USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 953 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 22 LYS NZ :NH3+ -150:sc= 0.771 (180deg=-0.156) USER MOD Set 1.2: A 99 GLN : amide:sc= -0.059 K(o=0.71,f=-6.6!) USER MOD Set 2.1: A 56 ASN : amide:sc= 0.00986 K(o=-0.26,f=-1.1) USER MOD Set 2.2: A 62 TYR OH : rot -18:sc= -0.272 USER MOD Set 3.1: A 20 GLN : amide:sc= 0.124 X(o=0.92,f=0.88) USER MOD Set 3.2: A 29 SER OG : rot 180:sc= 0.796 USER MOD Set 4.1: A 14 LYS NZ :NH3+ -157:sc= 0 (180deg=0) USER MOD Set 4.2: A 18 GLN : amide:sc= -0.0187 K(o=-0.091,f=-0.59) USER MOD Set 4.3: A 106 GLN : amide:sc= 0 K(o=-0.091,f=-0.59) USER MOD Set 4.4: A 110 GLN : amide:sc= -0.0727 X(o=-0.091,f=-0.11) USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0417 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0189 USER MOD Single : A 3 SER OG : rot 170:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0112 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0157 USER MOD Single : A 15 THR OG1 : rot 73:sc= 1.01 USER MOD Single : A 24 THR OG1 : rot 180:sc=-0.00655 USER MOD Single : A 26 ASN : amide:sc= -4.2! C(o=-4.2!,f=-5.4!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -1.15 X(o=-1.1,f=-0.83) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 159:sc= -0.214 (180deg=-0.779) USER MOD Single : A 52 THR OG1 : rot 136:sc= 0.011 USER MOD Single : A 53 MET CE :methyl -123:sc= -2.74 (180deg=-8.32!) USER MOD Single : A 54 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0631) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0.149 X(o=0.15,f=0) USER MOD Single : A 73 ASN : amide:sc= -0.0143 K(o=-0.014,f=-1.4!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -7.69! C(o=-7.7!,f=-16!) USER MOD Single : A 79 CYS SG : rot -127:sc= 0.432 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 35:sc= 0.0948 USER MOD Single : A 83 ASN : amide:sc= -0.121 X(o=-0.12,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -169:sc=-0.00875 (180deg=-0.144) USER MOD Single : A 87 THR OG1 : rot -66:sc= 0.193 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -127:sc= -2.48! (180deg=-4.51!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.938 24.285 1.311 1.00 0.00 N ATOM 2 CA GLY A 1 10.133 23.373 0.519 1.00 0.00 C ATOM 3 C GLY A 1 9.360 24.083 -0.575 1.00 0.00 C ATOM 4 O GLY A 1 9.100 25.282 -0.482 1.00 0.00 O ATOM 0 H1 GLY A 1 11.945 24.124 1.108 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.689 25.266 1.071 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.758 24.119 2.322 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.779 22.618 0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.435 22.849 1.172 1.00 0.00 H new ATOM 8 N SER A 2 8.993 23.341 -1.615 1.00 0.00 N ATOM 9 CA SER A 2 8.251 23.909 -2.735 1.00 0.00 C ATOM 10 C SER A 2 6.869 23.272 -2.848 1.00 0.00 C ATOM 11 O SER A 2 5.864 23.966 -3.003 1.00 0.00 O ATOM 12 CB SER A 2 9.024 23.713 -4.039 1.00 0.00 C ATOM 13 OG SER A 2 9.280 22.340 -4.280 1.00 0.00 O ATOM 0 H SER A 2 9.197 22.346 -1.705 1.00 0.00 H new ATOM 0 HA SER A 2 8.127 24.977 -2.553 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.454 24.131 -4.869 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.966 24.259 -3.992 1.00 0.00 H new ATOM 0 HG SER A 2 9.774 22.242 -5.121 1.00 0.00 H new ATOM 19 N SER A 3 6.827 21.946 -2.769 1.00 0.00 N ATOM 20 CA SER A 3 5.570 21.213 -2.867 1.00 0.00 C ATOM 21 C SER A 3 4.548 21.753 -1.871 1.00 0.00 C ATOM 22 O SER A 3 4.895 22.478 -0.940 1.00 0.00 O ATOM 23 CB SER A 3 5.803 19.722 -2.617 1.00 0.00 C ATOM 24 OG SER A 3 6.542 19.137 -3.676 1.00 0.00 O ATOM 0 H SER A 3 7.649 21.357 -2.637 1.00 0.00 H new ATOM 0 HA SER A 3 5.177 21.348 -3.875 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.339 19.587 -1.677 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.845 19.213 -2.514 1.00 0.00 H new ATOM 0 HG SER A 3 6.817 18.231 -3.422 1.00 0.00 H new ATOM 30 N GLY A 4 3.285 21.394 -2.077 1.00 0.00 N ATOM 31 CA GLY A 4 2.230 21.851 -1.191 1.00 0.00 C ATOM 32 C GLY A 4 1.105 20.843 -1.059 1.00 0.00 C ATOM 33 O GLY A 4 1.311 19.645 -1.252 1.00 0.00 O ATOM 0 H GLY A 4 2.973 20.795 -2.841 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.650 22.053 -0.206 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.828 22.792 -1.565 1.00 0.00 H new ATOM 37 N SER A 5 -0.087 21.329 -0.730 1.00 0.00 N ATOM 38 CA SER A 5 -1.248 20.461 -0.568 1.00 0.00 C ATOM 39 C SER A 5 -1.063 19.522 0.620 1.00 0.00 C ATOM 40 O SER A 5 -1.380 18.336 0.543 1.00 0.00 O ATOM 41 CB SER A 5 -1.486 19.649 -1.842 1.00 0.00 C ATOM 42 OG SER A 5 -1.229 20.427 -2.998 1.00 0.00 O ATOM 0 H SER A 5 -0.275 22.319 -0.570 1.00 0.00 H new ATOM 0 HA SER A 5 -2.118 21.091 -0.379 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.843 18.769 -1.842 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.515 19.291 -1.862 1.00 0.00 H new ATOM 0 HG SER A 5 -1.387 19.885 -3.799 1.00 0.00 H new ATOM 48 N SER A 6 -0.546 20.063 1.719 1.00 0.00 N ATOM 49 CA SER A 6 -0.313 19.274 2.922 1.00 0.00 C ATOM 50 C SER A 6 -1.521 18.397 3.239 1.00 0.00 C ATOM 51 O SER A 6 -1.403 17.178 3.353 1.00 0.00 O ATOM 52 CB SER A 6 -0.011 20.192 4.109 1.00 0.00 C ATOM 53 OG SER A 6 -0.979 21.221 4.217 1.00 0.00 O ATOM 0 H SER A 6 -0.281 21.045 1.800 1.00 0.00 H new ATOM 0 HA SER A 6 0.547 18.628 2.742 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.007 19.608 5.029 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.980 20.631 3.990 1.00 0.00 H new ATOM 0 HG SER A 6 -0.765 21.793 4.984 1.00 0.00 H new ATOM 59 N GLY A 7 -2.683 19.029 3.378 1.00 0.00 N ATOM 60 CA GLY A 7 -3.896 18.292 3.680 1.00 0.00 C ATOM 61 C GLY A 7 -3.934 16.935 3.005 1.00 0.00 C ATOM 62 O GLY A 7 -4.312 15.938 3.619 1.00 0.00 O ATOM 0 H GLY A 7 -2.806 20.038 3.287 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.978 18.160 4.759 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.760 18.876 3.364 1.00 0.00 H new ATOM 66 N PHE A 8 -3.541 16.897 1.736 1.00 0.00 N ATOM 67 CA PHE A 8 -3.533 15.653 0.975 1.00 0.00 C ATOM 68 C PHE A 8 -2.538 14.659 1.567 1.00 0.00 C ATOM 69 O PHE A 8 -2.848 13.478 1.737 1.00 0.00 O ATOM 70 CB PHE A 8 -3.187 15.927 -0.490 1.00 0.00 C ATOM 71 CG PHE A 8 -2.763 14.701 -1.245 1.00 0.00 C ATOM 72 CD1 PHE A 8 -3.700 13.908 -1.889 1.00 0.00 C ATOM 73 CD2 PHE A 8 -1.426 14.341 -1.313 1.00 0.00 C ATOM 74 CE1 PHE A 8 -3.312 12.779 -2.585 1.00 0.00 C ATOM 75 CE2 PHE A 8 -1.032 13.212 -2.008 1.00 0.00 C ATOM 76 CZ PHE A 8 -1.976 12.431 -2.645 1.00 0.00 C ATOM 0 H PHE A 8 -3.224 17.713 1.213 1.00 0.00 H new ATOM 0 HA PHE A 8 -4.531 15.218 1.030 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -4.054 16.366 -0.984 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -2.387 16.666 -0.534 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.745 14.176 -1.846 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -0.684 14.949 -0.818 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -4.052 12.169 -3.082 1.00 0.00 H new ATOM 0 HE2 PHE A 8 0.013 12.942 -2.052 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.671 11.550 -3.189 1.00 0.00 H new ATOM 86 N LEU A 9 -1.341 15.144 1.878 1.00 0.00 N ATOM 87 CA LEU A 9 -0.299 14.300 2.450 1.00 0.00 C ATOM 88 C LEU A 9 -0.823 13.529 3.658 1.00 0.00 C ATOM 89 O LEU A 9 -0.507 12.354 3.842 1.00 0.00 O ATOM 90 CB LEU A 9 0.907 15.149 2.857 1.00 0.00 C ATOM 91 CG LEU A 9 1.548 15.980 1.746 1.00 0.00 C ATOM 92 CD1 LEU A 9 2.674 16.838 2.302 1.00 0.00 C ATOM 93 CD2 LEU A 9 2.063 15.077 0.634 1.00 0.00 C ATOM 0 H LEU A 9 -1.068 16.118 1.743 1.00 0.00 H new ATOM 0 HA LEU A 9 0.009 13.582 1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.598 15.823 3.656 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.667 14.488 3.274 1.00 0.00 H new ATOM 0 HG LEU A 9 0.788 16.640 1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.118 17.422 1.496 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.277 17.511 3.062 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.435 16.196 2.747 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.516 15.686 -0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.808 14.391 1.038 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.234 14.506 0.215 1.00 0.00 H new ATOM 105 N ILE A 10 -1.627 14.199 4.476 1.00 0.00 N ATOM 106 CA ILE A 10 -2.199 13.577 5.664 1.00 0.00 C ATOM 107 C ILE A 10 -3.130 12.429 5.289 1.00 0.00 C ATOM 108 O ILE A 10 -3.084 11.356 5.892 1.00 0.00 O ATOM 109 CB ILE A 10 -2.978 14.597 6.516 1.00 0.00 C ATOM 110 CG1 ILE A 10 -2.015 15.598 7.158 1.00 0.00 C ATOM 111 CG2 ILE A 10 -3.797 13.883 7.581 1.00 0.00 C ATOM 112 CD1 ILE A 10 -1.723 16.799 6.287 1.00 0.00 C ATOM 0 H ILE A 10 -1.897 15.173 4.338 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.365 13.190 6.249 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.662 15.144 5.867 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.436 15.939 8.104 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.078 15.091 7.390 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.341 14.617 8.174 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.505 13.206 7.103 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.132 13.313 8.230 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -1.034 17.466 6.806 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -1.273 16.469 5.351 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.651 17.330 6.076 1.00 0.00 H new ATOM 124 N LEU A 11 -3.972 12.660 4.288 1.00 0.00 N ATOM 125 CA LEU A 11 -4.913 11.645 3.829 1.00 0.00 C ATOM 126 C LEU A 11 -4.203 10.319 3.576 1.00 0.00 C ATOM 127 O LEU A 11 -4.761 9.247 3.819 1.00 0.00 O ATOM 128 CB LEU A 11 -5.616 12.111 2.554 1.00 0.00 C ATOM 129 CG LEU A 11 -6.652 11.151 1.969 1.00 0.00 C ATOM 130 CD1 LEU A 11 -7.809 10.960 2.938 1.00 0.00 C ATOM 131 CD2 LEU A 11 -7.158 11.663 0.628 1.00 0.00 C ATOM 0 H LEU A 11 -4.022 13.542 3.778 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.657 11.495 4.612 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.107 13.062 2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.858 12.302 1.794 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.174 10.185 1.809 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.537 10.274 2.505 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.435 10.548 3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.286 11.921 3.129 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.894 10.967 0.227 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.619 12.641 0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.323 11.748 -0.067 1.00 0.00 H new ATOM 143 N LEU A 12 -2.970 10.397 3.089 1.00 0.00 N ATOM 144 CA LEU A 12 -2.181 9.204 2.806 1.00 0.00 C ATOM 145 C LEU A 12 -1.699 8.550 4.096 1.00 0.00 C ATOM 146 O LEU A 12 -1.854 7.343 4.288 1.00 0.00 O ATOM 147 CB LEU A 12 -0.985 9.557 1.920 1.00 0.00 C ATOM 148 CG LEU A 12 -1.275 9.704 0.427 1.00 0.00 C ATOM 149 CD1 LEU A 12 -2.346 10.757 0.191 1.00 0.00 C ATOM 150 CD2 LEU A 12 -0.003 10.056 -0.331 1.00 0.00 C ATOM 0 H LEU A 12 -2.494 11.275 2.882 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.818 8.494 2.278 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.556 10.492 2.280 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.224 8.787 2.048 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.645 8.749 