USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 766 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 62 MET CE :methyl -149:sc= -0.623 (180deg=-2.29!) USER MOD Set 1.2: A 105 MET CE :methyl -175:sc= -0.185 (180deg=-0.21) USER MOD Single : A 1 GLY N :NH3+ 153:sc= 0.0012 (180deg=0) USER MOD Single : A 2 SER OG : rot 14:sc= 0.705 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 72:sc= 0.557 USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 22 GLN : amide:sc= -1.48 K(o=-1.5,f=-2.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.52 K(o=-0.52,f=-1.9!) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 39 THR OG1 : rot 176:sc= -5.15! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -3.82! C(o=-3.8!,f=-3.7!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.0284 USER MOD Single : A 52 TYR OH : rot 30:sc= -1.25 USER MOD Single : A 53 THR OG1 : rot 180:sc=-0.00556 USER MOD Single : A 55 GLN : amide:sc= -0.314 K(o=-0.31,f=-3!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 51:sc= 0.00853 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -3.69! C(o=-3.7!,f=-3.2!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=-0.004) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0141 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.859 X(o=-0.86,f=-0.87) USER MOD Single : A 87 TYR OH : rot 10:sc= 0.335 USER MOD Single : A 88 TYR OH : rot 30:sc= -0.0508 USER MOD Single : A 93 SER OG : rot 141:sc= 1.03 USER MOD Single : A 95 ASN : amide:sc= -6.34 K(o=-6.3,f=-10!) USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 106:sc= 0.0238 USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.0355 USER MOD Single : A 106 THR OG1 : rot 38:sc= 0.144 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot -172:sc= -0.318 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.664 -23.574 15.688 1.00 0.00 N ATOM 2 CA GLY A 1 6.478 -22.967 15.110 1.00 0.00 C ATOM 3 C GLY A 1 5.278 -23.913 15.202 1.00 0.00 C ATOM 4 O GLY A 1 5.392 -25.097 14.891 1.00 0.00 O ATOM 0 H1 GLY A 1 8.513 -23.173 15.240 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.689 -23.383 16.710 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.641 -24.601 15.529 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.252 -22.035 15.629 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.666 -22.713 14.067 1.00 0.00 H new ATOM 8 N SER A 2 4.156 -23.352 15.628 1.00 0.00 N ATOM 9 CA SER A 2 2.937 -24.130 15.765 1.00 0.00 C ATOM 10 C SER A 2 1.718 -23.205 15.726 1.00 0.00 C ATOM 11 O SER A 2 1.832 -22.011 15.997 1.00 0.00 O ATOM 12 CB SER A 2 2.944 -24.944 17.060 1.00 0.00 C ATOM 13 OG SER A 2 3.782 -26.092 16.964 1.00 0.00 O ATOM 0 H SER A 2 4.066 -22.368 15.883 1.00 0.00 H new ATOM 0 HA SER A 2 2.883 -24.828 14.930 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.284 -24.314 17.882 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.927 -25.256 17.297 1.00 0.00 H new ATOM 0 HG SER A 2 4.355 -26.014 16.173 1.00 0.00 H new ATOM 18 N SER A 3 0.579 -23.792 15.387 1.00 0.00 N ATOM 19 CA SER A 3 -0.658 -23.035 15.310 1.00 0.00 C ATOM 20 C SER A 3 -1.806 -23.952 14.882 1.00 0.00 C ATOM 21 O SER A 3 -1.602 -24.891 14.115 1.00 0.00 O ATOM 22 CB SER A 3 -0.527 -21.861 14.338 1.00 0.00 C ATOM 23 OG SER A 3 -1.066 -20.658 14.878 1.00 0.00 O ATOM 0 H SER A 3 0.488 -24.783 15.163 1.00 0.00 H new ATOM 0 HA SER A 3 -0.873 -22.630 16.299 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.524 -21.709 14.093 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.040 -22.102 13.407 1.00 0.00 H new ATOM 0 HG SER A 3 -0.962 -19.932 14.228 1.00 0.00 H new ATOM 28 N GLY A 4 -2.988 -23.647 15.397 1.00 0.00 N ATOM 29 CA GLY A 4 -4.169 -24.431 15.077 1.00 0.00 C ATOM 30 C GLY A 4 -5.404 -23.538 14.955 1.00 0.00 C ATOM 31 O GLY A 4 -5.741 -23.084 13.862 1.00 0.00 O ATOM 0 H GLY A 4 -3.153 -22.868 16.034 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.011 -24.968 14.142 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -4.333 -25.180 15.851 1.00 0.00 H new ATOM 35 N SER A 5 -6.047 -23.311 16.092 1.00 0.00 N ATOM 36 CA SER A 5 -7.238 -22.480 16.125 1.00 0.00 C ATOM 37 C SER A 5 -8.334 -23.099 15.254 1.00 0.00 C ATOM 38 O SER A 5 -8.040 -23.803 14.289 1.00 0.00 O ATOM 39 CB SER A 5 -6.930 -21.057 15.657 1.00 0.00 C ATOM 40 OG SER A 5 -6.549 -20.209 16.738 1.00 0.00 O ATOM 0 H SER A 5 -5.765 -23.688 16.997 1.00 0.00 H new ATOM 0 HA SER A 5 -7.588 -22.427 17.156 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.129 -21.084 14.918 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.807 -20.641 15.162 1.00 0.00 H new ATOM 0 HG SER A 5 -6.359 -19.310 16.397 1.00 0.00 H new ATOM 45 N SER A 6 -9.573 -22.815 15.628 1.00 0.00 N ATOM 46 CA SER A 6 -10.713 -23.336 14.893 1.00 0.00 C ATOM 47 C SER A 6 -12.011 -22.756 15.461 1.00 0.00 C ATOM 48 O SER A 6 -12.060 -22.363 16.625 1.00 0.00 O ATOM 49 CB SER A 6 -10.749 -24.865 14.942 1.00 0.00 C ATOM 50 OG SER A 6 -10.760 -25.440 13.638 1.00 0.00 O ATOM 0 H SER A 6 -9.812 -22.231 16.430 1.00 0.00 H new ATOM 0 HA SER A 6 -10.613 -23.036 13.850 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.882 -25.231 15.492 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.634 -25.190 15.489 1.00 0.00 H new ATOM 0 HG SER A 6 -10.781 -26.417 13.711 1.00 0.00 H new ATOM 55 N GLY A 7 -13.028 -22.723 14.613 1.00 0.00 N ATOM 56 CA GLY A 7 -14.321 -22.198 15.016 1.00 0.00 C ATOM 57 C GLY A 7 -15.186 -23.294 15.641 1.00 0.00 C ATOM 58 O GLY A 7 -14.673 -24.191 16.308 1.00 0.00 O ATOM 0 H GLY A 7 -12.983 -23.051 13.648 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.182 -21.387 15.731 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.832 -21.775 14.151 1.00 0.00 H new ATOM 62 N ALA A 8 -16.486 -23.185 15.403 1.00 0.00 N ATOM 63 CA ALA A 8 -17.427 -24.156 15.934 1.00 0.00 C ATOM 64 C ALA A 8 -18.489 -24.462 14.877 1.00 0.00 C ATOM 65 O ALA A 8 -19.660 -24.133 15.054 1.00 0.00 O ATOM 66 CB ALA A 8 -18.035 -23.620 17.233 1.00 0.00 C ATOM 0 H ALA A 8 -16.909 -22.439 14.850 1.00 0.00 H new ATOM 0 HA ALA A 8 -16.920 -25.091 16.172 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -18.741 -24.348 17.632 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -17.243 -23.446 17.961 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -18.555 -22.683 17.032 1.00 0.00 H new ATOM 72 N SER A 9 -18.041 -25.089 13.799 1.00 0.00 N ATOM 73 CA SER A 9 -18.938 -25.443 12.712 1.00 0.00 C ATOM 74 C SER A 9 -18.135 -25.717 11.439 1.00 0.00 C ATOM 75 O SER A 9 -17.109 -25.083 11.199 1.00 0.00 O ATOM 76 CB SER A 9 -19.966 -24.337 12.463 1.00 0.00 C ATOM 77 OG SER A 9 -21.249 -24.674 12.985 1.00 0.00 O ATOM 0 H SER A 9 -17.069 -25.361 13.655 1.00 0.00 H new ATOM 0 HA SER A 9 -19.478 -26.347 12.995 1.00 0.00 H new ATOM 0 HB2 SER A 9 -19.620 -23.410 12.921 1.00 0.00 H new ATOM 0 HB3 SER A 9 -20.047 -24.152 11.392 1.00 0.00 H new ATOM 0 HG SER A 9 -21.227 -24.625 13.964 1.00 0.00 H new ATOM 82 N ILE A 10 -18.632 -26.663 10.656 1.00 0.00 N ATOM 83 CA ILE A 10 -17.974 -27.029 9.414 1.00 0.00 C ATOM 84 C ILE A 10 -19.017 -27.554 8.424 1.00 0.00 C ATOM 85 O ILE A 10 -19.786 -28.457 8.749 1.00 0.00 O ATOM 86 CB ILE A 10 -16.832 -28.010 9.681 1.00 0.00 C ATOM 87 CG1 ILE A 10 -16.176 -28.460 8.374 1.00 0.00 C ATOM 88 CG2 ILE A 10 -17.312 -29.197 10.519 1.00 0.00 C ATOM 89 CD1 ILE A 10 -17.070 -29.451 7.625 1.00 0.00 C ATOM 0 H ILE A 10 -19.483 -27.187 10.858 1.00 0.00 H new ATOM 0 HA ILE A 10 -17.511 -26.154 8.957 1.00 0.00 H new ATOM 0 HB ILE A 10 -16.069 -27.493 10.262 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.980 -27.593 7.744 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -15.212 -28.923 8.587 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -16.480 -29.879 10.694 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -17.693 -28.837 11.475 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -18.105 -29.722 9.986 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.581 -29.755 6.700 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -17.244 -30.328 8.249 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -18.023 -28.977 7.392 1.00 0.00 H new ATOM 100 N ASP A 11 -19.008 -26.966 7.236 1.00 0.00 N ATOM 101 CA ASP A 11 -19.944 -27.364 6.199 1.00 0.00 C ATOM 102 C ASP A 11 -19.744 -26.472 4.971 1.00 0.00 C ATOM 103 O ASP A 11 -20.478 -25.504 4.776 1.00 0.00 O ATOM 104 CB ASP A 11 -21.390 -27.203 6.669 1.00 0.00 C ATOM 105 CG ASP A 11 -22.404 -28.105 5.963 1.00 0.00 C ATOM 106 OD1 ASP A 11 -22.571 -29.250 6.436 1.00 0.00 O ATOM 107 OD2 ASP A 11 -22.988 -27.630 4.966 1.00 0.00 O ATOM 0 H ASP A 11 -18.368 -26.218 6.969 1.00 0.00 H new ATOM 0 HA ASP A 11 -19.758 -28.411 5.960 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -21.432 -27.403 7.740 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -21.689 -26.165 6.526 1.00 0.00 H new ATOM 111 N ILE A 12 -18.748 -26.831 4.174 1.00 0.00 N ATOM 112 CA ILE A 12 -18.443 -26.075 2.971 1.00 0.00 C ATOM 113 C ILE A 12 -19.494 -26.382 1.902 1.00 0.00 C ATOM 114 O ILE A 12 -19.268 -27.217 1.027 1.00 0.00 O ATOM 115 CB ILE A 12 -17.007 -26.346 2.517 1.00 0.00 C ATOM 116 CG1 ILE A 12 -16.001 -25.870 3.569 1.00 0.00 C ATOM 117 CG2 ILE A 12 -16.739 -25.725 1.146 1.00 0.00 C ATOM 118 CD1 ILE A 12 -14.579 -26.294 3.197 1.00 0.00 C ATOM 0 H ILE A 12 -18.142 -27.635 4.338 1.00 0.00 H new ATOM 0 HA ILE A 12 -18.493 -25.005 3.171 1.00 0.00 H new ATOM 0 HB ILE A 12 -16.879 -27.423 2.412 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -16.049 -24.785 3.659 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -16.265 -26.283 4.543 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -15.711 -25.932 0.847 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -17.423 -26.152 0.413 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -16.891 -24.647 1.199 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -13.884 -25.944 3.960 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -14.529 -27.381 3.132 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -14.310 -25.860 2.234 1.00 0.00 H new ATOM 129 N GLN A 13 -20.618 -25.690 2.006 1.00 0.00 N ATOM 130 CA GLN A 13 -21.704 -25.878 1.059 1.00 0.00 C ATOM 131 C GLN A 13 -22.178 -24.527 0.520 1.00 0.00 C ATOM 132 O GLN A 13 -23.378 -24.260 0.473 1.00 0.00 O ATOM 133 CB GLN A 13 -22.860 -26.651 1.697 1.00 0.00 C ATOM 134 CG GLN A 13 -23.914 -27.021 0.652 1.00 0.00 C ATOM 135 CD GLN A 13 -25.032 -27.862 1.274 1.00 0.00 C ATOM 136 OE1 GLN A 13 -24.838 -28.578 2.243 1.00 0.00 O ATOM 137 NE2 GLN A 13 -26.207 -27.736 0.664 1.00 0.00 N ATOM 0 H GLN A 13 -20.801 -24.997 2.732 1.00 0.00 H new ATOM 0 HA GLN A 13 -21.333 -26.470 0.223 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -22.479 -27.556 2.171 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -23.317 -26.048 2.482 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -24.335 -26.114 0.218 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -23.446 -27.576 -0.161 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -26.299 -27.119 -0.143 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -27.016 -28.257 1.003 1.00 0.00 H new ATOM 144 N ILE A 14 -21.212 -23.710 0.128 1.00 0.00 N ATOM 145 CA ILE A 14 -21.516 -22.393 -0.406 1.00 0.00 C ATOM 146 C ILE A 14 -20.419 -21.981 -1.392 1.00 0.00 C ATOM 147 O ILE A 14 -19.451 -21.327 -1.009 1.00 0.00 O ATOM 148 CB ILE A 14 -21.731 -21.391 0.729 1.00 0.00 C ATOM 149 CG1 ILE A 14 -22.174 -22.101 2.011 1.00 0.00 C ATOM 150 CG2 ILE A 14 -22.710 -20.292 0.314 1.00 0.00 C ATOM 151 CD1 ILE A 14 -22.296 -21.111 3.172 1.00 0.00 C ATOM 0 H ILE A 14 -20.218 -23.934 0.169 1.00 0.00 H new ATOM 0 HA ILE A 14 -22.453 -22.415 -0.962 1.00 0.00 H new ATOM 0 HB ILE A 14 -20.778 -20.907 0.942 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -23.132 -22.593 1.846 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -21.456 -22.880 2.266 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -22.844 -19.594 1.140 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -22.314 -19.760 -0.551 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -23.670 -20.739 0.057 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -22.612 -21.641 4.070 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -21.330 -20.639 3.350 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -23.033 -20.347 2.923 1.00 0.00 H new ATOM 162 N ILE A 15 -20.609 -22.381 -2.640 1.00 0.00 N ATOM 163 CA ILE A 15 -19.648 -22.062 -3.682 1.00 0.00 C ATOM 164 C ILE A 15 -19.886 -20.631 -4.168 1.00 0.00 C ATOM 165 O ILE A 15 -21.026 -20.238 -4.418 1.00 0.00 O ATOM 166 CB ILE A 15 -19.700 -23.108 -4.797 1.00 0.00 C ATOM 167 CG1 ILE A 15 -21.146 -23.407 -5.201 1.00 0.00 C ATOM 168 CG2 ILE A 15 -18.943 -24.375 -4.397 1.00 0.00 C ATOM 169 CD1 ILE A 15 -21.242 -23.731 -6.693 1.00 0.00 C ATOM 0 H ILE A 15 -21.414 -22.923 -2.953 1.00 0.00 H new ATOM 0 HA ILE A 15 -18.632 -22.100 -3.289 1.00 0.00 H new ATOM 0 HB ILE A 15 -19.199 -22.698 -5.674 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -21.524 -24.247 -4.618 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -21.777 -22.549 -4.970 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -18.996 -25.102 -5.208 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -17.900 -24.128 -4.198 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -19.393 -24.799 -3.499 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -22.280 -23.940 -6.954 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -20.886 -22.880 -7.274 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -20.629 -24.604 -6.916 1.00 0.00 H new ATOM 180 N ASP A 16 -18.794 -19.892 -4.289 1.00 0.00 N ATOM 181 CA ASP A 16 -18.870 -18.513 -4.741 1.00 0.00 C ATOM 182 C ASP A 16 -17.468 -17.899 -4.733 1.00 0.00 C ATOM 183 O ASP A 16 -16.623 -18.283 -3.925 1.00 0.00 O ATOM 184 CB ASP A 16 -19.756 -17.677 -3.814 1.00 0.00 C ATOM 185 CG ASP A 16 -19.188 -17.444 -2.413 1.00 0.00 C ATOM 186 OD1 ASP A 16 -18.193 -18.125 -2.084 1.00 0.00 O ATOM 187 OD2 ASP A 16 -19.760 -16.589 -1.703 1.00 0.00 O ATOM 0 H ASP A 16 -17.851 -20.222 -4.082 