00 0.00 C ATOM 997 C ILE A 60 108.011 -3.280 10.347 1.00 0.00 C ATOM 998 O ILE A 60 108.555 -3.438 9.268 1.00 0.00 O ATOM 999 CB ILE A 60 106.285 -1.472 9.892 1.00 0.00 C ATOM 1000 CG1 ILE A 60 105.817 -0.063 10.280 1.00 0.00 C ATOM 1001 CG2 ILE A 60 105.112 -2.440 10.098 1.00 0.00 C ATOM 1002 CD1 ILE A 60 104.885 0.486 9.197 1.00 0.00 C ATOM 0 H ILE A 60 108.775 -0.745 9.505 1.00 0.00 H new ATOM 0 HA ILE A 60 107.197 -1.949 11.804 1.00 0.00 H new ATOM 0 HB ILE A 60 106.602 -1.484 8.849 1.00 0.00 H new ATOM 0 HG12 ILE A 60 105.299 -0.092 11.239 1.00 0.00 H new ATOM 0 HG13 ILE A 60 106.677 0.596 10.402 1.00 0.00 H new ATOM 0 HG21 ILE A 60 104.269 -2.127 9.482 1.00 0.00 H new ATOM 0 HG22 ILE A 60 105.416 -3.447 9.811 1.00 0.00 H new ATOM 0 HG23 ILE A 60 104.816 -2.435 11.147 1.00 0.00 H new ATOM 0 HD11 ILE A 60 104.554 1.487 9.475 1.00 0.00 H new ATOM 0 HD12 ILE A 60 105.418 0.531 8.247 1.00 0.00 H new ATOM 0 HD13 ILE A 60 104.019 -0.168 9.097 1.00 0.00 H new ATOM 1014 N GLU A 61 107.850 -4.263 11.203 1.00 0.00 N ATOM 1015 CA GLU A 61 108.327 -5.645 10.893 1.00 0.00 C ATOM 1016 C GLU A 61 107.137 -6.552 10.565 1.00 0.00 C ATOM 1017 O GLU A 61 106.083 -6.424 11.162 1.00 0.00 O ATOM 1018 CB GLU A 61 109.018 -6.119 12.173 1.00 0.00 C ATOM 1019 CG GLU A 61 109.764 -7.427 11.901 1.00 0.00 C ATOM 1020 CD GLU A 61 110.344 -7.967 13.209 1.00 0.00 C ATOM 1021 OE1 GLU A 61 110.927 -7.186 13.943 1.00 0.00 O ATOM 1022 OE2 GLU A 61 110.195 -9.153 13.455 1.00 0.00 O ATOM 0 H GLU A 61 107.402 -4.162 12.114 1.00 0.00 H new ATOM 0 HA GLU A 61 108.995 -5.669 10.032 1.00 0.00 H new ATOM 0 HB2 GLU A 61 109.715 -5.358 12.525 1.00 0.00 H new ATOM 0 HB3 GLU A 61 108.281 -6.267 12.963 1.00 0.00 H new ATOM 0 HG2 GLU A 61 109.087 -8.159 11.462 1.00 0.00 H new ATOM 0 HG3 GLU A 61 110.563 -7.259 11.179 1.00 0.00 H new ATOM 1029 N THR A 62 107.308 -7.456 9.626 1.00 0.00 N ATOM 1030 CA THR A 62 106.210 -8.403 9.255 1.00 0.00 C ATOM 1031 C THR A 62 106.673 -9.857 9.403 1.00 0.00 C ATOM 1032 O THR A 62 107.772 -10.203 9.012 1.00 0.00 O ATOM 1033 CB THR A 62 105.883 -8.075 7.798 1.00 0.00 C ATOM 1034 OG1 THR A 62 107.080 -8.072 7.034 1.00 0.00 O ATOM 1035 CG2 THR A 62 105.223 -6.698 7.727 1.00 0.00 C ATOM 0 H THR A 62 108.172 -7.577 9.097 1.00 0.00 H new ATOM 0 HA THR A 62 105.338 -8.296 9.901 1.00 0.00 H new ATOM 0 HB THR A 62 105.202 -8.825 7.396 1.00 0.00 H new ATOM 0 HG1 THR A 62 107.549 -7.221 7.163 1.00 0.00 H new ATOM 0 HG21 THR A 62 104.988 -6.460 6.690 1.00 0.00 H new ATOM 0 HG22 THR A 62 104.305 -6.704 8.315 1.00 0.00 H new ATOM 0 HG23 THR A 62 105.905 -5.947 8.126 1.00 0.00 H new ATOM 1043 N GLU A 63 105.824 -10.691 9.959 1.00 0.00 N ATOM 1044 CA GLU A 63 106.240 -12.068 10.388 1.00 0.00 C ATOM 1045 C GLU A 63 106.352 -13.029 9.195 1.00 0.00 C ATOM 1046 O GLU A 63 105.989 -12.689 8.084 1.00 0.00 O ATOM 1047 CB GLU A 63 105.178 -12.555 11.391 1.00 0.00 C ATOM 1048 CG GLU A 63 103.781 -12.596 10.757 1.00 0.00 C ATOM 1049 CD GLU A 63 102.870 -13.501 11.588 1.00 0.00 C ATOM 1050 OE1 GLU A 63 103.097 -14.700 11.586 1.00 0.00 O ATOM 1051 OE2 GLU A 63 101.961 -12.980 12.213 1.00 0.00 O ATOM 0 H GLU A 63 104.844 -10.472 10.137 1.00 0.00 H new ATOM 0 HA GLU A 63 107.230 -12.041 10.843 1.00 0.00 H new ATOM 0 HB2 GLU A 63 105.445 -13.549 11.751 1.00 0.00 H new ATOM 0 HB3 GLU A 63 105.166 -11.895 12.258 1.00 0.00 H new ATOM 0 HG2 GLU A 63 103.364 -11.590 10.706 1.00 0.00 H new ATOM 0 HG3 GLU A 63 103.845 -12.967 9.734 1.00 0.00 H new ATOM 1058 N ASP A 64 106.854 -14.220 9.439 1.00 0.00 N ATOM 1059 CA ASP A 64 107.038 -15.234 8.343 1.00 0.00 C ATOM 1060 C ASP A 64 105.664 -15.700 7.849 1.00 0.00 C ATOM 1061 O ASP A 64 104.752 -15.870 8.638 1.00 0.00 O ATOM 1062 CB ASP A 64 107.802 -16.417 8.962 1.00 0.00 C ATOM 1063 CG ASP A 64 109.165 -15.961 9.492 1.00 0.00 C ATOM 1064 OD1 ASP A 64 109.996 -15.580 8.687 1.00 0.00 O ATOM 1065 OD2 ASP A 64 109.352 -16.003 10.698 1.00 0.00 O ATOM 0 H ASP A 64 107.148 -14.537 10.363 1.00 0.00 H new ATOM 0 HA ASP A 64 107.584 -14.817 7.497 1.00 0.00 H new ATOM 0 HB2 ASP A 64 107.217 -16.850 9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 64 107.939 -17.199 8.215 1.00 0.00 H new ATOM 1070 N PHE A 65 105.520 -15.903 6.557 1.00 0.00 N ATOM 1071 CA PHE A 65 104.197 -16.302 5.982 1.00 0.00 C ATOM 1072 C PHE A 65 104.377 -17.380 4.907 1.00 0.00 C ATOM 1073 O PHE A 65 105.476 -17.603 4.433 1.00 0.00 O ATOM 1074 CB PHE A 65 103.613 -15.016 5.384 1.00 0.00 C ATOM 1075 CG PHE A 65 104.459 -14.394 4.295 1.00 0.00 C ATOM 1076 CD1 PHE A 65 105.461 -13.430 4.628 1.00 0.00 C ATOM 1077 CD2 PHE A 65 104.254 -14.769 2.931 1.00 0.00 C ATOM 1078 CE1 PHE A 65 106.258 -12.842 3.597 1.00 0.00 C ATOM 1079 CE2 PHE A 65 105.050 -14.182 1.901 1.00 0.00 C ATOM 1080 CZ PHE A 65 106.052 -13.218 2.234 1.00 0.00 C ATOM 0 H PHE A 65 106.271 -15.808 5.873 1.00 0.00 H new ATOM 0 HA PHE A 65 103.536 -16.730 6.735 1.00 0.00 H new ATOM 0 HB2 PHE A 65 102.624 -15.234 4.980 1.00 0.00 H new ATOM 0 HB3 PHE A 65 103.477 -14.287 6.183 1.00 0.00 H new ATOM 0 HD1 PHE A 65 105.616 -13.146 5.658 1.00 0.00 H new ATOM 0 HD2 PHE A 65 103.497 -15.497 2.679 1.00 0.00 H new ATOM 0 HE1 PHE A 65 107.015 -12.114 3.848 1.00 0.00 H new ATOM 0 HE2 PHE A 65 104.895 -14.466 0.871 1.00 0.00 H new ATOM 0 HZ PHE A 65 106.654 -12.774 1.455 1.00 0.00 H new ATOM 1090 N GLU A 66 103.304 -18.041 4.531 1.00 0.00 N ATOM 1091 CA GLU A 66 103.367 -19.081 3.458 1.00 0.00 C ATOM 1092 C GLU A 66 102.360 -18.764 2.348 1.00 0.00 C ATOM 1093 O GLU A 66 101.310 -18.201 2.601 1.00 0.00 O ATOM 1094 CB GLU A 66 103.005 -20.399 4.153 1.00 0.00 C ATOM 1095 CG GLU A 66 104.273 -21.069 4.692 1.00 0.00 C ATOM 1096 CD GLU A 66 103.906 -22.320 5.498 1.00 0.00 C ATOM 1097 OE1 GLU A 66 102.921 -22.280 6.217 1.00 0.00 O ATOM 1098 OE2 GLU A 66 104.628 -23.298 5.388 1.00 0.00 O ATOM 0 H GLU A 66 102.376 -17.899 4.930 1.00 0.00 H new ATOM 0 HA GLU A 66 104.350 -19.126 2.989 1.00 0.00 H new ATOM 0 HB2 GLU A 66 102.308 -20.210 4.969 1.00 0.00 H new ATOM 0 HB3 GLU A 66 102.502 -21.064 3.451 1.00 0.00 H new ATOM 0 HG2 GLU A 66 104.930 -21.339 3.865 1.00 0.00 H new ATOM 0 HG3 GLU A 66 104.824 -20.370 5.322 1.00 0.00 H new ATOM 1105 N PHE A 67 102.687 -19.128 1.129 1.00 0.00 N ATOM 1106 CA PHE A 67 101.739 -18.974 -0.014 1.00 0.00 C ATOM 1107 C PHE A 67 102.001 -20.077 -1.046 1.00 0.00 C ATOM 1108 O PHE A 67 103.138 -20.373 -1.359 1.00 0.00 O ATOM 1109 CB PHE A 67 102.041 -17.593 -0.601 1.00 0.00 C ATOM 1110 CG PHE A 67 101.158 -17.221 -1.771 1.00 0.00 C ATOM 1111 CD1 PHE A 67 99.787 -16.882 -1.554 1.00 0.00 C ATOM 1112 CD2 PHE A 67 101.696 -17.212 -3.095 1.00 0.00 C ATOM 1113 CE1 PHE A 67 98.953 -16.532 -2.662 1.00 0.00 C ATOM 1114 CE2 PHE A 67 100.862 -16.862 -4.203 1.00 0.00 C ATOM 1115 CZ PHE A 67 99.491 -16.523 -3.986 1.00 0.00 C ATOM 0 H PHE A 67 103.589 -19.533 0.878 1.00 0.00 H new ATOM 0 HA PHE A 67 100.695 -19.057 0.289 1.00 0.00 H new ATOM 0 HB2 PHE A 67 101.927 -16.843 0.182 1.00 0.00 H new ATOM 0 HB3 PHE A 67 103.083 -17.564 -0.920 1.00 0.00 H new ATOM 0 HD1 PHE A 67 99.381 -16.890 -0.553 1.00 0.00 H new ATOM 0 HD2 PHE A 67 102.732 -17.469 -3.259 1.00 0.00 H new ATOM 0 HE1 PHE A 67 97.917 -16.275 -2.498 1.00 0.00 H new ATOM 0 HE2 PHE A 67 101.268 -16.854 -5.204 1.00 0.00 H new ATOM 0 HZ PHE A 67 98.861 -16.260 -4.823 1.00 0.00 H new ATOM 1125 N ASN A 68 100.956 -20.687 -1.570 1.00 0.00 N ATOM 1126 CA ASN A 68 101.085 -21.770 -2.609 1.00 0.00 C ATOM 1127 C ASN A 68 102.050 -22.882 -2.160 1.00 0.00 C ATOM 1128 O ASN A 68 102.734 -23.478 -2.975 1.00 0.00 O ATOM 1129 CB ASN A 68 101.602 -21.078 -3.880 1.00 0.00 C ATOM 1130 CG ASN A 68 100.427 -20.574 -4.724 1.00 0.00 C ATOM 1131 OD1 ASN A 68 100.362 -20.832 -5.910 1.00 0.00 O ATOM 1132 ND2 ASN A 68 99.489 -19.861 -4.162 1.00 0.00 N ATOM 0 H ASN A 68 99.993 -20.473 -1.313 1.00 0.00 H new ATOM 0 HA ASN A 68 100.125 -22.259 -2.778 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.250 -20.244 -3.611 1.00 0.00 H new ATOM 0 HB3 ASN A 68 102.205 -21.775 -4.462 1.00 0.00 H new ATOM 0 HD21 ASN A 68 98.704 -19.522 -4.718 1.00 0.00 H new ATOM 0 HD22 ASN A 68 99.541 -19.643 -3.167 1.00 0.00 H new ATOM 1139 N GLY A 69 102.097 -23.153 -0.876 1.00 0.00 N ATOM 1140 CA GLY A 69 102.947 -24.265 -0.345 1.00 0.00 C ATOM 1141 C GLY A 69 104.431 -23.867 -0.277 1.00 0.00 C ATOM 1142 O GLY A 69 105.281 -24.732 -0.158 1.00 0.00 O ATOM 0 H GLY A 69 101.574 -22.642 -0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 69 102.600 -24.545 0.650 1.00 0.00 H new ATOM 0 HA3 GLY A 69 102.835 -25.143 -0.981 1.00 0.00 H new ATOM 1146 N LYS A 70 104.748 -22.591 -0.349 1.00 0.00 N ATOM 1147 CA LYS A 70 106.170 -22.137 -0.281 1.00 0.00 C ATOM 1148 C LYS A 70 106.356 -21.201 0.915 1.00 0.00 C ATOM 1149 O LYS A 70 105.508 -20.366 1.178 1.00 0.00 O ATOM 1150 CB LYS A 70 106.416 -21.386 -1.591 1.00 0.00 C ATOM 1151 CG LYS A 70 106.368 -22.368 -2.764 1.00 0.00 C ATOM 1152 CD LYS A 70 106.724 -21.635 -4.058 1.00 0.00 C ATOM 1153 CE LYS A 70 106.565 -22.588 -5.245 1.00 0.00 C ATOM 1154 NZ LYS A 70 107.778 -23.450 -5.210 1.00 0.00 N ATOM 0 H LYS A 70 104.068 -21.838 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 70 106.865 -22.967 -0.156 1.00 0.00 H new ATOM 0 HB2 LYS A 70 105.663 -20.609 -1.723 1.00 0.00 H new ATOM 0 HB3 LYS A 70 107.385 -20.888 -1.560 1.00 0.00 H new ATOM 0 HG2 LYS A 70 107.066 -23.188 -2.594 1.00 0.00 H new ATOM 0 HG3 LYS A 70 105.374 -22.807 -2.844 1.00 0.00 H new ATOM 0 HD2 LYS A 70 106.078 -20.767 -4.186 1.00 0.00 H new ATOM 0 HD3 LYS A 70 107.748 -21.266 -4.009 1.00 0.00 H new ATOM 0 HE2 LYS A 70 105.656 -23.182 -5.155 1.00 0.00 H new ATOM 0 HE3 LYS A 70 106.497 -22.040 -6.