0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.538 10.847 -0.878 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.263 10.464 0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.005 11.716 0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.228 10.157 -1.393 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.397 10.997 0.046 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.735 9.266 -0.190 1.00 0.00 H new ATOM 162 N ARG A 13 -1.113 9.354 4.977 1.00 0.00 N ATOM 163 CA ARG A 13 -0.609 8.854 6.251 1.00 0.00 C ATOM 164 C ARG A 13 -1.723 8.189 7.054 1.00 0.00 C ATOM 165 O ARG A 13 -1.535 7.116 7.628 1.00 0.00 O ATOM 166 CB ARG A 13 0.008 9.995 7.063 1.00 0.00 C ATOM 167 CG ARG A 13 1.038 10.804 6.290 1.00 0.00 C ATOM 168 CD ARG A 13 1.588 11.949 7.127 1.00 0.00 C ATOM 169 NE ARG A 13 0.527 12.683 7.813 1.00 0.00 N ATOM 170 CZ ARG A 13 0.047 12.341 9.003 1.00 0.00 C ATOM 171 NH1 ARG A 13 0.530 11.281 9.636 1.00 0.00 N ATOM 172 NH2 ARG A 13 -0.918 13.059 9.563 1.00 0.00 N ATOM 0 H ARG A 13 -0.975 10.354 4.832 1.00 0.00 H new ATOM 0 HA ARG A 13 0.159 8.109 6.042 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -0.786 10.661 7.400 1.00 0.00 H new ATOM 0 HB3 ARG A 13 0.478 9.582 7.956 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.855 10.153 5.980 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.584 11.201 5.382 1.00 0.00 H new ATOM 0 HD2 ARG A 13 2.291 11.556 7.862 1.00 0.00 H new ATOM 0 HD3 ARG A 13 2.145 12.632 6.486 1.00 0.00 H new ATOM 0 HE ARG A 13 0.133 13.503 7.352 1.00 0.00 H new ATOM 0 HH11 ARG A 13 1.272 10.726 9.209 1.00 0.00 H new ATOM 0 HH12 ARG A 13 0.160 11.020 10.550 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -1.292 13.875 9.079 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -1.285 12.795 10.477 1.00 0.00 H new ATOM 186 N LYS A 14 -2.885 8.833 7.090 1.00 0.00 N ATOM 187 CA LYS A 14 -4.031 8.305 7.821 1.00 0.00 C ATOM 188 C LYS A 14 -4.641 7.114 7.090 1.00 0.00 C ATOM 189 O LYS A 14 -5.108 6.161 7.714 1.00 0.00 O ATOM 190 CB LYS A 14 -5.086 9.396 8.012 1.00 0.00 C ATOM 191 CG LYS A 14 -5.993 9.582 6.807 1.00 0.00 C ATOM 192 CD LYS A 14 -7.211 8.678 6.880 1.00 0.00 C ATOM 193 CE LYS A 14 -8.318 9.301 7.718 1.00 0.00 C ATOM 194 NZ LYS A 14 -9.666 8.832 7.292 1.00 0.00 N ATOM 0 H LYS A 14 -3.058 9.722 6.621 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.684 7.969 8.798 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -5.696 9.152 8.881 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -4.586 10.340 8.229 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.314 10.622 6.749 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -5.435 9.369 5.895 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.581 8.482 5.874 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -6.927 7.716 7.308 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.162 9.053 8.768 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.268 10.387 7.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.383 9.526 7.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.686 8.727 6.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.871 7.914 7.737 1.00 0.00 H new ATOM 208 N THR A 15 -4.632 7.173 5.762 1.00 0.00 N ATOM 209 CA THR A 15 -5.184 6.099 4.946 1.00 0.00 C ATOM 210 C THR A 15 -4.327 4.842 5.037 1.00 0.00 C ATOM 211 O THR A 15 -4.845 3.725 5.051 1.00 0.00 O ATOM 212 CB THR A 15 -5.303 6.521 3.468 1.00 0.00 C ATOM 213 OG1 THR A 15 -6.366 7.467 3.312 1.00 0.00 O ATOM 214 CG2 THR A 15 -5.556 5.312 2.580 1.00 0.00 C ATOM 0 H THR A 15 -4.248 7.953 5.229 1.00 0.00 H new ATOM 0 HA THR A 15 -6.179 5.885 5.337 1.00 0.00 H new ATOM 0 HB THR A 15 -4.362 6.982 3.167 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.096 8.329 3.693 1.00 0.00 H new ATOM 0 HG21 THR A 15 -5.636 5.634 1.542 1.00 0.00 H new ATOM 0 HG22 THR A 15 -4.729 4.609 2.679 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.484 4.826 2.882 1.00 0.00 H new ATOM 222 N LEU A 16 -3.014 5.032 5.099 1.00 0.00 N ATOM 223 CA LEU A 16 -2.084 3.912 5.190 1.00 0.00 C ATOM 224 C LEU A 16 -2.367 3.067 6.429 1.00 0.00 C ATOM 225 O LEU A 16 -2.269 1.841 6.391 1.00 0.00 O ATOM 226 CB LEU A 16 -0.642 4.422 5.225 1.00 0.00 C ATOM 227 CG LEU A 16 0.430 3.383 5.554 1.00 0.00 C ATOM 228 CD1 LEU A 16 0.410 2.254 4.535 1.00 0.00 C ATOM 229 CD2 LEU A 16 1.805 4.033 5.604 1.00 0.00 C ATOM 0 H LEU A 16 -2.570 5.950 5.088 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.221 3.287 4.308 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.409 4.860 4.254 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.579 5.224 5.960 1.00 0.00 H new ATOM 0 HG LEU A 16 0.212 2.963 6.536 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.180 1.524 4.785 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.567 1.770 4.547 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.602 2.658 3.541 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.556 3.279 5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.031 4.480 4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.814 4.806 6.372 1.00 0.00 H new ATOM 241 N GLU A 17 -2.720 3.733 7.525 1.00 0.00 N ATOM 242 CA GLU A 17 -3.019 3.043 8.773 1.00 0.00 C ATOM 243 C GLU A 17 -4.317 2.250 8.660 1.00 0.00 C ATOM 244 O GLU A 17 -4.408 1.119 9.136 1.00 0.00 O ATOM 245 CB GLU A 17 -3.120 4.047 9.925 1.00 0.00 C ATOM 246 CG GLU A 17 -1.802 4.724 10.258 1.00 0.00 C ATOM 247 CD GLU A 17 -1.731 5.182 11.703 1.00 0.00 C ATOM 248 OE1 GLU A 17 -2.047 4.369 12.598 1.00 0.00 O ATOM 249 OE2 GLU A 17 -1.360 6.351 11.939 1.00 0.00 O ATOM 0 H GLU A 17 -2.805 4.748 7.573 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.206 2.347 8.977 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.856 4.809 9.668 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.490 3.533 10.812 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.982 4.034 10.059 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.662 5.583 9.601 1.00 0.00 H new ATOM 256 N GLN A 18 -5.317 2.853 8.027 1.00 0.00 N ATOM 257 CA GLN A 18 -6.612 2.202 7.851 1.00 0.00 C ATOM 258 C GLN A 18 -6.454 0.853 7.159 1.00 0.00 C ATOM 259 O GLN A 18 -7.183 -0.095 7.451 1.00 0.00 O ATOM 260 CB GLN A 18 -7.551 3.099 7.041 1.00 0.00 C ATOM 261 CG GLN A 18 -7.834 4.438 7.702 1.00 0.00 C ATOM 262 CD GLN A 18 -9.156 5.036 7.263 1.00 0.00 C ATOM 263 OE1 GLN A 18 -10.214 4.687 7.788 1.00 0.00 O ATOM 264 NE2 GLN A 18 -9.103 5.945 6.296 1.00 0.00 N ATOM 0 H GLN A 18 -5.257 3.790 7.628 1.00 0.00 H new ATOM 0 HA GLN A 18 -7.043 2.034 8.838 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.114 3.274 6.058 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -8.494 2.575 6.883 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -7.838 4.311 8.785 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -7.028 5.133 7.466 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -8.205 6.205 5.889 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -9.961 6.383 5.961 1.00 0.00 H new ATOM 273 N LEU A 19 -5.497 0.774 6.240 1.00 0.00 N ATOM 274 CA LEU A 19 -5.243 -0.461 5.505 1.00 0.00 C ATOM 275 C LEU A 19 -4.615 -1.515 6.411 1.00 0.00 C ATOM 276 O LEU A 19 -4.934 -2.699 6.313 1.00 0.00 O ATOM 277 CB LEU A 19 -4.328 -0.186 4.311 1.00 0.00 C ATOM 278 CG LEU A 19 -4.873 0.773 3.252 1.00 0.00 C ATOM 279 CD1 LEU A 19 -3.747 1.304 2.381 1.00 0.00 C ATOM 280 CD2 LEU A 19 -5.929 0.083 2.401 1.00 0.00 C ATOM 0 H LEU A 19 -4.885 1.549 5.986 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.197 -0.843 5.143 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.387 0.216 4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.099 -1.136 3.828 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.339 1.617 3.760 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.155 1.985 1.634 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.027 1.837 3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.250 0.472 1.881 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.306 0.780 1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.488 -0.780 1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.751 -0.246 3.037 1.00 0.00 H new ATOM 292 N GLN A 20 -3.723 -1.074 7.292 1.00 0.00 N ATOM 293 CA GLN A 20 -3.052 -1.981 8.217 1.00 0.00 C ATOM 294 C GLN A 20 -4.065 -2.734 9.073 1.00 0.00 C ATOM 295 O GLN A 20 -3.911 -3.928 9.325 1.00 0.00 O ATOM 296 CB GLN A 20 -2.086 -1.205 9.114 1.00 0.00 C ATOM 297 CG GLN A 20 -0.694 -1.055 8.522 1.00 0.00 C ATOM 298 CD GLN A 20 0.210 -2.227 8.851 1.00 0.00 C ATOM 299 OE1 GLN A 20 -0.257 -3.351 9.041 1.00 0.00 O ATOM 300 NE2 GLN A 20 1.510 -1.971 8.921 1.00 0.00 N ATOM 0 H GLN A 20 -3.448 -0.096 7.385 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.489 -2.707 7.630 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.498 -0.215 9.307 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -2.010 -1.712 10.076 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.773 -0.955 7.439 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -0.242 -0.136 8.895 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.853 -1.025 8.756 1.00 0.00 H new ATOM 0 HE22 GLN A 20 2.166 -2.721 9.140 1.00 0.00 H new ATOM 309 N GLU A 21 -5.100 -2.027 9.516 1.00 0.00 N ATOM 310 CA GLU A 21 -6.137 -2.630 10.344 1.00 0.00 C ATOM 311 C GLU A 21 -6.538 -3.999 9.804 1.00 0.00 C ATOM 312 O GLU A 21 -7.013 -4.859 10.547 1.00 0.00 O ATOM 313 CB GLU A 21 -7.363 -1.717 10.412 1.00 0.00 C ATOM 314 CG GLU A 21 -7.068 -0.344 10.994 1.00 0.00 C ATOM 315 CD GLU A 21 -6.593 -0.410 12.431 1.00 0.00 C ATOM 316 OE1 GLU A 21 -5.405 -0.725 12.651 1.00 0.00 O ATOM 317 OE2 GLU A 21 -7.410 -0.146 13.339 1.00 0.00 O ATOM 0 H GLU A 21 -5.242 -1.037 9.315 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.733 -2.759 11.348 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.772 -1.597 9.409 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.132 -2.200 11.014 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.309 0.148 10.387 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.967 0.270 10.940 1.00 0.00 H new ATOM 324 N LYS A 22 -6.346 -4.195 8.504 1.00 0.00 N ATOM 325 CA LYS A 22 -6.685 -5.459 7.861 1.00 0.00 C ATOM 326 C LYS A 22 -5.604 -6.504 8.111 1.00 0.00 C ATOM 327 O LYS A 22 -5.899 -7.688 8.281 1.00 0.00 O ATOM 328 CB LYS A 22 -6.873 -5.254 6.356 1.00 0.00 C ATOM 329 CG LYS A 22 -7.907 -4.196 6.010 1.00 0.00 C ATOM 330 CD LYS A 22 -9.240 -4.476 6.684 1.00 0.00 C ATOM 331 CE LYS A 22 -10.251 -3.377 6.399 1.00 0.00 C ATOM 332 NZ LYS A 22 -11.651 -3.855 6.564 1.00 0.00 N ATOM 0 H LYS A 22 -5.957 -3.493 7.874 1.00 0.00 H new ATOM 0 HA LYS A 22 -7.619 -5.819 8.293 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.917 -4.974 5.914 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.168 -6.200 5.903 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.542 -3.216 6.317 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -8.045 -4.161 4.929 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.632 -5.431 6.335 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.093 -4.566 7.760 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.073 -2.537 7.070 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.110 -3.009 5.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.276 -3.328 5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.700 -4.869 6.