1.00 0.00 H new ATOM 0 HA ASP A 16 -19.294 -18.511 -5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -19.935 -16.709 -4.283 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -20.724 -18.169 -3.720 1.00 0.00 H new ATOM 191 N ARG A 17 -17.264 -16.958 -5.642 1.00 0.00 N ATOM 192 CA ARG A 17 -15.979 -16.289 -5.751 1.00 0.00 C ATOM 193 C ARG A 17 -15.792 -15.307 -4.591 1.00 0.00 C ATOM 194 O ARG A 17 -16.745 -14.658 -4.164 1.00 0.00 O ATOM 195 CB ARG A 17 -15.862 -15.531 -7.075 1.00 0.00 C ATOM 196 CG ARG A 17 -15.638 -16.496 -8.241 1.00 0.00 C ATOM 197 CD ARG A 17 -16.218 -15.932 -9.539 1.00 0.00 C ATOM 198 NE ARG A 17 -17.629 -16.351 -9.687 1.00 0.00 N ATOM 199 CZ ARG A 17 -18.432 -15.949 -10.681 1.00 0.00 C ATOM 200 NH1 ARG A 17 -17.969 -15.114 -11.622 1.00 0.00 N ATOM 201 NH2 ARG A 17 -19.699 -16.382 -10.736 1.00 0.00 N ATOM 0 H ARG A 17 -17.967 -16.643 -6.310 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.203 -17.054 -5.714 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.769 -14.951 -7.247 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -15.036 -14.822 -7.021 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.571 -16.680 -8.365 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -16.103 -17.456 -8.018 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -16.152 -14.844 -9.534 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -15.635 -16.283 -10.390 1.00 0.00 H new ATOM 0 HE ARG A 17 -18.015 -16.986 -8.988 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -17.005 -14.784 -11.581 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -18.581 -14.808 -12.379 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -20.052 -17.018 -10.021 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -20.310 -16.076 -11.493 1.00 0.00 H new ATOM 212 N PRO A 18 -14.525 -15.229 -4.103 1.00 0.00 N ATOM 213 CA PRO A 18 -14.201 -14.338 -3.002 1.00 0.00 C ATOM 214 C PRO A 18 -14.148 -12.883 -3.472 1.00 0.00 C ATOM 215 O PRO A 18 -13.470 -12.566 -4.448 1.00 0.00 O ATOM 216 CB PRO A 18 -12.869 -14.839 -2.470 1.00 0.00 C ATOM 217 CG PRO A 18 -12.273 -15.694 -3.575 1.00 0.00 C ATOM 218 CD PRO A 18 -13.372 -15.983 -4.585 1.00 0.00 C ATOM 0 HA PRO A 18 -14.957 -14.347 -2.217 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -12.210 -14.007 -2.222 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -13.006 -15.420 -1.558 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -11.442 -15.175 -4.053 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -11.876 -16.623 -3.167 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -13.082 -15.666 -5.587 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -13.590 -17.050 -4.638 1.00 0.00 H new ATOM 223 N GLY A 19 -14.874 -12.036 -2.755 1.00 0.00 N ATOM 224 CA GLY A 19 -14.917 -10.622 -3.086 1.00 0.00 C ATOM 225 C GLY A 19 -13.508 -10.026 -3.135 1.00 0.00 C ATOM 226 O GLY A 19 -12.523 -10.759 -3.191 1.00 0.00 O ATOM 0 H GLY A 19 -15.436 -12.302 -1.947 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -15.407 -10.485 -4.050 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -15.515 -10.090 -2.346 1.00 0.00 H new ATOM 230 N PRO A 20 -13.459 -8.667 -3.111 1.00 0.00 N ATOM 231 CA PRO A 20 -12.188 -7.965 -3.151 1.00 0.00 C ATOM 232 C PRO A 20 -11.471 -8.050 -1.802 1.00 0.00 C ATOM 233 O PRO A 20 -12.030 -8.553 -0.829 1.00 0.00 O ATOM 234 CB PRO A 20 -12.538 -6.540 -3.549 1.00 0.00 C ATOM 235 CG PRO A 20 -14.022 -6.381 -3.263 1.00 0.00 C ATOM 236 CD PRO A 20 -14.606 -7.767 -3.044 1.00 0.00 C ATOM 0 HA PRO A 20 -11.488 -8.403 -3.863 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.951 -5.820 -2.979 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -12.322 -6.364 -4.603 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -14.176 -5.758 -2.382 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.520 -5.884 -4.096 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -15.109 -7.837 -2.079 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -15.345 -8.010 -3.807 1.00 0.00 H new ATOM 241 N PRO A 21 -10.211 -7.537 -1.786 1.00 0.00 N ATOM 242 CA PRO A 21 -9.412 -7.550 -0.573 1.00 0.00 C ATOM 243 C PRO A 21 -9.895 -6.485 0.413 1.00 0.00 C ATOM 244 O PRO A 21 -10.416 -5.447 0.006 1.00 0.00 O ATOM 245 CB PRO A 21 -7.984 -7.322 -1.041 1.00 0.00 C ATOM 246 CG PRO A 21 -8.091 -6.730 -2.437 1.00 0.00 C ATOM 247 CD PRO A 21 -9.517 -6.933 -2.921 1.00 0.00 C ATOM 0 HA PRO A 21 -9.493 -8.489 -0.026 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -7.457 -6.645 -0.369 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -7.424 -8.257 -1.055 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.840 -5.669 -2.422 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.386 -7.215 -3.112 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.976 -5.987 -3.208 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.550 -7.582 -3.796 1.00 0.00 H new ATOM 252 N GLN A 22 -9.706 -6.778 1.691 1.00 0.00 N ATOM 253 CA GLN A 22 -10.116 -5.859 2.738 1.00 0.00 C ATOM 254 C GLN A 22 -9.682 -4.433 2.393 1.00 0.00 C ATOM 255 O GLN A 22 -10.469 -3.495 2.509 1.00 0.00 O ATOM 256 CB GLN A 22 -9.556 -6.288 4.096 1.00 0.00 C ATOM 257 CG GLN A 22 -10.582 -7.110 4.877 1.00 0.00 C ATOM 258 CD GLN A 22 -10.201 -7.200 6.357 1.00 0.00 C ATOM 259 OE1 GLN A 22 -10.086 -8.270 6.931 1.00 0.00 O ATOM 260 NE2 GLN A 22 -10.010 -6.020 6.940 1.00 0.00 N ATOM 0 H GLN A 22 -9.274 -7.640 2.025 1.00 0.00 H new ATOM 0 HA GLN A 22 -11.204 -5.881 2.807 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -8.649 -6.875 3.950 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -9.276 -5.407 4.673 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -11.568 -6.656 4.779 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -10.649 -8.112 4.453 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -10.123 -5.161 6.402 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.751 -5.974 7.925 1.00 0.00 H new ATOM 267 N ILE A 23 -8.431 -4.314 1.974 1.00 0.00 N ATOM 268 CA ILE A 23 -7.882 -3.019 1.611 1.00 0.00 C ATOM 269 C ILE A 23 -6.567 -3.219 0.854 1.00 0.00 C ATOM 270 O ILE A 23 -5.980 -4.300 0.899 1.00 0.00 O ATOM 271 CB ILE A 23 -7.750 -2.127 2.847 1.00 0.00 C ATOM 272 CG1 ILE A 23 -7.837 -0.647 2.467 1.00 0.00 C ATOM 273 CG2 ILE A 23 -6.468 -2.445 3.619 1.00 0.00 C ATOM 274 CD1 ILE A 23 -6.444 -0.054 2.248 1.00 0.00 C ATOM 0 H ILE A 23 -7.781 -5.094 1.878 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.560 -2.494 0.938 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.587 -2.339 3.512 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.430 -0.535 1.560 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.351 -0.095 3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.399 -1.797 4.493 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.486 -3.486 3.940 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.605 -2.279 2.975 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.535 0.998 1.979 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -5.861 -0.145 3.165 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.942 -0.592 1.444 1.00 0.00 H new ATOM 285 N VAL A 24 -6.144 -2.163 0.177 1.00 0.00 N ATOM 286 CA VAL A 24 -4.910 -2.210 -0.589 1.00 0.00 C ATOM 287 C VAL A 24 -4.149 -0.896 -0.402 1.00 0.00 C ATOM 288 O VAL A 24 -4.614 0.161 -0.823 1.00 0.00 O ATOM 289 CB VAL A 24 -5.215 -2.520 -2.056 1.00 0.00 C ATOM 290 CG1 VAL A 24 -3.933 -2.539 -2.891 1.00 0.00 C ATOM 291 CG2 VAL A 24 -5.978 -3.839 -2.190 1.00 0.00 C ATOM 0 H VAL A 24 -6.634 -1.269 0.142 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.267 -3.013 -0.228 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.852 -1.724 -2.441 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -4.178 -2.762 -3.929 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -3.447 -1.565 -2.834 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -3.259 -3.304 -2.505 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -6.182 -4.036 -3.242 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -5.377 -4.650 -1.779 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -6.919 -3.772 -1.644 1.00 0.00 H new ATOM 301 N LYS A 25 -2.990 -1.006 0.232 1.00 0.00 N ATOM 302 CA LYS A 25 -2.159 0.160 0.480 1.00 0.00 C ATOM 303 C LYS A 25 -0.765 -0.077 -0.104 1.00 0.00 C ATOM 304 O LYS A 25 -0.463 -1.175 -0.570 1.00 0.00 O ATOM 305 CB LYS A 25 -2.151 0.504 1.971 1.00 0.00 C ATOM 306 CG LYS A 25 -3.310 1.437 2.326 1.00 0.00 C ATOM 307 CD LYS A 25 -2.915 2.400 3.448 1.00 0.00 C ATOM 308 CE LYS A 25 -3.957 2.392 4.568 1.00 0.00 C ATOM 309 NZ LYS A 25 -3.395 2.986 5.802 1.00 0.00 N ATOM 0 H LYS A 25 -2.607 -1.885 0.581 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.570 1.035 -0.024 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.223 -0.411 2.559 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.205 0.978 2.233 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -3.609 2.004 1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.174 0.848 2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.942 2.117 3.849 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -2.814 3.409 3.048 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.839 2.952 4.257 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.281 1.370 4.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -4.115 2.973 6.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -2.567 2.435 6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -3.108 3.968 5.615 1.00 0.00 H new ATOM 319 N ILE A 26 0.047 0.968 -0.060 1.00 0.00 N ATOM 320 CA ILE A 26 1.401 0.887 -0.579 1.00 0.00 C ATOM 321 C ILE A 26 2.394 1.128 0.558 1.00 0.00 C ATOM 322 O ILE A 26 2.622 2.268 0.958 1.00 0.00 O ATOM 323 CB ILE A 26 1.579 1.840 -1.763 1.00 0.00 C ATOM 324 CG1 ILE A 26 0.651 1.459 -2.918 1.00 0.00 C ATOM 325 CG2 ILE A 26 3.044 1.902 -2.202 1.00 0.00 C ATOM 326 CD1 ILE A 26 -0.117 2.680 -3.429 1.00 0.00 C ATOM 0 H ILE A 26 -0.207 1.877 0.328 1.00 0.00 H new ATOM 0 HA ILE A 26 1.600 -0.111 -0.970 1.00 0.00 H new ATOM 0 HB ILE A 26 1.297 2.842 -1.440 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.234 1.026 -3.730 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.052 0.695 -2.587 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.143 2.586 -3.045 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.657 2.256 -1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.377 0.908 -2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.769 2.382 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.718 3.096 -2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.589 3.432 -3.781 1.00 0.00 H new ATOM 337 N GLU A 27 2.960 0.034 1.049 1.00 0.00 N ATOM 338 CA GLU A 27 3.924 0.112 2.134 1.00 0.00 C ATOM 339 C GLU A 27 4.832 1.329 1.950 1.00 0.00 C ATOM 340 O GLU A 27 5.142 2.028 2.913 1.00 0.00 O ATOM 341 CB GLU A 27 4.743 -1.175 2.232 1.00 0.00 C ATOM 342 CG GLU A 27 4.499 -1.882 3.567 1.00 0.00 C ATOM 343 CD GLU A 27 5.544 -1.469 4.606 1.00 0.00 C ATOM 344 OE1 GLU A 27 6.659 -2.028 4.540 1.00 0.00 O ATOM 345 OE2 GLU A 27 5.203 -0.604 5.442 1.00 0.00 O ATOM 0 H GLU A 27 2.769 -0.911 0.715 1.00 0.00 H new ATOM 0 HA GLU A 27 3.380 0.229 3.071 1.00 0.00 H new ATOM 0 HB2 GLU A 27 4.479 -1.841 1.411 1.00 0.00 H new ATOM 0 HB3 GLU A 27 5.803 -0.944 2.127 1.00 0.00 H new ATOM 0 HG2 GLU A 27 3.501 -1.640 3.934 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.532 -2.962 3.422 1.00 0.00 H new ATOM 350 N ASP A 28 5.235 1.543 0.706 1.00 0.00 N ATOM 351 CA ASP A 28 6.103 2.664 0.383 1.00 0.00 C ATOM 352 C ASP A 28 6.641 2.493 -1.039 1.00 0.00 C ATOM 353 O ASP A 28 6.330 1.509 -1.711 1.00 0.00 O ATOM 354 CB ASP A 28 7.299 2.727 1.336 1.00 0.00 C ATOM 355 CG ASP A 28 7.370 3.986 2.201 1.00 0.00 C ATOM 356 OD1 ASP A 28 6.352 4.276 2.867 1.00 0.00 O ATOM 357 OD2 ASP A 28 8.440 4.632 2.176 1.00 0.00 O ATOM 0 H ASP A 28 4.977 0.960 -0.090 1.00 0.00 H new ATOM 0 HA ASP A 28 5.519 3.580 0.475 1.00 0.00 H new ATOM 0 HB2 ASP A 28 7.269 1.856 1.990 1.00 0.00 H new ATOM 0 HB3 ASP A 28 8.215 2.655 0.750 1.00 0.00 H new ATOM 361 N VAL A 29 7.439 3.464 -1.457 1.00 0.00 N ATOM 362 CA VAL A 29 8.023 3.434 -2.787 1.00 0.00 C ATOM 363 C VAL A 29 9.403 4.091 -2.748 1.00 0.00 C ATOM 364 O VAL A 29 9.533 5.248 -2.349 1.00 0.00 O ATOM 365 CB VAL A 29 7.074 4.094 -3.790 1.00 0.00 C ATOM 366 CG1 VAL A 29 6.587 5.449 -3.274 1.00 0.00 C ATOM 367 CG2 VAL A 29 7.738 4.235 -5.161 1.00 0.00 C ATOM 0 H VAL A 29 7.695 4.277 -0.897 1.00 0.00 H new ATOM 0 HA VAL A 29 8.162 2.406 -3.120 1.00 0.00 H new ATOM 0 HB VAL A 29 6.204 3.447 -3.904 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.914 5.897 -4.006 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.058 5.310 -2.331 1.00 0.00 H new ATOM 0 HG13 VAL A 29 7.442 6.107 -3.117 1.00 0.00 H new ATOM 0 HG21 VAL A 29 7.043 4.707 -5.855 1.00 0.00 H new ATOM 0 HG22 VAL A 29 8.633 4.850 -5.070 1.00 0.00 H new ATOM 0 HG23 VAL A 29 8.012 3.249 -5.536 1.00 0.00 H new ATOM 377 N TRP A 30 10.400 3.326 -3.167 1.00 0.00 N ATOM 378 CA TRP A 30 11.767 3.820 -3.186 1.00 0.00 C ATOM 379 C TRP A 30 12.372 3.485 -4.550 1.00 0.00 C ATOM 380 O TRP A 30 11.998 2.492 -5.173 1.00 0.00 O ATOM 381 CB TRP A 30 12.572 3.247 -2.017 1.00 0.00 C ATOM 382 CG TRP A 30 12.632 1.719 -1.992 1.00 0.00 C ATOM 383 CD1 TRP A 30 13.604 0.923 -2.457 1.00 0.00 C ATOM 384 CD2 TRP A 30 11.632 0.829 -1.451 1.00 0.00 C ATOM 385 NE1 TRP A 30 13.306 -0.410 -2.257 1.00 0.00 N ATOM 386 CE2 TRP A 30 12.069 -0.468 -1.626 1.00 0.00 C ATOM 387 CE3 TRP A 30 10.400 1.111 -0.835 1.00 0.00 C ATOM 388 CZ2 TRP A 30 11.334 -1.587 -1.212 1.00 0.00 C ATOM 389 CZ3 TRP A 30 9.679 -0.018 -0.427 1.00 0.00 C ATOM 390 CH2 TRP A 30 10.104 -1.330 -0.596 1.00 0.00 C ATOM 0 H TRP A 30 10.289 2.367 -3.496 1.00 0.00 H new ATOM 0 HA TRP A 30 11.789 4.902 -3.053 1.00 0.00 H new ATOM 0 HB2 TRP A 30 13.588 3.639 -2.062 1.00 0.00 H new ATOM 0 HB3 TRP A 30 12.136 3.598 -1.082 1.00 0.00 H new ATOM 0 HD1 TRP A 30 14.508 1.279 -2.929 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.886 -1.205 -2.523 1.00 0.00 H new ATOM 0 HE3 TRP A 30 10.039 2.118 -0.