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 108.361 -23.263 -6.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 108.328 -23.240 -4.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 107.493 -24.450 -5.202 1.00 0.00 H new ATOM 1168 N ARG A 71 107.451 -21.340 1.627 1.00 0.00 N ATOM 1169 CA ARG A 71 107.693 -20.503 2.843 1.00 0.00 C ATOM 1170 C ARG A 71 108.501 -19.254 2.478 1.00 0.00 C ATOM 1171 O ARG A 71 109.511 -19.345 1.804 1.00 0.00 O ATOM 1172 CB ARG A 71 108.486 -21.395 3.800 1.00 0.00 C ATOM 1173 CG ARG A 71 107.600 -22.547 4.279 1.00 0.00 C ATOM 1174 CD ARG A 71 108.390 -23.439 5.243 1.00 0.00 C ATOM 1175 NE ARG A 71 107.473 -24.571 5.598 1.00 0.00 N ATOM 1176 CZ ARG A 71 107.914 -25.753 5.983 1.00 0.00 C ATOM 1177 NH1 ARG A 71 109.189 -26.034 6.121 1.00 0.00 N ATOM 1178 NH2 ARG A 71 107.040 -26.685 6.254 1.00 0.00 N ATOM 0 H ARG A 71 108.194 -22.005 1.413 1.00 0.00 H new ATOM 0 HA ARG A 71 106.761 -20.158 3.292 1.00 0.00 H new ATOM 0 HB2 ARG A 71 109.371 -21.787 3.299 1.00 0.00 H new ATOM 0 HB3 ARG A 71 108.835 -20.812 4.652 1.00 0.00 H new ATOM 0 HG2 ARG A 71 106.713 -22.154 4.776 1.00 0.00 H new ATOM 0 HG3 ARG A 71 107.255 -23.132 3.427 1.00 0.00 H new ATOM 0 HD2 ARG A 71 109.303 -23.808 4.775 1.00 0.00 H new ATOM 0 HD3 ARG A 71 108.689 -22.885 6.133 1.00 0.00 H new ATOM 0 HE ARG A 71 106.466 -24.421 5.539 1.00 0.00 H new ATOM 0 HH11 ARG A 71 109.892 -25.321 5.927 1.00 0.00 H new ATOM 0 HH12 ARG A 71 109.476 -26.965 6.422 1.00 0.00 H new ATOM 0 HH21 ARG A 71 106.043 -26.490 6.166 1.00 0.00 H new ATOM 0 HH22 ARG A 71 107.355 -27.608 6.554 1.00 0.00 H new ATOM 1192 N PHE A 72 108.054 -18.102 2.923 1.00 0.00 N ATOM 1193 CA PHE A 72 108.792 -16.829 2.668 1.00 0.00 C ATOM 1194 C PHE A 72 109.189 -16.190 4.001 1.00 0.00 C ATOM 1195 O PHE A 72 108.420 -16.209 4.947 1.00 0.00 O ATOM 1196 CB PHE A 72 107.801 -15.942 1.914 1.00 0.00 C ATOM 1197 CG PHE A 72 107.391 -16.502 0.572 1.00 0.00 C ATOM 1198 CD1 PHE A 72 106.395 -17.525 0.499 1.00 0.00 C ATOM 1199 CD2 PHE A 72 108.000 -16.011 -0.623 1.00 0.00 C ATOM 1200 CE1 PHE A 72 106.008 -18.057 -0.770 1.00 0.00 C ATOM 1201 CE2 PHE A 72 107.613 -16.542 -1.893 1.00 0.00 C ATOM 1202 CZ PHE A 72 106.618 -17.565 -1.966 1.00 0.00 C ATOM 0 H PHE A 72 107.194 -17.992 3.461 1.00 0.00 H new ATOM 0 HA PHE A 72 109.709 -16.980 2.098 1.00 0.00 H new ATOM 0 HB2 PHE A 72 106.911 -15.802 2.528 1.00 0.00 H new ATOM 0 HB3 PHE A 72 108.245 -14.957 1.768 1.00 0.00 H new ATOM 0 HD1 PHE A 72 105.935 -17.896 1.403 1.00 0.00 H new ATOM 0 HD2 PHE A 72 108.753 -15.239 -0.567 1.00 0.00 H new ATOM 0 HE1 PHE A 72 105.256 -18.830 -0.825 1.00 0.00 H new ATOM 0 HE2 PHE A 72 108.073 -16.170 -2.797 1.00 0.00 H new ATOM 0 HZ PHE A 72 106.327 -17.967 -2.925 1.00 0.00 H new ATOM 1212 N PHE A 73 110.372 -15.625 4.066 1.00 0.00 N ATOM 1213 CA PHE A 73 110.952 -15.202 5.380 1.00 0.00 C ATOM 1214 C PHE A 73 110.470 -13.796 5.748 1.00 0.00 C ATOM 1215 O PHE A 73 110.106 -13.017 4.886 1.00 0.00 O ATOM 1216 CB PHE A 73 112.470 -15.220 5.191 1.00 0.00 C ATOM 1217 CG PHE A 73 113.031 -16.599 4.936 1.00 0.00 C ATOM 1218 CD1 PHE A 73 113.333 -17.462 6.035 1.00 0.00 C ATOM 1219 CD2 PHE A 73 113.258 -17.040 3.597 1.00 0.00 C ATOM 1220 CE1 PHE A 73 113.862 -18.767 5.793 1.00 0.00 C ATOM 1221 CE2 PHE A 73 113.787 -18.346 3.354 1.00 0.00 C ATOM 1222 CZ PHE A 73 114.089 -19.210 4.453 1.00 0.00 C ATOM 0 H PHE A 73 110.965 -15.438 3.257 1.00 0.00 H new ATOM 0 HA PHE A 73 110.644 -15.865 6.188 1.00 0.00 H new ATOM 0 HB2 PHE A 73 112.732 -14.570 4.356 1.00 0.00 H new ATOM 0 HB3 PHE A 73 112.943 -14.803 6.080 1.00 0.00 H new ATOM 0 HD1 PHE A 73 113.161 -17.128 7.048 1.00 0.00 H new ATOM 0 HD2 PHE A 73 113.030 -16.387 2.768 1.00 0.00 H new ATOM 0 HE1 PHE A 73 114.091 -19.419 6.623 1.00 0.00 H new ATOM 0 HE2 PHE A 73 113.958 -18.680 2.341 1.00 0.00 H new ATOM 0 HZ PHE A 73 114.488 -20.197 4.271 1.00 0.00 H new ATOM 1232 N GLY A 74 110.474 -13.483 7.025 1.00 0.00 N ATOM 1233 CA GLY A 74 109.955 -12.168 7.510 1.00 0.00 C ATOM 1234 C GLY A 74 110.859 -11.036 7.017 1.00 0.00 C ATOM 1235 O GLY A 74 112.020 -11.252 6.715 1.00 0.00 O ATOM 0 H GLY A 74 110.822 -14.097 7.761 1.00 0.00 H new ATOM 0 HA2 GLY A 74 108.937 -12.014 7.151 1.00 0.00 H new ATOM 0 HA3 GLY A 74 109.913 -12.163 8.599 1.00 0.00 H new ATOM 1239 N VAL A 75 110.325 -9.839 6.943 1.00 0.00 N ATOM 1240 CA VAL A 75 111.081 -8.691 6.348 1.00 0.00 C ATOM 1241 C VAL A 75 110.857 -7.418 7.170 1.00 0.00 C ATOM 1242 O VAL A 75 109.869 -7.302 7.874 1.00 0.00 O ATOM 1243 CB VAL A 75 110.563 -8.521 4.909 1.00 0.00 C ATOM 1244 CG1 VAL A 75 110.893 -9.773 4.093 1.00 0.00 C ATOM 1245 CG2 VAL A 75 109.045 -8.293 4.881 1.00 0.00 C ATOM 0 H VAL A 75 109.388 -9.607 7.273 1.00 0.00 H new ATOM 0 HA VAL A 75 112.154 -8.881 6.349 1.00 0.00 H new ATOM 0 HB VAL A 75 111.052 -7.647 4.479 1.00 0.00 H new ATOM 0 HG11 VAL A 75 110.525 -9.651 3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 75 111.973 -9.921 4.074 1.00 0.00 H new ATOM 0 HG13 VAL A 75 110.416 -10.641 4.549 1.00 0.00 H new ATOM 0 HG21 VAL A 75 108.713 -8.177 3.849 1.00 0.00 H new ATOM 0 HG22 VAL A 75 108.540 -9.148 5.330 1.00 0.00 H new ATOM 0 HG23 VAL A 75 108.802 -7.392 5.444 1.00 0.00 H new ATOM 1255 N LYS A 76 111.771 -6.480 7.080 1.00 0.00 N ATOM 1256 CA LYS A 76 111.610 -5.168 7.778 1.00 0.00 C ATOM 1257 C LYS A 76 111.509 -4.047 6.740 1.00 0.00 C ATOM 1258 O LYS A 76 112.254 -4.034 5.775 1.00 0.00 O ATOM 1259 CB LYS A 76 112.877 -5.002 8.623 1.00 0.00 C ATOM 1260 CG LYS A 76 112.923 -6.077 9.714 1.00 0.00 C ATOM 1261 CD LYS A 76 114.145 -5.848 10.604 1.00 0.00 C ATOM 1262 CE LYS A 76 114.241 -6.970 11.640 1.00 0.00 C ATOM 1263 NZ LYS A 76 115.292 -6.521 12.596 1.00 0.00 N ATOM 0 H LYS A 76 112.634 -6.572 6.544 1.00 0.00 H new ATOM 0 HA LYS A 76 110.710 -5.129 8.392 1.00 0.00 H new ATOM 0 HB2 LYS A 76 113.760 -5.078 7.988 1.00 0.00 H new ATOM 0 HB3 LYS A 76 112.895 -4.011 9.076 1.00 0.00 H new ATOM 0 HG2 LYS A 76 112.012 -6.042 10.312 1.00 0.00 H new ATOM 0 HG3 LYS A 76 112.970 -7.068 9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 76 115.050 -5.821 9.997 1.00 0.00 H new ATOM 0 HD3 LYS A 76 114.068 -4.883 11.104 1.00 0.00 H new ATOM 0 HE2 LYS A 76 113.287 -7.124 12.145 1.00 0.00 H new ATOM 0 HE3 LYS A 76 114.511 -7.917 11.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 115.081 -6.893 13.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 116.219 -6.874 12.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 115.311 -5.482 12.628 1.00 0.00 H new ATOM 1277 N VAL A 77 110.601 -3.118 6.939 1.00 0.00 N ATOM 1278 CA VAL A 77 110.364 -2.039 5.926 1.00 0.00 C ATOM 1279 C VAL A 77 110.280 -0.683 6.638 1.00 0.00 C ATOM 1280 O VAL A 77 109.718 -0.584 7.713 1.00 0.00 O ATOM 1281 CB VAL A 77 109.032 -2.395 5.236 1.00 0.00 C ATOM 1282 CG1 VAL A 77 108.694 -1.363 4.153 1.00 0.00 C ATOM 1283 CG2 VAL A 77 109.126 -3.772 4.568 1.00 0.00 C ATOM 0 H VAL A 77 110.009 -3.062 7.768 1.00 0.00 H new ATOM 0 HA VAL A 77 111.168 -1.968 5.194 1.00 0.00 H new ATOM 0 HB VAL A 77 108.255 -2.401 6.001 1.00 0.00 H new ATOM 0 HG11 VAL A 77 107.751 -1.631 3.677 1.00 0.00 H new ATOM 0 HG12 VAL A 77 108.604 -0.376 4.606 1.00 0.00 H new ATOM 0 HG13 VAL A 77 109.487 -1.348 3.405 1.00 0.00 H new ATOM 0 HG21 VAL A 77 108.177 -4.008 4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 77 109.920 -3.761 3.821 1.00 0.00 H new ATOM 0 HG23 VAL A 77 109.348 -4.528 5.322 1.00 0.00 H new ATOM 1293 N LEU A 78 110.838 0.347 6.039 1.00 0.00 N ATOM 1294 CA LEU A 78 110.765 1.719 6.631 1.00 0.00 C ATOM 1295 C LEU A 78 110.469 2.757 5.528 1.00 0.00 C ATOM 1296 O LEU A 78 111.196 2.793 4.554 1.00 0.00 O ATOM 1297 CB LEU A 78 112.156 1.937 7.236 1.00 0.00 C ATOM 1298 CG LEU A 78 112.226 3.277 7.979 1.00 0.00 C ATOM 1299 CD1 LEU A 78 111.347 3.236 9.231 1.00 0.00 C ATOM 1300 CD2 LEU A 78 113.675 3.534 8.398 1.00 0.00 C ATOM 0 H LEU A 78 111.345 0.291 5.156 1.00 0.00 H new ATOM 0 HA LEU A 78 109.973 1.825 7.372 1.00 0.00 H new ATOM 0 HB2 LEU A 78 112.390 1.123 7.923 1.00 0.00 H new ATOM 0 HB3 LEU A 78 112.908 1.914 6.447 1.00 0.00 H new ATOM 0 HG LEU A 78 111.872 4.070 7.321 1.00 0.00 H new ATOM 0 HD11 LEU A 78 111.406 4.193 9.749 1.00 0.00 H new ATOM 0 HD12 LEU A 78 110.314 3.042 8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 78 111.694 2.443 9.894 1.00 0.00 H new ATOM 0 HD21 LEU A 78 113.737 4.485 8.928 1.00 0.00 H new ATOM 0 HD22 LEU A 78 114.012 2.731 9.053 1.00 0.00 H new ATOM 0 HD23 LEU A 78 114.309 3.570 7.512 1.00 0.00 H new ATOM 1312 N PRO A 79 109.430 3.567 5.688 1.00 0.00 N ATOM 1313 CA PRO A 79 109.119 4.633 4.679 1.00 0.00 C ATOM 1314 C PRO A 79 110.248 5.669 4.593 1.00 0.00 C ATOM 1315 O PRO A 79 110.919 5.938 5.574 1.00 0.00 O ATOM 1316 CB PRO A 79 107.841 5.278 5.225 1.00 0.00 C ATOM 1317 CG PRO A 79 107.251 4.218 6.086 1.00 0.00 C ATOM 1318 CD PRO A 79 108.426 3.594 6.772 1.00 0.00 C ATOM 0 HA PRO A 79 109.006 4.234 