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.956 -3.702 7.546 1.00 0.00 H new ATOM 346 N ASP A 23 -4.353 -6.061 8.134 1.00 0.00 N ATOM 347 CA ASP A 23 -3.228 -6.959 8.366 1.00 0.00 C ATOM 348 C ASP A 23 -3.292 -7.561 9.766 1.00 0.00 C ATOM 349 O ASP A 23 -3.261 -6.841 10.766 1.00 0.00 O ATOM 350 CB ASP A 23 -1.905 -6.214 8.178 1.00 0.00 C ATOM 351 CG ASP A 23 -0.768 -6.845 8.959 1.00 0.00 C ATOM 352 OD1 ASP A 23 -0.412 -8.001 8.654 1.00 0.00 O ATOM 353 OD2 ASP A 23 -0.236 -6.182 9.874 1.00 0.00 O ATOM 0 H ASP A 23 -4.092 -5.085 7.995 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.287 -7.769 7.639 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -1.649 -6.197 7.119 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.027 -5.178 8.493 1.00 0.00 H new ATOM 358 N THR A 24 -3.383 -8.885 9.833 1.00 0.00 N ATOM 359 CA THR A 24 -3.455 -9.583 11.110 1.00 0.00 C ATOM 360 C THR A 24 -2.212 -10.434 11.342 1.00 0.00 C ATOM 361 O THR A 24 -1.681 -10.486 12.451 1.00 0.00 O ATOM 362 CB THR A 24 -4.702 -10.485 11.189 1.00 0.00 C ATOM 363 OG1 THR A 24 -4.635 -11.501 10.182 1.00 0.00 O ATOM 364 CG2 THR A 24 -5.972 -9.667 11.008 1.00 0.00 C ATOM 0 H THR A 24 -3.409 -9.496 9.017 1.00 0.00 H new ATOM 0 HA THR A 24 -3.519 -8.818 11.884 1.00 0.00 H new ATOM 0 HB THR A 24 -4.726 -10.951 12.174 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.430 -12.071 10.239 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.840 -10.324 11.067 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.034 -8.913 11.792 1.00 0.00 H new ATOM 0 HG23 THR A 24 -5.954 -9.177 10.034 1.00 0.00 H new ATOM 372 N GLY A 25 -1.751 -11.100 10.288 1.00 0.00 N ATOM 373 CA GLY A 25 -0.572 -11.939 10.397 1.00 0.00 C ATOM 374 C GLY A 25 0.716 -11.141 10.342 1.00 0.00 C ATOM 375 O GLY A 25 1.806 -11.711 10.300 1.00 0.00 O ATOM 0 H GLY A 25 -2.173 -11.073 9.360 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.611 -12.495 11.334 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.576 -12.672 9.590 1.00 0.00 H new ATOM 379 N ASN A 26 0.590 -9.819 10.340 1.00 0.00 N ATOM 380 CA ASN A 26 1.754 -8.941 10.286 1.00 0.00 C ATOM 381 C ASN A 26 2.737 -9.406 9.217 1.00 0.00 C ATOM 382 O ASN A 26 3.951 -9.397 9.429 1.00 0.00 O ATOM 383 CB ASN A 26 2.448 -8.896 11.649 1.00 0.00 C ATOM 384 CG ASN A 26 2.584 -10.271 12.274 1.00 0.00 C ATOM 385 OD1 ASN A 26 1.643 -10.787 12.877 1.00 0.00 O ATOM 386 ND2 ASN A 26 3.760 -10.871 12.131 1.00 0.00 N ATOM 0 H ASN A 26 -0.305 -9.331 10.375 1.00 0.00 H new ATOM 0 HA ASN A 26 1.411 -7.939 10.027 1.00 0.00 H new ATOM 0 HB2 ASN A 26 3.437 -8.452 11.536 1.00 0.00 H new ATOM 0 HB3 ASN A 26 1.883 -8.249 12.320 1.00 0.00 H new ATOM 0 HD21 ASN A 26 3.911 -11.798 12.529 1.00 0.00 H new ATOM 0 HD22 ASN A 26 4.512 -10.405 11.623 1.00 0.00 H new ATOM 393 N ILE A 27 2.206 -9.810 8.068 1.00 0.00 N ATOM 394 CA ILE A 27 3.036 -10.277 6.965 1.00 0.00 C ATOM 395 C ILE A 27 3.510 -9.111 6.102 1.00 0.00 C ATOM 396 O ILE A 27 4.639 -9.107 5.611 1.00 0.00 O ATOM 397 CB ILE A 27 2.282 -11.284 6.078 1.00 0.00 C ATOM 398 CG1 ILE A 27 1.787 -12.465 6.916 1.00 0.00 C ATOM 399 CG2 ILE A 27 3.176 -11.768 4.948 1.00 0.00 C ATOM 400 CD1 ILE A 27 0.862 -13.395 6.164 1.00 0.00 C ATOM 0 H ILE A 27 1.204 -9.823 7.877 1.00 0.00 H new ATOM 0 HA ILE A 27 3.899 -10.773 7.409 1.00 0.00 H new ATOM 0 HB ILE A 27 1.417 -10.784 5.642 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.647 -13.032 7.273 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.269 -12.084 7.796 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.628 -12.479 4.330 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.483 -10.919 4.338 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.058 -12.254 5.365 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.551 -14.208 6.820 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.016 -12.843 5.830 1.00 0.00 H new ATOM 0 HD13 ILE A 27 1.383 -13.806 5.299 1.00 0.00 H new ATOM 412 N PHE A 28 2.640 -8.124 5.923 1.00 0.00 N ATOM 413 CA PHE A 28 2.968 -6.951 5.120 1.00 0.00 C ATOM 414 C PHE A 28 3.377 -5.780 6.009 1.00 0.00 C ATOM 415 O PHE A 28 3.951 -4.799 5.536 1.00 0.00 O ATOM 416 CB PHE A 28 1.775 -6.553 4.250 1.00 0.00 C ATOM 417 CG PHE A 28 1.000 -7.726 3.721 1.00 0.00 C ATOM 418 CD1 PHE A 28 -0.029 -8.284 4.462 1.00 0.00 C ATOM 419 CD2 PHE A 28 1.300 -8.269 2.482 1.00 0.00 C ATOM 420 CE1 PHE A 28 -0.743 -9.364 3.978 1.00 0.00 C ATOM 421 CE2 PHE A 28 0.589 -9.349 1.993 1.00 0.00 C ATOM 422 CZ PHE A 28 -0.434 -9.896 2.741 1.00 0.00 C ATOM 0 H PHE A 28 1.702 -8.112 6.323 1.00 0.00 H new ATOM 0 HA PHE A 28 3.809 -7.206 4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.106 -5.919 4.832 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.131 -5.955 3.411 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -0.276 -7.871 5.429 1.00 0.00 H new ATOM 0 HD2 PHE A 28 2.098 -7.844 1.892 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.542 -9.792 4.566 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.834 -9.764 1.027 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.992 -10.739 2.360 1.00 0.00 H new ATOM 432 N SER A 29 3.078 -5.892 7.300 1.00 0.00 N ATOM 433 CA SER A 29 3.410 -4.842 8.254 1.00 0.00 C ATOM 434 C SER A 29 4.920 -4.650 8.348 1.00 0.00 C ATOM 435 O SER A 29 5.399 -3.694 8.957 1.00 0.00 O ATOM 436 CB SER A 29 2.840 -5.179 9.634 1.00 0.00 C ATOM 437 OG SER A 29 2.525 -4.002 10.357 1.00 0.00 O ATOM 0 H SER A 29 2.607 -6.699 7.708 1.00 0.00 H new ATOM 0 HA SER A 29 2.965 -3.911 7.902 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.945 -5.791 9.522 1.00 0.00 H new ATOM 0 HB3 SER A 29 3.563 -5.771 10.195 1.00 0.00 H new ATOM 0 HG SER A 29 2.161 -4.244 11.234 1.00 0.00 H new ATOM 443 N GLU A 30 5.666 -5.569 7.740 1.00 0.00 N ATOM 444 CA GLU A 30 7.123 -5.501 7.757 1.00 0.00 C ATOM 445 C GLU A 30 7.703 -5.964 6.422 1.00 0.00 C ATOM 446 O GLU A 30 7.113 -6.775 5.708 1.00 0.00 O ATOM 447 CB GLU A 30 7.682 -6.359 8.893 1.00 0.00 C ATOM 448 CG GLU A 30 6.994 -6.125 10.227 1.00 0.00 C ATOM 449 CD GLU A 30 7.891 -6.441 11.409 1.00 0.00 C ATOM 450 OE1 GLU A 30 8.558 -7.496 11.382 1.00 0.00 O ATOM 451 OE2 GLU A 30 7.925 -5.633 12.361 1.00 0.00 O ATOM 0 H GLU A 30 5.286 -6.367 7.231 1.00 0.00 H new ATOM 0 HA GLU A 30 7.412 -4.463 7.920 1.00 0.00 H new ATOM 0 HB2 GLU A 30 7.586 -7.411 8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 30 8.747 -6.154 9.002 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.671 -5.086 10.288 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.096 -6.741 10.282 1.00 0.00 H new ATOM 458 N PRO A 31 8.887 -5.436 6.078 1.00 0.00 N ATOM 459 CA PRO A 31 9.573 -5.780 4.830 1.00 0.00 C ATOM 460 C PRO A 31 10.101 -7.210 4.833 1.00 0.00 C ATOM 461 O PRO A 31 10.605 -7.694 5.846 1.00 0.00 O ATOM 462 CB PRO A 31 10.732 -4.781 4.776 1.00 0.00 C ATOM 463 CG PRO A 31 10.985 -4.418 6.198 1.00 0.00 C ATOM 464 CD PRO A 31 9.647 -4.463 6.882 1.00 0.00 C ATOM 0 HA PRO A 31 8.906 -5.727 3.970 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.616 -5.224 4.317 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.471 -3.904 4.184 1.00 0.00 H new ATOM 0 HG2 PRO A 31 11.683 -5.116 6.660 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.429 -3.425 6.274 1.00 0.00 H new ATOM 0 HD2 PRO A 31 9.737 -4.782 7.920 1.00 0.00 H new ATOM 0 HD3 PRO A 31 9.166 -3.485 6.890 1.00 0.00 H new ATOM 472 N VAL A 32 9.983 -7.882 3.692 1.00 0.00 N ATOM 473 CA VAL A 32 10.451 -9.257 3.563 1.00 0.00 C ATOM 474 C VAL A 32 11.974 -9.324 3.576 1.00 0.00 C ATOM 475 O VAL A 32 12.654 -8.706 2.757 1.00 0.00 O ATOM 476 CB VAL A 32 9.931 -9.907 2.266 1.00 0.00 C ATOM 477 CG1 VAL A 32 10.451 -11.330 2.136 1.00 0.00 C ATOM 478 CG2 VAL A 32 8.411 -9.881 2.230 1.00 0.00 C ATOM 0 H VAL A 32 9.567 -7.497 2.844 1.00 0.00 H new ATOM 0 HA VAL A 32 10.059 -9.806 4.419 1.00 0.00 H new ATOM 0 HB VAL A 32 10.302 -9.332 1.418 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.073 -11.773 1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.541 -11.319 2.113 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.112 -11.920 2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.061 -10.344 1.307 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.017 -10.432 3.084 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.064 -8.849 2.272 1.00 0.00 H new ATOM 488 N PRO A 33 12.524 -10.090 4.529 1.00 0.00 N ATOM 489 CA PRO A 33 13.973 -10.257 4.673 1.00 0.00 C ATOM 490 C PRO A 33 14.579 -11.069 3.533 1.00 0.00 C ATOM 491 O PRO A 33 13.958 -12.002 3.025 1.00 0.00 O ATOM 492 CB PRO A 33 14.114 -11.010 5.999 1.00 0.00 C ATOM 493 CG PRO A 33 12.822 -11.733 6.163 1.00 0.00 C ATOM 494 CD PRO A 33 11.773 -10.854 5.540 1.00 0.00 C ATOM 0 HA PRO A 33 14.497 -9.301 4.652 1.00 0.00 H new ATOM 0 HB2 PRO A 33 14.955 -11.703 5.973 1.00 0.00 H new ATOM 0 HB3 PRO A 33 14.292 -10.324 6.827 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.855 -12.707 5.675 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.606 -11.912 7.216 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.974 -11.441 5.088 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.309 -10.198 6.277 1.00 0.00 H new ATOM 502 N LEU A 34 15.794 -10.707 3.136 1.00 0.00 N ATOM 503 CA LEU A 34 16.485 -11.403 2.057 1.00 0.00 C ATOM 504 C LEU A 34 17.178 -12.659 2.573 1.00 0.00 C ATOM 505 O LEU A 34 17.382 -13.618 1.829 1.00 0.00 O ATOM 506 CB LEU A 34 17.508 -10.476 1.398 1.00 0.00 C ATOM 507 CG LEU A 34 16.937 -9.278 0.638 1.00 0.00 C ATOM 508 CD1 LEU A 34 18.057 -8.448 0.031 1.00 0.00 C ATOM 509 CD2 LEU A 34 15.970 -9.742 -0.440 1.00 0.00 C ATOM 0 H LEU A 34 16.321 -9.935 3.545 1.00 0.00 H new ATOM 0 HA LEU A 34 15.742 -11.700 1.316 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.181 -10.104 2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.110 -11.066 0.707 1.00 0.00 H new ATOM 0 HG LEU A 34 16.390 -8.652 1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.632 -7.600 -0.506 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.711 -8.085 0.824 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.632 -9.064 -0.661 1.00 0.00 H new ATOM 0 HD21 LEU A 34 15.574 -8.876 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 34 16.493 -10.390 -1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.149 -10.293 0.020 1.00 0.00 H new ATOM 521 N SER A 35 17.536 -12.647 3.854 1.00 0.00 N ATOM 522 CA SER A 35 18.208 -13.785 4.470 1.00 0.00 C ATOM 523 C SER A 35 17.516 -15.093 4.096 1.00 0.00 C ATOM 524 O SER A 35 18.171 -16.083 3.775 1.00 0.00 O ATOM 525 CB SER A 35 18.235 -13.625 5.991 1.00 0.00 C ATOM 526 OG SER A 35 19.262 -12.735 6.393 1.00 0.00 O ATOM 0 H SER A 35 17.372 -11.862 4.484 1.00 0.00 H new ATOM 0 HA SER A 35 19.232 -13.817 4.097 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.271 -13.253 6.338 1.00 0.00 H new ATOM 0 HB3 SER A 35 18.388 -14.597 6.459 1.00 0.00 H new ATOM 0 HG SER A 35 19.257 -12.649 7.369 1.00 0.00 H new ATOM 532 N GLU A 36 16.188 -15.085 4.141 1.00 0.00 N ATOM 533 CA GLU A 36 15.407 -16.271 3.809 1.00 0.00 C ATOM 534 C GLU A 36 15.028 -16.276 2.331 1.00 0.00 C ATOM 535 O GLU A 36 14.709 -17.320 1.763 1.00 0.00 O ATOM 536 CB GLU A 36 14.144 -16.336 4.671 1.00 0.00 C ATOM 537 CG GLU A 36 13.439 -17.680 4.619 1.00 0.00 C ATOM 538 CD GLU A 36 12.651 -17.975 5.880 1.00 0.00 C ATOM 539 OE1 GLU A 36 13.137 -17.627 6.977 1.00 0.00 O ATOM 