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 11.697 -2.593 -1.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 8.725 0.142 0.053 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.488 -2.148 -0.253 1.00 0.00 H new ATOM 400 N GLY A 31 13.298 4.333 -4.974 1.00 0.00 N ATOM 401 CA GLY A 31 13.959 4.139 -6.254 1.00 0.00 C ATOM 402 C GLY A 31 12.972 3.643 -7.313 1.00 0.00 C ATOM 403 O GLY A 31 11.989 4.318 -7.614 1.00 0.00 O ATOM 0 H GLY A 31 13.606 5.155 -4.455 1.00 0.00 H new ATOM 0 HA2 GLY A 31 14.408 5.077 -6.581 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.770 3.419 -6.143 1.00 0.00 H new ATOM 407 N GLU A 32 13.267 2.467 -7.847 1.00 0.00 N ATOM 408 CA GLU A 32 12.417 1.874 -8.865 1.00 0.00 C ATOM 409 C GLU A 32 11.725 0.625 -8.316 1.00 0.00 C ATOM 410 O GLU A 32 11.480 -0.329 -9.054 1.00 0.00 O ATOM 411 CB GLU A 32 13.219 1.546 -10.126 1.00 0.00 C ATOM 412 CG GLU A 32 14.149 2.702 -10.501 1.00 0.00 C ATOM 413 CD GLU A 32 15.187 2.258 -11.532 1.00 0.00 C ATOM 414 OE1 GLU A 32 15.164 1.058 -11.882 1.00 0.00 O ATOM 415 OE2 GLU A 32 15.981 3.129 -11.950 1.00 0.00 O ATOM 0 H GLU A 32 14.083 1.909 -7.594 1.00 0.00 H new ATOM 0 HA GLU A 32 11.651 2.600 -9.139 1.00 0.00 H new ATOM 0 HB2 GLU A 32 13.805 0.641 -9.964 1.00 0.00 H new ATOM 0 HB3 GLU A 32 12.537 1.340 -10.951 1.00 0.00 H new ATOM 0 HG2 GLU A 32 13.563 3.529 -10.902 1.00 0.00 H new ATOM 0 HG3 GLU A 32 14.653 3.072 -9.608 1.00 0.00 H new ATOM 420 N ASN A 33 11.427 0.671 -7.025 1.00 0.00 N ATOM 421 CA ASN A 33 10.768 -0.445 -6.369 1.00 0.00 C ATOM 422 C ASN A 33 9.624 0.084 -5.501 1.00 0.00 C ATOM 423 O ASN A 33 9.837 0.932 -4.636 1.00 0.00 O ATOM 424 CB ASN A 33 11.738 -1.202 -5.461 1.00 0.00 C ATOM 425 CG ASN A 33 13.024 -1.559 -6.210 1.00 0.00 C ATOM 426 OD1 ASN A 33 13.162 -2.625 -6.787 1.00 0.00 O ATOM 427 ND2 ASN A 33 13.956 -0.610 -6.169 1.00 0.00 N ATOM 0 H ASN A 33 11.630 1.464 -6.416 1.00 0.00 H new ATOM 0 HA ASN A 33 10.397 -1.119 -7.141 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.977 -0.592 -4.590 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.263 -2.111 -5.093 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.850 -0.753 -6.639 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.776 0.260 -5.668 1.00 0.00 H new ATOM 433 N VAL A 34 8.434 -0.439 -5.764 1.00 0.00 N ATOM 434 CA VAL A 34 7.257 -0.030 -5.018 1.00 0.00 C ATOM 435 C VAL A 34 6.879 -1.132 -4.025 1.00 0.00 C ATOM 436 O VAL A 34 7.141 -2.309 -4.270 1.00 0.00 O ATOM 437 CB VAL A 34 6.122 0.320 -5.981 1.00 0.00 C ATOM 438 CG1 VAL A 34 4.758 0.025 -5.354 1.00 0.00 C ATOM 439 CG2 VAL A 34 6.215 1.780 -6.430 1.00 0.00 C ATOM 0 H VAL A 34 8.261 -1.142 -6.483 1.00 0.00 H new ATOM 0 HA VAL A 34 7.465 0.871 -4.441 1.00 0.00 H new ATOM 0 HB VAL A 34 6.227 -0.310 -6.864 1.00 0.00 H new ATOM 0 HG11 VAL A 34 3.969 0.283 -6.061 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.692 -1.035 -5.108 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.639 0.616 -4.446 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.396 2.003 -7.114 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.149 2.433 -5.560 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.166 1.945 -6.936 1.00 0.00 H new ATOM 449 N ALA A 35 6.270 -0.712 -2.927 1.00 0.00 N ATOM 450 CA ALA A 35 5.853 -1.649 -1.897 1.00 0.00 C ATOM 451 C ALA A 35 4.329 -1.615 -1.769 1.00 0.00 C ATOM 452 O ALA A 35 3.750 -0.571 -1.475 1.00 0.00 O ATOM 453 CB ALA A 35 6.556 -1.307 -0.581 1.00 0.00 C ATOM 0 H ALA A 35 6.055 0.265 -2.727 1.00 0.00 H new ATOM 0 HA ALA A 35 6.139 -2.666 -2.165 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.244 -2.009 0.192 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.635 -1.374 -0.717 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.290 -0.294 -0.279 1.00 0.00 H new ATOM 459 N LEU A 36 3.723 -2.771 -1.996 1.00 0.00 N ATOM 460 CA LEU A 36 2.277 -2.887 -1.910 1.00 0.00 C ATOM 461 C LEU A 36 1.905 -3.627 -0.623 1.00 0.00 C ATOM 462 O LEU A 36 2.680 -4.441 -0.125 1.00 0.00 O ATOM 463 CB LEU A 36 1.716 -3.537 -3.177 1.00 0.00 C ATOM 464 CG LEU A 36 1.498 -2.602 -4.369 1.00 0.00 C ATOM 465 CD1 LEU A 36 1.557 -3.375 -5.689 1.00 0.00 C ATOM 466 CD2 LEU A 36 0.192 -1.819 -4.221 1.00 0.00 C ATOM 0 H LEU A 36 4.207 -3.635 -2.239 1.00 0.00 H new ATOM 0 HA LEU A 36 1.818 -1.900 -1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.394 -4.333 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.764 -4.007 -2.930 1.00 0.00 H new ATOM 0 HG LEU A 36 2.309 -1.874 -4.385 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.399 -2.688 -6.520 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.534 -3.849 -5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.780 -4.140 -5.698 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.062 -1.162 -5.081 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.645 -2.515 -4.166 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.228 -1.221 -3.310 1.00 0.00 H new ATOM 477 N THR A 37 0.718 -3.317 -0.123 1.00 0.00 N ATOM 478 CA THR A 37 0.233 -3.943 1.096 1.00 0.00 C ATOM 479 C THR A 37 -1.292 -4.051 1.070 1.00 0.00 C ATOM 480 O THR A 37 -1.993 -3.052 1.224 1.00 0.00 O ATOM 481 CB THR A 37 0.764 -3.137 2.284 1.00 0.00 C ATOM 482 OG1 THR A 37 0.821 -1.799 1.798 1.00 0.00 O ATOM 483 CG2 THR A 37 2.219 -3.474 2.617 1.00 0.00 C ATOM 0 H THR A 37 0.078 -2.641 -0.539 1.00 0.00 H new ATOM 0 HA THR A 37 0.598 -4.966 1.188 1.00 0.00 H new ATOM 0 HB THR A 37 0.139 -3.324 3.157 1.00 0.00 H new ATOM 0 HG1 THR A 37 1.154 -1.208 2.505 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.546 -2.875 3.467 1.00 0.00 H new ATOM 0 HG22 THR A 37 2.299 -4.532 2.867 1.00 0.00 H new ATOM 0 HG23 THR A 37 2.849 -3.256 1.755 1.00 0.00 H new ATOM 491 N TRP A 38 -1.763 -5.275 0.872 1.00 0.00 N ATOM 492 CA TRP A 38 -3.193 -5.527 0.823 1.00 0.00 C ATOM 493 C TRP A 38 -3.552 -6.441 1.997 1.00 0.00 C ATOM 494 O TRP A 38 -2.690 -7.135 2.533 1.00 0.00 O ATOM 495 CB TRP A 38 -3.601 -6.106 -0.532 1.00 0.00 C ATOM 496 CG TRP A 38 -2.951 -7.453 -0.856 1.00 0.00 C ATOM 497 CD1 TRP A 38 -3.490 -8.675 -0.753 1.00 0.00 C ATOM 498 CD2 TRP A 38 -1.609 -7.665 -1.341 1.00 0.00 C ATOM 499 NE1 TRP A 38 -2.598 -9.656 -1.134 1.00 0.00 N ATOM 500 CE2 TRP A 38 -1.417 -9.022 -1.504 1.00 0.00 C ATOM 501 CE3 TRP A 38 -0.590 -6.741 -1.633 1.00 0.00 C ATOM 502 CZ2 TRP A 38 -0.216 -9.576 -1.963 1.00 0.00 C ATOM 503 CZ3 TRP A 38 0.603 -7.312 -2.091 1.00 0.00 C ATOM 504 CH2 TRP A 38 0.812 -8.675 -2.259 1.00 0.00 C ATOM 0 H TRP A 38 -1.179 -6.102 0.744 1.00 0.00 H new ATOM 0 HA TRP A 38 -3.753 -4.597 0.922 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -4.685 -6.223 -0.554 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -3.341 -5.392 -1.313 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -4.497 -8.868 -0.414 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -2.773 -10.661 -1.143 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -0.718 -5.675 -1.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.090 -10.642 -2.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 1.419 -6.646 -2.331 1.00 0.00 H new ATOM 0 HH2 TRP A 38 1.764 -9.037 -2.617 1.00 0.00 H new ATOM 514 N THR A 39 -4.826 -6.412 2.360 1.00 0.00 N ATOM 515 CA THR A 39 -5.310 -7.229 3.460 1.00 0.00 C ATOM 516 C THR A 39 -6.161 -8.384 2.931 1.00 0.00 C ATOM 517 O THR A 39 -6.719 -8.301 1.838 1.00 0.00 O ATOM 518 CB THR A 39 -6.060 -6.317 4.432 1.00 0.00 C ATOM 519 OG1 THR A 39 -6.934 -5.562 3.597 1.00 0.00 O ATOM 520 CG2 THR A 39 -5.150 -5.263 5.067 1.00 0.00 C ATOM 0 H THR A 39 -5.538 -5.835 1.912 1.00 0.00 H new ATOM 0 HA THR A 39 -4.485 -7.695 4.000 1.00 0.00 H new ATOM 0 HB THR A 39 -6.518 -6.921 5.215 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.505 -4.991 4.152 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.732 -4.642 5.748 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.351 -5.757 5.620 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.718 -4.637 4.286 1.00 0.00 H new ATOM 528 N PRO A 40 -6.237 -9.465 3.753 1.00 0.00 N ATOM 529 CA PRO A 40 -7.011 -10.637 3.379 1.00 0.00 C ATOM 530 C PRO A 40 -8.511 -10.374 3.530 1.00 0.00 C ATOM 531 O PRO A 40 -8.913 -9.418 4.191 1.00 0.00 O ATOM 532 CB PRO A 40 -6.509 -11.747 4.288 1.00 0.00 C ATOM 533 CG PRO A 40 -5.808 -11.053 5.445 1.00 0.00 C ATOM 534 CD PRO A 40 -5.589 -9.600 5.054 1.00 0.00 C ATOM 0 HA PRO A 40 -6.882 -10.909 2.331 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -7.334 -12.363 4.644 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.824 -12.408 3.756 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -6.411 -11.118 6.351 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -4.856 -11.538 5.661 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.027 -8.922 5.787 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.527 -9.362 4.994 1.00 0.00 H new ATOM 539 N PRO A 41 -9.317 -11.262 2.890 1.00 0.00 N ATOM 540 CA PRO A 41 -10.764 -11.135 2.947 1.00 0.00 C ATOM 541 C PRO A 41 -11.300 -11.578 4.310 1.00 0.00 C ATOM 542 O PRO A 41 -10.699 -12.422 4.973 1.00 0.00 O ATOM 543 CB PRO A 41 -11.278 -11.990 1.800 1.00 0.00 C ATOM 544 CG PRO A 41 -10.140 -12.929 1.435 1.00 0.00 C ATOM 545 CD PRO A 41 -8.876 -12.407 2.099 1.00 0.00 C ATOM 0 HA PRO A 41 -11.101 -10.104 2.840 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -12.165 -12.549 2.097 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.562 -11.371 0.949 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.358 -13.942 1.772 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -10.013 -12.973 0.353 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -8.416 -13.169 2.728 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -8.132 -12.113 1.358 1.00 0.00 H new ATOM 550 N LYS A 42 -12.424 -10.987 4.688 1.00 0.00 N ATOM 551 CA LYS A 42 -13.048 -11.310 5.960 1.00 0.00 C ATOM 552 C LYS A 42 -13.813 -12.629 5.828 1.00 0.00 C ATOM 553 O LYS A 42 -14.336 -13.148 6.813 1.00 0.00 O ATOM 554 CB LYS A 42 -13.912 -10.144 6.444 1.00 0.00 C ATOM 555 CG LYS A 42 -13.154 -9.284 7.458 1.00 0.00 C ATOM 556 CD LYS A 42 -13.981 -8.065 7.870 1.00 0.00 C ATOM 557 CE LYS A 42 -14.912 -8.402 9.036 1.00 0.00 C ATOM 558 NZ LYS A 42 -16.175 -7.640 8.927 1.00 0.00 N ATOM 0 H LYS A 42 -12.919 -10.286 4.136 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.290 -11.456 6.730 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -14.211 -9.531 5.594 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -14.826 -10.528 6.898 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.915 -9.880 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.208 -8.957 7.027 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -13.316 -7.250 8.155 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -14.568 -7.716 7.021 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -15.125 -9.471 9.042 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -14.420 -8.169 9.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -16.796 -7.880 9.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -15.968 -6.621 8.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -16.651 -7.882 8.034 1.00 0.00 H new ATOM 568 N ASP A 43 -13.854 -13.133 4.603 1.00 0.00 N ATOM 569 CA ASP A 43 -14.546 -14.380 4.330 1.00 0.00 C ATOM 570 C ASP A 43 -13.547 -15.406 3.791 1.00 0.00 C ATOM 571 O ASP A 43 -12.721 -15.083 2.937 1.00 0.00 O ATOM 572 CB ASP A 43 -15.638 -14.185 3.276 1.00 0.00 C ATOM 573 CG ASP A 43 -16.919 -14.988 3.516 1.00 0.00 C ATOM 574 OD1 ASP A 43 -17.441 -14.900 4.648 1.00 0.00 O ATOM 575 OD2 ASP A 43 -17.346 -15.673 2.561 1.00 0.00 O ATOM 0 H ASP A 43 -13.419 -12.700 3.789 1.00 0.00 H new ATOM 0 HA ASP A 43 -14.999 -14.724 5.260 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -15.894 -13.126 3.231 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -15.234 -14.457 2.301 1.00 0.00 H new ATOM 579 N ASP A 44 -13.655 -16.620 4.309 1.00 0.00 N ATOM 580 CA ASP A 44 -12.770 -17.694 3.891 1.00 0.00 C ATOM 581 C ASP A 44 -13.267 -19.017 4.479 1.00 0.00 C ATOM 582 O ASP A 44 -12.642 -19.572 5.381 1.00 0.00 O ATOM 583 CB ASP A 44 -11.343 -17.460 4.391 1.00 0.00 C ATOM 584 CG ASP A 44 -11.180 -17.486 5.912 1.00 0.00 C ATOM 585 OD1 ASP A 44 -12.172 -17.154 6.596 1.00 0.00 O ATOM 586 OD2 ASP A 44 -10.065 -17.837 6.357 1.00 0.00 O ATOM 0 H ASP A 44 -14.342 -16.884 5.015 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.769 -17.724 2.801 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -10.693 -18.220 3.958 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -10.997 -16.495 4.020 1.00 0.00 H new ATOM 590 N GLY A 45 -14.387 -19.480 3.945 1.00 0.00 N ATOM 591 CA GLY A 45 -14.975 -20.727 4.407 1.00 0.00 C ATOM 592 C GLY A 45 -15.049 -21.751 3.272 1.00 0.00 C ATOM 593 O GLY A 45 -14.667 -22.907 3.447 1.00 0.00 O ATOM 0 H GLY A 45 -14.903 -19.015 3.198 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.382 -21.131 5.228 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -15.975 -20.539 4.798 1.00 0.00 H new ATOM 597 N ASN A 46 -15.543 -21.289 2.132 1.00 0.00 N ATOM 598 CA ASN A 46 -15.672 -22.150 0.968 1.00 0.00 C ATOM 599 C ASN A 46 -14.874 -21.554 -0.193 1.00 0.00 C ATOM 600 O ASN A 46 -15.063 -20.392 -0.548 1.00 0.00 O ATOM 601 CB ASN A 46 -17.132 -22.266 0.528 1.00 0.00 C ATOM 602 CG ASN A 46 -18.078 -22.092 1.718 1.00 0.00 C ATOM 603 OD1 ASN A 46 -18.088 -21.077 2.394 1.00 0.00 O ATOM 604 ND2 ASN A 46 -18.872 -23.137 1.935 1.00 0.00 N ATOM 0 H ASN A 46 -15.859 -20.330 1.990 1.00 0.00 H new ATOM 0 HA ASN A 46 -15.297 -23.138 1.236 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -17.349 -21.511 -0.227 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -17.300 -23.238 0.064 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -19.540 -23.119 2.705 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -18.813 -23.957 1.331 1.00 0.00 H new ATOM 610 N ALA A 47 -13.999 -22.377 -0.752 1.00 0.00 N ATOM 611 CA ALA A 47 -13.172 -21.946 -1.866 1.00 0.00 C ATOM 612 C ALA A 47 -12.255 -20.811 -1.405 1.00 0.00 C ATOM 613 O ALA A 47 -12.209 -19.753 -2.030 1.00 0.00 O ATOM 614 CB ALA A 47 -14.067 -21.534 -3.037 1.00 0.00 C ATOM 0 H ALA A 47 -13.845 -23.340 -0.454 1.00 0.00 H new ATOM 0 HA ALA A 47 -12.538 -22.762 -2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -13.447 -21.211 -3.873 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -14.677 -22.383 -3.345 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -14.716 -20.714 -2.728 1.00 0.00 H new ATOM 620 N ALA A 48 -11.548 -21.071 -0.316 1.00 0.00 N ATOM 621 CA ALA A 48 -10.635 -20.084 0.236 1.00 0.00 C ATOM 622 C ALA A 48 -9.800 -19.478 -0.895 1.00 0.00 C ATOM 623 O ALA A 48 -9.811 -19.982 -2.017 1.00 0.00 O ATOM 624 CB ALA A 48 -9.767 -20.736 1.314 1.00 0.00 C ATOM 0 H ALA A 48 -11.588 -21.950 0.199 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.189 -19.273 0.709 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -9.083 -19.995 1.727 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.404 -21.125 2.108 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.195 -21.553 0.875 1.00 0.00 H new ATOM 630 N ILE A 49 -9.098 -18.407 -0.561 1.00 0.00 N ATOM 631 CA ILE A 49 -8.260 -17.727 -1.534 1.00 0.00 C ATOM 632 C ILE A 49 -6.931 -18.476 -1.667 1.00 0.00 C ATOM 633 O ILE A 49 -6.150 -18.534 -0.719 1.00 0.00 O ATOM 634 CB ILE A 49 -8.099 -16.251 -1.167 1.00 0.00 C ATOM 635 CG1 ILE A 49 -9.440 -15.518 -1.246 1.00 0.00 C ATOM 636 CG2 ILE A 49 -7.028 -15.583 -2.031 1.00 0.00 C ATOM 637 CD1 ILE A 49 -10.275 -15.763 0.013 1.00 0.00 C ATOM 0 H ILE A 49 -9.092 -17.992 0.371 1.00 0.00 H new ATOM 0 HA ILE A 49 -8.733 -17.736 -2.516 1.00 0.00 H new ATOM 0 HB ILE A 49 -7.759 -16.191 -0.133 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -9.267 -14.449 -1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.992 -15.855 -2.124 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.935 -14.534 -1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.073 -16.086 -1.880 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -7.312 -15.652 -3.081 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -11.223 -15.231 -0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -10.467 -16.831 0.120 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -9.731 -15.402 0.886 1.00 0.00 H new ATOM 648 N THR A 50 -6.715 -19.028 -2.852 1.00 0.00 N ATOM 649 CA THR A 50 -5.496 -19.770 -3.121 1.00 0.00 C ATOM 650 C THR A 50 -4.307 -18.814 -3.241 1.00 0.00 C ATOM 651 O THR A 50 -3.162 -19.213 -3.028 1.00 0.00 O ATOM 652 CB THR A 50 -5.724 -20.615 -4.376 1.00 0.00 C ATOM 653 OG1 THR A 50 -6.390 -19.732 -5.274 1.00 0.00 O ATOM 654 CG2 THR A 50 -6.733 -21.743 -4.146 1.00 0.00 C ATOM 0 H THR A 50 -7.364 -18.976 -3.637 1.00 0.00 H new ATOM 0 HA THR A 50 -5.252 -20.443 -2.299 1.00 0.00 H new ATOM 0 HB THR A 50 -4.775 -21.037 -4.706 1.00 0.00 H new ATOM 0 HG1 THR A 50 -6.575 -20.199 -6.115 1.00 0.00 H new ATOM 0 HG21 THR A 50 -6.859 -22.312 -5.067 1.00 0.00 H new ATOM 0 HG22 THR A 50 -6.368 -22.403 -3.359 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.692 -21.318 -3.848 1.00 0.00 H new ATOM 662 N GLY A 51 -4.618 -17.573 -3.582 1.00 0.00 N ATOM 663 CA GLY A 51 -3.589 -16.557 -3.733 1.00 0.00 C ATOM 664 C GLY A 51 -4.201 -15.210 -4.121 1.00 0.00 C ATOM 665 O GLY A 51 -5.407 -15.007 -3.979 1.00 0.00 O ATOM 0 H GLY A 51 -5.568 -17.247 -3.758 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -3.035 -16.454 -2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.874 -16.869 -4.495 1.00 0.00 H new ATOM 669 N TYR A 52 -3.342 -14.323 -4.603 1.00 0.00 N ATOM 670 CA TYR A 52 -3.784 -13.001 -5.012 1.00 0.00 C ATOM 671 C TYR A 52 -3.012 -12.522 -6.243 1.00 0.00 C ATOM 672 O TYR A 52 -1.784 -12.444 -6.219 1.00 0.00 O ATOM 673 CB TYR A 52 -3.475 -12.070 -3.837 1.00 0.00 C ATOM 674 CG TYR A 52 -4.247 -12.404 -2.560 1.00 0.00 C ATOM 675 CD1 TYR A 52 -3.879 -13.490 -1.794 1.00 0.00 C ATOM 676 CD2 TYR A 52 -5.314 -11.616 -2.173 1.00 0.00 C ATOM 677 CE1 TYR A 52 -4.607 -13.803 -0.591 1.00 0.00 C ATOM 678 CE2 TYR A 52 -6.042 -11.929 -0.971 1.00 0.00 C ATOM 679 CZ TYR A 52 -5.652 -13.007 -0.240 1.00 0.00 C ATOM 680 OH TYR A 52 -6.339 -13.303 0.897 1.00 0.00 O ATOM 0 H TYR A 52 -2.343 -14.494 -4.719 1.00 0.00 H new ATOM 0 HA TYR A 52 -4.843 -13.013 -5.268 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -2.407 -12.112 -3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -3.702 -11.045 -4.129 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.045 -14.106 -2.096 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -5.602 -10.765 -2.772 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -4.329 -14.650 0.018 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -6.878 -11.322 -0.657 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.737 -13.733 1.540 1.00 0.00 H new ATOM 689 N THR A 53 -3.763 -12.214 -7.291 1.00 0.00 N ATOM 690 CA THR A 53 -3.164 -11.745 -8.529 1.00 0.00 C ATOM 691 C THR A 53 -2.939 -10.233 -8.472 1.00 0.00 C ATOM 692 O THR A 53 -3.836 -9.481 -8.097 1.00 0.00 O ATOM 693 CB THR A 53 -4.066 -12.182 -9.685 1.00 0.00 C ATOM 694 OG1 THR A 53 -3.844 -13.586 -9.787 1.00 0.00 O ATOM 695 CG2 THR A 53 -3.597 -11.633 -11.033 1.00 0.00 C ATOM 0 H THR A 53 -4.781 -12.280 -7.308 1.00 0.00 H new ATOM 0 HA THR A 53 -2.178 -12.183 -8.683 1.00 0.00 H new ATOM 0 HB THR A 53 -5.087 -11.852 -9.493 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.392 -13.952 -10.512 1.00 0.00 H new ATOM 0 HG21 THR A 53 -4.272 -11.973 -11.819 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.596 -10.543 -11.002 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.589 -11.991 -11.241 1.00 0.00 H new ATOM 703 N ILE A 54 -1.735 -9.833 -8.853 1.00 0.00 N ATOM 704 CA ILE A 54 -1.379 -8.424 -8.851 1.00 0.00 C ATOM 705 C ILE A 54 -1.148 -7.958 -10.289 1.00 0.00 C ATOM 706 O ILE A 54 -0.641 -8.714 -11.117 1.00 0.00 O ATOM 707 CB ILE A 54 -0.186 -8.173 -7.924 1.00 0.00 C ATOM 708 CG1 ILE A 54 -0.567 -8.418 -6.462 1.00 0.00 C ATOM 709 CG2 ILE A 54 0.390 -6.772 -8.140 1.00 0.00 C ATOM 710 CD1 ILE A 54 0.333 -9.482 -5.833 1.00 0.00 C ATOM 0 H ILE A 54 -0.993 -10.460 -9.165 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.197 -7.826 -8.449 1.00 0.00 H new ATOM 0 HB ILE A 54 0.599 -8.886 -8.176 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.484 -7.488 -5.900 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.608 -8.735 -6.402 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.236 -6.619 -7.470 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.723 -6.671 -9.173 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.378 -6.027 -7.931 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.042 -9.637 -4.794 1.00 0.00 H new ATOM 0 HD12 ILE A 54 0.229 -10.417 -6.383 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.371 -9.151 -5.873 1.00 0.00 H new ATOM 721 N GLN A 55 -1.532 -6.716 -10.544 1.00 0.00 N ATOM 722 CA GLN A 55 -1.373 -6.140 -11.869 1.00 0.00 C ATOM 723 C GLN A 55 -0.959 -4.671 -11.763 1.00 0.00 C ATOM 724 O GLN A 55 -1.450 -3.944 -10.902 1.00 0.00 O ATOM 725 CB GLN A 55 -2.656 -6.291 -12.689 1.00 0.00 C ATOM 726 CG GLN A 55 -3.238 -7.698 -12.543 1.00 0.00 C ATOM 727 CD GLN A 55 -4.118 -8.054 -13.744 1.00 0.00 C ATOM 728 OE1 GLN A 55 -4.270 -7.290 -14.683 1.00 0.00 O ATOM 729 NE2 GLN A 55 -4.686 -9.254 -13.661 1.00 0.00 N ATOM 0 H GLN A 55 -1.953 -6.092 -9.856 1.00 0.00 H new ATOM 0 HA GLN A 55 -0.583 -6.683 -12.388 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -3.390 -5.554 -12.362 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -2.447 -6.087 -13.739 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -2.429 -8.423 -12.453 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -3.825 -7.760 -11.626 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -4.516 -9.843 -12.846 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -5.291 -9.585 -14.412 1.00 0.00 H new ATOM 736 N LYS A 56 -0.058 -4.279 -12.652 1.00 0.00 N ATOM 737 CA LYS A 56 0.429 -2.909 -12.670 1.00 0.00 C ATOM 738 C LYS A 56 -0.058 -2.216 -13.944 1.00 0.00 C ATOM 739 O LYS A 56 -0.220 -2.858 -14.981 1.00 0.00 O ATOM 740 CB LYS A 56 1.948 -2.879 -12.495 1.00 0.00 C ATOM 741 CG LYS A 56 2.658 -3.287 -13.787 1.00 0.00 C ATOM 742 CD LYS A 56 4.077 -3.782 -13.502 1.00 0.00 C ATOM 743 CE LYS A 56 4.600 -4.645 -14.652 1.00 0.00 C ATOM 744 NZ LYS A 56 5.792 -4.022 -15.267 1.00 0.00 N ATOM 0 H LYS A 56 0.348 -4.885 -13.365 1.00 0.00 H new ATOM 0 HA LYS A 56 0.023 -2.349 -11.828 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.264 -1.878 -12.203 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.238 -3.553 -11.688 1.00 0.00 H new ATOM 0 HG2 LYS A 56 2.089 -4.071 -14.286 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.696 -2.437 -14.469 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.740 -2.930 -13.352 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.086 -4.359 -12.577 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.852 -5.639 -14.283 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.820 -4.772 -15.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.134 -4.621 -16.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.541 -3.083 -15.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.540 -3.924 -14.552 1.00 0.00 H new ATOM 754 N ALA A 57 -0.276 -0.915 -13.825 1.00 0.00 N ATOM 755 CA ALA A 57 -0.740 -0.129 -14.956 1.00 0.00 C ATOM 756 C ALA A 57 -0.291 1.324 -14.780 1.00 0.00 C ATOM 757 O ALA A 57 -0.196 1.815 -13.656 1.00 0.00 O ATOM 758 CB ALA A 57 -2.260 -0.257 -15.077 1.00 0.00 C ATOM 0 H ALA A 57 -0.140 -0.385 -12.964 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.306 -0.499 -15.885 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.608 0.332 -15.925 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.526 -1.303 -15.228 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.730 0.108 -14.164 1.00 0.00 H new ATOM 764 N ASP A 58 -0.027 1.968 -15.906 1.00 0.00 N ATOM 765 CA ASP A 58 0.410 3.355 -15.890 1.00 0.00 C ATOM 766 C ASP A 58 -0.789 4.266 -16.156 1.00 0.00 C ATOM 767 O ASP A 58 -1.903 3.787 -16.362 1.00 0.00 O ATOM 768 CB ASP A 58 1.453 3.615 -16.979 1.00 0.00 C ATOM 769 CG ASP A 58 2.894 3.737 -16.478 1.00 0.00 C ATOM 770 OD1 ASP A 58 3.211 4.807 -15.915 1.00 0.00 O ATOM 771 OD2 ASP A 58 3.646 2.757 -16.670 1.00 0.00 O ATOM 0 H ASP A 58 -0.107 1.556 -16.836 1.00 0.00 H new ATOM 0 HA ASP A 58 0.849 3.560 -14.913 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.405 2.806 -17.708 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.188 4.533 -17.504 1.00 0.00 H new ATOM 775 N LYS A 59 -0.520 5.563 -16.144 1.00 0.00 N ATOM 776 CA LYS A 59 -1.564 6.546 -16.381 1.00 0.00 C ATOM 777 C LYS A 59 -1.663 6.826 -17.882 1.00 0.00 C ATOM 778 O LYS A 59 -2.279 7.806 -18.296 1.00 0.00 O ATOM 779 CB LYS A 59 -1.321 7.800 -15.537 1.00 0.00 C ATOM 780 CG LYS A 59 -2.174 7.778 -14.267 1.00 0.00 C ATOM 781 CD LYS A 59 -3.579 8.318 -14.540 1.00 0.00 C ATOM 782 CE LYS A 59 -4.015 9.292 -13.445 1.00 0.00 C ATOM 783 NZ LYS A 59 -4.983 10.275 -13.981 1.00 0.00 N ATOM 0 H LYS A 59 0.406 5.956 -15.974 1.00 0.00 H new ATOM 0 HA LYS A 59 -2.532 6.158 -16.063 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -0.266 7.865 -15.270 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.557 8.689 -16.123 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.240 6.759 -13.887 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -1.695 8.377 -13.492 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.598 8.821 -15.507 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -4.286 7.490 -14.598 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.466 8.742 -12.619 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.144 9.811 -13.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.269 10.929 -13.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.540 10.812 -14.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -5.821 9.776 -14.342 1.00 0.00 H new ATOM 793 N LYS A 60 -1.046 5.946 -18.658 1.00 0.00 N ATOM 794 CA LYS A 60 -1.057 6.085 -20.104 1.00 0.00 C ATOM 795 C LYS A 60 -2.472 5.827 -20.626 1.00 0.00 C ATOM 796 O LYS A 60 -3.014 6.630 -21.384 1.00 0.00 O ATOM 797 CB LYS A 60 0.006 5.186 -20.737 1.00 0.00 C ATOM 798 CG LYS A 60 1.414 5.658 -20.369 1.00 0.00 C ATOM 799 CD LYS A 60 1.589 7.148 -20.669 1.00 0.00 C ATOM 800 CE LYS A 60 3.068 7.508 -20.811 1.00 0.00 C ATOM 801 NZ LYS A 60 3.221 8.815 -21.491 1.00 0.00 N ATOM 0 H LYS A 60 -0.535 5.134 -18.312 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.792 7.103 -20.391 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.136 4.158 -20.402 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.110 5.187 -21.821 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.599 5.472 -19.311 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.152 5.082 -20.927 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.059 7.402 -21.587 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.142 7.739 -19.869 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.535 7.547 -19.827 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.584 6.734 -21.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.232 9.044 -21.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.793 8.766 -22.