3.671 1.00 0.00 H new ATOM 0 HB2 PRO A 79 108.060 6.181 5.795 1.00 0.00 H new ATOM 0 HB3 PRO A 79 107.163 5.565 4.422 1.00 0.00 H new ATOM 0 HG2 PRO A 79 106.548 4.637 6.806 1.00 0.00 H new ATOM 0 HG3 PRO A 79 106.702 3.486 5.494 1.00 0.00 H new ATOM 0 HD2 PRO A 79 108.762 4.183 7.625 1.00 0.00 H new ATOM 0 HD3 PRO A 79 108.199 2.595 7.144 1.00 0.00 H new ATOM 1326 N ILE A 80 110.450 6.239 3.426 1.00 0.00 N ATOM 1327 CA ILE A 80 111.419 7.371 3.267 1.00 0.00 C ATOM 1328 C ILE A 80 110.871 8.410 2.279 1.00 0.00 C ATOM 1329 O ILE A 80 109.881 8.169 1.611 1.00 0.00 O ATOM 1330 CB ILE A 80 112.732 6.759 2.744 1.00 0.00 C ATOM 1331 CG1 ILE A 80 112.513 6.028 1.407 1.00 0.00 C ATOM 1332 CG2 ILE A 80 113.292 5.779 3.782 1.00 0.00 C ATOM 1333 CD1 ILE A 80 113.860 5.653 0.784 1.00 0.00 C ATOM 0 H ILE A 80 109.977 5.963 2.566 1.00 0.00 H new ATOM 0 HA ILE A 80 111.582 7.885 4.214 1.00 0.00 H new ATOM 0 HB ILE A 80 113.443 7.568 2.577 1.00 0.00 H new ATOM 0 HG12 ILE A 80 111.916 5.130 1.568 1.00 0.00 H new ATOM 0 HG13 ILE A 80 111.952 6.665 0.723 1.00 0.00 H new ATOM 0 HG21 ILE A 80 114.221 5.347 3.410 1.00 0.00 H new ATOM 0 HG22 ILE A 80 113.486 6.308 4.715 1.00 0.00 H new ATOM 0 HG23 ILE A 80 112.568 4.984 3.960 1.00 0.00 H new ATOM 0 HD11 ILE A 80 113.693 5.137 -0.161 1.00 0.00 H new ATOM 0 HD12 ILE A 80 114.442 6.557 0.605 1.00 0.00 H new ATOM 0 HD13 ILE A 80 114.405 4.998 1.464 1.00 0.00 H new ATOM 1345 N LYS A 81 111.516 9.549 2.193 1.00 0.00 N ATOM 1346 CA LYS A 81 111.233 10.516 1.090 1.00 0.00 C ATOM 1347 C LYS A 81 112.471 10.633 0.195 1.00 0.00 C ATOM 1348 O LYS A 81 113.568 10.811 0.688 1.00 0.00 O ATOM 1349 CB LYS A 81 110.940 11.849 1.780 1.00 0.00 C ATOM 1350 CG LYS A 81 109.644 11.744 2.588 1.00 0.00 C ATOM 1351 CD LYS A 81 108.445 11.755 1.638 1.00 0.00 C ATOM 1352 CE LYS A 81 107.149 11.888 2.444 1.00 0.00 C ATOM 1353 NZ LYS A 81 106.201 12.594 1.538 1.00 0.00 N ATOM 0 H LYS A 81 112.235 9.852 2.850 1.00 0.00 H new ATOM 0 HA LYS A 81 110.398 10.204 0.463 1.00 0.00 H new ATOM 0 HB2 LYS A 81 111.767 12.118 2.437 1.00 0.00 H new ATOM 0 HB3 LYS A 81 110.852 12.642 1.037 1.00 0.00 H new ATOM 0 HG2 LYS A 81 109.645 10.828 3.178 1.00 0.00 H new ATOM 0 HG3 LYS A 81 109.573 12.575 3.290 1.00 0.00 H new ATOM 0 HD2 LYS A 81 108.534 12.583 0.935 1.00 0.00 H new ATOM 0 HD3 LYS A 81 108.426 10.838 1.050 1.00 0.00 H new ATOM 0 HE2 LYS A 81 106.763 10.911 2.735 1.00 0.00 H new ATOM 0 HE3 LYS A 81 107.312 12.452 3.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 105.454 13.048 2.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 106.713 13.318 0.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 105.772 11.910 0.883 1.00 0.00 H new ATOM 1367 N ILE A 82 112.293 10.535 -1.101 1.00 0.00 N ATOM 1368 CA ILE A 82 113.456 10.533 -2.045 1.00 0.00 C ATOM 1369 C ILE A 82 113.516 11.891 -2.755 1.00 0.00 C ATOM 1370 O ILE A 82 112.555 12.299 -3.385 1.00 0.00 O ATOM 1371 CB ILE A 82 113.195 9.386 -3.040 1.00 0.00 C ATOM 1372 CG1 ILE A 82 113.090 8.046 -2.297 1.00 0.00 C ATOM 1373 CG2 ILE A 82 114.345 9.283 -4.050 1.00 0.00 C ATOM 1374 CD1 ILE A 82 112.478 6.991 -3.222 1.00 0.00 C ATOM 0 H ILE A 82 111.381 10.455 -1.550 1.00 0.00 H new ATOM 0 HA ILE A 82 114.411 10.383 -1.541 1.00 0.00 H new ATOM 0 HB ILE A 82 112.260 9.600 -3.558 1.00 0.00 H new ATOM 0 HG12 ILE A 82 114.077 7.724 -1.965 1.00 0.00 H new ATOM 0 HG13 ILE A 82 112.476 8.161 -1.404 1.00 0.00 H new ATOM 0 HG21 ILE A 82 114.146 8.468 -4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 82 114.430 10.219 -4.602 1.00 0.00 H new ATOM 0 HG23 ILE A 82 115.278 9.088 -3.521 1.00 0.00 H new ATOM 0 HD11 ILE A 82 112.405 6.041 -2.692 1.00 0.00 H new ATOM 0 HD12 ILE A 82 111.483 7.312 -3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 82 113.110 6.868 -4.102 1.00 0.00 H new ATOM 1386 N LEU A 83 114.633 12.573 -2.650 1.00 0.00 N ATOM 1387 CA LEU A 83 114.776 13.926 -3.270 1.00 0.00 C ATOM 1388 C LEU A 83 115.707 13.855 -4.484 1.00 0.00 C ATOM 1389 O LEU A 83 116.879 13.542 -4.349 1.00 0.00 O ATOM 1390 CB LEU A 83 115.390 14.808 -2.179 1.00 0.00 C ATOM 1391 CG LEU A 83 114.409 14.964 -1.012 1.00 0.00 C ATOM 1392 CD1 LEU A 83 115.124 15.614 0.172 1.00 0.00 C ATOM 1393 CD2 LEU A 83 113.235 15.848 -1.443 1.00 0.00 C ATOM 0 H LEU A 83 115.461 12.243 -2.154 1.00 0.00 H new ATOM 0 HA LEU A 83 113.821 14.318 -3.620 1.00 0.00 H new ATOM 0 HB2 LEU A 83 116.321 14.366 -1.825 1.00 0.00 H new ATOM 0 HB3 LEU A 83 115.638 15.787 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 83 114.037 13.982 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 83 114.426 15.725 1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 83 115.960 14.986 0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 83 115.497 16.595 -0.122 1.00 0.00 H new ATOM 0 HD21 LEU A 83 112.538 15.958 -0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 83 113.607 16.829 -1.737 1.00 0.00 H new ATOM 0 HD23 LEU A 83 112.723 15.387 -2.287 1.00 0.00 H new ATOM 1405 N ILE A 84 115.186 14.142 -5.655 1.00 0.00 N ATOM 1406 CA ILE A 84 116.025 14.169 -6.895 1.00 0.00 C ATOM 1407 C ILE A 84 115.757 15.491 -7.625 1.00 0.00 C ATOM 1408 O ILE A 84 114.628 15.785 -7.973 1.00 0.00 O ATOM 1409 CB ILE A 84 115.582 12.957 -7.737 1.00 0.00 C ATOM 1410 CG1 ILE A 84 115.809 11.654 -6.958 1.00 0.00 C ATOM 1411 CG2 ILE A 84 116.393 12.886 -9.037 1.00 0.00 C ATOM 1412 CD1 ILE A 84 115.052 10.509 -7.635 1.00 0.00 C ATOM 0 H ILE A 84 114.201 14.362 -5.805 1.00 0.00 H new ATOM 0 HA ILE A 84 117.094 14.109 -6.692 1.00 0.00 H new ATOM 0 HB ILE A 84 114.523 13.076 -7.964 1.00 0.00 H new ATOM 0 HG12 ILE A 84 116.874 11.425 -6.917 1.00 0.00 H new ATOM 0 HG13 ILE A 84 115.468 11.770 -5.929 1.00 0.00 H new ATOM 0 HG21 ILE A 84 116.069 12.025 -9.621 1.00 0.00 H new ATOM 0 HG22 ILE A 84 116.235 13.797 -9.615 1.00 0.00 H new ATOM 0 HG23 ILE A 84 117.452 12.786 -8.800 1.00 0.00 H new ATOM 0 HD11 ILE A 84 115.216 9.586 -7.079 1.00 0.00 H new ATOM 0 HD12 ILE A 84 113.986 10.738 -7.653 1.00 0.00 H new ATOM 0 HD13 ILE A 84 115.414 10.387 -8.656 1.00 0.00 H new ATOM 1424 N GLY A 85 116.785 16.279 -7.848 1.00 0.00 N ATOM 1425 CA GLY A 85 116.618 17.611 -8.512 1.00 0.00 C ATOM 1426 C GLY A 85 115.775 18.535 -7.626 1.00 0.00 C ATOM 1427 O GLY A 85 116.148 18.821 -6.502 1.00 0.00 O ATOM 0 H GLY A 85 117.746 16.050 -7.594 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.594 18.060 -8.696 1.00 0.00 H new ATOM 0 HA3 GLY A 85 116.137 17.485 -9.482 1.00 0.00 H new ATOM 1431 N ASN A 86 114.653 18.992 -8.133 1.00 0.00 N ATOM 1432 CA ASN A 86 113.714 19.823 -7.316 1.00 0.00 C ATOM 1433 C ASN A 86 112.407 19.073 -7.010 1.00 0.00 C ATOM 1434 O ASN A 86 111.428 19.696 -6.634 1.00 0.00 O ATOM 1435 CB ASN A 86 113.429 21.051 -8.181 1.00 0.00 C ATOM 1436 CG ASN A 86 112.804 22.149 -7.318 1.00 0.00 C ATOM 1437 OD1 ASN A 86 113.419 22.631 -6.388 1.00 0.00 O ATOM 1438 ND2 ASN A 86 111.598 22.569 -7.591 1.00 0.00 N ATOM 0 H ASN A 86 114.346 18.821 -9.091 1.00 0.00 H new ATOM 0 HA ASN A 86 114.147 20.077 -6.349 1.00 0.00 H new ATOM 0 HB2 ASN A 86 114.352 21.412 -8.635 1.00 0.00 H new ATOM 0 HB3 ASN A 86 112.755 20.787 -8.996 1.00 0.00 H new ATOM 0 HD21 ASN A 86 111.172 23.302 -7.023 1.00 0.00 H new ATOM 0 HD22 ASN A 86 111.082 22.164 -8.372 1.00 0.00 H new ATOM 1445 N LYS A 87 112.381 17.764 -7.163 1.00 0.00 N ATOM 1446 CA LYS A 87 111.112 16.991 -6.987 1.00 0.00 C ATOM 1447 C LYS A 87 111.260 15.969 -5.855 1.00 0.00 C ATOM 1448 O LYS A 87 112.319 15.394 -5.675 1.00 0.00 O ATOM 1449 CB LYS A 87 110.894 16.277 -8.321 1.00 0.00 C ATOM 1450 CG LYS A 87 110.582 17.305 -9.411 1.00 0.00 C ATOM 1451 CD LYS A 87 110.262 16.581 -10.720 1.00 0.00 C ATOM 1452 CE LYS A 87 110.067 17.609 -11.838 1.00 0.00 C ATOM 1453 NZ LYS A 87 109.318 16.883 -12.901 1.00 0.00 N ATOM 0 H LYS A 87 113.195 17.198 -7.404 1.00 0.00 H new ATOM 0 HA LYS A 87 110.274 17.636 -6.724 1.00 0.00 H new ATOM 0 HB2 LYS A 87 111.784 15.707 -8.589 1.00 0.00 H new ATOM 0 HB3 LYS A 87 110.073 15.565 -8.234 1.00 0.00 H new ATOM 0 HG2 LYS A 87 109.737 17.925 -9.110 1.00 0.00 H new ATOM 0 HG3 LYS A 87 111.433 17.972 -9.551 1.00 0.00 H new ATOM 0 HD2 LYS A 87 111.071 15.898 -10.977 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.361 15.979 -10.604 1.00 0.00 H new ATOM 0 HE2 LYS A 87 109.509 18.476 -11.484 1.00 0.00 H new ATOM 0 HE3 LYS A 87 111.024 17.975 -12.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 109.146 17.523 -13.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 109.876 16.067 -13.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 108.408 16.552 -12.521 1.00 0.00 H new ATOM 1467 N LYS A 88 110.205 15.748 -5.103 1.00 0.00 N ATOM 1468 CA LYS A 88 110.233 14.740 -3.995 1.00 0.00 C ATOM 1469 C LYS A 88 109.126 13.697 -4.197 1.00 0.00 C ATOM 1470 O LYS A 88 107.980 14.043 -4.421 1.00 0.00 O ATOM 1471 CB LYS A 88 110.042 15.533 -2.691 1.00 0.00 C ATOM 1472 CG LYS A 88 108.711 16.298 -2.677 1.00 0.00 C ATOM 1473 CD LYS A 88 108.597 17.096 -1.376 1.00 0.00 C ATOM 1474 CE LYS A 88 107.174 17.637 -1.232 1.00 0.00 C ATOM 1475 NZ LYS A 88 107.115 18.201 0.146 1.00 0.00 N ATOM 0 H LYS A 88 109.314 16.231 -5.213 1.00 0.00 H new ATOM 0 HA LYS A 88 111.172 14.187 -3.970 1.00 0.00 H new ATOM 0 HB2 LYS A 88 110.077 14.850 -1.842 1.00 0.00 H new ATOM 0 HB3 LYS A 88 110.866 16.236 -2.569 1.00 0.00 H new ATOM 0 HG2 LYS A 88 108.656 16.969 -3.534 1.00 0.00 H new ATOM 0 HG3 LYS A 88 107.877 15.601 -2.763 1.00 0.00 H new ATOM 0 HD2 LYS A 88 108.844 16.461 -0.525 1.00 0.00 H new ATOM 0 HD3 LYS A 88 109.312 17.919 -1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 88 106.964 18.401 -1.981 1.00 0.00 H new ATOM 0 HE3 LYS A 88 106.435 16.847 -1.