540 OE2 GLU A 36 11.550 -18.553 5.771 1.00 0.00 O ATOM 0 H GLU A 36 15.631 -14.272 4.404 1.00 0.00 H new ATOM 0 HA GLU A 36 16.022 -17.148 4.012 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.408 -16.114 5.705 1.00 0.00 H new ATOM 0 HB3 GLU A 36 13.452 -15.560 4.345 1.00 0.00 H new ATOM 0 HG2 GLU A 36 12.766 -17.700 3.762 1.00 0.00 H new ATOM 0 HG3 GLU A 36 14.177 -18.467 4.464 1.00 0.00 H new ATOM 547 N VAL A 37 15.065 -15.100 1.713 1.00 0.00 N ATOM 548 CA VAL A 37 14.726 -14.967 0.301 1.00 0.00 C ATOM 549 C VAL A 37 15.844 -14.272 -0.469 1.00 0.00 C ATOM 550 O VAL A 37 15.823 -13.059 -0.683 1.00 0.00 O ATOM 551 CB VAL A 37 13.418 -14.177 0.110 1.00 0.00 C ATOM 552 CG1 VAL A 37 12.751 -14.558 -1.205 1.00 0.00 C ATOM 553 CG2 VAL A 37 12.477 -14.414 1.282 1.00 0.00 C ATOM 0 H VAL A 37 15.326 -14.225 2.168 1.00 0.00 H new ATOM 0 HA VAL A 37 14.592 -15.976 -0.089 1.00 0.00 H new ATOM 0 HB VAL A 37 13.657 -13.114 0.074 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.828 -13.990 -1.323 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.424 -14.333 -2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.523 -15.624 -1.202 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.558 -13.848 1.131 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.242 -15.476 1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.956 -14.088 2.205 1.00 0.00 H new ATOM 563 N PRO A 38 16.843 -15.057 -0.898 1.00 0.00 N ATOM 564 CA PRO A 38 17.988 -14.538 -1.653 1.00 0.00 C ATOM 565 C PRO A 38 17.602 -14.095 -3.059 1.00 0.00 C ATOM 566 O PRO A 38 18.328 -13.337 -3.703 1.00 0.00 O ATOM 567 CB PRO A 38 18.944 -15.732 -1.711 1.00 0.00 C ATOM 568 CG PRO A 38 18.065 -16.928 -1.576 1.00 0.00 C ATOM 569 CD PRO A 38 16.933 -16.510 -0.679 1.00 0.00 C ATOM 0 HA PRO A 38 18.418 -13.653 -1.185 1.00 0.00 H new ATOM 0 HB2 PRO A 38 19.497 -15.751 -2.650 1.00 0.00 H new ATOM 0 HB3 PRO A 38 19.680 -15.689 -0.908 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.694 -17.251 -2.548 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.612 -17.768 -1.148 1.00 0.00 H new ATOM 0 HD2 PRO A 38 16.004 -17.015 -0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 38 17.139 -16.747 0.365 1.00 0.00 H new ATOM 577 N ASP A 39 16.457 -14.572 -3.531 1.00 0.00 N ATOM 578 CA ASP A 39 15.973 -14.223 -4.863 1.00 0.00 C ATOM 579 C ASP A 39 14.679 -13.419 -4.777 1.00 0.00 C ATOM 580 O ASP A 39 13.832 -13.493 -5.668 1.00 0.00 O ATOM 581 CB ASP A 39 15.749 -15.487 -5.694 1.00 0.00 C ATOM 582 CG ASP A 39 17.050 -16.115 -6.154 1.00 0.00 C ATOM 583 OD1 ASP A 39 17.666 -16.856 -5.359 1.00 0.00 O ATOM 584 OD2 ASP A 39 17.453 -15.868 -7.309 1.00 0.00 O ATOM 0 H ASP A 39 15.845 -15.202 -3.012 1.00 0.00 H new ATOM 0 HA ASP A 39 16.730 -13.608 -5.349 1.00 0.00 H new ATOM 0 HB2 ASP A 39 15.188 -16.212 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 39 15.139 -15.243 -6.564 1.00 0.00 H new ATOM 589 N TYR A 40 14.533 -12.654 -3.702 1.00 0.00 N ATOM 590 CA TYR A 40 13.341 -11.839 -3.499 1.00 0.00 C ATOM 591 C TYR A 40 13.130 -10.882 -4.668 1.00 0.00 C ATOM 592 O TYR A 40 12.105 -10.931 -5.348 1.00 0.00 O ATOM 593 CB TYR A 40 13.454 -11.049 -2.194 1.00 0.00 C ATOM 594 CG TYR A 40 12.245 -10.193 -1.898 1.00 0.00 C ATOM 595 CD1 TYR A 40 10.958 -10.682 -2.090 1.00 0.00 C ATOM 596 CD2 TYR A 40 12.387 -8.894 -1.424 1.00 0.00 C ATOM 597 CE1 TYR A 40 9.850 -9.903 -1.822 1.00 0.00 C ATOM 598 CE2 TYR A 40 11.284 -8.108 -1.152 1.00 0.00 C ATOM 599 CZ TYR A 40 10.018 -8.617 -1.353 1.00 0.00 C ATOM 600 OH TYR A 40 8.916 -7.837 -1.084 1.00 0.00 O ATOM 0 H TYR A 40 15.226 -12.581 -2.957 1.00 0.00 H new ATOM 0 HA TYR A 40 12.481 -12.507 -3.439 1.00 0.00 H new ATOM 0 HB2 TYR A 40 13.606 -11.746 -1.370 1.00 0.00 H new ATOM 0 HB3 TYR A 40 14.337 -10.412 -2.240 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.822 -11.689 -2.455 1.00 0.00 H new ATOM 0 HD2 TYR A 40 13.377 -8.492 -1.266 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.857 -10.299 -1.979 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.412 -7.101 -0.784 1.00 0.00 H new ATOM 0 HH TYR A 40 9.208 -6.959 -0.760 1.00 0.00 H new ATOM 610 N LEU A 41 14.109 -10.013 -4.897 1.00 0.00 N ATOM 611 CA LEU A 41 14.032 -9.044 -5.985 1.00 0.00 C ATOM 612 C LEU A 41 14.044 -9.744 -7.341 1.00 0.00 C ATOM 613 O LEU A 41 13.322 -9.354 -8.259 1.00 0.00 O ATOM 614 CB LEU A 41 15.198 -8.057 -5.899 1.00 0.00 C ATOM 615 CG LEU A 41 15.461 -7.449 -4.520 1.00 0.00 C ATOM 616 CD1 LEU A 41 16.783 -6.698 -4.513 1.00 0.00 C ATOM 617 CD2 LEU A 41 14.320 -6.529 -4.116 1.00 0.00 C ATOM 0 H LEU A 41 14.965 -9.960 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 41 13.093 -8.499 -5.886 1.00 0.00 H new ATOM 0 HB2 LEU A 41 16.104 -8.566 -6.229 1.00 0.00 H new ATOM 0 HB3 LEU A 41 15.014 -7.245 -6.603 1.00 0.00 H new ATOM 0 HG LEU A 41 15.522 -8.258 -3.792 1.00 0.00 H new ATOM 0 HD11 LEU A 41 16.954 -6.272 -3.524 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.593 -7.385 -4.757 1.00 0.00 H new ATOM 0 HD13 LEU A 41 16.751 -5.898 -5.252 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.525 -6.106 -3.133 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.226 -5.724 -4.845 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.390 -7.097 -4.080 1.00 0.00 H new ATOM 629 N ASP A 42 14.865 -10.782 -7.457 1.00 0.00 N ATOM 630 CA ASP A 42 14.968 -11.540 -8.699 1.00 0.00 C ATOM 631 C ASP A 42 13.602 -11.684 -9.362 1.00 0.00 C ATOM 632 O ASP A 42 13.495 -11.708 -10.588 1.00 0.00 O ATOM 633 CB ASP A 42 15.567 -12.921 -8.430 1.00 0.00 C ATOM 634 CG ASP A 42 17.067 -12.871 -8.218 1.00 0.00 C ATOM 635 OD1 ASP A 42 17.516 -12.118 -7.327 1.00 0.00 O ATOM 636 OD2 ASP A 42 17.792 -13.583 -8.942 1.00 0.00 O ATOM 0 H ASP A 42 15.469 -11.118 -6.707 1.00 0.00 H new ATOM 0 HA ASP A 42 15.625 -10.994 -9.376 1.00 0.00 H new ATOM 0 HB2 ASP A 42 15.093 -13.354 -7.549 1.00 0.00 H new ATOM 0 HB3 ASP A 42 15.343 -13.580 -9.269 1.00 0.00 H new ATOM 641 N HIS A 43 12.559 -11.781 -8.543 1.00 0.00 N ATOM 642 CA HIS A 43 11.199 -11.924 -9.050 1.00 0.00 C ATOM 643 C HIS A 43 10.410 -10.631 -8.864 1.00 0.00 C ATOM 644 O HIS A 43 9.539 -10.302 -9.670 1.00 0.00 O ATOM 645 CB HIS A 43 10.486 -13.076 -8.342 1.00 0.00 C ATOM 646 CG HIS A 43 11.000 -14.429 -8.731 1.00 0.00 C ATOM 647 ND1 HIS A 43 10.317 -15.279 -9.574 1.00 0.00 N ATOM 648 CD2 HIS A 43 12.139 -15.075 -8.388 1.00 0.00 C ATOM 649 CE1 HIS A 43 11.013 -16.391 -9.732 1.00 0.00 C ATOM 650 NE2 HIS A 43 12.122 -16.293 -9.023 1.00 0.00 N ATOM 0 H HIS A 43 12.630 -11.763 -7.526 1.00 0.00 H new ATOM 0 HA HIS A 43 11.257 -12.143 -10.116 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.594 -12.952 -7.264 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.420 -13.024 -8.564 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.916 -14.702 -7.737 1.00 0.00 H new ATOM 0 HE1 HIS A 43 10.724 -17.237 -10.338 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.848 -17.006 -8.957 1.00 0.00 H new ATOM 659 N ILE A 44 10.722 -9.903 -7.797 1.00 0.00 N ATOM 660 CA ILE A 44 10.043 -8.646 -7.506 1.00 0.00 C ATOM 661 C ILE A 44 10.879 -7.452 -7.955 1.00 0.00 C ATOM 662 O ILE A 44 12.031 -7.300 -7.550 1.00 0.00 O ATOM 663 CB ILE A 44 9.737 -8.507 -6.003 1.00 0.00 C ATOM 664 CG1 ILE A 44 8.751 -9.590 -5.558 1.00 0.00 C ATOM 665 CG2 ILE A 44 9.183 -7.123 -5.701 1.00 0.00 C ATOM 666 CD1 ILE A 44 7.550 -9.723 -6.467 1.00 0.00 C ATOM 0 H ILE A 44 11.440 -10.162 -7.120 1.00 0.00 H new ATOM 0 HA ILE A 44 9.105 -8.659 -8.061 1.00 0.00 H new ATOM 0 HB ILE A 44 10.665 -8.635 -5.445 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.271 -10.547 -5.513 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.409 -9.366 -4.548 1.00 0.00 H new ATOM 0 HG21 ILE A 44 8.972 -7.040 -4.635 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.916 -6.368 -5.985 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.264 -6.968 -6.266 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.894 -10.509 -6.091 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.007 -8.778 -6.493 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.882 -9.978 -7.473 1.00 0.00 H new ATOM 678 N LYS A 45 10.289 -6.608 -8.794 1.00 0.00 N ATOM 679 CA LYS A 45 10.977 -5.425 -9.299 1.00 0.00 C ATOM 680 C LYS A 45 10.873 -4.271 -8.306 1.00 0.00 C ATOM 681 O LYS A 45 11.822 -3.508 -8.122 1.00 0.00 O ATOM 682 CB LYS A 45 10.391 -5.005 -10.648 1.00 0.00 C ATOM 683 CG LYS A 45 10.816 -5.899 -11.800 1.00 0.00 C ATOM 684 CD LYS A 45 10.000 -7.181 -11.841 1.00 0.00 C ATOM 685 CE LYS A 45 10.662 -8.234 -12.717 1.00 0.00 C ATOM 686 NZ LYS A 45 9.720 -9.333 -13.070 1.00 0.00 N ATOM 0 H LYS A 45 9.336 -6.721 -9.139 1.00 0.00 H new ATOM 0 HA LYS A 45 12.030 -5.676 -9.430 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.303 -5.008 -10.579 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.694 -3.980 -10.863 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.699 -5.362 -12.741 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.874 -6.143 -11.702 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.880 -7.570 -10.830 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.001 -6.966 -12.220 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.033 -7.767 -13.629 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.526 -8.649 -12.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.208 -10.030 -13.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.385 -9.796 -12.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.908 -8.941 -13.589 1.00 0.00 H new ATOM 700 N LYS A 46 9.714 -4.149 -7.667 1.00 0.00 N ATOM 701 CA LYS A 46 9.485 -3.091 -6.691 1.00 0.00 C ATOM 702 C LYS A 46 8.920 -3.660 -5.394 1.00 0.00 C ATOM 703 O LYS A 46 7.706 -3.737 -5.198 1.00 0.00 O ATOM 704 CB LYS A 46 8.527 -2.042 -7.260 1.00 0.00 C ATOM 705 CG LYS A 46 9.207 -1.022 -8.157 1.00 0.00 C ATOM 706 CD LYS A 46 8.214 -0.006 -8.698 1.00 0.00 C ATOM 707 CE LYS A 46 7.744 0.949 -7.610 1.00 0.00 C ATOM 708 NZ LYS A 46 7.117 2.173 -8.180 1.00 0.00 N ATOM 0 H LYS A 46 8.918 -4.771 -7.808 1.00 0.00 H new ATOM 0 HA LYS A 46 10.443 -2.619 -6.473 1.00 0.00 H new ATOM 0 HB2 LYS A 46 7.744 -2.546 -7.826 1.00 0.00 H new ATOM 0 HB3 LYS A 46 8.040 -1.521 -6.435 1.00 0.00 H new ATOM 0 HG2 LYS A 46 9.988 -0.507 -7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.694 -1.533 -8.987 1.00 0.00 H new ATOM 0 HD2 LYS A 46 8.676 0.561 -9.506 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.355 -0.526 -9.123 1.00 0.00 H new ATOM 0 HE2 LYS A 46 7.027 0.440 -6.965 1.00 0.00 H new ATOM 0 HE3 LYS A 46 8.591 1.232 -6.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 6.810 2.798 -7.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 7.808 2.672 -8.