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.746 9.554 -20.934 1.00 0.00 H new ATOM 811 N SER A 61 -3.030 4.703 -20.198 1.00 0.00 N ATOM 812 CA SER A 61 -4.371 4.329 -20.613 1.00 0.00 C ATOM 813 C SER A 61 -4.919 3.238 -19.692 1.00 0.00 C ATOM 814 O SER A 61 -5.704 2.394 -20.122 1.00 0.00 O ATOM 815 CB SER A 61 -4.385 3.852 -22.067 1.00 0.00 C ATOM 816 OG SER A 61 -5.024 4.790 -22.931 1.00 0.00 O ATOM 0 H SER A 61 -2.578 4.040 -19.569 1.00 0.00 H new ATOM 0 HA SER A 61 -5.009 5.210 -20.542 1.00 0.00 H new ATOM 0 HB2 SER A 61 -3.362 3.687 -22.404 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.899 2.893 -22.129 1.00 0.00 H new ATOM 0 HG SER A 61 -4.640 5.680 -22.788 1.00 0.00 H new ATOM 821 N MET A 62 -4.482 3.289 -18.442 1.00 0.00 N ATOM 822 CA MET A 62 -4.918 2.315 -17.456 1.00 0.00 C ATOM 823 C MET A 62 -4.824 0.893 -18.012 1.00 0.00 C ATOM 824 O MET A 62 -5.786 0.130 -17.942 1.00 0.00 O ATOM 825 CB MET A 62 -6.364 2.611 -17.051 1.00 0.00 C ATOM 826 CG MET A 62 -6.499 4.033 -16.502 1.00 0.00 C ATOM 827 SD MET A 62 -5.580 4.190 -14.981 1.00 0.00 S ATOM 828 CE MET A 62 -6.377 2.925 -14.005 1.00 0.00 C ATOM 0 H MET A 62 -3.830 3.990 -18.090 1.00 0.00 H new ATOM 0 HA MET A 62 -4.265 2.389 -16.586 1.00 0.00 H new ATOM 0 HB2 MET A 62 -7.020 2.486 -17.913 1.00 0.00 H new ATOM 0 HB3 MET A 62 -6.688 1.894 -16.297 1.00 0.00 H new ATOM 0 HG2 MET A 62 -6.131 4.751 -17.235 1.00 0.00 H new ATOM 0 HG3 MET A 62 -7.549 4.266 -16.328 1.00 0.00 H new ATOM 0 HE1 MET A 62 -6.360 3.212 -12.954 1.00 0.00 H new ATOM 0 HE2 MET A 62 -7.410 2.809 -14.333 1.00 0.00 H new ATOM 0 HE3 MET A 62 -5.848 1.980 -14.132 1.00 0.00 H new ATOM 836 N GLU A 63 -3.656 0.579 -18.551 1.00 0.00 N ATOM 837 CA GLU A 63 -3.423 -0.740 -19.118 1.00 0.00 C ATOM 838 C GLU A 63 -2.681 -1.625 -18.116 1.00 0.00 C ATOM 839 O GLU A 63 -1.730 -1.181 -17.476 1.00 0.00 O ATOM 840 CB GLU A 63 -2.654 -0.640 -20.437 1.00 0.00 C ATOM 841 CG GLU A 63 -3.423 0.201 -21.458 1.00 0.00 C ATOM 842 CD GLU A 63 -3.058 -0.205 -22.888 1.00 0.00 C ATOM 843 OE1 GLU A 63 -3.094 -1.424 -23.159 1.00 0.00 O ATOM 844 OE2 GLU A 63 -2.752 0.715 -23.678 1.00 0.00 O ATOM 0 H GLU A 63 -2.860 1.214 -18.608 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.388 -1.199 -19.332 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.675 -0.196 -20.258 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.482 -1.639 -20.839 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.495 0.077 -21.303 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.199 1.257 -21.307 1.00 0.00 H new ATOM 849 N TRP A 64 -3.145 -2.862 -18.011 1.00 0.00 N ATOM 850 CA TRP A 64 -2.536 -3.814 -17.098 1.00 0.00 C ATOM 851 C TRP A 64 -1.887 -4.921 -17.932 1.00 0.00 C ATOM 852 O TRP A 64 -2.298 -5.174 -19.063 1.00 0.00 O ATOM 853 CB TRP A 64 -3.564 -4.345 -16.096 1.00 0.00 C ATOM 854 CG TRP A 64 -4.457 -3.263 -15.488 1.00 0.00 C ATOM 855 CD1 TRP A 64 -5.549 -2.698 -16.021 1.00 0.00 C ATOM 856 CD2 TRP A 64 -4.290 -2.634 -14.199 1.00 0.00 C ATOM 857 NE1 TRP A 64 -6.095 -1.755 -15.175 1.00 0.00 N ATOM 858 CE2 TRP A 64 -5.305 -1.715 -14.032 1.00 0.00 C ATOM 859 CE3 TRP A 64 -3.313 -2.835 -13.209 1.00 0.00 C ATOM 860 CZ2 TRP A 64 -5.442 -0.924 -12.885 1.00 0.00 C ATOM 861 CZ3 TRP A 64 -3.463 -2.037 -12.069 1.00 0.00 C ATOM 862 CH2 TRP A 64 -4.479 -1.106 -11.885 1.00 0.00 C ATOM 0 H TRP A 64 -3.935 -3.227 -18.543 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.764 -3.333 -16.497 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -4.193 -5.083 -16.593 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -3.039 -4.862 -15.293 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -5.951 -2.949 -16.991 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.926 -1.191 -15.355 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.510 -3.549 -13.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -6.247 -0.212 -12.777 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -2.738 -2.153 -11.276 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -4.525 -0.526 -10.975 1.00 0.00 H new ATOM 872 N PHE A 65 -0.882 -5.550 -17.340 1.00 0.00 N ATOM 873 CA PHE A 65 -0.171 -6.624 -18.014 1.00 0.00 C ATOM 874 C PHE A 65 0.187 -7.743 -17.035 1.00 0.00 C ATOM 875 O PHE A 65 1.114 -8.515 -17.281 1.00 0.00 O ATOM 876 CB PHE A 65 1.117 -6.023 -18.578 1.00 0.00 C ATOM 877 CG PHE A 65 1.123 -5.880 -20.101 1.00 0.00 C ATOM 878 CD1 PHE A 65 0.504 -4.820 -20.687 1.00 0.00 C ATOM 879 CD2 PHE A 65 1.747 -6.812 -20.869 1.00 0.00 C ATOM 880 CE1 PHE A 65 0.510 -4.687 -22.101 1.00 0.00 C ATOM 881 CE2 PHE A 65 1.752 -6.681 -22.283 1.00 0.00 C ATOM 882 CZ PHE A 65 1.134 -5.621 -22.869 1.00 0.00 C ATOM 0 H PHE A 65 -0.543 -5.337 -16.402 1.00 0.00 H new ATOM 0 HA PHE A 65 -0.797 -7.051 -18.798 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.274 -5.041 -18.131 1.00 0.00 H new ATOM 0 HB3 PHE A 65 1.959 -6.648 -18.279 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.008 -4.080 -20.077 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.239 -7.653 -20.403 1.00 0.00 H new ATOM 0 HE1 PHE A 65 0.020 -3.845 -22.566 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.246 -7.423 -22.893 1.00 0.00 H new ATOM 0 HZ PHE A 65 1.138 -5.520 -23.944 1.00 0.00 H new ATOM 891 N THR A 66 -0.564 -7.797 -15.945 1.00 0.00 N ATOM 892 CA THR A 66 -0.337 -8.809 -14.927 1.00 0.00 C ATOM 893 C THR A 66 1.070 -8.669 -14.342 1.00 0.00 C ATOM 894 O THR A 66 2.012 -8.326 -15.055 1.00 0.00 O ATOM 895 CB THR A 66 -0.600 -10.179 -15.556 1.00 0.00 C ATOM 896 OG1 THR A 66 -2.020 -10.263 -15.624 1.00 0.00 O ATOM 897 CG2 THR A 66 -0.201 -11.332 -14.633 1.00 0.00 C ATOM 0 H THR A 66 -1.331 -7.156 -15.744 1.00 0.00 H new ATOM 0 HA THR A 66 -1.019 -8.685 -14.086 1.00 0.00 H new ATOM 0 HB THR A 66 -0.052 -10.259 -16.495 1.00 0.00 H new ATOM 0 HG1 THR A 66 -2.278 -11.121 -16.021 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.408 -12.282 -15.127 1.00 0.00 H new ATOM 0 HG22 THR A 66 0.863 -11.265 -14.406 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.774 -11.272 -13.707 1.00 0.00 H new ATOM 905 N VAL A 67 1.167 -8.940 -13.048 1.00 0.00 N ATOM 906 CA VAL A 67 2.443 -8.849 -12.358 1.00 0.00 C ATOM 907 C VAL A 67 2.761 -10.196 -11.705 1.00 0.00 C ATOM 908 O VAL A 67 3.894 -10.671 -11.775 1.00 0.00 O ATOM 909 CB VAL A 67 2.415 -7.691 -11.360 1.00 0.00 C ATOM 910 CG1 VAL A 67 3.593 -7.779 -10.386 1.00 0.00 C ATOM 911 CG2 VAL A 67 2.402 -6.343 -12.084 1.00 0.00 C ATOM 0 H VAL A 67 0.383 -9.222 -12.460 1.00 0.00 H new ATOM 0 HA VAL A 67 3.246 -8.633 -13.063 1.00 0.00 H new ATOM 0 HB VAL A 67 1.494 -7.769 -10.782 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.550 -6.944 -9.687 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.540 -8.718 -9.834 1.00 0.00 H new ATOM 0 HG13 VAL A 67 4.529 -7.738 -10.943 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.382 -5.536 -11.351 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.297 -6.252 -12.700 1.00 0.00 H new ATOM 0 HG23 VAL A 67 1.518 -6.279 -12.718 1.00 0.00 H new ATOM 921 N ILE A 68 1.742 -10.771 -11.084 1.00 0.00 N ATOM 922 CA ILE A 68 1.900 -12.054 -10.418 1.00 0.00 C ATOM 923 C ILE A 68 0.556 -12.785 -10.404 1.00 0.00 C ATOM 924 O ILE A 68 -0.499 -12.156 -10.483 1.00 0.00 O ATOM 925 CB ILE A 68 2.509 -11.863 -9.027 1.00 0.00 C ATOM 926 CG1 ILE A 68 3.541 -12.953 -8.727 1.00 0.00 C ATOM 927 CG2 ILE A 68 1.420 -11.794 -7.956 1.00 0.00 C ATOM 928 CD1 ILE A 68 4.965 -12.401 -8.816 1.00 0.00 C ATOM 0 H ILE A 68 0.804 -10.373 -11.028 1.00 0.00 H new ATOM 0 HA ILE A 68 2.601 -12.684 -10.965 1.00 0.00 H new ATOM 0 HB ILE A 68 3.035 -10.908 -9.012 1.00 0.00 H new ATOM 0 HG12 ILE A 68 3.367 -13.359 -7.731 1.00 0.00 H new ATOM 0 HG13 ILE A 68 3.422 -13.776 -9.432 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.880 -11.658 -6.977 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.757 -10.955 -8.165 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.845 -12.720 -7.961 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.678 -13.196 -8.598 1.00 0.00 H new ATOM 0 HD12 ILE A 68 5.145 -12.018 -9.820 1.00 0.00 H new ATOM 0 HD13 ILE A 68 5.089 -11.595 -8.093 1.00 0.00 H new ATOM 939 N GLU A 69 0.637 -14.103 -10.305 1.00 0.00 N ATOM 940 CA GLU A 69 -0.560 -14.927 -10.280 1.00 0.00 C ATOM 941 C GLU A 69 -0.429 -16.023 -9.221 1.00 0.00 C ATOM 942 O GLU A 69 0.647 -16.593 -9.043 1.00 0.00 O ATOM 943 CB GLU A 69 -0.839 -15.528 -11.660 1.00 0.00 C ATOM 944 CG GLU A 69 -1.091 -14.430 -12.695 1.00 0.00 C ATOM 945 CD GLU A 69 -1.956 -14.950 -13.846 1.00 0.00 C ATOM 946 OE1 GLU A 69 -3.195 -14.922 -13.681 1.00 0.00 O ATOM 947 OE2 GLU A 69 -1.359 -15.363 -14.864 1.00 0.00 O ATOM 0 H GLU A 69 1.513 -14.622 -10.241 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.408 -14.295 -10.016 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.007 -16.140 -11.972 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.705 -16.187 -11.605 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.584 -13.583 -12.219 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.140 -14.068 -13.085 1.00 0.00 H new ATOM 952 N HIS A 70 -1.538 -16.285 -8.546 1.00 0.00 N ATOM 953 CA HIS A 70 -1.560 -17.303 -7.509 1.00 0.00 C ATOM 954 C HIS A 70 -0.354 -17.121 -6.586 1.00 0.00 C ATOM 955 O HIS A 70 0.538 -17.968 -6.550 1.00 0.00 O ATOM 956 CB HIS A 70 -1.633 -18.702 -8.122 1.00 0.00 C ATOM 957 CG HIS A 70 -2.775 -18.888 -9.093 1.00 0.00 C ATOM 958 ND1 HIS A 70 -3.455 -20.086 -9.229 1.00 0.00 N ATOM 959 CD2 HIS A 70 -3.348 -18.018 -9.973 1.00 0.00 C ATOM 960 CE1 HIS A 70 -4.392 -19.932 -10.153 1.00 0.00 C ATOM 961 NE2 HIS A 70 -4.324 -18.649 -10.612 1.00 0.00 N ATOM 0 H HIS A 70 -2.428 -15.810 -8.697 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.458 -17.190 -6.902 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.695 -18.912 -8.636 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.728 -19.434 -7.320 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -3.056 -16.989 -10.124 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -5.087 -20.689 -10.485 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -4.925 -18.242 -11.329 1.00 0.00 H new ATOM 968 N TYR A 71 -0.364 -16.011 -5.862 1.00 0.00 N ATOM 969 CA TYR A 71 0.720 -15.708 -4.942 1.00 0.00 C ATOM 970 C TYR A 71 0.478 -16.358 -3.578 1.00 0.00 C ATOM 971 O TYR A 71 -0.394 -17.213 -3.441 1.00 0.00 O ATOM 972 CB TYR A 71 0.719 -14.187 -4.777 1.00 0.00 C ATOM 973 CG TYR A 71 2.093 -13.596 -4.452 1.00 0.00 C ATOM 974 CD1 TYR A 71 3.205 -14.006 -5.159 1.00 0.00 C ATOM 975 CD2 TYR A 71 2.219 -12.653 -3.452 1.00 0.00 C ATOM 976 CE1 TYR A 71 4.497 -13.450 -4.853 1.00 0.00 C ATOM 977 CE2 TYR A 71 3.512 -12.098 -3.146 1.00 0.00 C ATOM 978 CZ TYR A 71 4.587 -12.522 -3.862 1.00 0.00 C ATOM 979 OH TYR A 71 5.808 -11.997 -3.572 1.00 0.00 O ATOM 0 H TYR A 71 -1.105 -15.311 -5.894 1.00 0.00 H new ATOM 0 HA TYR A 71 1.668 -16.086 -5.326 1.00 0.00 H new ATOM 0 HB2 TYR A 71 0.347 -13.732 -5.695 1.00 0.00 H new ATOM 0 HB3 TYR A 71 0.022 -13.918 -3.983 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.106 -14.744 -5.942 1.00 0.00 H new ATOM 0 HD2 TYR A 71 1.348 -12.332 -2.899 1.00 0.00 H new ATOM 0 HE1 TYR A 71 5.375 -13.763 -5.398 1.00 0.00 H new ATOM 0 HE2 TYR A 71 3.625 -11.361 -2.365 1.00 0.00 H new ATOM 0 HH TYR A 71 5.720 -11.347 -2.844 1.00 0.00 H new ATOM 988 N HIS A 72 1.266 -15.926 -2.604 1.00 0.00 N ATOM 989 CA HIS A 72 1.149 -16.455 -1.256 1.00 0.00 C ATOM 990 C HIS A 72 1.049 -15.299 -0.259 1.00 0.00 C ATOM 991 O HIS A 72 -0.028 -15.016 0.261 1.00 0.00 O ATOM 992 CB HIS A 72 2.304 -17.409 -0.945 1.00 0.00 C ATOM 993 CG HIS A 72 2.227 -18.038 0.425 1.00 0.00 C ATOM 994 ND1 HIS A 72 3.091 -17.703 1.453 1.00 0.00 N ATOM 995 CD2 HIS A 72 1.381 -18.983 0.927 1.00 0.00 C ATOM 996 CE1 HIS A 72 2.772 -18.421 2.520 1.00 0.00 C ATOM 997 NE2 HIS A 72 1.711 -19.215 2.191 1.00 0.00 N ATOM 0 H HIS A 72 1.988 -15.215 -2.722 1.00 0.00 H new ATOM 0 HA HIS A 72 0.236 -17.044 -1.170 1.00 0.00 H new ATOM 0 HB2 HIS A 72 2.322 -18.199 -1.696 1.00 0.00 H new ATOM 0 HB3 HIS A 72 3.245 -16.865 -1.032 1.00 0.00 H new ATOM 0 HD2 HIS A 72 0.578 -19.462 0.387 1.00 0.00 H new ATOM 0 HE1 HIS A 72 3.264 -18.385 3.481 1.00 0.00 H new ATOM 0 HE2 HIS A 72 1.249 -19.877 2.814 1.00 0.00 H new ATOM 1004 N ARG A 73 2.187 -14.664 -0.023 1.00 0.00 N ATOM 1005 CA ARG A 73 2.242 -13.546 0.904 1.00 0.00 C ATOM 1006 C ARG A 73 1.164 -12.517 0.557 1.00 0.00 C ATOM 1007 O ARG A 73 0.362 -12.734 -0.351 1.00 0.00 O ATOM 1008 CB ARG A 73 3.613 -12.868 0.870 1.00 0.00 C ATOM 1009 CG ARG A 73 4.423 -13.205 2.123 1.00 0.00 C ATOM 1010 CD ARG A 73 4.673 -11.954 2.967 1.00 0.00 C ATOM 1011 NE ARG A 73 6.105 -11.582 2.908 1.00 0.00 N ATOM 1012 CZ ARG A 73 7.094 -12.317 3.433 1.00 0.00 C ATOM 1013 NH1 ARG A 73 6.814 -13.469 4.058 1.00 0.00 N ATOM 1014 NH2 ARG A 73 8.364 -11.901 3.331 1.00 0.00 N ATOM 0 H ARG A 73 3.079 -14.902 -0.458 1.00 0.00 H new ATOM 0 HA ARG A 73 2.068 -13.938 1.906 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.159 -13.188 -0.017 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.487 -11.788 0.794 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.890 -13.948 2.716 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.375 -13.651 1.836 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.059 -11.130 2.602 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.379 -12.137 4.000 1.00 0.00 H new ATOM 0 HE ARG A 73 6.354 -10.712 2.438 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.848 -13.786 4.134 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.567 -14.029 4.458 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.577 -11.025 2.854 1.00 0.00 H new ATOM 0 HH22 ARG A 73 9.118 -12.460 3.731 1.00 0.00 H new ATOM 1025 N THR A 74 1.179 -11.418 1.299 1.00 0.00 N ATOM 1026 CA THR A 74 0.213 -10.355 1.080 1.00 0.00 C ATOM 1027 C THR A 74 0.922 -9.071 0.647 1.00 0.00 C ATOM 1028 O THR A 74 0.276 -8.051 0.410 1.00 0.00 O ATOM 1029 CB THR A 74 -0.608 -10.193 2.361 1.00 0.00 C ATOM 1030 OG1 THR A 74 0.353 -10.304 3.407 1.00 0.00 O ATOM 1031 CG2 THR A 74 -1.556 -11.371 2.601 1.00 0.00 C ATOM 0 H THR A 74 1.845 -11.242 2.052 1.00 0.00 H new ATOM 0 HA THR A 74 -0.470 -10.602 0.267 1.00 0.00 H new ATOM 0 HB THR A 74 -1.182 -9.268 2.309 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.094 -10.209 4.274 1.00 0.00 H new ATOM 0 HG21 THR A 74 -2.115 -11.206 3.522 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.251 -11.455 1.765 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.978 -12.291 2.687 1.00 0.00 H new ATOM 1039 N SER A 75 2.241 -9.162 0.557 1.00 0.00 N ATOM 1040 CA SER A 75 3.044 -8.020 0.156 1.00 0.00 C ATOM 1041 C SER A 75 4.016 -8.427 -0.953 1.00 0.00 C ATOM 1042 O SER A 75 4.602 -9.508 -0.904 1.00 0.00 O ATOM 1043 CB SER A 75 3.810 -7.441 1.348 1.00 0.00 C ATOM 1044 OG SER A 75 3.900 -8.367 2.426 1.00 0.00 O ATOM 0 H SER A 75 2.773 -10.009 0.755 1.00 0.00 