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 106.167 18.592 0.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 107.312 17.450 0.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 107.824 18.955 0.243 1.00 0.00 H new ATOM 1489 N ILE A 89 109.475 12.433 -4.119 1.00 0.00 N ATOM 1490 CA ILE A 89 108.471 11.335 -4.291 1.00 0.00 C ATOM 1491 C ILE A 89 108.547 10.399 -3.078 1.00 0.00 C ATOM 1492 O ILE A 89 109.608 10.206 -2.513 1.00 0.00 O ATOM 1493 CB ILE A 89 108.860 10.605 -5.593 1.00 0.00 C ATOM 1494 CG1 ILE A 89 108.818 11.574 -6.783 1.00 0.00 C ATOM 1495 CG2 ILE A 89 107.881 9.459 -5.876 1.00 0.00 C ATOM 1496 CD1 ILE A 89 109.546 10.952 -7.977 1.00 0.00 C ATOM 0 H ILE A 89 110.427 12.113 -3.941 1.00 0.00 H new ATOM 0 HA ILE A 89 107.447 11.704 -4.356 1.00 0.00 H new ATOM 0 HB ILE A 89 109.869 10.212 -5.466 1.00 0.00 H new ATOM 0 HG12 ILE A 89 107.784 11.795 -7.049 1.00 0.00 H new ATOM 0 HG13 ILE A 89 109.286 12.520 -6.511 1.00 0.00 H new ATOM 0 HG21 ILE A 89 108.169 8.954 -6.798 1.00 0.00 H new ATOM 0 HG22 ILE A 89 107.904 8.748 -5.050 1.00 0.00 H new ATOM 0 HG23 ILE A 89 106.873 9.859 -5.981 1.00 0.00 H new ATOM 0 HD11 ILE A 89 109.515 11.641 -8.821 1.00 0.00 H new ATOM 0 HD12 ILE A 89 110.583 10.754 -7.708 1.00 0.00 H new ATOM 0 HD13 ILE A 89 109.058 10.017 -8.254 1.00 0.00 H new ATOM 1508 N ASP A 90 107.429 9.828 -2.686 1.00 0.00 N ATOM 1509 CA ASP A 90 107.416 8.864 -1.537 1.00 0.00 C ATOM 1510 C ASP A 90 108.044 7.533 -1.964 1.00 0.00 C ATOM 1511 O ASP A 90 107.778 7.048 -3.049 1.00 0.00 O ATOM 1512 CB ASP A 90 105.944 8.658 -1.162 1.00 0.00 C ATOM 1513 CG ASP A 90 105.361 9.970 -0.632 1.00 0.00 C ATOM 1514 OD1 ASP A 90 105.435 10.188 0.566 1.00 0.00 O ATOM 1515 OD2 ASP A 90 104.849 10.734 -1.434 1.00 0.00 O ATOM 0 H ASP A 90 106.519 9.991 -3.117 1.00 0.00 H new ATOM 0 HA ASP A 90 107.989 9.245 -0.691 1.00 0.00 H new ATOM 0 HB2 ASP A 90 105.380 8.323 -2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 90 105.857 7.878 -0.406 1.00 0.00 H new ATOM 1520 N GLY A 91 108.864 6.955 -1.116 1.00 0.00 N ATOM 1521 CA GLY A 91 109.491 5.634 -1.424 1.00 0.00 C ATOM 1522 C GLY A 91 109.661 4.843 -0.126 1.00 0.00 C ATOM 1523 O GLY A 91 109.122 5.217 0.900 1.00 0.00 O ATOM 0 H GLY A 91 109.127 7.350 -0.213 1.00 0.00 H new ATOM 0 HA2 GLY A 91 108.869 5.077 -2.124 1.00 0.00 H new ATOM 0 HA3 GLY A 91 110.459 5.780 -1.904 1.00 0.00 H new ATOM 1527 N ALA A 92 110.407 3.761 -0.173 1.00 0.00 N ATOM 1528 CA ALA A 92 110.628 2.922 1.044 1.00 0.00 C ATOM 1529 C ALA A 92 111.888 2.069 0.878 1.00 0.00 C ATOM 1530 O ALA A 92 112.283 1.761 -0.230 1.00 0.00 O ATOM 1531 CB ALA A 92 109.383 2.039 1.150 1.00 0.00 C ATOM 0 H ALA A 92 110.875 3.423 -1.014 1.00 0.00 H new ATOM 0 HA ALA A 92 110.773 3.524 1.941 1.00 0.00 H new ATOM 0 HB1 ALA A 92 109.469 1.391 2.022 1.00 0.00 H new ATOM 0 HB2 ALA A 92 108.498 2.668 1.251 1.00 0.00 H new ATOM 0 HB3 ALA A 92 109.293 1.428 0.252 1.00 0.00 H new ATOM 1537 N ILE A 93 112.506 1.693 1.975 1.00 0.00 N ATOM 1538 CA ILE A 93 113.713 0.809 1.922 1.00 0.00 C ATOM 1539 C ILE A 93 113.324 -0.578 2.444 1.00 0.00 C ATOM 1540 O ILE A 93 112.571 -0.688 3.397 1.00 0.00 O ATOM 1541 CB ILE A 93 114.769 1.466 2.834 1.00 0.00 C ATOM 1542 CG1 ILE A 93 115.096 2.886 2.355 1.00 0.00 C ATOM 1543 CG2 ILE A 93 116.066 0.646 2.821 1.00 0.00 C ATOM 1544 CD1 ILE A 93 115.850 3.638 3.454 1.00 0.00 C ATOM 0 H ILE A 93 112.220 1.966 2.915 1.00 0.00 H new ATOM 0 HA ILE A 93 114.105 0.693 0.912 1.00 0.00 H new ATOM 0 HB ILE A 93 114.356 1.504 3.842 1.00 0.00 H new ATOM 0 HG12 ILE A 93 115.700 2.845 1.449 1.00 0.00 H new ATOM 0 HG13 ILE A 93 114.178 3.416 2.102 1.00 0.00 H new ATOM 0 HG21 ILE A 93 116.803 1.121 3.469 1.00 0.00 H new ATOM 0 HG22 ILE A 93 115.862 -0.363 3.181 1.00 0.00 H new ATOM 0 HG23 ILE A 93 116.455 0.597 1.804 1.00 0.00 H new ATOM 0 HD11 ILE A 93 116.081 4.647 3.112 1.00 0.00 H new ATOM 0 HD12 ILE A 93 115.230 3.692 4.349 1.00 0.00 H new ATOM 0 HD13 ILE A 93 116.776 3.112 3.685 1.00 0.00 H new ATOM 1556 N VAL A 94 113.834 -1.618 1.824 1.00 0.00 N ATOM 1557 CA VAL A 94 113.455 -3.015 2.210 1.00 0.00 C ATOM 1558 C VAL A 94 114.723 -3.799 2.579 1.00 0.00 C ATOM 1559 O VAL A 94 115.690 -3.797 1.839 1.00 0.00 O ATOM 1560 CB VAL A 94 112.758 -3.620 0.975 1.00 0.00 C ATOM 1561 CG1 VAL A 94 112.300 -5.055 1.267 1.00 0.00 C ATOM 1562 CG2 VAL A 94 111.522 -2.795 0.600 1.00 0.00 C ATOM 0 H VAL A 94 114.505 -1.556 1.058 1.00 0.00 H new ATOM 0 HA VAL A 94 112.793 -3.046 3.075 1.00 0.00 H new ATOM 0 HB VAL A 94 113.475 -3.615 0.154 1.00 0.00 H new ATOM 0 HG11 VAL A 94 111.810 -5.467 0.385 1.00 0.00 H new ATOM 0 HG12 VAL A 94 113.164 -5.668 1.522 1.00 0.00 H new ATOM 0 HG13 VAL A 94 111.600 -5.051 2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 94 111.042 -3.236 -0.274 1.00 0.00 H new ATOM 0 HG22 VAL A 94 110.821 -2.789 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 94 111.823 -1.772 0.372 1.00 0.00 H new ATOM 1572 N VAL A 95 114.707 -4.457 3.715 1.00 0.00 N ATOM 1573 CA VAL A 95 115.857 -5.323 4.130 1.00 0.00 C ATOM 1574 C VAL A 95 115.297 -6.593 4.803 1.00 0.00 C ATOM 1575 O VAL A 95 114.414 -6.474 5.630 1.00 0.00 O ATOM 1576 CB VAL A 95 116.680 -4.478 5.122 1.00 0.00 C ATOM 1577 CG1 VAL A 95 117.897 -5.269 5.617 1.00 0.00 C ATOM 1578 CG2 VAL A 95 117.187 -3.200 4.442 1.00 0.00 C ATOM 0 H VAL A 95 113.935 -4.430 4.381 1.00 0.00 H new ATOM 0 HA VAL A 95 116.479 -5.639 3.293 1.00 0.00 H new ATOM 0 HB VAL A 95 116.032 -4.225 5.961 1.00 0.00 H new ATOM 0 HG11 VAL A 95 118.468 -4.658 6.317 1.00 0.00 H new ATOM 0 HG12 VAL A 95 117.562 -6.177 6.118 1.00 0.00 H new ATOM 0 HG13 VAL A 95 118.528 -5.534 4.769 1.00 0.00 H new ATOM 0 HG21 VAL A 95 117.766 -2.614 5.155 1.00 0.00 H new ATOM 0 HG22 VAL A 95 117.817 -3.465 3.593 1.00 0.00 H new ATOM 0 HG23 VAL A 95 116.338 -2.612 4.094 1.00 0.00 H new ATOM 1588 N PRO A 96 115.802 -7.769 4.448 1.00 0.00 N ATOM 1589 CA PRO A 96 115.333 -9.040 5.097 1.00 0.00 C ATOM 1590 C PRO A 96 115.531 -9.010 6.620 1.00 0.00 C ATOM 1591 O PRO A 96 116.403 -8.318 7.117 1.00 0.00 O ATOM 1592 CB PRO A 96 116.225 -10.108 4.463 1.00 0.00 C ATOM 1593 CG PRO A 96 116.595 -9.519 3.146 1.00 0.00 C ATOM 1594 CD PRO A 96 116.828 -8.067 3.427 1.00 0.00 C ATOM 0 HA PRO A 96 114.268 -9.214 4.946 1.00 0.00 H new ATOM 0 HB2 PRO A 96 117.105 -10.309 5.074 1.00 0.00 H new ATOM 0 HB3 PRO A 96 115.696 -11.054 4.345 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.489 -9.991 2.739 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.800 -9.657 2.414 1.00 0.00 H new ATOM 0 HD2 PRO A 96 117.836 -7.882 3.799 1.00 0.00 H new ATOM 0 HD3 PRO A 96 116.701 -7.455 2.534 1.00 0.00 H new ATOM 1602 N LYS A 97 114.728 -9.757 7.346 1.00 0.00 N ATOM 1603 CA LYS A 97 114.834 -9.785 8.844 1.00 0.00 C ATOM 1604 C LYS A 97 116.172 -10.397 9.276 1.00 0.00 C ATOM 1605 O LYS A 97 116.745 -9.985 10.270 1.00 0.00 O ATOM 1606 CB LYS A 97 113.670 -10.650 9.343 1.00 0.00 C ATOM 1607 CG LYS A 97 113.549 -10.526 10.863 1.00 0.00 C ATOM 1608 CD LYS A 97 112.463 -11.478 11.368 1.00 0.00 C ATOM 1609 CE LYS A 97 112.305 -11.317 12.882 1.00 0.00 C ATOM 1610 NZ LYS A 97 111.073 -12.083 13.223 1.00 0.00 N ATOM 0 H LYS A 97 113.997 -10.354 6.960 1.00 0.00 H new ATOM 0 HA LYS A 97 114.788 -8.778 9.260 1.00 0.00 H new ATOM 0 HB2 LYS A 97 112.741 -10.335 8.868 1.00 0.00 H new ATOM 0 HB3 LYS A 97 113.833 -11.691 9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 97 114.503 -10.762 11.335 1.00 0.00 H new ATOM 0 HG3 LYS A 97 113.304 -9.500 11.136 1.00 0.00 H new ATOM 0 HD2 LYS A 97 111.518 -11.266 10.869 1.00 0.00 H new ATOM 0 HD3 LYS A 97 112.727 -12.508 11.127 1.00 0.00 H new ATOM 0 HE2 LYS A 97 113.173 -11.708 13.413 1.00 0.00 H new ATOM 0 HE3 LYS A 97 112.207 -10.267 13.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 110.297 -11.421 13.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 110.809 -12.690 12.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 111.252 -12.673 14.060 1.00 0.00 H new ATOM 1624 N LYS A 98 116.657 -11.368 8.535 1.00 0.00 N ATOM 1625 CA LYS A 98 117.926 -12.069 8.915 1.00 0.00 C ATOM 1626 C LYS A 98 119.133 -11.348 8.307 1.00 0.00 C ATOM 1627 O LYS A 98 119.228 -11.207 7.102 1.00 0.00 O ATOM 1628 CB LYS A 98 117.803 -13.484 8.343 1.00 0.00 C ATOM 1629 CG LYS A 98 118.931 -14.359 8.892 1.00 0.00 C ATOM 1630 CD LYS A 98 118.849 -15.753 8.267 1.00 0.00 C ATOM 1631 CE LYS A 98 119.882 -16.670 8.923 1.00 0.00 C ATOM 1632 NZ LYS A 98 120.163 -17.722 7.907 1.00 0.00 N ATOM 0 H LYS A 98 116.223 -11.707 7.676 1.00 0.00 H new ATOM 0 HA LYS A 98 118.073 -12.084 9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 98 116.836 -13.911 8.608 1.00 0.00 H new ATOM 0 HB3 LYS A 98 117.850 -13.453 7.254 1.00 0.00 H new ATOM 0 HG2 LYS A 98 119.897 -13.906 8.670 1.00 0.00 H new ATOM 0 HG3 LYS A 98 118.854 -14.431 9.977 1.00 0.00 H new ATOM 0 HD2 LYS A 98 117.848 -16.163 8.399 1.00 0.00 H new ATOM 0 HD3 LYS A 98 119.030 -15.693 7.194 1.00 0.00 H new ATOM 0 HE2 LYS A 98 120.787 -16.122 9.184 1.00 0.00 H new ATOM 0 HE3 LYS A 98 119.495 -17.105 9.