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 6.294 1.905 -8.756 1.00 0.00 H new ATOM 722 N PRO A 47 9.818 -4.066 -4.483 1.00 0.00 N ATOM 723 CA PRO A 47 9.432 -4.633 -3.188 1.00 0.00 C ATOM 724 C PRO A 47 8.816 -3.591 -2.260 1.00 0.00 C ATOM 725 O PRO A 47 9.520 -2.947 -1.482 1.00 0.00 O ATOM 726 CB PRO A 47 10.755 -5.145 -2.615 1.00 0.00 C ATOM 727 CG PRO A 47 11.800 -4.309 -3.272 1.00 0.00 C ATOM 728 CD PRO A 47 11.280 -4.002 -4.649 1.00 0.00 C ATOM 0 HA PRO A 47 8.671 -5.406 -3.292 1.00 0.00 H new ATOM 0 HB2 PRO A 47 10.785 -5.037 -1.531 1.00 0.00 H new ATOM 0 HB3 PRO A 47 10.899 -6.203 -2.834 1.00 0.00 H new ATOM 0 HG2 PRO A 47 11.978 -3.393 -2.709 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.750 -4.841 -3.323 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.603 -3.019 -4.991 1.00 0.00 H new ATOM 0 HD3 PRO A 47 11.633 -4.726 -5.383 1.00 0.00 H new ATOM 736 N MET A 48 7.500 -3.431 -2.346 1.00 0.00 N ATOM 737 CA MET A 48 6.791 -2.469 -1.512 1.00 0.00 C ATOM 738 C MET A 48 6.243 -3.137 -0.256 1.00 0.00 C ATOM 739 O MET A 48 6.022 -4.348 -0.231 1.00 0.00 O ATOM 740 CB MET A 48 5.648 -1.823 -2.299 1.00 0.00 C ATOM 741 CG MET A 48 5.097 -0.565 -1.649 1.00 0.00 C ATOM 742 SD MET A 48 6.372 0.670 -1.332 1.00 0.00 S ATOM 743 CE MET A 48 7.184 0.734 -2.927 1.00 0.00 C ATOM 0 H MET A 48 6.903 -3.956 -2.985 1.00 0.00 H new ATOM 0 HA MET A 48 7.499 -1.696 -1.212 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.000 -1.580 -3.301 1.00 0.00 H new ATOM 0 HB3 MET A 48 4.841 -2.547 -2.412 1.00 0.00 H new ATOM 0 HG2 MET A 48 4.331 -0.133 -2.294 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.611 -0.829 -0.710 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.725 1.675 -3.022 1.00 0.00 H new ATOM 0 HE2 MET A 48 7.884 -0.097 -3.013 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.438 0.663 -3.718 1.00 0.00 H new ATOM 753 N ASP A 49 6.026 -2.342 0.786 1.00 0.00 N ATOM 754 CA ASP A 49 5.503 -2.857 2.046 1.00 0.00 C ATOM 755 C ASP A 49 4.760 -1.768 2.812 1.00 0.00 C ATOM 756 O ASP A 49 4.689 -0.621 2.370 1.00 0.00 O ATOM 757 CB ASP A 49 6.640 -3.416 2.904 1.00 0.00 C ATOM 758 CG ASP A 49 7.469 -4.448 2.167 1.00 0.00 C ATOM 759 OD1 ASP A 49 8.433 -4.053 1.477 1.00 0.00 O ATOM 760 OD2 ASP A 49 7.155 -5.651 2.280 1.00 0.00 O ATOM 0 H ASP A 49 6.204 -1.338 0.783 1.00 0.00 H new ATOM 0 HA ASP A 49 4.801 -3.659 1.819 1.00 0.00 H new ATOM 0 HB2 ASP A 49 7.285 -2.598 3.225 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.224 -3.865 3.805 1.00 0.00 H new ATOM 765 N PHE A 50 4.205 -2.134 3.962 1.00 0.00 N ATOM 766 CA PHE A 50 3.464 -1.189 4.789 1.00 0.00 C ATOM 767 C PHE A 50 4.403 -0.164 5.418 1.00 0.00 C ATOM 768 O PHE A 50 4.063 1.013 5.540 1.00 0.00 O ATOM 769 CB PHE A 50 2.693 -1.930 5.883 1.00 0.00 C ATOM 770 CG PHE A 50 1.317 -2.362 5.462 1.00 0.00 C ATOM 771 CD1 PHE A 50 0.473 -1.482 4.804 1.00 0.00 C ATOM 772 CD2 PHE A 50 0.869 -3.646 5.722 1.00 0.00 C ATOM 773 CE1 PHE A 50 -0.794 -1.875 4.414 1.00 0.00 C ATOM 774 CE2 PHE A 50 -0.396 -4.046 5.334 1.00 0.00 C ATOM 775 CZ PHE A 50 -1.229 -3.159 4.680 1.00 0.00 C ATOM 0 H PHE A 50 4.254 -3.079 4.343 1.00 0.00 H new ATOM 0 HA PHE A 50 2.756 -0.663 4.149 1.00 0.00 H new ATOM 0 HB2 PHE A 50 3.263 -2.808 6.187 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.610 -1.285 6.758 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.809 -0.477 4.593 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.516 -4.343 6.234 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.443 -1.179 3.902 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.733 -5.051 5.542 1.00 0.00 H new ATOM 0 HZ PHE A 50 -2.218 -3.469 4.377 1.00 0.00 H new ATOM 785 N PHE A 51 5.585 -0.620 5.817 1.00 0.00 N ATOM 786 CA PHE A 51 6.574 0.256 6.434 1.00 0.00 C ATOM 787 C PHE A 51 7.389 0.990 5.374 1.00 0.00 C ATOM 788 O PHE A 51 7.780 2.143 5.561 1.00 0.00 O ATOM 789 CB PHE A 51 7.506 -0.551 7.341 1.00 0.00 C ATOM 790 CG PHE A 51 8.839 0.103 7.565 1.00 0.00 C ATOM 791 CD1 PHE A 51 8.972 1.145 8.468 1.00 0.00 C ATOM 792 CD2 PHE A 51 9.959 -0.325 6.871 1.00 0.00 C ATOM 793 CE1 PHE A 51 10.198 1.748 8.677 1.00 0.00 C ATOM 794 CE2 PHE A 51 11.188 0.274 7.075 1.00 0.00 C ATOM 795 CZ PHE A 51 11.307 1.313 7.978 1.00 0.00 C ATOM 0 H PHE A 51 5.882 -1.591 5.724 1.00 0.00 H new ATOM 0 HA PHE A 51 6.043 0.995 7.034 1.00 0.00 H new ATOM 0 HB2 PHE A 51 7.019 -0.705 8.304 1.00 0.00 H new ATOM 0 HB3 PHE A 51 7.663 -1.536 6.902 1.00 0.00 H new ATOM 0 HD1 PHE A 51 8.107 1.490 9.015 1.00 0.00 H new ATOM 0 HD2 PHE A 51 9.871 -1.136 6.163 1.00 0.00 H new ATOM 0 HE1 PHE A 51 10.289 2.558 9.386 1.00 0.00 H new ATOM 0 HE2 PHE A 51 12.054 -0.070 6.529 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.266 1.784 8.137 1.00 0.00 H new ATOM 805 N THR A 52 7.642 0.313 4.258 1.00 0.00 N ATOM 806 CA THR A 52 8.413 0.899 3.168 1.00 0.00 C ATOM 807 C THR A 52 7.659 2.056 2.522 1.00 0.00 C ATOM 808 O THR A 52 8.133 3.191 2.515 1.00 0.00 O ATOM 809 CB THR A 52 8.744 -0.149 2.088 1.00 0.00 C ATOM 810 OG1 THR A 52 9.594 -1.163 2.635 1.00 0.00 O ATOM 811 CG2 THR A 52 9.425 0.502 0.894 1.00 0.00 C ATOM 0 H THR A 52 7.325 -0.641 4.085 1.00 0.00 H new ATOM 0 HA THR A 52 9.342 1.270 3.601 1.00 0.00 H new ATOM 0 HB THR A 52 7.811 -0.601 1.752 1.00 0.00 H new ATOM 0 HG1 THR A 52 9.275 -2.045 2.351 1.00 0.00 H new ATOM 0 HG21 THR A 52 9.649 -0.257 0.145 1.00 0.00 H new ATOM 0 HG22 THR A 52 8.763 1.253 0.463 1.00 0.00 H new ATOM 0 HG23 THR A 52 10.351 0.977 1.218 1.00 0.00 H new ATOM 819 N MET A 53 6.482 1.760 1.980 1.00 0.00 N ATOM 820 CA MET A 53 5.662 2.777 1.333 1.00 0.00 C ATOM 821 C MET A 53 5.495 3.996 2.236 1.00 0.00 C ATOM 822 O MET A 53 5.393 5.126 1.758 1.00 0.00 O ATOM 823 CB MET A 53 4.290 2.204 0.973 1.00 0.00 C ATOM 824 CG MET A 53 3.281 2.283 2.107 1.00 0.00 C ATOM 825 SD MET A 53 2.324 3.811 2.081 1.00 0.00 S ATOM 826 CE MET A 53 1.400 3.605 0.561 1.00 0.00 C ATOM 0 H MET A 53 6.075 0.825 1.976 1.00 0.00 H new ATOM 0 HA MET A 53 6.169 3.089 0.420 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.897 2.741 0.110 1.00 0.00 H new ATOM 0 HB3 MET A 53 4.408 1.162 0.674 1.00 0.00 H new ATOM 0 HG2 MET A 53 2.602 1.433 2.044 1.00 0.00 H new ATOM 0 HG3 MET A 53 3.804 2.203 3.060 1.00 0.00 H new ATOM 0 HE1 MET A 53 1.598 4.447 -0.102 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.704 2.679 0.073 1.00 0.00 H new ATOM 0 HE3 MET A 53 0.334 3.563 0.786 1.00 0.00 H new ATOM 836 N LYS A 54 5.468 3.759 3.543 1.00 0.00 N ATOM 837 CA LYS A 54 5.316 4.837 4.513 1.00 0.00 C ATOM 838 C LYS A 54 6.519 5.773 4.481 1.00 0.00 C ATOM 839 O LYS A 54 6.372 6.991 4.579 1.00 0.00 O ATOM 840 CB LYS A 54 5.139 4.263 5.920 1.00 0.00 C ATOM 841 CG LYS A 54 5.046 5.324 7.003 1.00 0.00 C ATOM 842 CD LYS A 54 3.942 6.325 6.710 1.00 0.00 C ATOM 843 CE LYS A 54 3.964 7.483 7.696 1.00 0.00 C ATOM 844 NZ LYS A 54 3.712 7.029 9.091 1.00 0.00 N ATOM 0 H LYS A 54 5.549 2.830 3.955 1.00 0.00 H new ATOM 0 HA LYS A 54 4.427 5.409 4.246 1.00 0.00 H new ATOM 0 HB2 LYS A 54 4.236 3.652 5.943 1.00 0.00 H new ATOM 0 HB3 LYS A 54 5.977 3.602 6.142 1.00 0.00 H new ATOM 0 HG2 LYS A 54 4.860 4.847 7.965 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.999 5.846 7.085 1.00 0.00 H new ATOM 0 HD2 LYS A 54 4.056 6.707 5.696 1.00 0.00 H new ATOM 0 HD3 LYS A 54 2.974 5.825 6.756 1.00 0.00 H new ATOM 0 HE2 LYS A 54 4.931 7.984 7.646 1.00 0.00 H new ATOM 0 HE3 LYS A 54 3.210 8.217 7.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 3.634 7.856 9.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 2.826 6.485 9.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 4.499 6.428 9.408 1.00 0.00 H new ATOM 858 N GLN A 55 7.708 5.196 4.343 1.00 0.00 N ATOM 859 CA GLN A 55 8.937 5.979 4.298 1.00 0.00 C ATOM 860 C GLN A 55 8.912 6.964 3.134 1.00 0.00 C ATOM 861 O GLN A 55 9.209 8.146 3.303 1.00 0.00 O ATOM 862 CB GLN A 55 10.151 5.057 4.173 1.00 0.00 C ATOM 863 CG GLN A 55 10.289 4.074 5.326 1.00 0.00 C ATOM 864 CD GLN A 55 10.950 4.693 6.542 1.00 0.00 C ATOM 865 OE1 GLN A 55 12.170 4.851 6.588 1.00 0.00 O ATOM 866 NE2 GLN A 55 10.145 5.046 7.538 1.00 0.00 N ATOM 0 H GLN A 55 7.846 4.189 4.260 1.00 0.00 H new ATOM 0 HA GLN A 55 9.012 6.543 5.228 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.080 4.501 3.238 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.054 5.665 4.114 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.302 3.703 5.603 1.00 0.00 H new ATOM 0 HG3 GLN A 55 10.873 3.214 4.998 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.139 4.897 7.458 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.533 5.466 8.383 1.00 0.00 H new ATOM 875 N ASN A 56 8.555 6.470 1.953 1.00 0.00 N ATOM 876 CA ASN A 56 8.492 7.307 0.761 1.00 0.00 C ATOM 877 C ASN A 56 7.464 8.422 0.934 1.00 0.00 C ATOM 878 O ASN A 56 7.660 9.541 0.458 1.00 0.00 O ATOM 879 CB ASN A 56 8.142 6.461 -0.465 1.00 0.00 C ATOM 880 CG ASN A 56 9.211 5.433 -0.781 1.00 0.00 C ATOM 881 OD1 ASN A 56 10.405 5.707 -0.663 1.00 0.00 O ATOM 882 ND2 ASN A 56 8.785 4.242 -1.188 1.00 0.00 N ATOM 0 H ASN A 56 8.305 5.494 1.796 1.00 0.00 H new ATOM 0 HA ASN A 56 9.472 7.760 0.613 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.193 5.953 -0.294 1.00 0.00 H new ATOM 0 HB3 ASN A 56 8.004 7.114 -1.327 1.00 0.00 H new ATOM 0 HD21 ASN A 56 9.458 3.511 -1.417 1.00 0.00 H new ATOM 0 HD22 ASN A 56 7.785 4.059 -1.271 1.00 0.00 H new ATOM 889 N LEU A 57 6.369 8.109 1.616 1.00 0.00 N ATOM 890 CA LEU A 57 5.309 9.083 1.852 1.00 0.00 C ATOM 891 C LEU A 57 5.817 10.244 2.702 1.00 0.00 C ATOM 892 O LEU A 57 5.508 11.404 2.431 1.00 0.00 O ATOM 893 CB LEU A 57 4.118 8.415 2.541 1.00 0.00 C ATOM 894 CG LEU A 57 3.255 9.322 3.419 1.00 0.00 C ATOM 895 CD1 LEU A 57 1.814 8.835 3.436 1.00 0.00 C ATOM 896 CD2 LEU A 57 3.814 9.386 4.833 1.00 0.00 C ATOM 0 H LEU A 57 6.191 7.188 2.016 1.00 0.00 H new ATOM 0 HA LEU A 57 4.988 9.475 0.887 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.482 7.973 1.774 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.492 7.597 3.156 1.00 0.00 H new ATOM 0 HG LEU A 57 3.273 10.327 2.997 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.215 9.493 4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.415 8.842 2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.777 7.820 3.833 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.187 10.036 5.443 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.827 8.385 5.265 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.829 9.783 4.805 1.00 0.00 H new ATOM 908 N GLU A 58 6.599 9.922 3.727 1.00 0.00 N ATOM 909 CA GLU A 58 7.152 10.940 4.614 1.00 0.00 C ATOM 910 C GLU A 58 8.263 11.722 3.921 1.00 0.00 C ATOM 911 O GLU A 58 8.709 12.757 4.414 1.00 0.00 O ATOM 912 CB GLU A 58 7.688 10.295 5.894 1.00 0.00 C ATOM 913 CG GLU A 58 6.602 9.714 6.784 1.00 0.00 C ATOM 914 CD GLU A 58 7.123 9.302 8.147 1.00 0.00 C ATOM 915 OE1 GLU A 58 7.947 8.365 8.210 1.00 0.00 O ATOM 916 OE2 GLU A 58 6.708 9.918 9.151 1.00 0.00 O ATOM 0 H GLU A 58 6.864 8.966 3.964 1.00 0.00 H new ATOM 0 HA GLU A 58 6.352 11.634 4.872 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.388 9.504 5.626 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.249 11.040 6.459 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.808 10.450 6.910 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.159 8.848 6.292 1.00 0.00 H new ATOM 923 N ALA A 59 8.706 11.218 2.774 1.00 0.00 N ATOM 924 CA ALA A 59 9.764 11.869 2.012 1.00 0.00 C ATOM 925 C ALA A 59 9.187 12.706 0.874 1.00 0.00 C ATOM 926 O ALA A 59 9.892 13.056 -0.072 1.00 0.00 O ATOM 927 CB ALA A 59 10.735 10.832 1.466 1.00 0.00 C ATOM 0 H ALA A 59 8.348 10.361 2.352 1.00 0.00 H new ATOM 0 HA ALA A 59 10.302 12.538 2.683 1.00 0.00 H new ATOM 0 HB1 ALA A 59 11.520 11.332 0.899 1.00 0.00 H new ATOM 0 HB2 ALA A 59 11.180 10.280 2.293 1.00 0.00 H new ATOM 0 HB3 ALA A 59 10.201 10.141 0.814 1.00 0.00 H new ATOM 933 N TYR A 60 7.900 13.022 0.974 1.00 0.00 N ATOM 934 CA TYR A 60 7.227 13.815 -0.048 1.00 0.00 C ATOM 