H new ATOM 0 HA SER A 75 2.375 -7.247 -0.222 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.813 -7.156 1.030 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.314 -6.533 1.691 1.00 0.00 H new ATOM 0 HG SER A 75 4.397 -7.960 3.166 1.00 0.00 H new ATOM 1049 N ALA A 76 4.158 -7.540 -1.927 1.00 0.00 N ATOM 1050 CA ALA A 76 5.050 -7.795 -3.046 1.00 0.00 C ATOM 1051 C ALA A 76 5.675 -6.475 -3.503 1.00 0.00 C ATOM 1052 O ALA A 76 4.997 -5.450 -3.564 1.00 0.00 O ATOM 1053 CB ALA A 76 4.277 -8.493 -4.166 1.00 0.00 C ATOM 0 H ALA A 76 3.671 -6.645 -1.965 1.00 0.00 H new ATOM 0 HA ALA A 76 5.861 -8.459 -2.748 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.946 -8.684 -5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 76 3.877 -9.438 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.456 -7.855 -4.494 1.00 0.00 H new ATOM 1059 N THR A 77 6.961 -6.543 -3.815 1.00 0.00 N ATOM 1060 CA THR A 77 7.686 -5.367 -4.265 1.00 0.00 C ATOM 1061 C THR A 77 7.767 -5.343 -5.792 1.00 0.00 C ATOM 1062 O THR A 77 8.255 -6.291 -6.407 1.00 0.00 O ATOM 1063 CB THR A 77 9.056 -5.365 -3.584 1.00 0.00 C ATOM 1064 OG1 THR A 77 8.751 -5.309 -2.192 1.00 0.00 O ATOM 1065 CG2 THR A 77 9.839 -4.078 -3.846 1.00 0.00 C ATOM 0 H THR A 77 7.520 -7.395 -3.765 1.00 0.00 H new ATOM 0 HA THR A 77 7.166 -4.451 -3.983 1.00 0.00 H new ATOM 0 HB THR A 77 9.636 -6.219 -3.933 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.583 -5.306 -1.675 1.00 0.00 H new ATOM 0 HG21 THR A 77 10.803 -4.129 -3.340 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.998 -3.960 -4.918 1.00 0.00 H new ATOM 0 HG23 THR A 77 9.275 -3.226 -3.467 1.00 0.00 H new ATOM 1073 N ILE A 78 7.282 -4.250 -6.362 1.00 0.00 N ATOM 1074 CA ILE A 78 7.293 -4.090 -7.806 1.00 0.00 C ATOM 1075 C ILE A 78 8.679 -3.619 -8.252 1.00 0.00 C ATOM 1076 O ILE A 78 9.426 -3.040 -7.464 1.00 0.00 O ATOM 1077 CB ILE A 78 6.158 -3.167 -8.252 1.00 0.00 C ATOM 1078 CG1 ILE A 78 4.827 -3.594 -7.629 1.00 0.00 C ATOM 1079 CG2 ILE A 78 6.078 -3.094 -9.779 1.00 0.00 C ATOM 1080 CD1 ILE A 78 4.223 -4.779 -8.383 1.00 0.00 C ATOM 0 H ILE A 78 6.879 -3.466 -5.849 1.00 0.00 H new ATOM 0 HA ILE A 78 7.107 -5.046 -8.296 1.00 0.00 H new ATOM 0 HB ILE A 78 6.375 -2.161 -7.892 1.00 0.00 H new ATOM 0 HG12 ILE A 78 4.981 -3.864 -6.584 1.00 0.00 H new ATOM 0 HG13 ILE A 78 4.130 -2.756 -7.643 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.263 -2.431 -10.069 1.00 0.00 H new ATOM 0 HG22 ILE A 78 7.018 -2.708 -10.175 1.00 0.00 H new ATOM 0 HG23 ILE A 78 5.897 -4.090 -10.182 1.00 0.00 H new ATOM 0 HD11 ILE A 78 3.278 -5.062 -7.919 1.00 0.00 H new ATOM 0 HD12 ILE A 78 4.048 -4.498 -9.422 1.00 0.00 H new ATOM 0 HD13 ILE A 78 4.912 -5.623 -8.346 1.00 0.00 H new ATOM 1091 N THR A 79 8.982 -3.886 -9.514 1.00 0.00 N ATOM 1092 CA THR A 79 10.266 -3.497 -10.073 1.00 0.00 C ATOM 1093 C THR A 79 10.080 -2.902 -11.470 1.00 0.00 C ATOM 1094 O THR A 79 8.954 -2.779 -11.952 1.00 0.00 O ATOM 1095 CB THR A 79 11.181 -4.723 -10.053 1.00 0.00 C ATOM 1096 OG1 THR A 79 10.327 -5.801 -10.427 1.00 0.00 O ATOM 1097 CG2 THR A 79 11.642 -5.086 -8.640 1.00 0.00 C ATOM 0 H THR A 79 8.361 -4.367 -10.165 1.00 0.00 H new ATOM 0 HA THR A 79 10.735 -2.713 -9.479 1.00 0.00 H new ATOM 0 HB THR A 79 12.051 -4.536 -10.682 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.841 -6.636 -10.441 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.289 -5.963 -8.682 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.193 -4.249 -8.211 1.00 0.00 H new ATOM 0 HG23 THR A 79 10.773 -5.305 -8.019 1.00 0.00 H new ATOM 1105 N GLU A 80 11.200 -2.547 -12.081 1.00 0.00 N ATOM 1106 CA GLU A 80 11.175 -1.966 -13.414 1.00 0.00 C ATOM 1107 C GLU A 80 10.183 -0.801 -13.465 1.00 0.00 C ATOM 1108 O GLU A 80 9.119 -0.914 -14.072 1.00 0.00 O ATOM 1109 CB GLU A 80 10.835 -3.023 -14.466 1.00 0.00 C ATOM 1110 CG GLU A 80 12.100 -3.532 -15.159 1.00 0.00 C ATOM 1111 CD GLU A 80 11.805 -3.945 -16.603 1.00 0.00 C ATOM 1112 OE1 GLU A 80 10.923 -4.814 -16.776 1.00 0.00 O ATOM 1113 OE2 GLU A 80 12.468 -3.383 -17.501 1.00 0.00 O ATOM 0 H GLU A 80 12.131 -2.650 -11.678 1.00 0.00 H new ATOM 0 HA GLU A 80 12.169 -1.582 -13.642 1.00 0.00 H new ATOM 0 HB2 GLU A 80 10.314 -3.856 -13.995 1.00 0.00 H new ATOM 0 HB3 GLU A 80 10.156 -2.600 -15.206 1.00 0.00 H new ATOM 0 HG2 GLU A 80 12.863 -2.754 -15.148 1.00 0.00 H new ATOM 0 HG3 GLU A 80 12.504 -4.382 -14.609 1.00 0.00 H new ATOM 1118 N LEU A 81 10.568 0.291 -12.823 1.00 0.00 N ATOM 1119 CA LEU A 81 9.727 1.475 -12.788 1.00 0.00 C ATOM 1120 C LEU A 81 10.570 2.706 -13.129 1.00 0.00 C ATOM 1121 O LEU A 81 11.698 2.840 -12.656 1.00 0.00 O ATOM 1122 CB LEU A 81 9.002 1.579 -11.445 1.00 0.00 C ATOM 1123 CG LEU A 81 8.101 0.399 -11.076 1.00 0.00 C ATOM 1124 CD1 LEU A 81 7.780 0.402 -9.579 1.00 0.00 C ATOM 1125 CD2 LEU A 81 6.835 0.388 -11.934 1.00 0.00 C ATOM 0 H LEU A 81 11.452 0.381 -12.322 1.00 0.00 H new ATOM 0 HA LEU A 81 8.943 1.407 -13.542 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.749 1.700 -10.660 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.396 2.485 -11.451 1.00 0.00 H new ATOM 0 HG LEU A 81 8.641 -0.524 -11.287 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.138 -0.447 -9.343 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.706 0.327 -9.008 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.267 1.328 -9.319 1.00 0.00 H new ATOM 0 HD21 LEU A 81 6.212 -0.460 -11.652 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.281 1.313 -11.777 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.109 0.303 -12.986 1.00 0.00 H new ATOM 1136 N VAL A 82 9.992 3.572 -13.946 1.00 0.00 N ATOM 1137 CA VAL A 82 10.677 4.787 -14.356 1.00 0.00 C ATOM 1138 C VAL A 82 10.351 5.908 -13.369 1.00 0.00 C ATOM 1139 O VAL A 82 9.183 6.169 -13.081 1.00 0.00 O ATOM 1140 CB VAL A 82 10.306 5.135 -15.800 1.00 0.00 C ATOM 1141 CG1 VAL A 82 10.872 6.499 -16.196 1.00 0.00 C ATOM 1142 CG2 VAL A 82 10.775 4.045 -16.764 1.00 0.00 C ATOM 0 H VAL A 82 9.056 3.458 -14.336 1.00 0.00 H new ATOM 0 HA VAL A 82 11.757 4.641 -14.338 1.00 0.00 H new ATOM 0 HB VAL A 82 9.219 5.192 -15.863 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.595 6.723 -17.226 1.00 0.00 H new ATOM 0 HG12 VAL A 82 10.467 7.266 -15.536 1.00 0.00 H new ATOM 0 HG13 VAL A 82 11.958 6.481 -16.108 1.00 0.00 H new ATOM 0 HG21 VAL A 82 10.499 4.317 -17.783 1.00 0.00 H new ATOM 0 HG22 VAL A 82 11.858 3.941 -16.697 1.00 0.00 H new ATOM 0 HG23 VAL A 82 10.303 3.099 -16.501 1.00 0.00 H new ATOM 1152 N ILE A 83 11.404 6.542 -12.874 1.00 0.00 N ATOM 1153 CA ILE A 83 11.246 7.630 -11.924 1.00 0.00 C ATOM 1154 C ILE A 83 10.622 8.834 -12.632 1.00 0.00 C ATOM 1155 O ILE A 83 11.089 9.243 -13.694 1.00 0.00 O ATOM 1156 CB ILE A 83 12.577 7.942 -11.238 1.00 0.00 C ATOM 1157 CG1 ILE A 83 12.964 6.830 -10.260 1.00 0.00 C ATOM 1158 CG2 ILE A 83 12.539 9.314 -10.562 1.00 0.00 C ATOM 1159 CD1 ILE A 83 14.374 7.051 -9.709 1.00 0.00 C ATOM 0 H ILE A 83 12.371 6.323 -13.113 1.00 0.00 H new ATOM 0 HA ILE A 83 10.563 7.340 -11.125 1.00 0.00 H new ATOM 0 HB ILE A 83 13.353 7.983 -12.002 1.00 0.00 H new ATOM 0 HG12 ILE A 83 12.249 6.799 -9.438 1.00 0.00 H new ATOM 0 HG13 ILE A 83 12.913 5.864 -10.763 1.00 0.00 H new ATOM 0 HG21 ILE A 83 13.498 9.510 -10.082 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.343 10.083 -11.310 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.748 9.328 -9.812 1.00 0.00 H new ATOM 0 HD11 ILE A 83 14.624 6.247 -9.017 1.00 0.00 H new ATOM 0 HD12 ILE A 83 15.089 7.057 -10.532 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.415 8.006 -9.186 1.00 0.00 H new ATOM 1170 N GLY A 84 9.577 9.367 -12.016 1.00 0.00 N ATOM 1171 CA GLY A 84 8.884 10.516 -12.576 1.00 0.00 C ATOM 1172 C GLY A 84 7.613 10.085 -13.311 1.00 0.00 C ATOM 1173 O GLY A 84 7.346 10.549 -14.418 1.00 0.00 O ATOM 0 H GLY A 84 9.193 9.025 -11.135 1.00 0.00 H new ATOM 0 HA2 GLY A 84 8.628 11.215 -11.779 1.00 0.00 H new ATOM 0 HA3 GLY A 84 9.545 11.044 -13.264 1.00 0.00 H new ATOM 1177 N ASN A 85 6.864 9.204 -12.665 1.00 0.00 N ATOM 1178 CA ASN A 85 5.628 8.706 -13.243 1.00 0.00 C ATOM 1179 C ASN A 85 4.786 8.049 -12.147 1.00 0.00 C ATOM 1180 O ASN A 85 5.313 7.646 -11.111 1.00 0.00 O ATOM 1181 CB ASN A 85 5.907 7.655 -14.319 1.00 0.00 C ATOM 1182 CG ASN A 85 6.152 8.313 -15.678 1.00 0.00 C ATOM 1183 OD1 ASN A 85 5.281 8.942 -16.258 1.00 0.00 O ATOM 1184 ND2 ASN A 85 7.380 8.133 -16.153 1.00 0.00 N ATOM 0 H ASN A 85 7.089 8.822 -11.746 1.00 0.00 H new ATOM 0 HA ASN A 85 5.102 9.549 -13.691 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.777 7.062 -14.036 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.063 6.969 -14.390 1.00 0.00 H new ATOM 0 HD21 ASN A 85 7.642 8.532 -17.054 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.061 7.596 -15.616 1.00 0.00 H new ATOM 1190 N GLU A 86 3.491 7.962 -12.413 1.00 0.00 N ATOM 1191 CA GLU A 86 2.570 7.361 -11.462 1.00 0.00 C ATOM 1192 C GLU A 86 1.923 6.114 -12.067 1.00 0.00 C ATOM 1193 O GLU A 86 1.607 6.088 -13.256 1.00 0.00 O ATOM 1194 CB GLU A 86 1.509 8.368 -11.015 1.00 0.00 C ATOM 1195 CG GLU A 86 0.543 7.737 -10.012 1.00 0.00 C ATOM 1196 CD GLU A 86 -0.883 7.707 -10.566 1.00 0.00 C ATOM 1197 OE1 GLU A 86 -1.538 8.770 -10.505 1.00 0.00 O ATOM 1198 OE2 GLU A 86 -1.285 6.622 -11.041 1.00 0.00 O ATOM 0 H GLU A 86 3.057 8.297 -13.273 1.00 0.00 H new ATOM 0 HA GLU A 86 3.134 7.062 -10.578 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.992 9.235 -10.564 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.955 8.727 -11.882 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.867 6.723 -9.778 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.563 8.301 -9.079 1.00 0.00 H new ATOM 1203 N TYR A 87 1.743 5.110 -11.221 1.00 0.00 N ATOM 1204 CA TYR A 87 1.139 3.863 -11.657 1.00 0.00 C ATOM 1205 C TYR A 87 0.035 3.422 -10.693 1.00 0.00 C ATOM 1206 O TYR A 87 -0.137 4.013 -9.628 1.00 0.00 O ATOM 1207 CB TYR A 87 2.260 2.822 -11.640 1.00 0.00 C ATOM 1208 CG TYR A 87 3.536 3.270 -12.356 1.00 0.00 C ATOM 1209 CD1 TYR A 87 4.362 4.208 -11.771 1.00 0.00 C ATOM 1210 CD2 TYR A 87 3.861 2.736 -13.586 1.00 0.00 C ATOM 1211 CE1 TYR A 87 5.563 4.629 -12.444 1.00 0.00 C ATOM 1212 CE2 TYR A 87 5.062 3.157 -14.259 1.00 0.00 C ATOM 1213 CZ TYR A 87 5.853 4.084 -13.655 1.00 0.00 C ATOM 1214 OH TYR A 87 6.988 4.481 -14.291 1.00 0.00 O ATOM 0 H TYR A 87 2.005 5.135 -10.236 1.00 0.00 H new ATOM 0 HA TYR A 87 0.691 3.978 -12.644 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.502 2.581 -10.605 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.898 1.905 -12.105 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.107 4.626 -10.808 1.00 0.00 H new ATOM 0 HD2 TYR A 87 3.214 2.002 -14.044 1.00 0.00 H new ATOM 0 HE1 TYR A 87 6.219 5.361 -11.997 1.00 0.00 H new ATOM 0 HE2 TYR A 87 5.329 2.746 -15.222 1.00 0.00 H new ATOM 0 HH TYR A 87 7.534 5.019 -13.681 1.00 0.00 H new ATOM 1223 N TYR A 88 -0.684 2.387 -11.101 1.00 0.00 N ATOM 1224 CA TYR A 88 -1.767 1.861 -10.287 1.00 0.00 C ATOM 1225 C TYR A 88 -1.599 0.356 -10.059 1.00 0.00 C ATOM 1226 O TYR A 88 -0.983 -0.333 -10.870 1.00 0.00 O ATOM 1227 CB TYR A 88 -3.050 2.104 -11.083 1.00 0.00 C ATOM 1228 CG TYR A 88 -3.598 3.526 -10.960 1.00 0.00 C ATOM 1229 CD1 TYR A 88 -3.879 4.052 -9.714 1.00 0.00 C ATOM 1230 CD2 TYR A 88 -3.813 4.284 -12.093 1.00 0.00 C ATOM 1231 CE1 TYR A 88 -4.395 5.392 -9.598 1.00 0.00 C ATOM 1232 CE2 TYR A 88 -4.330 5.623 -11.976 1.00 0.00 C ATOM 1233 CZ TYR A 88 -4.595 6.111 -10.735 1.00 0.00 C ATOM 1234 OH TYR A 88 -5.082 7.376 -10.625 1.00 0.00 O ATOM 0 H TYR A 88 -0.538 1.898 -11.984 1.00 0.00 H new ATOM 0 HA TYR A 88 -1.784 2.345 -9.311 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -2.859 1.889 -12.134 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -3.813 1.401 -10.747 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -3.712 3.459 -8.827 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -3.594 3.873 -13.067 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -4.618 5.816 -8.630 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.503 6.226 -12.855 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.791 7.766 -9.774 1.00 0.00 H new ATOM 1243 N PHE A 89 -2.160 -0.108 -8.952 1.00 0.00 N ATOM 1244 CA PHE A 89 -2.080 -1.517 -8.607 1.00 0.00 C ATOM 1245 C PHE A 89 -3.458 -2.069 -8.234 1.00 0.00 C ATOM 1246 O PHE A 89 -4.202 -1.437 -7.486 1.00 0.00 O ATOM 1247 CB PHE A 89 -1.153 -1.630 -7.395 1.00 0.00 C ATOM 1248 CG PHE A 89 0.202 -0.946 -7.582 1.00 0.00 C ATOM 1249 CD1 PHE A 89 1.124 -1.483 -8.424 1.00 0.00 C ATOM 1250 CD2 PHE A 89 0.484 0.201 -6.907 1.00 0.00 C ATOM 1251 CE1 PHE A 89 2.383 -0.849 -8.598 1.00 0.00 C ATOM 1252 CE2 PHE A 89 1.742 0.836 -7.081 1.00 0.00 C ATOM 1253 CZ PHE A 89 2.665 0.298 -7.922 1.00 0.00 C ATOM 0 H PHE A 89 -2.672 0.467 -8.283 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.708 -2.088 -9.458 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.651 -1.196 -6.528 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.989 -2.684 -7.173 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.899 -2.393 -8.961 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.249 0.629 -6.239 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.116 -1.277 -9.266 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.966 1.747 -6.545 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.622 0.781 -8.054 1.00 0.00 H new ATOM 1262 N ARG A 90 -3.756 -3.242 -8.772 1.00 0.00 N ATOM 1263 CA ARG A 90 -5.031 -3.886 -8.506 1.00 0.00 C ATOM 1264 C ARG A 90 -4.810 -5.313 -8.002 1.00 0.00 C ATOM 1265 O ARG A 90 -4.135 -6.108 -8.654 1.00 0.00 O ATOM 1266 CB ARG A 90 -5.902 -3.925 -9.763 1.00 0.00 C ATOM 1267 CG ARG A 90 -6.973 -5.012 -9.653 1.00 0.00 C ATOM 1268 CD ARG A 90 -6.593 -6.242 -10.480 1.00 0.00 C ATOM 1269 NE ARG A 90 -6.364 -5.854 -11.889 1.00 0.00 N ATOM 1270 CZ ARG A 90 -7.334 -5.472 -12.730 1.00 0.00 C ATOM 1271 NH1 ARG A 90 -8.606 -5.424 -12.310 1.00 0.00 N ATOM 1272 NH2 ARG A 90 -7.034 -5.137 -13.993 1.00 0.00 N ATOM 0 H ARG A 90 -3.136 -3.764 -9.391 