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 120.865 -18.391 8.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 119.285 -18.232 7.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 120.536 -17.279 7.043 1.00 0.00 H new ATOM 1646 N THR A 99 120.044 -10.899 9.142 1.00 0.00 N ATOM 1647 CA THR A 99 121.281 -10.217 8.649 1.00 0.00 C ATOM 1648 C THR A 99 122.490 -10.623 9.503 1.00 0.00 C ATOM 1649 O THR A 99 122.342 -10.941 10.671 1.00 0.00 O ATOM 1650 CB THR A 99 120.999 -8.708 8.745 1.00 0.00 C ATOM 1651 OG1 THR A 99 122.136 -7.992 8.288 1.00 0.00 O ATOM 1652 CG2 THR A 99 120.680 -8.282 10.186 1.00 0.00 C ATOM 0 H THR A 99 119.979 -10.979 10.157 1.00 0.00 H new ATOM 0 HA THR A 99 121.521 -10.499 7.624 1.00 0.00 H new ATOM 0 HB THR A 99 120.130 -8.485 8.126 1.00 0.00 H new ATOM 0 HG1 THR A 99 121.961 -7.029 8.345 1.00 0.00 H new ATOM 0 HG21 THR A 99 120.486 -7.210 10.214 1.00 0.00 H new ATOM 0 HG22 THR A 99 119.799 -8.819 10.538 1.00 0.00 H new ATOM 0 HG23 THR A 99 121.528 -8.515 10.830 1.00 0.00 H new ATOM 1660 N TYR A 100 123.668 -10.609 8.922 1.00 0.00 N ATOM 1661 CA TYR A 100 124.905 -10.992 9.670 1.00 0.00 C ATOM 1662 C TYR A 100 125.633 -9.739 10.168 1.00 0.00 C ATOM 1663 O TYR A 100 125.889 -9.602 11.351 1.00 0.00 O ATOM 1664 CB TYR A 100 125.766 -11.748 8.657 1.00 0.00 C ATOM 1665 CG TYR A 100 127.001 -12.372 9.262 1.00 0.00 C ATOM 1666 CD1 TYR A 100 126.947 -13.703 9.782 1.00 0.00 C ATOM 1667 CD2 TYR A 100 128.223 -11.633 9.317 1.00 0.00 C ATOM 1668 CE1 TYR A 100 128.116 -14.294 10.355 1.00 0.00 C ATOM 1669 CE2 TYR A 100 129.390 -12.223 9.890 1.00 0.00 C ATOM 1670 CZ TYR A 100 129.337 -13.554 10.409 1.00 0.00 C ATOM 1671 OH TYR A 100 130.465 -14.125 10.964 1.00 0.00 O ATOM 0 H TYR A 100 123.824 -10.345 7.949 1.00 0.00 H new ATOM 0 HA TYR A 100 124.684 -11.599 10.548 1.00 0.00 H new ATOM 0 HB2 TYR A 100 125.164 -12.529 8.192 1.00 0.00 H new ATOM 0 HB3 TYR A 100 126.066 -11.063 7.864 1.00 0.00 H new ATOM 0 HD1 TYR A 100 126.024 -14.262 9.742 1.00 0.00 H new ATOM 0 HD2 TYR A 100 128.264 -10.628 8.925 1.00 0.00 H new ATOM 0 HE1 TYR A 100 128.076 -15.300 10.747 1.00 0.00 H new ATOM 0 HE2 TYR A 100 130.313 -11.664 9.931 1.00 0.00 H new ATOM 0 HH TYR A 100 131.209 -13.488 10.921 1.00 0.00 H new ATOM 1681 N HIS A 101 125.963 -8.839 9.268 1.00 0.00 N ATOM 1682 CA HIS A 101 126.683 -7.587 9.650 1.00 0.00 C ATOM 1683 C HIS A 101 126.076 -6.385 8.919 1.00 0.00 C ATOM 1684 O HIS A 101 125.270 -6.554 8.020 1.00 0.00 O ATOM 1685 CB HIS A 101 128.129 -7.812 9.205 1.00 0.00 C ATOM 1686 CG HIS A 101 129.060 -6.696 9.592 1.00 0.00 C ATOM 1687 ND1 HIS A 101 129.353 -6.402 10.914 1.00 0.00 N ATOM 1688 CD2 HIS A 101 129.770 -5.791 8.841 1.00 0.00 C ATOM 1689 CE1 HIS A 101 130.206 -5.362 10.919 1.00 0.00 C ATOM 1690 NE2 HIS A 101 130.494 -4.950 9.682 1.00 0.00 N ATOM 0 H HIS A 101 125.759 -8.924 8.272 1.00 0.00 H new ATOM 0 HA HIS A 101 126.613 -7.378 10.717 1.00 0.00 H new ATOM 0 HB2 HIS A 101 128.493 -8.744 9.638 1.00 0.00 H new ATOM 0 HB3 HIS A 101 128.152 -7.934 8.122 1.00 0.00 H new ATOM 0 HD2 HIS A 101 129.767 -5.740 7.762 1.00 0.00 H new ATOM 0 HE1 HIS A 101 130.609 -4.914 11.815 1.00 0.00 H new ATOM 0 HE2 HIS A 101 131.111 -4.184 9.411 1.00 0.00 H new ATOM 1698 N SER A 102 126.460 -5.189 9.305 1.00 0.00 N ATOM 1699 CA SER A 102 125.935 -3.956 8.633 1.00 0.00 C ATOM 1700 C SER A 102 126.723 -3.683 7.350 1.00 0.00 C ATOM 1701 O SER A 102 127.886 -4.036 7.251 1.00 0.00 O ATOM 1702 CB SER A 102 126.132 -2.814 9.635 1.00 0.00 C ATOM 1703 OG SER A 102 125.412 -3.104 10.824 1.00 0.00 O ATOM 0 H SER A 102 127.120 -5.014 10.063 1.00 0.00 H new ATOM 0 HA SER A 102 124.887 -4.063 8.355 1.00 0.00 H new ATOM 0 HB2 SER A 102 127.192 -2.690 9.859 1.00 0.00 H new ATOM 0 HB3 SER A 102 125.785 -1.874 9.206 1.00 0.00 H new ATOM 0 HG SER A 102 124.970 -2.291 11.145 1.00 0.00 H new ATOM 1709 N SER A 103 126.093 -3.062 6.379 1.00 0.00 N ATOM 1710 CA SER A 103 126.755 -2.802 5.064 1.00 0.00 C ATOM 1711 C SER A 103 126.493 -1.365 4.606 1.00 0.00 C ATOM 1712 O SER A 103 125.751 -0.637 5.243 1.00 0.00 O ATOM 1713 CB SER A 103 126.116 -3.799 4.096 1.00 0.00 C ATOM 1714 OG SER A 103 126.379 -5.121 4.545 1.00 0.00 O ATOM 0 H SER A 103 125.134 -2.720 6.446 1.00 0.00 H new ATOM 0 HA SER A 103 127.837 -2.920 5.119 1.00 0.00 H new ATOM 0 HB2 SER A 103 125.041 -3.629 4.038 1.00 0.00 H new ATOM 0 HB3 SER A 103 126.516 -3.657 3.092 1.00 0.00 H new ATOM 0 HG SER A 103 125.970 -5.763 3.928 1.00 0.00 H new ATOM 1720 N GLU A 104 127.101 -0.966 3.511 1.00 0.00 N ATOM 1721 CA GLU A 104 126.873 0.400 2.947 1.00 0.00 C ATOM 1722 C GLU A 104 126.023 0.329 1.671 1.00 0.00 C ATOM 1723 O GLU A 104 126.134 1.193 0.819 1.00 0.00 O ATOM 1724 CB GLU A 104 128.274 0.932 2.625 1.00 0.00 C ATOM 1725 CG GLU A 104 128.850 1.656 3.844 1.00 0.00 C ATOM 1726 CD GLU A 104 130.306 2.045 3.572 1.00 0.00 C ATOM 1727 OE1 GLU A 104 130.575 2.542 2.491 1.00 0.00 O ATOM 1728 OE2 GLU A 104 131.127 1.837 4.450 1.00 0.00 O ATOM 0 H GLU A 104 127.755 -1.540 2.979 1.00 0.00 H new ATOM 0 HA GLU A 104 126.335 1.043 3.644 1.00 0.00 H new ATOM 0 HB2 GLU A 104 128.928 0.109 2.338 1.00 0.00 H new ATOM 0 HB3 GLU A 104 128.227 1.613 1.775 1.00 0.00 H new ATOM 0 HG2 GLU A 104 128.260 2.546 4.063 1.00 0.00 H new ATOM 0 HG3 GLU A 104 128.793 1.012 4.722 1.00 0.00 H new ATOM 1735 N ILE A 105 125.190 -0.679 1.537 1.00 0.00 N ATOM 1736 CA ILE A 105 124.325 -0.814 0.321 1.00 0.00 C ATOM 1737 C ILE A 105 122.858 -0.904 0.760 1.00 0.00 C ATOM 1738 O ILE A 105 122.512 -1.719 1.596 1.00 0.00 O ATOM 1739 CB ILE A 105 124.775 -2.112 -0.383 1.00 0.00 C ATOM 1740 CG1 ILE A 105 126.282 -2.085 -0.717 1.00 0.00 C ATOM 1741 CG2 ILE A 105 123.972 -2.326 -1.675 1.00 0.00 C ATOM 1742 CD1 ILE A 105 126.650 -0.900 -1.624 1.00 0.00 C ATOM 0 H ILE A 105 125.073 -1.421 2.227 1.00 0.00 H new ATOM 0 HA ILE A 105 124.417 0.037 -0.354 1.00 0.00 H new ATOM 0 HB ILE A 105 124.589 -2.936 0.306 1.00 0.00 H new ATOM 0 HG12 ILE A 105 126.857 -2.026 0.207 1.00 0.00 H new ATOM 0 HG13 ILE A 105 126.561 -3.017 -1.208 1.00 0.00 H new ATOM 0 HG21 ILE A 105 124.301 -3.245 -2.160 1.00 0.00 H new ATOM 0 HG22 ILE A 105 122.911 -2.401 -1.436 1.00 0.00 H new ATOM 0 HG23 ILE A 105 124.133 -1.483 -2.347 1.00 0.00 H new ATOM 0 HD11 ILE A 105 127.720 -0.920 -1.833 1.00 0.00 H new ATOM 0 HD12 ILE A 105 126.096 -0.972 -2.560 1.00 0.00 H new ATOM 0 HD13 ILE A 105 126.396 0.034 -1.123 1.00 0.00 H new ATOM 1754 N ILE A 106 122.011 -0.070 0.200 1.00 0.00 N ATOM 1755 CA ILE A 106 120.545 -0.121 0.514 1.00 0.00 C ATOM 1756 C ILE A 106 119.733 -0.245 -0.780 1.00 0.00 C ATOM 1757 O ILE A 106 120.111 0.305 -1.799 1.00 0.00 O ATOM 1758 CB ILE A 106 120.210 1.185 1.257 1.00 0.00 C ATOM 1759 CG1 ILE A 106 120.581 2.419 0.422 1.00 0.00 C ATOM 1760 CG2 ILE A 106 120.973 1.232 2.583 1.00 0.00 C ATOM 1761 CD1 ILE A 106 119.917 3.660 1.021 1.00 0.00 C ATOM 0 H ILE A 106 122.277 0.652 -0.469 1.00 0.00 H new ATOM 0 HA ILE A 106 120.297 -0.985 1.130 1.00 0.00 H new ATOM 0 HB ILE A 106 119.135 1.201 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 106 121.663 2.546 0.403 1.00 0.00 H new ATOM 0 HG13 ILE A 106 120.258 2.283 -0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.734 2.157 3.107 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.684 0.381 3.199 1.00 0.00 H new ATOM 0 HG23 ILE A 106 122.045 1.191 2.388 1.00 0.00 H new ATOM 0 HD11 ILE A 106 120.181 4.536 0.428 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.835 3.531 1.017 1.00 0.00 H new ATOM 0 HD13 ILE A 106 120.262 3.798 2.046 1.00 0.00 H new ATOM 1773 N GLU A 107 118.631 -0.959 -0.733 1.00 0.00 N ATOM 1774 CA GLU A 107 117.748 -1.100 -1.931 1.00 0.00 C ATOM 1775 C GLU A 107 116.394 -0.441 -1.664 1.00 0.00 C ATOM 1776 O GLU A 107 115.767 -0.696 -0.650 1.00 0.00 O ATOM 1777 CB GLU A 107 117.578 -2.605 -2.138 1.00 0.00 C ATOM 1778 CG GLU A 107 118.764 -3.151 -2.937 1.00 0.00 C ATOM 1779 CD GLU A 107 118.615 -4.663 -3.113 1.00 0.00 C ATOM 1780 OE1 GLU A 107 117.521 -5.098 -3.435 1.00 0.00 O ATOM 1781 OE2 GLU A 107 119.597 -5.361 -2.925 1.00 0.00 O ATOM 0 H GLU A 107 118.305 -1.455 0.096 1.00 0.00 H new ATOM 0 HA GLU A 107 118.173 -0.619 -2.812 1.00 0.00 H new ATOM 0 HB2 GLU A 107 117.513 -3.110 -1.174 1.00 0.00 H new ATOM 0 HB3 GLU A 107 116.647 -2.807 -2.667 1.00 0.00 H new ATOM 0 HG2 GLU A 107 118.813 -2.665 -3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 107 119.697 -2.925 -2.421 1.00 0.00 H new ATOM 1788 N ILE A 108 115.950 0.396 -2.573 1.00 0.00 N ATOM 1789 CA ILE A 108 114.694 1.184 -2.360 1.00 0.00 C ATOM 1790 C ILE A 108 113.636 0.749 -3.385 1.00 0.00 C ATOM 1791 O ILE A 108 113.964 0.344 -4.483 1.00 0.00 O ATOM 1792 CB ILE A 108 115.104 2.657 -2.553 1.00 0.00 C ATOM 1793 CG1 ILE A 108 116.132 3.057 -1.487 1.00 0.00 C ATOM 1794 CG2 ILE A 108 113.889 3.587 -2.424 1.00 0.00 C ATOM 1795 CD1 ILE A 108 116.807 4.370 -1.888 1.00 0.00 C ATOM 0 H ILE A 108 116.412 0.568 -3.466 1.00 0.00 H new ATOM 0 HA ILE A 108 114.256 1.029 -1.374 1.00 0.00 H new ATOM 0 HB ILE A 108 115.531 2.756 -3.551 1.00 0.00 H new ATOM 0 HG12 ILE A 108 115.642 3.169 -0.520 1.00 0.00 H new ATOM 