935 C TYR A 60 7.411 13.194 -1.429 1.00 0.00 C ATOM 936 O TYR A 60 7.699 13.891 -2.403 1.00 0.00 O ATOM 937 CB TYR A 60 7.763 15.248 -0.045 1.00 0.00 C ATOM 938 CG TYR A 60 7.288 16.070 1.131 1.00 0.00 C ATOM 939 CD1 TYR A 60 7.867 15.922 2.386 1.00 0.00 C ATOM 940 CD2 TYR A 60 6.258 16.993 0.989 1.00 0.00 C ATOM 941 CE1 TYR A 60 7.435 16.670 3.464 1.00 0.00 C ATOM 942 CE2 TYR A 60 5.822 17.746 2.061 1.00 0.00 C ATOM 943 CZ TYR A 60 6.413 17.582 3.296 1.00 0.00 C ATOM 944 OH TYR A 60 5.980 18.329 4.367 1.00 0.00 O ATOM 0 H TYR A 60 7.303 12.741 1.752 1.00 0.00 H new ATOM 0 HA TYR A 60 6.162 13.831 0.183 1.00 0.00 H new ATOM 0 HB2 TYR A 60 8.853 15.219 -0.041 1.00 0.00 H new ATOM 0 HB3 TYR A 60 7.461 15.742 -0.968 1.00 0.00 H new ATOM 0 HD1 TYR A 60 8.668 15.210 2.521 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.791 17.123 0.024 1.00 0.00 H new ATOM 0 HE1 TYR A 60 7.895 16.542 4.433 1.00 0.00 H new ATOM 0 HE2 TYR A 60 5.022 18.460 1.933 1.00 0.00 H new ATOM 0 HH TYR A 60 5.256 18.924 4.080 1.00 0.00 H new ATOM 954 N ARG A 61 7.244 11.878 -1.507 1.00 0.00 N ATOM 955 CA ARG A 61 7.392 11.160 -2.767 1.00 0.00 C ATOM 956 C ARG A 61 6.035 10.940 -3.430 1.00 0.00 C ATOM 957 O ARG A 61 5.946 10.782 -4.647 1.00 0.00 O ATOM 958 CB ARG A 61 8.083 9.816 -2.536 1.00 0.00 C ATOM 959 CG ARG A 61 9.539 9.942 -2.117 1.00 0.00 C ATOM 960 CD ARG A 61 10.356 8.744 -2.573 1.00 0.00 C ATOM 961 NE ARG A 61 11.792 8.999 -2.494 1.00 0.00 N ATOM 962 CZ ARG A 61 12.699 8.313 -3.181 1.00 0.00 C ATOM 963 NH1 ARG A 61 12.320 7.335 -3.992 1.00 0.00 N ATOM 964 NH2 ARG A 61 13.987 8.604 -3.055 1.00 0.00 N ATOM 0 H ARG A 61 7.006 11.286 -0.711 1.00 0.00 H new ATOM 0 HA ARG A 61 8.008 11.767 -3.431 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.539 9.265 -1.768 1.00 0.00 H new ATOM 0 HB3 ARG A 61 8.027 9.227 -3.451 1.00 0.00 H new ATOM 0 HG2 ARG A 61 9.962 10.854 -2.538 1.00 0.00 H new ATOM 0 HG3 ARG A 61 9.600 10.034 -1.033 1.00 0.00 H new ATOM 0 HD2 ARG A 61 10.107 7.880 -1.957 1.00 0.00 H new ATOM 0 HD3 ARG A 61 10.088 8.492 -3.599 1.00 0.00 H new ATOM 0 HE ARG A 61 12.116 9.744 -1.878 1.00 0.00 H new ATOM 0 HH11 ARG A 61 11.330 7.108 -4.089 1.00 0.00 H new ATOM 0 HH12 ARG A 61 13.018 6.810 -4.518 1.00 0.00 H new ATOM 0 HH21 ARG A 61 14.282 9.355 -2.430 1.00 0.00 H new ATOM 0 HH22 ARG A 61 14.683 8.077 -3.583 1.00 0.00 H new ATOM 978 N TYR A 62 4.983 10.931 -2.620 1.00 0.00 N ATOM 979 CA TYR A 62 3.630 10.727 -3.126 1.00 0.00 C ATOM 980 C TYR A 62 2.833 12.027 -3.091 1.00 0.00 C ATOM 981 O TYR A 62 2.276 12.399 -2.056 1.00 0.00 O ATOM 982 CB TYR A 62 2.913 9.652 -2.308 1.00 0.00 C ATOM 983 CG TYR A 62 3.656 8.337 -2.252 1.00 0.00 C ATOM 984 CD1 TYR A 62 4.319 7.843 -3.369 1.00 0.00 C ATOM 985 CD2 TYR A 62 3.696 7.587 -1.083 1.00 0.00 C ATOM 986 CE1 TYR A 62 4.999 6.640 -3.323 1.00 0.00 C ATOM 987 CE2 TYR A 62 4.374 6.385 -1.028 1.00 0.00 C ATOM 988 CZ TYR A 62 5.024 5.916 -2.150 1.00 0.00 C ATOM 989 OH TYR A 62 5.700 4.719 -2.099 1.00 0.00 O ATOM 0 H TYR A 62 5.040 11.063 -1.610 1.00 0.00 H new ATOM 0 HA TYR A 62 3.703 10.396 -4.162 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.764 10.019 -1.292 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.924 9.483 -2.734 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.303 8.409 -4.289 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.188 7.950 -0.202 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.508 6.270 -4.201 1.00 0.00 H new ATOM 0 HE2 TYR A 62 4.395 5.815 -0.111 1.00 0.00 H new ATOM 0 HH TYR A 62 5.852 4.390 -3.010 1.00 0.00 H new ATOM 999 N LEU A 63 2.782 12.714 -4.226 1.00 0.00 N ATOM 1000 CA LEU A 63 2.052 13.974 -4.326 1.00 0.00 C ATOM 1001 C LEU A 63 0.646 13.746 -4.872 1.00 0.00 C ATOM 1002 O LEU A 63 -0.275 14.506 -4.577 1.00 0.00 O ATOM 1003 CB LEU A 63 2.809 14.954 -5.225 1.00 0.00 C ATOM 1004 CG LEU A 63 4.241 15.284 -4.801 1.00 0.00 C ATOM 1005 CD1 LEU A 63 5.084 15.650 -6.012 1.00 0.00 C ATOM 1006 CD2 LEU A 63 4.248 16.416 -3.783 1.00 0.00 C ATOM 0 H LEU A 63 3.237 12.421 -5.090 1.00 0.00 H new ATOM 0 HA LEU A 63 1.969 14.399 -3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.836 14.544 -6.235 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.242 15.884 -5.274 1.00 0.00 H new ATOM 0 HG LEU A 63 4.675 14.400 -4.335 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.100 15.882 -5.692 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.105 14.811 -6.707 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.652 16.520 -6.506 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.275 16.638 -3.492 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.796 17.304 -4.224 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.678 16.117 -2.903 1.00 0.00 H new ATOM 1018 N ASN A 64 0.490 12.694 -5.669 1.00 0.00 N ATOM 1019 CA ASN A 64 -0.804 12.366 -6.256 1.00 0.00 C ATOM 1020 C ASN A 64 -1.332 11.045 -5.705 1.00 0.00 C ATOM 1021 O ASN A 64 -0.559 10.144 -5.375 1.00 0.00 O ATOM 1022 CB ASN A 64 -0.691 12.285 -7.781 1.00 0.00 C ATOM 1023 CG ASN A 64 0.148 13.409 -8.358 1.00 0.00 C ATOM 1024 OD1 ASN A 64 -0.338 14.523 -8.555 1.00 0.00 O ATOM 1025 ND2 ASN A 64 1.415 13.121 -8.632 1.00 0.00 N ATOM 0 H ASN A 64 1.243 12.055 -5.923 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.505 13.157 -5.991 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.252 11.327 -8.060 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.689 12.318 -8.219 1.00 0.00 H new ATOM 0 HD21 ASN A 64 2.028 13.837 -9.022 1.00 0.00 H new ATOM 0 HD22 ASN A 64 1.775 12.184 -8.452 1.00 0.00 H new ATOM 1032 N PHE A 65 -2.652 10.937 -5.606 1.00 0.00 N ATOM 1033 CA PHE A 65 -3.285 9.726 -5.093 1.00 0.00 C ATOM 1034 C PHE A 65 -2.861 8.506 -5.906 1.00 0.00 C ATOM 1035 O PHE A 65 -2.561 7.450 -5.349 1.00 0.00 O ATOM 1036 CB PHE A 65 -4.808 9.869 -5.121 1.00 0.00 C ATOM 1037 CG PHE A 65 -5.515 8.936 -4.181 1.00 0.00 C ATOM 1038 CD1 PHE A 65 -5.464 9.139 -2.812 1.00 0.00 C ATOM 1039 CD2 PHE A 65 -6.232 7.854 -4.668 1.00 0.00 C ATOM 1040 CE1 PHE A 65 -6.113 8.280 -1.945 1.00 0.00 C ATOM 1041 CE2 PHE A 65 -6.884 6.993 -3.807 1.00 0.00 C ATOM 1042 CZ PHE A 65 -6.826 7.207 -2.443 1.00 0.00 C ATOM 0 H PHE A 65 -3.305 11.673 -5.874 1.00 0.00 H new ATOM 0 HA PHE A 65 -2.961 9.585 -4.062 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.073 10.896 -4.869 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.163 9.688 -6.135 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -4.911 9.978 -2.417 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -6.281 7.682 -5.733 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.063 8.448 -0.879 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -7.439 6.153 -4.199 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.337 6.537 -1.768 1.00 0.00 H new ATOM 1052 N ASP A 66 -2.842 8.660 -7.226 1.00 0.00 N ATOM 1053 CA ASP A 66 -2.456 7.571 -8.116 1.00 0.00 C ATOM 1054 C ASP A 66 -1.122 6.967 -7.689 1.00 0.00 C ATOM 1055 O ASP A 66 -0.890 5.769 -7.857 1.00 0.00 O ATOM 1056 CB ASP A 66 -2.364 8.072 -9.558 1.00 0.00 C ATOM 1057 CG ASP A 66 -2.319 6.938 -10.563 1.00 0.00 C ATOM 1058 OD1 ASP A 66 -3.289 6.153 -10.615 1.00 0.00 O ATOM 1059 OD2 ASP A 66 -1.315 6.837 -11.298 1.00 0.00 O ATOM 0 H ASP A 66 -3.089 9.527 -7.703 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.221 6.797 -8.056 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.221 8.710 -9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -1.472 8.688 -9.669 1.00 0.00 H new ATOM 1064 N ASP A 67 -0.250 7.801 -7.136 1.00 0.00 N ATOM 1065 CA ASP A 67 1.061 7.350 -6.685 1.00 0.00 C ATOM 1066 C ASP A 67 0.940 6.519 -5.411 1.00 0.00 C ATOM 1067 O ASP A 67 1.351 5.359 -5.373 1.00 0.00 O ATOM 1068 CB ASP A 67 1.982 8.547 -6.442 1.00 0.00 C ATOM 1069 CG ASP A 67 2.560 9.102 -7.728 1.00 0.00 C ATOM 1070 OD1 ASP A 67 2.819 8.307 -8.655 1.00 0.00 O ATOM 1071 OD2 ASP A 67 2.753 10.334 -7.809 1.00 0.00 O ATOM 0 H ASP A 67 -0.427 8.795 -6.989 1.00 0.00 H new ATOM 0 HA ASP A 67 1.491 6.725 -7.467 1.00 0.00 H new ATOM 0 HB2 ASP A 67 1.426 9.331 -5.929 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.795 8.248 -5.781 1.00 0.00 H new ATOM 1076 N PHE A 68 0.376 7.120 -4.369 1.00 0.00 N ATOM 1077 CA PHE A 68 0.203 6.437 -3.093 1.00 0.00 C ATOM 1078 C PHE A 68 -0.495 5.094 -3.285 1.00 0.00 C ATOM 1079 O PHE A 68 -0.056 4.074 -2.755 1.00 0.00 O ATOM 1080 CB PHE A 68 -0.602 7.309 -2.127 1.00 0.00 C ATOM 1081 CG PHE A 68 -0.866 6.652 -0.804 1.00 0.00 C ATOM 1082 CD1 PHE A 68 0.056 6.743 0.227 1.00 0.00 C ATOM 1083 CD2 PHE A 68 -2.037 5.944 -0.587 1.00 0.00 C ATOM 1084 CE1 PHE A 68 -0.184 6.139 1.446 1.00 0.00 C ATOM 1085 CE2 PHE A 68 -2.284 5.337 0.630 1.00 0.00 C ATOM 1086 CZ PHE A 68 -1.356 5.436 1.648 1.00 0.00 C ATOM 0 H PHE A 68 0.031 8.080 -4.383 1.00 0.00 H new ATOM 0 HA PHE A 68 1.191 6.256 -2.670 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.065 8.242 -1.959 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.554 7.568 -2.591 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.973 7.293 0.075 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.767 5.865 -1.379 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.544 6.216 2.240 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.200 4.787 0.784 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.546 4.964 2.601 1.00 0.00 H new ATOM 1096 N GLU A 69 -1.585 5.104 -4.047 1.00 0.00 N ATOM 1097 CA GLU A 69 -2.344 3.887 -4.308 1.00 0.00 C ATOM 1098 C GLU A 69 -1.468 2.831 -4.975 1.00 0.00 C ATOM 1099 O GLU A 69 -1.435 1.677 -4.547 1.00 0.00 O ATOM 1100 CB GLU A 69 -3.554 4.195 -5.194 1.00 0.00 C ATOM 1101 CG GLU A 69 -4.289 2.953 -5.672 1.00 0.00 C ATOM 1102 CD GLU A 69 -5.607 3.281 -6.346 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -5.675 4.313 -7.044 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -6.570 2.503 -6.176 1.00 0.00 O ATOM 0 H GLU A 69 -1.961 5.940 -4.493 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.692 3.494 -3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.248 4.827 -4.640 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.223 4.768 -6.061 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.655 2.405 -6.369 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.473 2.294 -4.823 1.00 0.00 H new ATOM 1111 N GLU A 70 -0.759 3.234 -6.025 1.00 0.00 N ATOM 1112 CA GLU A 70 0.117 2.323 -6.752 1.00 0.00 C ATOM 1113 C GLU A 70 0.932 1.467 -5.786 1.00 0.00 C ATOM 1114 O GLU A 70 0.908 0.238 -5.857 1.00 0.00 O ATOM 1115 CB GLU A 70 1.053 3.107 -7.673 1.00 0.00 C ATOM 1116 CG GLU A 70 1.833 2.229 -8.637 1.00 0.00 C ATOM 1117 CD GLU A 70 1.014 1.818 -9.845 1.00 0.00 C ATOM 1118 OE1 GLU A 70 0.140 2.607 -10.265 1.00 0.00 O ATOM 1119 OE2 GLU A 70 1.245 0.709 -10.371 1.00 0.00 O ATOM 0 H GLU A 70 -0.774 4.186 -6.391 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.506 1.664 -7.357 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.468 3.828 -8.244 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.755 3.677 -7.064 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.723 2.763 -8.971 1.00 0.00 H new ATOM 0 HG3 GLU A 70 2.175 1.336 -8.114 1.00 0.00 H new ATOM 1126 N ASP A 71 1.654 2.126 -4.886 1.00 0.00 N ATOM 1127 CA ASP A 71 2.478 1.427 -3.907 1.00 0.00 C ATOM 1128 C ASP A 71 1.697 0.292 -3.252 1.00 0.00 C ATOM 1129 O ASP A 71 2.105 -0.869 -3.308 1.00 0.00 