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.544 -3.302 -7.741 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -6.377 -2.955 -9.911 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -5.278 -4.111 -10.637 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.101 -5.297 -8.609 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.930 -4.620 -9.996 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -5.694 -6.702 -10.070 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -7.386 -6.987 -10.424 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.407 -5.879 -12.242 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.836 -5.678 -11.349 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.344 -5.133 -12.951 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.067 -5.173 -14.314 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.773 -4.846 -14.633 1.00 0.00 H new ATOM 1283 N VAL A 91 -5.391 -5.595 -6.845 1.00 0.00 N ATOM 1284 CA VAL A 91 -5.266 -6.913 -6.246 1.00 0.00 C ATOM 1285 C VAL A 91 -6.589 -7.665 -6.397 1.00 0.00 C ATOM 1286 O VAL A 91 -7.640 -7.166 -5.998 1.00 0.00 O ATOM 1287 CB VAL A 91 -4.813 -6.785 -4.790 1.00 0.00 C ATOM 1288 CG1 VAL A 91 -4.654 -8.162 -4.142 1.00 0.00 C ATOM 1289 CG2 VAL A 91 -3.518 -5.977 -4.687 1.00 0.00 C ATOM 0 H VAL A 91 -5.950 -4.933 -6.306 1.00 0.00 H new ATOM 0 HA VAL A 91 -4.501 -7.495 -6.760 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.588 -6.246 -4.245 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.331 -8.042 -3.108 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.609 -8.688 -4.166 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.909 -8.738 -4.690 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -3.219 -5.901 -3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.732 -6.475 -5.255 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.679 -4.978 -5.091 1.00 0.00 H new ATOM 1299 N PHE A 92 -6.495 -8.854 -6.975 1.00 0.00 N ATOM 1300 CA PHE A 92 -7.673 -9.680 -7.184 1.00 0.00 C ATOM 1301 C PHE A 92 -7.832 -10.702 -6.056 1.00 0.00 C ATOM 1302 O PHE A 92 -7.088 -10.672 -5.077 1.00 0.00 O ATOM 1303 CB PHE A 92 -7.468 -10.423 -8.505 1.00 0.00 C ATOM 1304 CG PHE A 92 -7.901 -9.629 -9.739 1.00 0.00 C ATOM 1305 CD1 PHE A 92 -9.069 -8.930 -9.723 1.00 0.00 C ATOM 1306 CD2 PHE A 92 -7.119 -9.621 -10.852 1.00 0.00 C ATOM 1307 CE1 PHE A 92 -9.470 -8.194 -10.868 1.00 0.00 C ATOM 1308 CE2 PHE A 92 -7.522 -8.884 -11.997 1.00 0.00 C ATOM 1309 CZ PHE A 92 -8.688 -8.187 -11.982 1.00 0.00 C ATOM 0 H PHE A 92 -5.622 -9.265 -7.305 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.567 -9.057 -7.202 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.414 -10.683 -8.604 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -8.026 -11.359 -8.474 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -9.690 -8.936 -8.839 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.192 -10.175 -10.865 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -10.396 -7.639 -10.856 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.901 -8.878 -12.881 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.994 -7.628 -12.854 1.00 0.00 H new ATOM 1318 N SER A 93 -8.806 -11.581 -6.232 1.00 0.00 N ATOM 1319 CA SER A 93 -9.074 -12.611 -5.242 1.00 0.00 C ATOM 1320 C SER A 93 -9.175 -13.978 -5.922 1.00 0.00 C ATOM 1321 O SER A 93 -10.239 -14.355 -6.409 1.00 0.00 O ATOM 1322 CB SER A 93 -10.355 -12.308 -4.465 1.00 0.00 C ATOM 1323 OG SER A 93 -10.166 -11.278 -3.500 1.00 0.00 O ATOM 0 H SER A 93 -9.420 -11.602 -7.046 1.00 0.00 H new ATOM 0 HA SER A 93 -8.247 -12.626 -4.533 1.00 0.00 H new ATOM 0 HB2 SER A 93 -11.139 -12.012 -5.162 1.00 0.00 H new ATOM 0 HB3 SER A 93 -10.698 -13.214 -3.965 1.00 0.00 H new ATOM 0 HG SER A 93 -10.958 -10.701 -3.478 1.00 0.00 H new ATOM 1328 N GLU A 94 -8.052 -14.681 -5.934 1.00 0.00 N ATOM 1329 CA GLU A 94 -8.001 -15.998 -6.547 1.00 0.00 C ATOM 1330 C GLU A 94 -8.812 -16.999 -5.722 1.00 0.00 C ATOM 1331 O GLU A 94 -9.139 -16.735 -4.566 1.00 0.00 O ATOM 1332 CB GLU A 94 -6.555 -16.469 -6.714 1.00 0.00 C ATOM 1333 CG GLU A 94 -6.141 -16.459 -8.187 1.00 0.00 C ATOM 1334 CD GLU A 94 -6.988 -17.439 -9.001 1.00 0.00 C ATOM 1335 OE1 GLU A 94 -8.094 -17.029 -9.412 1.00 0.00 O ATOM 1336 OE2 GLU A 94 -6.510 -18.578 -9.195 1.00 0.00 O ATOM 0 H GLU A 94 -7.171 -14.364 -5.529 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.444 -15.933 -7.541 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.890 -15.823 -6.141 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -6.448 -17.475 -6.309 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -6.251 -15.453 -8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.087 -16.724 -8.274 1.00 0.00 H new ATOM 1341 N ASN A 95 -9.113 -18.127 -6.348 1.00 0.00 N ATOM 1342 CA ASN A 95 -9.880 -19.169 -5.686 1.00 0.00 C ATOM 1343 C ASN A 95 -10.066 -20.347 -6.645 1.00 0.00 C ATOM 1344 O ASN A 95 -9.454 -20.387 -7.711 1.00 0.00 O ATOM 1345 CB ASN A 95 -11.267 -18.662 -5.286 1.00 0.00 C ATOM 1346 CG ASN A 95 -12.073 -18.238 -6.515 1.00 0.00 C ATOM 1347 OD1 ASN A 95 -11.549 -17.704 -7.479 1.00 0.00 O ATOM 1348 ND2 ASN A 95 -13.372 -18.505 -6.428 1.00 0.00 N ATOM 0 H ASN A 95 -8.840 -18.342 -7.307 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.335 -19.472 -4.792 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -11.803 -19.444 -4.748 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.166 -17.818 -4.604 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.995 -18.261 -7.197 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -13.745 -18.954 -5.592 1.00 0.00 H new ATOM 1354 N MET A 96 -10.915 -21.276 -6.232 1.00 0.00 N ATOM 1355 CA MET A 96 -11.190 -22.451 -7.042 1.00 0.00 C ATOM 1356 C MET A 96 -12.311 -22.176 -8.045 1.00 0.00 C ATOM 1357 O MET A 96 -13.170 -23.028 -8.270 1.00 0.00 O ATOM 1358 CB MET A 96 -11.591 -23.615 -6.132 1.00 0.00 C ATOM 1359 CG MET A 96 -12.991 -23.400 -5.554 1.00 0.00 C ATOM 1360 SD MET A 96 -14.078 -24.715 -6.080 1.00 0.00 S ATOM 1361 CE MET A 96 -13.768 -25.909 -4.790 1.00 0.00 C ATOM 0 H MET A 96 -11.422 -21.239 -5.347 1.00 0.00 H new ATOM 0 HA MET A 96 -10.287 -22.706 -7.597 1.00 0.00 H new ATOM 0 HB2 MET A 96 -11.565 -24.548 -6.695 1.00 0.00 H new ATOM 0 HB3 MET A 96 -10.870 -23.713 -5.321 1.00 0.00 H new ATOM 0 HG2 MET A 96 -12.943 -23.370 -4.465 1.00 0.00 H new ATOM 0 HG3 MET A 96 -13.385 -22.438 -5.882 1.00 0.00 H new ATOM 0 HE1 MET A 96 -14.372 -26.799 -4.966 1.00 0.00 H new ATOM 0 HE2 MET A 96 -12.712 -26.180 -4.791 1.00 0.00 H new ATOM 0 HE3 MET A 96 -14.031 -25.478 -3.824 1.00 0.00 H new ATOM 1369 N CYS A 97 -12.269 -20.983 -8.619 1.00 0.00 N ATOM 1370 CA CYS A 97 -13.272 -20.585 -9.593 1.00 0.00 C ATOM 1371 C CYS A 97 -12.584 -19.754 -10.677 1.00 0.00 C ATOM 1372 O CYS A 97 -12.535 -20.159 -11.838 1.00 0.00 O ATOM 1373 CB CYS A 97 -14.427 -19.826 -8.937 1.00 0.00 C ATOM 1374 SG CYS A 97 -16.014 -20.312 -9.709 1.00 0.00 S ATOM 0 H CYS A 97 -11.556 -20.279 -8.429 1.00 0.00 H new ATOM 0 HA CYS A 97 -13.718 -21.471 -10.045 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -14.453 -20.039 -7.868 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -14.275 -18.752 -9.044 1.00 0.00 H new ATOM 0 HG CYS A 97 -16.988 -19.664 -9.143 1.00 0.00 H new ATOM 1379 N GLY A 98 -12.070 -18.606 -10.261 1.00 0.00 N ATOM 1380 CA GLY A 98 -11.388 -17.713 -11.183 1.00 0.00 C ATOM 1381 C GLY A 98 -10.882 -16.462 -10.462 1.00 0.00 C ATOM 1382 O GLY A 98 -10.504 -16.525 -9.293 1.00 0.00 O ATOM 0 H GLY A 98 -12.112 -18.273 -9.298 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.550 -18.234 -11.646 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -12.067 -17.425 -11.985 1.00 0.00 H new ATOM 1386 N LEU A 99 -10.892 -15.354 -11.189 1.00 0.00 N ATOM 1387 CA LEU A 99 -10.440 -14.090 -10.633 1.00 0.00 C ATOM 1388 C LEU A 99 -11.654 -13.225 -10.291 1.00 0.00 C ATOM 1389 O LEU A 99 -12.713 -13.364 -10.901 1.00 0.00 O ATOM 1390 CB LEU A 99 -9.449 -13.412 -11.581 1.00 0.00 C ATOM 1391 CG LEU A 99 -7.999 -13.893 -11.492 1.00 0.00 C ATOM 1392 CD1 LEU A 99 -7.526 -13.943 -10.038 1.00 0.00 C ATOM 1393 CD2 LEU A 99 -7.824 -15.239 -12.199 1.00 0.00 C ATOM 0 H LEU A 99 -11.206 -15.306 -12.158 1.00 0.00 H new ATOM 0 HA LEU A 99 -9.895 -14.256 -9.704 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -9.797 -13.558 -12.604 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.468 -12.339 -11.388 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.367 -13.172 -12.011 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.493 -14.288 -10.003 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.591 -12.947 -9.600 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -8.157 -14.630 -9.474 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -6.785 -15.558 -12.121 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -8.468 -15.983 -11.730 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.094 -15.136 -13.250 1.00 0.00 H new ATOM 1404 N SER A 100 -11.461 -12.350 -9.315 1.00 0.00 N ATOM 1405 CA SER A 100 -12.527 -11.461 -8.884 1.00 0.00 C ATOM 1406 C SER A 100 -12.637 -10.273 -9.840 1.00 0.00 C ATOM 1407 O SER A 100 -11.647 -9.592 -10.107 1.00 0.00 O ATOM 1408 CB SER A 100 -12.291 -10.972 -7.453 1.00 0.00 C ATOM 1409 OG SER A 100 -10.973 -10.460 -7.275 1.00 0.00 O ATOM 0 H SER A 100 -10.582 -12.238 -8.810 1.00 0.00 H new ATOM 0 HA SER A 100 -13.464 -12.018 -8.899 1.00 0.00 H new ATOM 0 HB2 SER A 100 -13.017 -10.196 -7.210 1.00 0.00 H new ATOM 0 HB3 SER A 100 -12.458 -11.794 -6.757 1.00 0.00 H new ATOM 0 HG SER A 100 -11.006 -9.482 -7.227 1.00 0.00 H new ATOM 1414 N GLU A 101 -13.848 -10.059 -10.331 1.00 0.00 N ATOM 1415 CA GLU A 101 -14.100 -8.965 -11.253 1.00 0.00 C ATOM 1416 C GLU A 101 -13.904 -7.621 -10.548 1.00 0.00 C ATOM 1417 O GLU A 101 -13.595 -6.618 -11.190 1.00 0.00 O ATOM 1418 CB GLU A 101 -15.502 -9.067 -11.856 1.00 0.00 C ATOM 1419 CG GLU A 101 -15.451 -9.665 -13.264 1.00 0.00 C ATOM 1420 CD GLU A 101 -16.508 -9.028 -14.168 1.00 0.00 C ATOM 1421 OE1 GLU A 101 -16.312 -7.846 -14.525 1.00 0.00 O ATOM 1422 OE2 GLU A 101 -17.488 -9.737 -14.482 1.00 0.00 O ATOM 0 H GLU A 101 -14.666 -10.625 -10.108 1.00 0.00 H new ATOM 0 HA GLU A 101 -13.383 -9.033 -12.071 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -16.133 -9.685 -11.217 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -15.959 -8.078 -11.893 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.461 -9.512 -13.693 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -15.613 -10.742 -13.212 1.00 0.00 H new ATOM 1427 N ASP A 102 -14.091 -7.644 -9.237 1.00 0.00 N ATOM 1428 CA ASP A 102 -13.939 -6.441 -8.437 1.00 0.00 C ATOM 1429 C ASP A 102 -12.565 -6.453 -7.763 1.00 0.00 C ATOM 1430 O ASP A 102 -12.159 -7.462 -7.190 1.00 0.00 O ATOM 1431 CB ASP A 102 -15.003 -6.368 -7.341 1.00 0.00 C ATOM 1432 CG ASP A 102 -16.225 -7.262 -7.566 1.00 0.00 C ATOM 1433 OD1 ASP A 102 -16.948 -6.996 -8.550 1.00 0.00 O ATOM 1434 OD2 ASP A 102 -16.407 -8.190 -6.749 1.00 0.00 O ATOM 0 H ASP A 102 -14.347 -8.478 -8.708 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.045 -5.581 -9.098 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -14.543 -6.639 -6.391 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -15.339 -5.335 -7.250 1.00 0.00 H new ATOM 1438 N ALA A 103 -11.887 -5.318 -7.853 1.00 0.00 N ATOM 1439 CA ALA A 103 -10.568 -5.185 -7.259 1.00 0.00 C ATOM 1440 C ALA A 103 -10.510 -3.893 -6.441 1.00 0.00 C ATOM 1441 O ALA A 103 -11.241 -2.944 -6.720 1.00 0.00 O ATOM 1442 CB ALA A 103 -9.505 -5.227 -8.358 1.00 0.00 C ATOM 0 H ALA A 103 -12.227 -4.482 -8.329 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.368 -6.015 -6.581 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.516 -5.127 -7.911 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.569 -6.176 -8.890 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.672 -4.408 -9.057 1.00 0.00 H new ATOM 1448 N THR A 104 -9.632 -3.898 -5.449 1.00 0.00 N ATOM 1449 CA THR A 104 -9.469 -2.737 -4.589 1.00 0.00 C ATOM 1450 C THR A 104 -8.171 -2.000 -4.928 1.00 0.00 C ATOM 1451 O THR A 104 -7.096 -2.392 -4.480 1.00 0.00 O ATOM 1452 CB THR A 104 -9.535 -3.213 -3.136 1.00 0.00 C ATOM 1453 OG1 THR A 104 -10.908 -3.539 -2.940 1.00 0.00 O ATOM 1454 CG2 THR A 104 -9.273 -2.083 -2.137 1.00 0.00 C ATOM 0 H THR A 104 -9.026 -4.686 -5.221 1.00 0.00 H new ATOM 0 HA THR A 104 -10.268 -2.013 -4.746 1.00 0.00 H new ATOM 0 HB THR A 104 -8.807 -4.010 -2.981 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.041 -3.859 -2.023 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.332 -2.474 -1.121 1.00 0.00 H new ATOM 0 HG22 THR A 104 -8.280 -1.668 -2.309 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.021 -1.301 -2.268 1.00 0.00 H new ATOM 1462 N MET A 105 -8.317 -0.946 -5.718 1.00 0.00 N ATOM 1463 CA MET A 105 -7.171 -0.151 -6.123 1.00 0.00 C ATOM 1464 C MET A 105 -6.669 0.716 -4.966 1.00 0.00 C ATOM 1465 O MET A 105 -7.463 1.311 -4.241 1.00 0.00 O ATOM 1466 CB MET A 105 -7.562 0.746 -7.300 1.00 0.00 C ATOM 1467 CG MET A 105 -6.321 1.311 -7.994 1.00 0.00 C ATOM 1468 SD MET A 105 -6.641 2.974 -8.558 1.00 0.00 S ATOM 1469 CE MET A 105 -6.930 2.662 -10.293 1.00 0.00 C ATOM 0 H MET A 105 -9.212 -0.625 -6.088 1.00 0.00 H new ATOM 0 HA MET A 105 -6.370 -0.828 -6.420 1.00 0.00 H new ATOM 0 HB2 MET A 105 -8.155 0.176 -8.015 1.00 0.00 H new ATOM 0 HB3 MET A 105 -8.189 1.564 -6.946 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.476 1.308 -7.305 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.047 0.678 -8.838 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.059 3.609 -10.817 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.078 2.128 -10.713 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.830 2.058 -10.409 1.00 0.00 H new ATOM 1477 N THR A 106 -5.351 0.757 -4.830 1.00 0.00 N ATOM 1478 CA THR A 106 -4.732 1.540 -3.774 1.00 0.00 C ATOM 1479 C THR A 106 -5.457 2.878 -3.608 1.00 0.00 C ATOM 1480 O THR A 106 -5.546 3.660 -4.552 1.00 0.00 O ATOM 1481 CB THR A 106 -3.247 1.691 -4.104 1.00 0.00 C ATOM 1482 OG1 THR A 106 -3.232 2.041 -5.485 1.00 0.00 O ATOM 1483 CG2 THR A 106 -2.497 0.358 -4.050 1.00 0.00 C ATOM 0 H THR A 106 -4.695 0.261 -5.433 1.00 0.00 H new ATOM 0 HA THR A 106 -4.815 1.038 -2.810 1.00 0.00 H new ATOM 0 HB THR A 106 -2.790 2.394 -3.407 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.978 2.647 -5.677 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.447 0.521 -4.292 1.00 0.00 H new ATOM 0 HG22 THR A 106 -2.577 -0.064 -3.048 1.00 0.00 H new ATOM 0 HG23 THR A 106 -2.932 -0.334 -4.771 1.00 0.00 H new ATOM 1491 N LYS A 107 -5.955 3.098 -2.400 1.00 0.00 N ATOM 1492 CA LYS A 107 -6.668 4.328 -2.098 1.00 0.00 C ATOM 1493 C LYS A 107 -5.956 5.504 -2.771 1.00 0.00 C ATOM 1494 O LYS A 107 -6.604 6.431 -3.255 1.00 0.00 O ATOM 1495 CB LYS A 107 -6.834 4.494 -0.587 1.00 0.00 C ATOM 1496 CG LYS A 107 -8.286 4.258 -0.165 1.00 0.00 C ATOM 1497 CD LYS A 107 -9.075 5.569 -0.160 1.00 0.00 C ATOM 1498 CE LYS A 107 -9.647 5.860 1.230 1.00 0.00 C ATOM 1499 NZ LYS A 107 -8.895 6.955 1.881 1.00 0.00 N ATOM 0 H LYS A 107 -5.879 2.446 -1.619 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.679 4.291 -2.504 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -6.182 3.792 -0.067 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -6.524 5.496 -0.292 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -8.756 3.549 -0.847 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -8.312 3.810 0.828 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.427 6.389 -0.469 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.886 5.512 -0.886 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -10.699 6.133 1.147 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -9.598 4.962 1.