0 HG13 ILE A 108 116.880 2.272 -1.376 1.00 0.00 H new ATOM 0 HG21 ILE A 108 114.205 4.621 -2.564 1.00 0.00 H new ATOM 0 HG22 ILE A 108 113.150 3.328 -3.182 1.00 0.00 H new ATOM 0 HG23 ILE A 108 113.448 3.474 -1.434 1.00 0.00 H new ATOM 0 HD11 ILE A 108 117.537 4.651 -1.128 1.00 0.00 H new ATOM 0 HD12 ILE A 108 117.311 4.242 -2.846 1.00 0.00 H new ATOM 0 HD13 ILE A 108 116.055 5.154 -1.976 1.00 0.00 H new ATOM 1807 N ILE A 109 112.380 0.839 -3.016 1.00 0.00 N ATOM 1808 CA ILE A 109 111.264 0.677 -4.001 1.00 0.00 C ATOM 1809 C ILE A 109 110.482 1.992 -4.112 1.00 0.00 C ATOM 1810 O ILE A 109 110.489 2.789 -3.190 1.00 0.00 O ATOM 1811 CB ILE A 109 110.370 -0.462 -3.479 1.00 0.00 C ATOM 1812 CG1 ILE A 109 109.850 -0.169 -2.062 1.00 0.00 C ATOM 1813 CG2 ILE A 109 111.167 -1.769 -3.460 1.00 0.00 C ATOM 1814 CD1 ILE A 109 108.559 -0.953 -1.817 1.00 0.00 C ATOM 0 H ILE A 109 112.077 1.021 -2.059 1.00 0.00 H new ATOM 0 HA ILE A 109 111.636 0.434 -4.996 1.00 0.00 H new ATOM 0 HB ILE A 109 109.513 -0.548 -4.147 1.00 0.00 H new ATOM 0 HG12 ILE A 109 110.602 -0.447 -1.323 1.00 0.00 H new ATOM 0 HG13 ILE A 109 109.667 0.899 -1.945 1.00 0.00 H new ATOM 0 HG21 ILE A 109 110.534 -2.576 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 109 111.503 -2.005 -4.470 1.00 0.00 H new ATOM 0 HG23 ILE A 109 112.032 -1.658 -2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 109 108.192 -0.744 -0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 109 107.807 -0.654 -2.548 1.00 0.00 H new ATOM 0 HD13 ILE A 109 108.757 -2.020 -1.916 1.00 0.00 H new ATOM 1826 N ALA A 110 109.819 2.208 -5.226 1.00 0.00 N ATOM 1827 CA ALA A 110 109.074 3.486 -5.448 1.00 0.00 C ATOM 1828 C ALA A 110 107.772 3.218 -6.223 1.00 0.00 C ATOM 1829 O ALA A 110 107.620 2.143 -6.771 1.00 0.00 O ATOM 1830 CB ALA A 110 110.020 4.370 -6.261 1.00 0.00 C ATOM 0 H ALA A 110 109.763 1.544 -5.998 1.00 0.00 H new ATOM 0 HA ALA A 110 108.788 3.962 -4.510 1.00 0.00 H new ATOM 0 HB1 ALA A 110 109.540 5.328 -6.463 1.00 0.00 H new ATOM 0 HB2 ALA A 110 110.938 4.536 -5.697 1.00 0.00 H new ATOM 0 HB3 ALA A 110 110.258 3.878 -7.204 1.00 0.00 H new ATOM 1836 N PRO A 111 106.866 4.185 -6.254 1.00 0.00 N ATOM 1837 CA PRO A 111 105.599 4.033 -7.044 1.00 0.00 C ATOM 1838 C PRO A 111 105.886 3.809 -8.537 1.00 0.00 C ATOM 1839 O PRO A 111 105.128 3.138 -9.216 1.00 0.00 O ATOM 1840 CB PRO A 111 104.888 5.372 -6.830 1.00 0.00 C ATOM 1841 CG PRO A 111 105.435 5.858 -5.534 1.00 0.00 C ATOM 1842 CD PRO A 111 106.888 5.498 -5.576 1.00 0.00 C ATOM 0 HA PRO A 111 105.011 3.172 -6.727 1.00 0.00 H new ATOM 0 HB2 PRO A 111 105.097 6.071 -7.640 1.00 0.00 H new ATOM 0 HB3 PRO A 111 103.806 5.249 -6.787 1.00 0.00 H new ATOM 0 HG2 PRO A 111 105.297 6.934 -5.424 1.00 0.00 H new ATOM 0 HG3 PRO A 111 104.934 5.384 -4.690 1.00 0.00 H new ATOM 0 HD2 PRO A 111 107.473 6.232 -6.130 1.00 0.00 H new ATOM 0 HD3 PRO A 111 107.320 5.433 -4.577 1.00 0.00 H new ATOM 1850 N MET A 112 106.968 4.365 -9.034 1.00 0.00 N ATOM 1851 CA MET A 112 107.315 4.227 -10.482 1.00 0.00 C ATOM 1852 C MET A 112 108.837 4.126 -10.670 1.00 0.00 C ATOM 1853 O MET A 112 109.592 4.396 -9.752 1.00 0.00 O ATOM 1854 CB MET A 112 106.686 5.440 -11.211 1.00 0.00 C ATOM 1855 CG MET A 112 107.471 6.760 -11.062 1.00 0.00 C ATOM 1856 SD MET A 112 107.359 7.412 -9.376 1.00 0.00 S ATOM 1857 CE MET A 112 105.605 7.856 -9.420 1.00 0.00 C ATOM 0 H MET A 112 107.632 4.915 -8.489 1.00 0.00 H new ATOM 0 HA MET A 112 106.915 3.307 -10.908 1.00 0.00 H new ATOM 0 HB2 MET A 112 106.598 5.203 -12.271 1.00 0.00 H new ATOM 0 HB3 MET A 112 105.675 5.590 -10.832 1.00 0.00 H new ATOM 0 HG2 MET A 112 108.517 6.594 -11.320 1.00 0.00 H new ATOM 0 HG3 MET A 112 107.082 7.497 -11.765 1.00 0.00 H new ATOM 0 HE1 MET A 112 105.356 8.444 -8.536 1.00 0.00 H new ATOM 0 HE2 MET A 112 105.401 8.443 -10.315 1.00 0.00 H new ATOM 0 HE3 MET A 112 105.000 6.949 -9.435 1.00 0.00 H new ATOM 1867 N LYS A 113 109.274 3.742 -11.849 1.00 0.00 N ATOM 1868 CA LYS A 113 110.742 3.567 -12.108 1.00 0.00 C ATOM 1869 C LYS A 113 111.435 4.933 -12.146 1.00 0.00 C ATOM 1870 O LYS A 113 111.310 5.669 -13.109 1.00 0.00 O ATOM 1871 CB LYS A 113 110.860 2.866 -13.465 1.00 0.00 C ATOM 1872 CG LYS A 113 112.302 2.395 -13.672 1.00 0.00 C ATOM 1873 CD LYS A 113 112.362 1.437 -14.864 1.00 0.00 C ATOM 1874 CE LYS A 113 112.180 2.223 -16.164 1.00 0.00 C ATOM 1875 NZ LYS A 113 112.024 1.186 -17.223 1.00 0.00 N ATOM 0 H LYS A 113 108.672 3.541 -12.648 1.00 0.00 H new ATOM 0 HA LYS A 113 111.220 2.981 -11.323 1.00 0.00 H new ATOM 0 HB2 LYS A 113 110.179 2.016 -13.508 1.00 0.00 H new ATOM 0 HB3 LYS A 113 110.570 3.547 -14.265 1.00 0.00 H new ATOM 0 HG2 LYS A 113 112.953 3.251 -13.847 1.00 0.00 H new ATOM 0 HG3 LYS A 113 112.665 1.897 -12.773 1.00 0.00 H new ATOM 0 HD2 LYS A 113 113.318 0.913 -14.875 1.00 0.00 H new ATOM 0 HD3 LYS A 113 111.584 0.679 -14.774 1.00 0.00 H new ATOM 0 HE2 LYS A 113 111.305 2.871 -16.114 1.00 0.00 H new ATOM 0 HE3 LYS A 113 113.040 2.863 -16.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 111.894 1.649 -18.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 112.875 0.588 -17.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 111.194 0.596 -17.012 1.00 0.00 H new ATOM 1889 N LEU A 114 112.165 5.264 -11.101 1.00 0.00 N ATOM 1890 CA LEU A 114 112.843 6.604 -11.014 1.00 0.00 C ATOM 1891 C LEU A 114 113.821 6.814 -12.176 1.00 0.00 C ATOM 1892 O LEU A 114 113.989 7.925 -12.647 1.00 0.00 O ATOM 1893 CB LEU A 114 113.613 6.612 -9.688 1.00 0.00 C ATOM 1894 CG LEU A 114 112.630 6.544 -8.516 1.00 0.00 C ATOM 1895 CD1 LEU A 114 113.401 6.271 -7.223 1.00 0.00 C ATOM 1896 CD2 LEU A 114 111.890 7.877 -8.390 1.00 0.00 C ATOM 0 H LEU A 114 112.321 4.657 -10.297 1.00 0.00 H new ATOM 0 HA LEU A 114 112.106 7.405 -11.066 1.00 0.00 H new ATOM 0 HB2 LEU A 114 114.298 5.765 -9.650 1.00 0.00 H new ATOM 0 HB3 LEU A 114 114.219 7.515 -9.614 1.00 0.00 H new ATOM 0 HG LEU A 114 111.911 5.744 -8.692 1.00 0.00 H new ATOM 0 HD11 LEU A 114 112.703 6.222 -6.387 1.00 0.00 H new ATOM 0 HD12 LEU A 114 113.931 5.323 -7.309 1.00 0.00 H new ATOM 0 HD13 LEU A 114 114.118 7.074 -7.051 1.00 0.00 H new ATOM 0 HD21 LEU A 114 111.191 7.827 -7.555 1.00 0.00 H new ATOM 0 HD22 LEU A 114 112.609 8.677 -8.214 1.00 0.00 H new ATOM 0 HD23 LEU A 114 111.342 8.078 -9.311 1.00 0.00 H new ATOM 1908 N ARG A 115 114.456 5.756 -12.635 1.00 0.00 N ATOM 1909 CA ARG A 115 115.527 5.891 -13.680 1.00 0.00 C ATOM 1910 C ARG A 115 114.955 6.458 -14.982 1.00 0.00 C ATOM 1911 O ARG A 115 115.624 7.210 -15.667 1.00 0.00 O ATOM 1912 CB ARG A 115 116.084 4.485 -13.926 1.00 0.00 C ATOM 1913 CG ARG A 115 116.767 3.972 -12.659 1.00 0.00 C ATOM 1914 CD ARG A 115 117.421 2.615 -12.944 1.00 0.00 C ATOM 1915 NE ARG A 115 117.884 2.094 -11.616 1.00 0.00 N ATOM 1916 CZ ARG A 115 118.052 0.808 -11.373 1.00 0.00 C ATOM 1917 NH1 ARG A 115 117.853 -0.125 -12.276 1.00 0.00 N ATOM 1918 NH2 ARG A 115 118.446 0.446 -10.182 1.00 0.00 N ATOM 0 H ARG A 115 114.277 4.800 -12.328 1.00 0.00 H new ATOM 0 HA ARG A 115 116.304 6.576 -13.341 1.00 0.00 H new ATOM 0 HB2 ARG A 115 115.279 3.810 -14.215 1.00 0.00 H new ATOM 0 HB3 ARG A 115 116.795 4.505 -14.752 1.00 0.00 H new ATOM 0 HG2 ARG A 115 117.519 4.687 -12.324 1.00 0.00 H new ATOM 0 HG3 ARG A 115 116.038 3.875 -11.854 1.00 0.00 H new ATOM 0 HD2 ARG A 115 116.711 1.929 -13.407 1.00 0.00 H new ATOM 0 HD3 ARG A 115 118.257 2.722 -13.635 1.00 0.00 H new ATOM 0 HE ARG A 115 118.077 2.762 -10.869 1.00 0.00 H new ATOM 0 HH11 ARG A 115 117.554 0.131 -13.217 1.00 0.00 H new ATOM 0 HH12 ARG A 115 117.997 -1.106 -12.036 1.00 0.00 H new ATOM 0 HH21 ARG A 115 118.616 1.151 -9.465 1.00 0.00 H new ATOM 0 HH22 ARG A 115 118.583 -0.542 -9.969 1.00 0.00 H new ATOM 1932 N GLU A 116 113.735 6.098 -15.311 1.00 0.00 N ATOM 1933 CA GLU A 116 113.086 6.636 -16.548 1.00 0.00 C ATOM 1934 C GLU A 116 112.593 8.059 -16.277 1.00 0.00 C ATOM 1935 O GLU A 116 112.853 8.962 -17.051 1.00 0.00 O ATOM 1936 CB GLU A 116 111.919 5.698 -16.869 1.00 0.00 C ATOM 1937 CG GLU A 116 111.331 6.059 -18.235 1.00 0.00 C ATOM 1938 CD GLU A 116 110.083 5.212 -18.497 1.00 0.00 C ATOM 1939 OE1 GLU A 116 109.272 5.089 -17.594 1.00 0.00 O ATOM 1940 OE2 GLU A 116 109.959 4.701 -19.598 1.00 0.00 O ATOM 0 H GLU A 116 113.160 5.451 -14.772 1.00 0.00 H new ATOM 0 HA GLU A 116 113.776 6.681 -17.390 1.00 0.00 H new ATOM 0 HB2 GLU A 116 112.261 4.663 -16.871 1.00 0.00 H new ATOM 0 HB3 GLU A 116 111.152 5.779 -16.099 1.00 0.00 H new ATOM 0 HG2 GLU A 116 111.076 7.118 -18.264 1.00 0.00 H new ATOM 0 HG3 GLU A 116 112.070 5.887 -19.017 1.00 0.00 H new ATOM 1947 N GLN A 117 111.900 8.258 -15.176 1.00 0.00 N ATOM 1948 CA GLN A 117 111.227 9.575 -14.913 1.00 0.00 C ATOM 1949 C GLN A 117 112.254 10.710 -14.809 1.00 0.00 C ATOM 1950 O GLN A 117 111.977 11.826 -15.212 1.00 0.00 O ATOM 1951 CB GLN A 117 110.474 9.421 -13.585 1.00 0.00 C ATOM 1952 CG GLN A 117 109.363 8.381 -13.740 1.00 0.00 C ATOM 1953 CD GLN A 117 108.235 8.957 -14.599 1.00 0.00 C ATOM 1954 OE1 GLN A 117 107.794 10.068 -14.377 1.00 0.00 O ATOM 1955 NE2 GLN A 117 107.746 8.246 -15.577 1.00 0.00 N ATOM 0 H GLN A 117 111.771 7.560 -14.444 1.00 0.00 H new ATOM 0 HA GLN A 117 110.552 9.831 -15.730 1.00 0.00 H new ATOM 0 HB2 GLN A 117 111.164 9.116 -12.798 1.00 0.00 H new ATOM 