O ATOM 1130 CB ASP A 71 2.975 2.402 -2.839 1.00 0.00 C ATOM 1131 CG ASP A 71 3.321 3.763 -3.412 1.00 0.00 C ATOM 1132 OD1 ASP A 71 4.124 3.815 -4.367 1.00 0.00 O ATOM 1133 OD2 ASP A 71 2.790 4.773 -2.906 1.00 0.00 O ATOM 0 H ASP A 71 1.685 3.143 -4.814 1.00 0.00 H new ATOM 0 HA ASP A 71 3.336 1.001 -4.428 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.209 2.518 -2.073 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.854 1.983 -2.350 1.00 0.00 H new ATOM 1138 N PHE A 72 0.572 0.633 -2.632 1.00 0.00 N ATOM 1139 CA PHE A 72 -0.264 -0.357 -1.965 1.00 0.00 C ATOM 1140 C PHE A 72 -0.549 -1.539 -2.887 1.00 0.00 C ATOM 1141 O PHE A 72 -0.370 -2.695 -2.505 1.00 0.00 O ATOM 1142 CB PHE A 72 -1.581 0.278 -1.512 1.00 0.00 C ATOM 1143 CG PHE A 72 -2.601 -0.722 -1.047 1.00 0.00 C ATOM 1144 CD1 PHE A 72 -3.431 -1.357 -1.957 1.00 0.00 C ATOM 1145 CD2 PHE A 72 -2.727 -1.028 0.299 1.00 0.00 C ATOM 1146 CE1 PHE A 72 -4.371 -2.277 -1.531 1.00 0.00 C ATOM 1147 CE2 PHE A 72 -3.664 -1.948 0.730 1.00 0.00 C ATOM 1148 CZ PHE A 72 -4.487 -2.574 -0.187 1.00 0.00 C ATOM 0 H PHE A 72 0.219 1.588 -2.578 1.00 0.00 H new ATOM 0 HA PHE A 72 0.276 -0.722 -1.091 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.377 0.980 -0.703 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.999 0.855 -2.337 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.343 -1.131 -3.009 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.086 -0.542 1.019 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.015 -2.763 -2.249 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.753 -2.177 1.782 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.219 -3.294 0.147 1.00 0.00 H new ATOM 1158 N ASN A 73 -0.991 -1.239 -4.104 1.00 0.00 N ATOM 1159 CA ASN A 73 -1.301 -2.276 -5.081 1.00 0.00 C ATOM 1160 C ASN A 73 -0.169 -3.295 -5.171 1.00 0.00 C ATOM 1161 O ASN A 73 -0.395 -4.503 -5.073 1.00 0.00 O ATOM 1162 CB ASN A 73 -1.552 -1.653 -6.456 1.00 0.00 C ATOM 1163 CG ASN A 73 -2.862 -0.892 -6.515 1.00 0.00 C ATOM 1164 OD1 ASN A 73 -3.757 -1.111 -5.699 1.00 0.00 O ATOM 1165 ND2 ASN A 73 -2.979 0.009 -7.484 1.00 0.00 N ATOM 0 H ASN A 73 -1.142 -0.287 -4.437 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.204 -2.791 -4.753 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.732 -0.979 -6.702 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -1.556 -2.438 -7.212 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.837 0.553 -7.574 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.211 0.157 -8.138 1.00 0.00 H new ATOM 1172 N LEU A 74 1.050 -2.801 -5.357 1.00 0.00 N ATOM 1173 CA LEU A 74 2.220 -3.668 -5.459 1.00 0.00 C ATOM 1174 C LEU A 74 2.268 -4.656 -4.299 1.00 0.00 C ATOM 1175 O LEU A 74 2.237 -5.870 -4.503 1.00 0.00 O ATOM 1176 CB LEU A 74 3.499 -2.830 -5.485 1.00 0.00 C ATOM 1177 CG LEU A 74 3.856 -2.189 -6.828 1.00 0.00 C ATOM 1178 CD1 LEU A 74 4.997 -1.198 -6.660 1.00 0.00 C ATOM 1179 CD2 LEU A 74 4.221 -3.259 -7.847 1.00 0.00 C ATOM 0 H LEU A 74 1.255 -1.805 -5.440 1.00 0.00 H new ATOM 0 HA LEU A 74 2.144 -4.232 -6.389 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.406 -2.039 -4.741 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.330 -3.463 -5.175 1.00 0.00 H new ATOM 0 HG LEU A 74 2.984 -1.647 -7.195 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.237 -0.752 -7.625 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.699 -0.415 -5.963 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.874 -1.715 -6.271 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.472 -2.787 -8.797 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.078 -3.827 -7.486 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.374 -3.930 -7.989 1.00 0.00 H new ATOM 1191 N ILE A 75 2.343 -4.128 -3.082 1.00 0.00 N ATOM 1192 CA ILE A 75 2.393 -4.964 -1.889 1.00 0.00 C ATOM 1193 C ILE A 75 1.564 -6.230 -2.071 1.00 0.00 C ATOM 1194 O ILE A 75 1.960 -7.313 -1.637 1.00 0.00 O ATOM 1195 CB ILE A 75 1.885 -4.205 -0.649 1.00 0.00 C ATOM 1196 CG1 ILE A 75 2.781 -3.000 -0.358 1.00 0.00 C ATOM 1197 CG2 ILE A 75 1.831 -5.134 0.555 1.00 0.00 C ATOM 1198 CD1 ILE A 75 2.315 -2.169 0.815 1.00 0.00 C ATOM 0 H ILE A 75 2.370 -3.125 -2.896 1.00 0.00 H new ATOM 0 HA ILE A 75 3.438 -5.235 -1.736 1.00 0.00 H new ATOM 0 HB ILE A 75 0.877 -3.844 -0.851 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.795 -3.350 -0.165 1.00 0.00 H new ATOM 0 HG13 ILE A 75 2.826 -2.368 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.470 -4.583 1.424 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.155 -5.963 0.345 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.829 -5.522 0.760 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.998 -1.332 0.962 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.313 -1.789 0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 75 2.297 -2.786 1.714 1.00 0.00 H new ATOM 1210 N VAL A 76 0.410 -6.090 -2.716 1.00 0.00 N ATOM 1211 CA VAL A 76 -0.474 -7.223 -2.959 1.00 0.00 C ATOM 1212 C VAL A 76 -0.043 -8.002 -4.197 1.00 0.00 C ATOM 1213 O VAL A 76 0.027 -9.231 -4.177 1.00 0.00 O ATOM 1214 CB VAL A 76 -1.935 -6.767 -3.136 1.00 0.00 C ATOM 1215 CG1 VAL A 76 -2.820 -7.946 -3.510 1.00 0.00 C ATOM 1216 CG2 VAL A 76 -2.440 -6.093 -1.869 1.00 0.00 C ATOM 0 H VAL A 76 0.066 -5.202 -3.080 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.406 -7.870 -2.085 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.975 -6.041 -3.948 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.848 -7.605 -3.631 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.470 -8.381 -4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.777 -8.698 -2.722 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.473 -5.777 -2.012 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.387 -6.795 -1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.822 -5.223 -1.649 1.00 0.00 H new ATOM 1226 N SER A 77 0.246 -7.278 -5.273 1.00 0.00 N ATOM 1227 CA SER A 77 0.668 -7.900 -6.523 1.00 0.00 C ATOM 1228 C SER A 77 1.926 -8.739 -6.315 1.00 0.00 C ATOM 1229 O SER A 77 1.888 -9.966 -6.404 1.00 0.00 O ATOM 1230 CB SER A 77 0.924 -6.834 -7.589 1.00 0.00 C ATOM 1231 OG SER A 77 1.589 -7.384 -8.712 1.00 0.00 O ATOM 0 H SER A 77 0.196 -6.260 -5.305 1.00 0.00 H new ATOM 0 HA SER A 77 -0.134 -8.556 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.023 -6.394 -7.903 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.524 -6.029 -7.165 1.00 0.00 H new ATOM 0 HG SER A 77 1.739 -6.682 -9.379 1.00 0.00 H new ATOM 1237 N ASN A 78 3.037 -8.067 -6.035 1.00 0.00 N ATOM 1238 CA ASN A 78 4.308 -8.749 -5.815 1.00 0.00 C ATOM 1239 C ASN A 78 4.105 -10.027 -5.006 1.00 0.00 C ATOM 1240 O ASN A 78 4.749 -11.045 -5.264 1.00 0.00 O ATOM 1241 CB ASN A 78 5.288 -7.824 -5.092 1.00 0.00 C ATOM 1242 CG ASN A 78 4.604 -6.954 -4.054 1.00 0.00 C ATOM 1243 OD1 ASN A 78 3.815 -7.441 -3.244 1.00 0.00 O ATOM 1244 ND2 ASN A 78 4.904 -5.661 -4.075 1.00 0.00 N ATOM 0 H ASN A 78 3.084 -7.051 -5.955 1.00 0.00 H new ATOM 0 HA ASN A 78 4.722 -9.017 -6.787 1.00 0.00 H new ATOM 0 HB2 ASN A 78 6.059 -8.423 -4.608 1.00 0.00 H new ATOM 0 HB3 ASN A 78 5.789 -7.188 -5.822 1.00 0.00 H new ATOM 0 HD21 ASN A 78 4.475 -5.027 -3.401 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.564 -5.302 -4.765 1.00 0.00 H new ATOM 1251 N CYS A 79 3.208 -9.966 -4.029 1.00 0.00 N ATOM 1252 CA CYS A 79 2.921 -11.118 -3.181 1.00 0.00 C ATOM 1253 C CYS A 79 2.093 -12.154 -3.935 1.00 0.00 C ATOM 1254 O CYS A 79 2.272 -13.359 -3.753 1.00 0.00 O ATOM 1255 CB CYS A 79 2.180 -10.677 -1.918 1.00 0.00 C ATOM 1256 SG CYS A 79 2.483 -11.728 -0.479 1.00 0.00 S ATOM 0 H CYS A 79 2.667 -9.131 -3.804 1.00 0.00 H new ATOM 0 HA CYS A 79 3.869 -11.573 -2.896 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.473 -9.655 -1.676 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.110 -10.662 -2.124 1.00 0.00 H new ATOM 0 HG CYS A 79 1.348 -12.125 0.015 1.00 0.00 H new ATOM 1262 N LEU A 80 1.187 -11.677 -4.780 1.00 0.00 N ATOM 1263 CA LEU A 80 0.329 -12.562 -5.561 1.00 0.00 C ATOM 1264 C LEU A 80 1.060 -13.078 -6.796 1.00 0.00 C ATOM 1265 O LEU A 80 0.579 -13.979 -7.485 1.00 0.00 O ATOM 1266 CB LEU A 80 -0.948 -11.829 -5.979 1.00 0.00 C ATOM 1267 CG LEU A 80 -1.924 -11.486 -4.852 1.00 0.00 C ATOM 1268 CD1 LEU A 80 -3.016 -10.556 -5.357 1.00 0.00 C ATOM 1269 CD2 LEU A 80 -2.528 -12.752 -4.265 1.00 0.00 C ATOM 0 H LEU A 80 1.027 -10.683 -4.942 1.00 0.00 H new ATOM 0 HA LEU A 80 0.063 -13.415 -4.936 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.664 -10.904 -6.481 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.472 -12.442 -6.712 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.373 -10.972 -4.064 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.701 -10.323 -4.542 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.567 -9.635 -5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.564 -11.043 -6.164 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.220 -12.488 -3.465 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.064 -13.294 -5.044 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.734 -13.382 -3.865 1.00 0.00 H new ATOM 1281 N LYS A 81 2.225 -12.504 -7.071 1.00 0.00 N ATOM 1282 CA LYS A 81 3.026 -12.907 -8.221 1.00 0.00 C ATOM 1283 C LYS A 81 4.205 -13.772 -7.787 1.00 0.00 C ATOM 1284 O LYS A 81 4.660 -14.639 -8.534 1.00 0.00 O ATOM 1285 CB LYS A 81 3.534 -11.674 -8.972 1.00 0.00 C ATOM 1286 CG LYS A 81 4.890 -11.185 -8.492 1.00 0.00 C ATOM 1287 CD LYS A 81 5.375 -9.997 -9.306 1.00 0.00 C ATOM 1288 CE LYS A 81 5.935 -10.435 -10.651 1.00 0.00 C ATOM 1289 NZ LYS A 81 5.784 -9.376 -11.686 1.00 0.00 N ATOM 0 H LYS A 81 2.637 -11.757 -6.512 1.00 0.00 H new ATOM 0 HA LYS A 81 2.392 -13.494 -8.885 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.597 -11.907 -10.035 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.808 -10.868 -8.864 1.00 0.00 H new ATOM 0 HG2 LYS A 81 4.825 -10.905 -7.441 1.00 0.00 H new ATOM 0 HG3 LYS A 81 5.616 -11.995 -8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.551 -9.301 -9.463 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.143 -9.461 -8.748 1.00 0.00 H new ATOM 0 HE2 LYS A 81 6.990 -10.687 -10.541 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.424 -11.340 -10.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.178 -9.713 -12.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 4.776 -9.153 -11.