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -9.296 7.140 2.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -7.896 6.681 1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -8.963 7.816 1.301 1.00 0.00 H new ATOM 1509 N GLU A 108 -4.634 5.428 -2.781 1.00 0.00 N ATOM 1510 CA GLU A 108 -3.828 6.473 -3.386 1.00 0.00 C ATOM 1511 C GLU A 108 -2.822 5.868 -4.367 1.00 0.00 C ATOM 1512 O GLU A 108 -2.435 4.708 -4.228 1.00 0.00 O ATOM 1513 CB GLU A 108 -3.119 7.307 -2.317 1.00 0.00 C ATOM 1514 CG GLU A 108 -4.122 7.883 -1.316 1.00 0.00 C ATOM 1515 CD GLU A 108 -3.429 8.814 -0.320 1.00 0.00 C ATOM 1516 OE1 GLU A 108 -2.951 8.291 0.710 1.00 0.00 O ATOM 1517 OE2 GLU A 108 -3.392 10.030 -0.610 1.00 0.00 O ATOM 0 H GLU A 108 -4.100 4.657 -2.379 1.00 0.00 H new ATOM 0 HA GLU A 108 -4.489 7.139 -3.940 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -2.391 6.689 -1.792 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.566 8.118 -2.791 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -4.900 8.429 -1.849 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -4.613 7.071 -0.779 1.00 0.00 H new ATOM 1522 N SER A 109 -2.425 6.679 -5.335 1.00 0.00 N ATOM 1523 CA SER A 109 -1.471 6.238 -6.339 1.00 0.00 C ATOM 1524 C SER A 109 -0.055 6.266 -5.762 1.00 0.00 C ATOM 1525 O SER A 109 0.156 6.744 -4.648 1.00 0.00 O ATOM 1526 CB SER A 109 -1.550 7.108 -7.595 1.00 0.00 C ATOM 1527 OG SER A 109 -1.079 8.432 -7.358 1.00 0.00 O ATOM 0 H SER A 109 -2.747 7.641 -5.446 1.00 0.00 H new ATOM 0 HA SER A 109 -1.721 5.216 -6.623 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.961 6.651 -8.390 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.582 7.147 -7.944 1.00 0.00 H new ATOM 0 HG SER A 109 -1.261 8.990 -8.143 1.00 0.00 H new ATOM 1532 N ALA A 110 0.880 5.749 -6.545 1.00 0.00 N ATOM 1533 CA ALA A 110 2.271 5.710 -6.126 1.00 0.00 C ATOM 1534 C ALA A 110 3.129 6.459 -7.148 1.00 0.00 C ATOM 1535 O ALA A 110 3.086 6.157 -8.339 1.00 0.00 O ATOM 1536 CB ALA A 110 2.710 4.255 -5.951 1.00 0.00 C ATOM 0 H ALA A 110 0.702 5.353 -7.468 1.00 0.00 H new ATOM 0 HA ALA A 110 2.396 6.207 -5.164 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.753 4.225 -5.637 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.089 3.776 -5.194 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.601 3.726 -6.898 1.00 0.00 H new ATOM 1542 N VAL A 111 3.887 7.421 -6.644 1.00 0.00 N ATOM 1543 CA VAL A 111 4.753 8.216 -7.497 1.00 0.00 C ATOM 1544 C VAL A 111 6.210 7.813 -7.256 1.00 0.00 C ATOM 1545 O VAL A 111 6.709 7.921 -6.136 1.00 0.00 O ATOM 1546 CB VAL A 111 4.498 9.706 -7.262 1.00 0.00 C ATOM 1547 CG1 VAL A 111 3.888 10.360 -8.503 1.00 0.00 C ATOM 1548 CG2 VAL A 111 3.608 9.921 -6.036 1.00 0.00 C ATOM 0 H VAL A 111 3.919 7.668 -5.655 1.00 0.00 H new ATOM 0 HA VAL A 111 4.532 8.025 -8.547 1.00 0.00 H new ATOM 0 HB VAL A 111 5.458 10.185 -7.069 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.717 11.419 -8.309 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.572 10.251 -9.345 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.940 9.877 -8.740 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.441 10.988 -5.890 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.651 9.422 -6.189 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.097 9.506 -5.154 1.00 0.00 H new ATOM 1558 N ILE A 112 6.851 7.359 -8.322 1.00 0.00 N ATOM 1559 CA ILE A 112 8.239 6.940 -8.239 1.00 0.00 C ATOM 1560 C ILE A 112 9.134 8.175 -8.114 1.00 0.00 C ATOM 1561 O ILE A 112 8.840 9.220 -8.695 1.00 0.00 O ATOM 1562 CB ILE A 112 8.599 6.039 -9.423 1.00 0.00 C ATOM 1563 CG1 ILE A 112 7.561 4.929 -9.601 1.00 0.00 C ATOM 1564 CG2 ILE A 112 10.016 5.481 -9.276 1.00 0.00 C ATOM 1565 CD1 ILE A 112 7.305 4.200 -8.280 1.00 0.00 C ATOM 0 H ILE A 112 6.434 7.272 -9.249 1.00 0.00 H new ATOM 0 HA ILE A 112 8.401 6.336 -7.346 1.00 0.00 H new ATOM 0 HB ILE A 112 8.584 6.643 -10.330 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.629 5.354 -9.972 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.908 4.218 -10.351 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.247 4.844 -10.130 1.00 0.00 H new ATOM 0 HG22 ILE A 112 10.729 6.305 -9.234 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.083 4.896 -8.359 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.563 3.416 -8.435 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.234 3.755 -7.924 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.935 4.909 -7.539 1.00 0.00 H new ATOM 1576 N ALA A 113 10.205 8.016 -7.350 1.00 0.00 N ATOM 1577 CA ALA A 113 11.143 9.105 -7.141 1.00 0.00 C ATOM 1578 C ALA A 113 12.366 8.581 -6.387 1.00 0.00 C ATOM 1579 O ALA A 113 12.246 7.696 -5.541 1.00 0.00 O ATOM 1580 CB ALA A 113 10.445 10.245 -6.398 1.00 0.00 C ATOM 0 H ALA A 113 10.444 7.149 -6.868 1.00 0.00 H new ATOM 0 HA ALA A 113 11.489 9.502 -8.096 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.149 11.062 -6.241 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.601 10.601 -6.989 1.00 0.00 H new ATOM 0 HB3 ALA A 113 10.086 9.885 -5.434 1.00 0.00 H new ATOM 1586 N ARG A 114 13.516 9.148 -6.722 1.00 0.00 N ATOM 1587 CA ARG A 114 14.761 8.749 -6.087 1.00 0.00 C ATOM 1588 C ARG A 114 14.790 9.222 -4.632 1.00 0.00 C ATOM 1589 O ARG A 114 15.664 9.996 -4.245 1.00 0.00 O ATOM 1590 CB ARG A 114 15.968 9.327 -6.828 1.00 0.00 C ATOM 1591 CG ARG A 114 16.467 8.357 -7.902 1.00 0.00 C ATOM 1592 CD ARG A 114 17.990 8.419 -8.030 1.00 0.00 C ATOM 1593 NE ARG A 114 18.624 7.748 -6.873 1.00 0.00 N ATOM 1594 CZ ARG A 114 19.084 8.390 -5.791 1.00 0.00 C ATOM 1595 NH1 ARG A 114 18.984 9.724 -5.711 1.00 0.00 N ATOM 1596 NH2 ARG A 114 19.644 7.700 -4.790 1.00 0.00 N ATOM 0 H ARG A 114 13.612 9.881 -7.425 1.00 0.00 H new ATOM 0 HA ARG A 114 14.816 7.661 -6.120 1.00 0.00 H new ATOM 0 HB2 ARG A 114 15.696 10.277 -7.288 1.00 0.00 H new ATOM 0 HB3 ARG A 114 16.770 9.534 -6.119 1.00 0.00 H new ATOM 0 HG2 ARG A 114 16.160 7.342 -7.651 1.00 0.00 H new ATOM 0 HG3 ARG A 114 16.008 8.601 -8.860 1.00 0.00 H new ATOM 0 HD2 ARG A 114 18.305 7.939 -8.956 1.00 0.00 H new ATOM 0 HD3 ARG A 114 18.317 9.458 -8.082 1.00 0.00 H new ATOM 0 HE ARG A 114 18.716 6.733 -6.901 1.00 0.00 H new ATOM 0 HH11 ARG A 114 18.558 10.250 -6.474 1.00 0.00 H new ATOM 0 HH12 ARG A 114 19.334 10.213 -4.887 1.00 0.00 H new ATOM 0 HH21 ARG A 114 19.721 6.685 -4.851 1.00 0.00 H new ATOM 0 HH22 ARG A 114 19.994 8.190 -3.966 1.00 0.00 H new ATOM 1607 N ASP A 115 13.825 8.737 -3.866 1.00 0.00 N ATOM 1608 CA ASP A 115 13.729 9.102 -2.462 1.00 0.00 C ATOM 1609 C ASP A 115 13.529 7.837 -1.624 1.00 0.00 C ATOM 1610 O ASP A 115 12.441 7.266 -1.605 1.00 0.00 O ATOM 1611 CB ASP A 115 12.536 10.026 -2.213 1.00 0.00 C ATOM 1612 CG ASP A 115 12.748 11.075 -1.119 1.00 0.00 C ATOM 1613 OD1 ASP A 115 13.921 11.253 -0.723 1.00 0.00 O ATOM 1614 OD2 ASP A 115 11.734 11.675 -0.704 1.00 0.00 O ATOM 0 H ASP A 115 13.102 8.094 -4.190 1.00 0.00 H new ATOM 0 HA ASP A 115 14.648 9.617 -2.184 1.00 0.00 H new ATOM 0 HB2 ASP A 115 12.292 10.538 -3.144 1.00 0.00 H new ATOM 0 HB3 ASP A 115 11.672 9.416 -1.948 1.00 0.00 H new ATOM 1618 N GLY A 116 14.598 7.437 -0.951 1.00 0.00 N ATOM 1619 CA GLY A 116 14.554 6.250 -0.114 1.00 0.00 C ATOM 1620 C GLY A 116 14.491 6.627 1.368 1.00 0.00 C ATOM 1621 O GLY A 116 15.402 7.271 1.888 1.00 0.00 O ATOM 0 H GLY A 116 15.500 7.914 -0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 116 13.685 5.647 -0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 116 15.436 5.637 -0.300 1.00 0.00 H new ATOM 1625 N LYS A 117 13.408 6.210 2.007 1.00 0.00 N ATOM 1626 CA LYS A 117 13.215 6.495 3.418 1.00 0.00 C ATOM 1627 C LYS A 117 14.036 5.510 4.251 1.00 0.00 C ATOM 1628 O LYS A 117 14.846 4.760 3.710 1.00 0.00 O ATOM 1629 CB LYS A 117 11.724 6.500 3.764 1.00 0.00 C ATOM 1630 CG LYS A 117 11.278 7.882 4.249 1.00 0.00 C ATOM 1631 CD LYS A 117 11.537 8.048 5.747 1.00 0.00 C ATOM 1632 CE LYS A 117 10.906 9.337 6.274 1.00 0.00 C ATOM 1633 NZ LYS A 117 10.018 9.049 7.423 1.00 0.00 N ATOM 0 H LYS A 117 12.655 5.677 1.573 1.00 0.00 H new ATOM 0 HA LYS A 117 13.578 7.494 3.658 1.00 0.00 H new ATOM 0 HB2 LYS A 117 11.143 6.213 2.888 1.00 0.00 H new ATOM 0 HB3 LYS A 117 11.524 5.757 4.536 1.00 0.00 H new ATOM 0 HG2 LYS A 117 11.812 8.655 3.696 1.00 0.00 H new ATOM 0 HG3 LYS A 117 10.216 8.018 4.043 1.00 0.00 H new ATOM 0 HD2 LYS A 117 11.130 7.193 6.287 1.00 0.00 H new ATOM 0 HD3 LYS A 117 12.611 8.062 5.934 1.00 0.00 H new ATOM 0 HE2 LYS A 117 11.688 10.034 6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 117 10.337 9.821 5.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 9.598 9.936 7.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 9.262 8.401 7.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 10.570 8.607 8.186 1.00 0.00 H new ATOM 1643 N ILE A 118 13.799 5.544 5.553 1.00 0.00 N ATOM 1644 CA ILE A 118 14.507 4.662 6.467 1.00 0.00 C ATOM 1645 C ILE A 118 13.578 4.277 7.620 1.00 0.00 C ATOM 1646 O ILE A 118 12.985 5.145 8.260 1.00 0.00 O ATOM 1647 CB ILE A 118 15.819 5.305 6.922 1.00 0.00 C ATOM 1648 CG1 ILE A 118 16.956 4.975 5.954 1.00 0.00 C ATOM 1649 CG2 ILE A 118 16.155 4.905 8.360 1.00 0.00 C ATOM 1650 CD1 ILE A 118 18.186 5.840 6.236 1.00 0.00 C ATOM 0 H ILE A 118 13.126 6.168 5.998 1.00 0.00 H new ATOM 0 HA ILE A 118 14.789 3.738 5.963 1.00 0.00 H new ATOM 0 HB ILE A 118 15.691 6.387 6.910 1.00 0.00 H new ATOM 0 HG12 ILE A 118 17.220 3.921 6.044 1.00 0.00 H new ATOM 0 HG13 ILE A 118 16.623 5.134 4.928 1.00 0.00 H new ATOM 0 HG21 ILE A 118 17.092 5.375 8.659 1.00 0.00 H new ATOM 0 HG22 ILE A 118 15.356 5.233 9.025 1.00 0.00 H new ATOM 0 HG23 ILE A 118 16.257 3.822 8.422 1.00 0.00 H new ATOM 0 HD11 ILE A 118 18.979 5.585 5.533 1.00 0.00 H new ATOM 0 HD12 ILE A 118 17.925 6.892 6.122 1.00 0.00 H new ATOM 0 HD13 ILE A 118 18.531 5.660 7.254 1.00 0.00 H new ATOM 1661 N TYR A 119 13.481 2.976 7.850 1.00 0.00 N ATOM 1662 CA TYR A 119 12.636 2.466 8.916 1.00 0.00 C ATOM 1663 C TYR A 119 13.073 3.016 10.275 1.00 0.00 C ATOM 1664 O TYR A 119 13.519 4.158 10.371 1.00 0.00 O ATOM 1665 CB TYR A 119 12.821 0.947 8.910 1.00 0.00 C ATOM 1666 CG TYR A 119 11.543 0.163 9.215 1.00 0.00 C ATOM 1667 CD1 TYR A 119 10.565 0.721 10.013 1.00 0.00 C ATOM 1668 CD2 TYR A 119 11.369 -1.102 8.693 1.00 0.00 C ATOM 1669 CE1 TYR A 119 9.362 -0.017 10.300 1.00 0.00 C ATOM 1670 CE2 TYR A 119 10.166 -1.840 8.980 1.00 0.00 C ATOM 1671 CZ TYR A 119 9.221 -1.260 9.770 1.00 0.00 C ATOM 1672 OH TYR A 119 8.086 -1.958 10.041 1.00 0.00 O ATOM 0 H TYR A 119 13.974 2.260 7.316 1.00 0.00 H new ATOM 0 HA TYR A 119 11.599 2.762 8.758 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.198 0.641 7.934 1.00 0.00 H new ATOM 0 HB3 TYR A 119 13.582 0.681 9.644 1.00 0.00 H new ATOM 0 HD1 TYR A 119 10.702 1.711 10.422 1.00 0.00 H new ATOM 0 HD2 TYR A 119 12.135 -1.539 8.069 1.00 0.00 H new ATOM 0 HE1 TYR A 119 8.589 0.408 10.923 1.00 0.00 H new ATOM 0 HE2 TYR A 119 10.017 -2.831 8.578 1.00 0.00 H new ATOM 0 HH TYR A 119 8.124 -2.830 9.595 1.00 0.00 H new ATOM 1681 N LYS A 120 12.927 2.178 11.291 1.00 0.00 N ATOM 1682 CA LYS A 120 13.301 2.566 12.640 1.00 0.00 C ATOM 1683 C LYS A 120 14.810 2.385 12.818 1.00 0.00 C ATOM 1684 O LYS A 120 15.268 1.314 13.217 1.00 0.00 O ATOM 1685 CB LYS A 120 12.465 1.804 13.668 1.00 0.00 C ATOM 1686 CG LYS A 120 11.891 2.754 14.721 1.00 0.00 C ATOM 1687 CD LYS A 120 11.708 2.040 16.063 1.00 0.00 C ATOM 1688 CE LYS A 120 10.279 2.207 16.581 1.00 0.00 C ATOM 1689 NZ LYS A 120 9.436 1.068 16.156 1.00 0.00 N ATOM 0 H LYS A 120 12.555 1.232 11.207 1.00 0.00 H new ATOM 0 HA LYS A 120 13.084 3.621 12.807 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.653 1.280 13.165 1.00 0.00 H new ATOM 0 HB3 LYS A 120 13.081 1.047 14.153 1.00 0.00 H new ATOM 0 HG2 LYS A 120 12.557 3.608 14.847 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.933 3.145 14.379 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.936 0.980 15.949 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.412 2.441 16.792 1.00 0.00 H new ATOM 0 HE2 LYS A 120 10.286 2.275 17.669 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.857 3.139 16.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 8.469 1.198 16.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.415 1.020 15.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.831 0.184 16.535 1.00 0.00 H new TER 1699 LYS A 120