0 HB3 GLN A 117 110.050 10.379 -13.283 1.00 0.00 H new ATOM 0 HG2 GLN A 117 109.760 7.477 -14.202 1.00 0.00 H new ATOM 0 HG3 GLN A 117 108.979 8.096 -12.761 1.00 0.00 H new ATOM 0 HE21 GLN A 117 108.115 7.314 -15.764 1.00 0.00 H new ATOM 0 HE22 GLN A 117 106.994 8.622 -16.155 1.00 0.00 H new ATOM 1964 N PHE A 118 113.421 10.426 -14.277 1.00 0.00 N ATOM 1965 CA PHE A 118 114.459 11.487 -14.086 1.00 0.00 C ATOM 1966 C PHE A 118 115.637 11.342 -15.064 1.00 0.00 C ATOM 1967 O PHE A 118 116.625 12.039 -14.922 1.00 0.00 O ATOM 1968 CB PHE A 118 114.942 11.300 -12.648 1.00 0.00 C ATOM 1969 CG PHE A 118 113.908 11.676 -11.613 1.00 0.00 C ATOM 1970 CD1 PHE A 118 113.847 13.015 -11.117 1.00 0.00 C ATOM 1971 CD2 PHE A 118 112.991 10.692 -11.129 1.00 0.00 C ATOM 1972 CE1 PHE A 118 112.870 13.371 -10.138 1.00 0.00 C ATOM 1973 CE2 PHE A 118 112.012 11.048 -10.150 1.00 0.00 C ATOM 1974 CZ PHE A 118 111.951 12.388 -9.653 1.00 0.00 C ATOM 0 H PHE A 118 113.699 9.496 -13.965 1.00 0.00 H new ATOM 0 HA PHE A 118 114.044 12.477 -14.276 1.00 0.00 H new ATOM 0 HB2 PHE A 118 115.229 10.259 -12.502 1.00 0.00 H new ATOM 0 HB3 PHE A 118 115.837 11.903 -12.492 1.00 0.00 H new ATOM 0 HD1 PHE A 118 114.540 13.758 -11.483 1.00 0.00 H new ATOM 0 HD2 PHE A 118 113.038 9.680 -11.503 1.00 0.00 H new ATOM 0 HE1 PHE A 118 112.825 14.383 -9.764 1.00 0.00 H new ATOM 0 HE2 PHE A 118 111.318 10.305 -9.785 1.00 0.00 H new ATOM 0 HZ PHE A 118 111.212 12.657 -8.913 1.00 0.00 H new ATOM 1984 N ASN A 119 115.558 10.460 -16.048 1.00 0.00 N ATOM 1985 CA ASN A 119 116.682 10.248 -17.031 1.00 0.00 C ATOM 1986 C ASN A 119 118.027 9.998 -16.321 1.00 0.00 C ATOM 1987 O ASN A 119 119.028 10.629 -16.625 1.00 0.00 O ATOM 1988 CB ASN A 119 116.725 11.521 -17.890 1.00 0.00 C ATOM 1989 CG ASN A 119 115.448 11.617 -18.726 1.00 0.00 C ATOM 1990 OD1 ASN A 119 115.315 10.951 -19.734 1.00 0.00 O ATOM 1991 ND2 ASN A 119 114.493 12.422 -18.346 1.00 0.00 N ATOM 0 H ASN A 119 114.744 9.868 -16.212 1.00 0.00 H new ATOM 0 HA ASN A 119 116.511 9.360 -17.640 1.00 0.00 H new ATOM 0 HB2 ASN A 119 116.821 12.400 -17.252 1.00 0.00 H new ATOM 0 HB3 ASN A 119 117.598 11.503 -18.542 1.00 0.00 H new ATOM 0 HD21 ASN A 119 113.636 12.492 -18.895 1.00 0.00 H new ATOM 0 HD22 ASN A 119 114.604 12.981 -17.500 1.00 0.00 H new ATOM 1998 N LEU A 120 118.045 9.078 -15.384 1.00 0.00 N ATOM 1999 CA LEU A 120 119.245 8.891 -14.505 1.00 0.00 C ATOM 2000 C LEU A 120 120.216 7.877 -15.115 1.00 0.00 C ATOM 2001 O LEU A 120 119.804 6.856 -15.635 1.00 0.00 O ATOM 2002 CB LEU A 120 118.709 8.368 -13.170 1.00 0.00 C ATOM 2003 CG LEU A 120 117.861 9.446 -12.492 1.00 0.00 C ATOM 2004 CD1 LEU A 120 116.996 8.802 -11.407 1.00 0.00 C ATOM 2005 CD2 LEU A 120 118.780 10.493 -11.856 1.00 0.00 C ATOM 0 H LEU A 120 117.271 8.442 -15.189 1.00 0.00 H new ATOM 0 HA LEU A 120 119.794 9.825 -14.385 1.00 0.00 H new ATOM 0 HB2 LEU A 120 118.111 7.472 -13.334 1.00 0.00 H new ATOM 0 HB3 LEU A 120 119.538 8.083 -12.522 1.00 0.00 H new ATOM 0 HG LEU A 120 117.221 9.926 -13.232 1.00 0.00 H new ATOM 0 HD11 LEU A 120 116.391 9.568 -10.922 1.00 0.00 H new ATOM 0 HD12 LEU A 120 116.343 8.055 -11.858 1.00 0.00 H new ATOM 0 HD13 LEU A 120 117.637 8.324 -10.667 1.00 0.00 H new ATOM 0 HD21 LEU A 120 118.177 11.261 -11.373 1.00 0.00 H new ATOM 0 HD22 LEU A 120 119.419 10.014 -11.114 1.00 0.00 H new ATOM 0 HD23 LEU A 120 119.399 10.950 -12.628 1.00 0.00 H new ATOM 2017 N LYS A 121 121.496 8.166 -15.048 1.00 0.00 N ATOM 2018 CA LYS A 121 122.537 7.202 -15.517 1.00 0.00 C ATOM 2019 C LYS A 121 123.407 6.766 -14.335 1.00 0.00 C ATOM 2020 O LYS A 121 123.525 7.483 -13.357 1.00 0.00 O ATOM 2021 CB LYS A 121 123.370 7.983 -16.535 1.00 0.00 C ATOM 2022 CG LYS A 121 124.273 7.017 -17.305 1.00 0.00 C ATOM 2023 CD LYS A 121 125.151 7.805 -18.278 1.00 0.00 C ATOM 2024 CE LYS A 121 125.940 6.833 -19.157 1.00 0.00 C ATOM 2025 NZ LYS A 121 127.045 6.338 -18.288 1.00 0.00 N ATOM 0 H LYS A 121 121.865 9.043 -14.682 1.00 0.00 H new ATOM 0 HA LYS A 121 122.106 6.300 -15.952 1.00 0.00 H new ATOM 0 HB2 LYS A 121 122.715 8.514 -17.226 1.00 0.00 H new ATOM 0 HB3 LYS A 121 123.974 8.735 -16.027 1.00 0.00 H new ATOM 0 HG2 LYS A 121 124.896 6.454 -16.611 1.00 0.00 H new ATOM 0 HG3 LYS A 121 123.668 6.293 -17.850 1.00 0.00 H new ATOM 0 HD2 LYS A 121 124.533 8.453 -18.899 1.00 0.00 H new ATOM 0 HD3 LYS A 121 125.835 8.450 -17.726 1.00 0.00 H new ATOM 0 HE2 LYS A 121 125.311 6.012 -19.501 1.00 0.00 H new ATOM 0 HE3 LYS A 121 126.329 7.331 -20.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 127.958 6.656 -18.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 126.925 6.714 -17.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 127.025 5.299 -18.259 1.00 0.00 H new ATOM 2039 N ASP A 122 124.016 5.602 -14.422 1.00 0.00 N ATOM 2040 CA ASP A 122 124.864 5.071 -13.293 1.00 0.00 C ATOM 2041 C ASP A 122 125.965 6.066 -12.899 1.00 0.00 C ATOM 2042 O ASP A 122 126.594 6.662 -13.755 1.00 0.00 O ATOM 2043 CB ASP A 122 125.499 3.776 -13.810 1.00 0.00 C ATOM 2044 CG ASP A 122 124.410 2.732 -14.067 1.00 0.00 C ATOM 2045 OD1 ASP A 122 123.537 2.594 -13.225 1.00 0.00 O ATOM 2046 OD2 ASP A 122 124.466 2.087 -15.101 1.00 0.00 O ATOM 0 H ASP A 122 123.962 4.989 -15.235 1.00 0.00 H new ATOM 0 HA ASP A 122 124.254 4.905 -12.405 1.00 0.00 H new ATOM 0 HB2 ASP A 122 126.051 3.973 -14.729 1.00 0.00 H new ATOM 0 HB3 ASP A 122 126.216 3.396 -13.082 1.00 0.00 H new ATOM 2051 N GLY A 123 126.189 6.235 -11.615 1.00 0.00 N ATOM 2052 CA GLY A 123 127.208 7.216 -11.128 1.00 0.00 C ATOM 2053 C GLY A 123 126.546 8.514 -10.649 1.00 0.00 C ATOM 2054 O GLY A 123 127.132 9.233 -9.858 1.00 0.00 O ATOM 0 H GLY A 123 125.702 5.727 -10.877 1.00 0.00 H new ATOM 0 HA2 GLY A 123 127.780 6.774 -10.312 1.00 0.00 H new ATOM 0 HA3 GLY A 123 127.913 7.439 -11.928 1.00 0.00 H new ATOM 2058 N ASP A 124 125.348 8.823 -11.111 1.00 0.00 N ATOM 2059 CA ASP A 124 124.658 10.089 -10.684 1.00 0.00 C ATOM 2060 C ASP A 124 124.337 10.033 -9.187 1.00 0.00 C ATOM 2061 O ASP A 124 124.198 8.961 -8.628 1.00 0.00 O ATOM 2062 CB ASP A 124 123.368 10.192 -11.507 1.00 0.00 C ATOM 2063 CG ASP A 124 123.650 10.887 -12.842 1.00 0.00 C ATOM 2064 OD1 ASP A 124 124.401 11.850 -12.847 1.00 0.00 O ATOM 2065 OD2 ASP A 124 123.103 10.445 -13.839 1.00 0.00 O ATOM 0 H ASP A 124 124.819 8.249 -11.768 1.00 0.00 H new ATOM 0 HA ASP A 124 125.293 10.959 -10.852 1.00 0.00 H new ATOM 0 HB2 ASP A 124 122.961 9.197 -11.685 1.00 0.00 H new ATOM 0 HB3 ASP A 124 122.615 10.750 -10.950 1.00 0.00 H new ATOM 2070 N VAL A 125 124.220 11.175 -8.551 1.00 0.00 N ATOM 2071 CA VAL A 125 124.030 11.217 -7.064 1.00 0.00 C ATOM 2072 C VAL A 125 122.622 11.740 -6.744 1.00 0.00 C ATOM 2073 O VAL A 125 122.177 12.720 -7.312 1.00 0.00 O ATOM 2074 CB VAL A 125 125.118 12.166 -6.522 1.00 0.00 C ATOM 2075 CG1 VAL A 125 125.036 12.256 -4.993 1.00 0.00 C ATOM 2076 CG2 VAL A 125 126.513 11.647 -6.894 1.00 0.00 C ATOM 0 H VAL A 125 124.248 12.089 -9.003 1.00 0.00 H new ATOM 0 HA VAL A 125 124.120 10.232 -6.606 1.00 0.00 H new ATOM 0 HB VAL A 125 124.953 13.148 -6.964 1.00 0.00 H new ATOM 0 HG11 VAL A 125 125.810 12.930 -4.626 1.00 0.00 H new ATOM 0 HG12 VAL A 125 124.057 12.637 -4.703 1.00 0.00 H new ATOM 0 HG13 VAL A 125 125.182 11.266 -4.562 1.00 0.00 H new ATOM 0 HG21 VAL A 125 127.270 12.327 -6.505 1.00 0.00 H new ATOM 0 HG22 VAL A 125 126.659 10.656 -6.463 1.00 0.00 H new ATOM 0 HG23 VAL A 125 126.602 11.588 -7.979 1.00 0.00 H new ATOM 2086 N ILE A 126 121.936 11.079 -5.839 1.00 0.00 N ATOM 2087 CA ILE A 126 120.603 11.563 -5.360 1.00 0.00 C ATOM 2088 C ILE A 126 120.593 11.602 -3.827 1.00 0.00 C ATOM 2089 O ILE A 126 121.404 10.952 -3.192 1.00 0.00 O ATOM 2090 CB ILE A 126 119.552 10.577 -5.903 1.00 0.00 C ATOM 2091 CG1 ILE A 126 119.845 9.139 -5.450 1.00 0.00 C ATOM 2092 CG2 ILE A 126 119.546 10.628 -7.433 1.00 0.00 C ATOM 2093 CD1 ILE A 126 118.619 8.260 -5.707 1.00 0.00 C ATOM 0 H ILE A 126 122.251 10.211 -5.406 1.00 0.00 H new ATOM 0 HA ILE A 126 120.386 12.572 -5.712 1.00 0.00 H new ATOM 0 HB ILE A 126 118.579 10.871 -5.509 1.00 0.00 H new ATOM 0 HG12 ILE A 126 120.707 8.746 -5.989 1.00 0.00 H new ATOM 0 HG13 ILE A 126 120.099 9.125 -4.390 1.00 0.00 H new ATOM 0 HG21 ILE A 126 118.802 9.930 -7.817 1.00 0.00 H new ATOM 0 HG22 ILE A 126 119.301 11.638 -7.762 1.00 0.00 H new ATOM 0 HG23 ILE A 126 120.531 10.353 -7.810 1.00 0.00 H new ATOM 0 HD11 ILE A 126 118.829 7.240 -5.385 1.00 0.00 H new ATOM 0 HD12 ILE A 126 117.768 8.649 -5.148 1.00 0.00 H new ATOM 0 HD13 ILE A 126 118.385 8.264 -6.772 1.00 0.00 H new ATOM 2105 N LYS A 127 119.684 12.353 -3.247 1.00 0.00 N ATOM 2106 CA LYS A 127 119.660 12.524 -1.762 1.00 0.00 C ATOM 2107 C LYS A 127 118.448 11.804 -1.167 1.00 0.00 C ATOM 2108 O LYS A 127 117.364 11.864 -1.717 1.00 0.00 O ATOM 2109 CB LYS A 127 119.549 14.033 -1.536 1.00 0.00 C ATOM 2110 CG LYS A 127 120.838 14.718 -1.992 1.00 0.00 C ATOM 2111 CD LYS A 127 120.770 16.210 -1.659 1.00 0.00 C ATOM 2112 CE LYS A 127 122.011 16.914 -2.211 1.00 0.00 C ATOM 2113 NZ LYS A 127 121.614 18.344 -2.344 1.00 0.00 N ATOM 0 H LYS A 127 118.952 12.858 -3.746 1.00 0.00 H new ATOM 0 HA LYS A 127 120.546 12.105 -1.285 1.00 0.00 H new ATOM 0 HB2 LYS A 127 118.699 14.432 -2.089 1.00 0.00 H new ATOM 0 HB3 LYS A 127 119.369 14.240 -0.481 1.00 0.00 H new ATOM 0 HG2 LYS A 127 121.698 14.264 -1.499 1.00 0.00 H new ATOM 0 HG3 LYS A 127 120.976 14.580 -3.064 1.00 0.00 H new ATOM 0 HD2 LYS A 127 119.869 16.648 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 127 120.709 16.350 -0.580 1.00 0.00 H new ATOM 0 HE2 LYS A 127 122.861 16.801 -1.538 1.00 0.00 H new ATOM 0 HE3 LYS A 127 122.308 16.495 -3.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 122.414 18.893 -2.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 120.807 18.421 -2.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 121.343 18.717 -1.412 1.00 0.00 H new ATOM 2127 N ILE A 128 118.632 11.131 -0.054 1.00 0.00 N ATOM 2128 CA ILE A 128 117.492 10.453 0.641 1.00 0.00 C ATOM 2129 C ILE A 128 117.237 11.114 2.001 1.00 0.00 C ATOM 2130 O ILE A 128 118.167 11.432 2.723 1.00 0.00 O ATOM 2131 CB ILE A 128 117.884 8.972 0.795 1.00 0.00 C ATOM 2132 CG1 ILE A 128 119.209 8.813 1.557 1.00 0.00 C ATOM 2133 CG2 ILE A 128 118.023 8.339 -0.593 1.00 0.00 C ATOM 2134 CD1 ILE A 128 119.402 7.348 1.958 1.00 0.00 C ATOM 0 H ILE A 128 119.535 11.022 0.407 1.00 0.00 H new ATOM 0 HA ILE A 128 116.566 10.538 0.072 1.00 0.00 H new ATOM 0 HB ILE A 128 117.101 8.473 1.367 1.00 0.00 H new ATOM 0 HG12 ILE A 128 120.040 9.142 0.933 1.00 0.00 H new ATOM 0 HG13 ILE A 128 119.207 9.446 2.445 1.00 0.00 H new ATOM 0 HG21 ILE A 128 118.301 7.290 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 128 117.073 8.412 -1.123 1.00 0.00 H new ATOM 0 HG23 ILE A 128 118.794 8.864 -1.157 1.00 0.00 H new ATOM 0 HD11 ILE A 128 120.343 7.239 2.498 1.00 0.00 H new ATOM 0 HD12 ILE A 128 118.578 7.034 2.598 1.00 0.00 H new ATOM 0 HD13 ILE A 128 119.423 6.726 1.063 1.00 0.00 H new ATOM 2146 N LEU A 129 115.984 11.320 2.337 1.00 0.00 N ATOM 2147 CA LEU A 129 115.621 11.963 3.637 1.00 0.00 C ATOM 2148 C LEU A 129 114.998 10.928 4.575 1.00 0.00 C ATOM 2149 O LEU A 129 114.065 10.238 4.205 1.00 0.00 O ATOM 2150 CB LEU A 129 114.603 13.046 3.271 1.00 0.00 C ATOM 2151 CG LEU A 129 114.336 13.945 4.483 1.00 0.00 C ATOM 2152 CD1 LEU A 129 113.877 15.327 4.009 1.00 0.00 C ATOM 2153 CD2 LEU A 129 113.242 13.323 5.358 1.00 0.00 C ATOM 0 H LEU A 129 115.187 11.065 1.754 1.00 0.00 H new ATOM 0 HA LEU A 129 116.486 12.379 4.153 1.00 0.00 H new ATOM 0 HB2 LEU A 129 114.978 13.644 2.440 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.673 12.585 2.938 1.00 0.00 H new ATOM 0 HG LEU A 129 115.254 14.043 5.062 1.00 0.00 H new ATOM 0 HD11 LEU A 129 113.688 15.964 4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 129 114.654 15.776 3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 129 112.962 15.226 3.426 1.00 0.00 H new ATOM 0 HD21 LEU A 129 113.055 13.965 6.219 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.326 13.220 4.777 1.00 0.00 H new ATOM 0 HD23 LEU A 129 113.566 12.341 5.702 1.00 0.00 H new ATOM 2165 N ILE A 130 115.514 10.825 5.779 1.00 0.00 N ATOM 2166 CA ILE A 130 115.023 9.795 6.751 1.00 0.00 C ATOM 2167 C ILE A 130 114.454 10.508 7.985 1.00 0.00 C ATOM 2168 O ILE A 130 115.065 11.428 8.501 1.00 0.00 O ATOM 2169 CB ILE A 130 116.251 8.941 7.121 1.00 0.00 C ATOM 2170 CG1 ILE A 130 116.875 8.299 5.870 1.00 0.00 C ATOM 2171 CG2 ILE A 130 115.843 7.819 8.084 1.00 0.00 C ATOM 2172 CD1 ILE A 130 118.353 7.998 6.137 1.00 0.00 C ATOM 0 H ILE A 130 116.264 11.419 6.133 1.00 0.00 H new ATOM 0 HA ILE A 130 114.233 9.169 6.336 1.00 0.00 H new ATOM 0 HB ILE A 130 116.980 9.600 7.593 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.345 7.381 5.616 1.00 0.00 H new ATOM 0 HG13 ILE A 130 116.777 8.970 5.016 1.00 0.00 H new ATOM 0 HG21 ILE A 130 116.719 7.222 8.339 1.00 0.00 H new ATOM 0 HG22 ILE A 130 115.423 8.253 8.991 1.00 0.00 H new ATOM 0 HG23 ILE A 130 115.097 7.184 7.607 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.797 7.543 5.252 1.00 0.00 H new ATOM 0 HD12 ILE A 130 118.877 8.925 6.370 1.00 0.00 H new ATOM 0 HD13 ILE A 130 118.438 7.311 6.979 1.00 0.00 H new ATOM 2184 N LYS A 131 113.301 10.081 8.449 1.00 0.00 N ATOM 2185 CA LYS A 131 112.675 10.704 9.658 1.00 0.00 C ATOM 2186 C LYS A 131 113.106 9.953 10.922 1.00 0.00 C ATOM 2187 O LYS A 131 113.078 8.735 10.957 1.00 0.00 O ATOM 2188 CB LYS A 131 111.164 10.580 9.450 1.00 0.00 C ATOM 2189 CG LYS A 131 110.734 11.462 8.276 1.00 0.00 C ATOM 2190 CD LYS A 131 109.208 11.445 8.159 1.00 0.00 C ATOM 2191 CE LYS A 131 108.781 12.244 6.925 1.00 0.00 C ATOM 2192 NZ LYS A 131 108.891 11.287 5.789 1.00 0.00 N ATOM 0 H LYS A 131 112.763 9.319 8.036 1.00 0.00 H new ATOM 0 HA LYS A 131 112.978 11.744 9.783 1.00 0.00 H new ATOM 0 HB2 LYS A 131 110.898 9.541 9.254 1.00 0.00 H new ATOM 0 HB3 LYS A 131 110.636 10.879 10.355 1.00 0.00 H new ATOM 0 HG2 LYS A 131 111.087 12.482 8.425 1.00 0.00 H new ATOM 0 HG3 LYS A 131 111.185 11.101 7.352 1.00 0.00 H new ATOM 0 HD2 LYS A 131 108.850 10.418 8.082 1.00 0.00 H new ATOM 0 HD3 LYS A 131 108.759 11.873 9.055 1.00 0.00 H new ATOM 0 HE2 LYS A 131 107.762 12.617 7.030 1.00 0.00 H new ATOM 0 HE3 LYS A 131 109.424 13.111 6.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 108.116 11.456 5.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 109.803 11.423 5.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 108.832 10.313 6.149 1.00 0.00 H new ATOM 2206 N GLY A 132 113.498 10.678 11.946 1.00 0.00 N ATOM 2207 CA GLY A 132 113.923 10.041 13.230 1.00 0.00 C ATOM 2208 C GLY A 132 113.775 11.049 14.372 1.00 0.00 C ATOM 2209 O GLY A 132 113.445 12.199 14.143 1.00 0.00 O ATOM 0 H GLY A 132 113.541 11.697 11.943 1.00 0.00 H new ATOM 0 HA2 GLY A 132 113.316 9.158 13.429 1.00 0.00 H new ATOM 0 HA3 GLY A 132 114.958 9.706 13.158 1.00 0.00 H new ATOM 2213 N ASP A 133 114.016 10.616 15.589 1.00 0.00 N ATOM 2214 CA ASP A 133 113.910 11.526 16.773 1.00 0.00 C ATOM 2215 C ASP A 133 114.793 11.020 17.920 1.00 0.00 C ATOM 2216 O ASP A 133 115.248 9.890 17.898 1.00 0.00 O ATOM 2217 CB ASP A 133 112.423 11.539 17.168 1.00 0.00 C ATOM 2218 CG ASP A 133 111.916 10.130 17.508 1.00 0.00 C ATOM 2219 OD1 ASP A 133 111.975 9.274 16.641 1.00 0.00 O ATOM 2220 OD2 ASP A 133 111.479 9.934 18.631 1.00 0.00 O ATOM 0 H ASP A 133 114.285 9.658 15.813 1.00 0.00 H new ATOM 0 HA ASP A 133 114.257 12.533 16.541 1.00 0.00 H new ATOM 0 HB2 ASP A 133 112.280 12.195 18.027 1.00 0.00 H new ATOM 0 HB3 ASP A 133 111.832 11.951 16.350 1.00 0.00 H new ATOM 2225 N LYS A 134 115.026 11.852 18.910 1.00 0.00 N ATOM 2226 CA LYS A 134 115.855 11.447 20.086 1.00 0.00 C ATOM 2227 C LYS A 134 115.004 11.451 21.360 1.00 0.00 C ATOM 2228 O LYS A 134 114.113 12.269 21.505 1.00 0.00 O ATOM 2229 CB LYS A 134 116.960 12.502 20.178 1.00 0.00 C ATOM 2230 CG LYS A 134 117.898 12.368 18.976 1.00 0.00 C ATOM 2231 CD LYS A 134 119.071 13.337 19.133 1.00 0.00 C ATOM 2232 CE LYS A 134 119.965 13.263 17.893 1.00 0.00 C ATOM 2233 NZ LYS A 134 121.101 14.183 18.183 1.00 0.00 N ATOM 0 H LYS A 134 114.670 12.807 18.950 1.00 0.00 H new ATOM 0 HA LYS A 134 116.260 10.441 19.976 1.00 0.00 H new ATOM 0 HB2 LYS A 134 116.523 13.500 20.202 1.00 0.00 H new ATOM 0 HB3 LYS A 134 117.520 12.377 21.105 1.00 0.00 H new ATOM 0 HG2 LYS A 134 118.266 11.345 18.901 1.00 0.00 H new ATOM 0 HG3 LYS A 134 117.357 12.581 18.054 1.00 0.00 H new ATOM 0 HD2 LYS A 134 118.701 14.353 19.267 1.00 0.00 H new ATOM 0 HD3 LYS A 134 119.646 13.087 20.024 1.00 0.00 H new ATOM 0 HE2 LYS A 134 120.315 12.246 17.719 1.00 0.00 H new ATOM 0 HE3 LYS A 134 119.425 13.572 16.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 121.759 14.187 17.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 120.738 15.145 18.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 121.600 13.860 19.036 1.00 0.00 H new ATOM 2247 N ASP A 135 115.281 10.544 22.269 1.00 0.00 N ATOM 2248 CA ASP A 135 114.510 10.466 23.548 1.00 0.00 C ATOM 2249 C ASP A 135 115.455 10.195 24.721 1.00 0.00 C ATOM 2250 O ASP A 135 116.588 9.791 24.522 1.00 0.00 O ATOM 2251 CB ASP A 135 113.541 9.297 23.358 1.00 0.00 C ATOM 2252 CG ASP A 135 112.504 9.652 22.291 1.00 0.00 C ATOM 2253 OD1 ASP A 135 111.993 10.759 22.332 1.00 0.00 O ATOM 2254 OD2 ASP A 135 112.237 8.810 21.449 1.00 0.00 O ATOM 0 H ASP A 135 116.019 9.846 22.175 1.00 0.00 H new ATOM 0 HA ASP A 135 113.987 11.396 23.771 1.00 0.00 H new ATOM 0 HB2 ASP A 135 114.089 8.403 23.062 1.00 0.00 H new ATOM 0 HB3 ASP A 135 113.043 9.068 24.300 1.00 0.00 H new ATOM 2259 N GLU A 136 114.991 10.417 25.930 1.00 0.00 N ATOM 2260 CA GLU A 136 115.835 10.183 27.142 1.00 0.00 C ATOM 2261 C GLU A 136 114.947 9.922 28.360 1.00 0.00 C ATOM 2262 O GLU A 136 114.040 10.706 28.587 1.00 0.00 O ATOM 2263 CB GLU A 136 116.634 11.475 27.324 1.00 0.00 C ATOM 2264 CG GLU A 136 117.707 11.269 28.395 1.00 0.00 C ATOM 2265 CD GLU A 136 118.429 12.592 28.659 1.00 0.00 C ATOM 2266 OE1 GLU A 136 118.775 13.258 27.697 1.00 0.00 O ATOM 2267 OE2 GLU A 136 118.623 12.916 29.819 1.00 0.00 O ATOM 2268 OXT GLU A 136 115.188 8.942 29.046 1.00 0.00 O ATOM 0 H GLU A 136 114.049 10.755 26.128 1.00 0.00 H new ATOM 0 HA GLU A 136 116.486 9.315 27.033 1.00 0.00 H new ATOM 0 HB2 GLU A 136 117.098 11.763 26.381 1.00 0.00 H new ATOM 0 HB3 GLU A 136 115.968 12.288 27.613 1.00 0.00 H new ATOM 0 HG2 GLU A 136 117.251 10.902 29.315 1.00 0.00 H new ATOM 0 HG3 GLU A 136 118.421 10.512 28.069 1.00 0.00 H new TER 2275 GLU A 136