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 6.293 -8.521 -11.384 1.00 0.00 H new ATOM 1303 N TYR A 82 4.694 -13.533 -6.575 1.00 0.00 N ATOM 1304 CA TYR A 82 5.820 -14.290 -6.042 1.00 0.00 C ATOM 1305 C TYR A 82 5.354 -15.619 -5.454 1.00 0.00 C ATOM 1306 O TYR A 82 5.894 -16.676 -5.776 1.00 0.00 O ATOM 1307 CB TYR A 82 6.550 -13.474 -4.973 1.00 0.00 C ATOM 1308 CG TYR A 82 7.964 -13.942 -4.716 1.00 0.00 C ATOM 1309 CD1 TYR A 82 8.836 -14.193 -5.769 1.00 0.00 C ATOM 1310 CD2 TYR A 82 8.431 -14.131 -3.422 1.00 0.00 C ATOM 1311 CE1 TYR A 82 10.130 -14.621 -5.539 1.00 0.00 C ATOM 1312 CE2 TYR A 82 9.722 -14.557 -3.182 1.00 0.00 C ATOM 1313 CZ TYR A 82 10.569 -14.801 -4.243 1.00 0.00 C ATOM 1314 OH TYR A 82 11.856 -15.226 -4.010 1.00 0.00 O ATOM 0 H TYR A 82 4.328 -12.821 -5.943 1.00 0.00 H new ATOM 0 HA TYR A 82 6.506 -14.498 -6.863 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.572 -12.428 -5.278 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.985 -13.522 -4.042 1.00 0.00 H new ATOM 0 HD1 TYR A 82 8.497 -14.051 -6.784 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.772 -13.941 -2.588 1.00 0.00 H new ATOM 0 HE1 TYR A 82 10.794 -14.813 -6.369 1.00 0.00 H new ATOM 0 HE2 TYR A 82 10.067 -14.699 -2.168 1.00 0.00 H new ATOM 0 HH TYR A 82 12.454 -14.844 -4.686 1.00 0.00 H new ATOM 1324 N ASN A 83 4.346 -15.554 -4.590 1.00 0.00 N ATOM 1325 CA ASN A 83 3.805 -16.751 -3.957 1.00 0.00 C ATOM 1326 C ASN A 83 2.513 -17.191 -4.637 1.00 0.00 C ATOM 1327 O ASN A 83 2.078 -16.587 -5.617 1.00 0.00 O ATOM 1328 CB ASN A 83 3.550 -16.495 -2.470 1.00 0.00 C ATOM 1329 CG ASN A 83 4.776 -15.959 -1.757 1.00 0.00 C ATOM 1330 OD1 ASN A 83 5.534 -16.715 -1.149 1.00 0.00 O ATOM 1331 ND2 ASN A 83 4.975 -14.649 -1.827 1.00 0.00 N ATOM 0 H ASN A 83 3.888 -14.686 -4.313 1.00 0.00 H new ATOM 0 HA ASN A 83 4.539 -17.550 -4.062 1.00 0.00 H new ATOM 0 HB2 ASN A 83 2.731 -15.784 -2.362 1.00 0.00 H new ATOM 0 HB3 ASN A 83 3.233 -17.423 -1.994 1.00 0.00 H new ATOM 0 HD21 ASN A 83 5.783 -14.230 -1.366 1.00 0.00 H new ATOM 0 HD22 ASN A 83 4.320 -14.061 -2.342 1.00 0.00 H new ATOM 1338 N ALA A 84 1.904 -18.249 -4.112 1.00 0.00 N ATOM 1339 CA ALA A 84 0.661 -18.769 -4.667 1.00 0.00 C ATOM 1340 C ALA A 84 -0.399 -18.932 -3.583 1.00 0.00 C ATOM 1341 O ALA A 84 -0.120 -18.757 -2.396 1.00 0.00 O ATOM 1342 CB ALA A 84 0.909 -20.096 -5.368 1.00 0.00 C ATOM 0 H ALA A 84 2.252 -18.763 -3.302 1.00 0.00 H new ATOM 0 HA ALA A 84 0.290 -18.049 -5.397 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.029 -20.472 -5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.626 -19.952 -6.176 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.308 -20.816 -4.653 1.00 0.00 H new ATOM 1348 N LYS A 85 -1.616 -19.267 -3.997 1.00 0.00 N ATOM 1349 CA LYS A 85 -2.718 -19.455 -3.061 1.00 0.00 C ATOM 1350 C LYS A 85 -2.311 -20.380 -1.918 1.00 0.00 C ATOM 1351 O LYS A 85 -2.535 -20.071 -0.747 1.00 0.00 O ATOM 1352 CB LYS A 85 -3.938 -20.030 -3.786 1.00 0.00 C ATOM 1353 CG LYS A 85 -4.557 -19.071 -4.788 1.00 0.00 C ATOM 1354 CD LYS A 85 -5.209 -19.814 -5.942 1.00 0.00 C ATOM 1355 CE LYS A 85 -5.768 -18.853 -6.980 1.00 0.00 C ATOM 1356 NZ LYS A 85 -6.839 -17.987 -6.413 1.00 0.00 N ATOM 0 H LYS A 85 -1.864 -19.414 -4.975 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.976 -18.482 -2.643 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.646 -20.944 -4.303 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.691 -20.308 -3.049 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.300 -18.450 -4.288 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.789 -18.400 -5.173 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -4.478 -20.473 -6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.011 -20.447 -5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.963 -18.229 -7.368 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.166 -19.419 -7.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.321 -17.481 -7.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.527 -18.576 -5.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.418 -17.298 -5.757 1.00 0.00 H new ATOM 1370 N ASP A 86 -1.711 -21.513 -2.266 1.00 0.00 N ATOM 1371 CA ASP A 86 -1.270 -22.482 -1.269 1.00 0.00 C ATOM 1372 C ASP A 86 -0.638 -21.779 -0.072 1.00 0.00 C ATOM 1373 O ASP A 86 -1.078 -21.950 1.066 1.00 0.00 O ATOM 1374 CB ASP A 86 -0.273 -23.463 -1.886 1.00 0.00 C ATOM 1375 CG ASP A 86 -0.949 -24.519 -2.737 1.00 0.00 C ATOM 1376 OD1 ASP A 86 -2.149 -24.783 -2.512 1.00 0.00 O ATOM 1377 OD2 ASP A 86 -0.280 -25.081 -3.628 1.00 0.00 O ATOM 0 H ASP A 86 -1.519 -21.783 -3.231 1.00 0.00 H new ATOM 0 HA ASP A 86 -2.144 -23.035 -0.923 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.443 -22.913 -2.496 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.293 -23.949 -1.091 1.00 0.00 H new ATOM 1382 N THR A 87 0.397 -20.988 -0.335 1.00 0.00 N ATOM 1383 CA THR A 87 1.092 -20.261 0.720 1.00 0.00 C ATOM 1384 C THR A 87 0.125 -19.396 1.520 1.00 0.00 C ATOM 1385 O THR A 87 -1.073 -19.364 1.238 1.00 0.00 O ATOM 1386 CB THR A 87 2.208 -19.368 0.147 1.00 0.00 C ATOM 1387 OG1 THR A 87 1.643 -18.358 -0.695 1.00 0.00 O ATOM 1388 CG2 THR A 87 3.209 -20.196 -0.646 1.00 0.00 C ATOM 0 H THR A 87 0.773 -20.834 -1.271 1.00 0.00 H new ATOM 0 HA THR A 87 1.537 -21.008 1.377 1.00 0.00 H new ATOM 0 HB THR A 87 2.729 -18.896 0.980 1.00 0.00 H new ATOM 0 HG1 THR A 87 1.238 -18.778 -1.483 1.00 0.00 H new ATOM 0 HG21 THR A 87 3.988 -19.544 -1.041 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.659 -20.945 0.006 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.698 -20.692 -1.471 1.00 0.00 H new ATOM 1396 N ILE A 88 0.652 -18.695 2.518 1.00 0.00 N ATOM 1397 CA ILE A 88 -0.165 -17.827 3.357 1.00 0.00 C ATOM 1398 C ILE A 88 -0.162 -16.395 2.834 1.00 0.00 C ATOM 1399 O ILE A 88 -1.202 -15.862 2.446 1.00 0.00 O ATOM 1400 CB ILE A 88 0.327 -17.829 4.817 1.00 0.00 C ATOM 1401 CG1 ILE A 88 -0.252 -19.027 5.570 1.00 0.00 C ATOM 1402 CG2 ILE A 88 -0.054 -16.527 5.506 1.00 0.00 C ATOM 1403 CD1 ILE A 88 0.152 -19.078 7.028 1.00 0.00 C ATOM 0 H ILE A 88 1.641 -18.711 2.765 1.00 0.00 H new ATOM 0 HA ILE A 88 -1.181 -18.222 3.324 1.00 0.00 H new ATOM 0 HB ILE A 88 1.414 -17.913 4.820 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.340 -18.996 5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.072 -19.945 5.079 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.300 -16.544 6.537 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.402 -15.689 4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -1.138 -16.414 5.497 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.295 -19.953 7.499 1.00 0.00 H new ATOM 0 HD12 ILE A 88 1.238 -19.140 7.103 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.195 -18.177 7.534 1.00 0.00 H new ATOM 1415 N PHE A 89 1.015 -15.776 2.824 1.00 0.00 N ATOM 1416 CA PHE A 89 1.154 -14.406 2.347 1.00 0.00 C ATOM 1417 C PHE A 89 0.243 -14.151 1.150 1.00 0.00 C ATOM 1418 O PHE A 89 -0.175 -13.019 0.904 1.00 0.00 O ATOM 1419 CB PHE A 89 2.608 -14.121 1.966 1.00 0.00 C ATOM 1420 CG PHE A 89 3.605 -14.891 2.785 1.00 0.00 C ATOM 1421 CD1 PHE A 89 3.498 -14.940 4.165 1.00 0.00 C ATOM 1422 CD2 PHE A 89 4.648 -15.568 2.172 1.00 0.00 C ATOM 1423 CE1 PHE A 89 4.413 -15.648 4.919 1.00 0.00 C ATOM 1424 CE2 PHE A 89 5.566 -16.278 2.923 1.00 0.00 C ATOM 1425 CZ PHE A 89 5.448 -16.319 4.297 1.00 0.00 C ATOM 0 H PHE A 89 1.886 -16.202 3.141 1.00 0.00 H new ATOM 0 HA PHE A 89 0.859 -13.735 3.154 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.753 -14.361 0.913 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.803 -13.055 2.080 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.690 -14.419 4.657 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.744 -15.540 1.097 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.319 -15.677 5.995 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.375 -16.800 2.434 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.163 -16.875 4.885 1.00 0.00 H new ATOM 1435 N TYR A 90 -0.059 -15.210 0.409 1.00 0.00 N ATOM 1436 CA TYR A 90 -0.918 -15.102 -0.765 1.00 0.00 C ATOM 1437 C TYR A 90 -2.365 -14.846 -0.359 1.00 0.00 C ATOM 1438 O TYR A 90 -2.968 -13.851 -0.761 1.00 0.00 O ATOM 1439 CB TYR A 90 -0.830 -16.377 -1.606 1.00 0.00 C ATOM 1440 CG TYR A 90 -1.446 -16.239 -2.980 1.00 0.00 C ATOM 1441 CD1 TYR A 90 -2.821 -16.117 -3.137 1.00 0.00 C ATOM 1442 CD2 TYR A 90 -0.653 -16.230 -4.121 1.00 0.00 C ATOM 1443 CE1 TYR A 90 -3.388 -15.992 -4.391 1.00 0.00 C ATOM 1444 CE2 TYR A 90 -1.210 -16.104 -5.378 1.00 0.00 C ATOM 1445 CZ TYR A 90 -2.578 -15.986 -5.508 1.00 0.00 C ATOM 1446 OH TYR A 90 -3.139 -15.860 -6.759 1.00 0.00 O ATOM 0 H TYR A 90 0.278 -16.154 0.600 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.572 -14.257 -1.361 1.00 0.00 H new ATOM 0 HB2 TYR A 90 0.217 -16.660 -1.713 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.327 -17.188 -1.074 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -3.457 -16.120 -2.264 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.418 -16.323 -4.023 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -4.459 -15.900 -4.496 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.578 -16.098 -6.254 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.432 -15.873 -7.437 1.00 0.00 H new ATOM 1456 N ARG A 91 -2.918 -15.753 0.441 1.00 0.00 N ATOM 1457 CA ARG A 91 -4.295 -15.626 0.902 1.00 0.00 C ATOM 1458 C ARG A 91 -4.499 -14.315 1.655 1.00 0.00 C ATOM 1459 O ARG A 91 -5.548 -13.681 1.546 1.00 0.00 O ATOM 1460 CB ARG A 91 -4.664 -16.806 1.804 1.00 0.00 C ATOM 1461 CG ARG A 91 -4.522 -18.158 1.125 1.00 0.00 C ATOM 1462 CD ARG A 91 -5.432 -19.198 1.758 1.00 0.00 C ATOM 1463 NE ARG A 91 -6.843 -18.918 1.505 1.00 0.00 N ATOM 1464 CZ ARG A 91 -7.835 -19.425 2.229 1.00 0.00 C ATOM 1465 NH1 ARG A 91 -7.571 -20.233 3.246 1.00 0.00 N ATOM 1466 NH2 ARG A 91 -9.093 -19.123 1.935 1.00 0.00 N ATOM 0 H ARG A 91 -2.433 -16.583 0.783 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.945 -15.627 0.027 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.031 -16.786 2.691 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.693 -16.685 2.143 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -4.760 -18.061 0.066 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.486 -18.492 1.190 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.182 -20.184 1.367 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.256 -19.228 2.833 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.080 -18.299 0.730 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -6.605 -20.467 3.474 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.334 -20.621 3.800 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -9.299 -18.501 1.153 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -9.854 -19.512 2.491 1.00 0.00 H new ATOM 1480 N ALA A 92 -3.487 -13.914 2.420 1.00 0.00 N ATOM 1481 CA ALA A 92 -3.555 -12.678 3.189 1.00 0.00 C ATOM 1482 C ALA A 92 -3.604 -11.462 2.271 1.00 0.00 C ATOM 1483 O ALA A 92 -4.342 -10.511 2.525 1.00 0.00 O ATOM 1484 CB ALA A 92 -2.367 -12.580 4.136 1.00 0.00 C ATOM 0 H ALA A 92 -2.612 -14.427 2.523 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.473 -12.694 3.776 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.430 -11.652 4.704 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.378 -13.427 4.822 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.441 -12.591 3.561 1.00 0.00 H new ATOM 1490 N ALA A 93 -2.813 -11.500 1.204 1.00 0.00 N ATOM 1491 CA ALA A 93 -2.767 -10.400 0.248 1.00 0.00 C ATOM 1492 C ALA A 93 -4.102 -10.245 -0.474 1.00 0.00 C ATOM 1493 O ALA A 93 -4.573 -9.129 -0.695 1.00 0.00 O ATOM 1494 CB ALA A 93 -1.646 -10.620 -0.756 1.00 0.00 C ATOM 0 H ALA A 93 -2.195 -12.280 0.980 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.571 -9.480 0.799 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -1.623 -9.791 -1.464 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.693 -10.675 -0.231 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -1.818 -11.552 -1.294 1.00 0.00 H new ATOM 1500 N VAL A 94 -4.707 -11.372 -0.839 1.00 0.00 N ATOM 1501 CA VAL A 94 -5.988 -11.360 -1.535 1.00 0.00 C ATOM 1502 C VAL A 94 -7.024 -10.547 -0.767 1.00 0.00 C ATOM 1503 O VAL A 94 -7.671 -9.661 -1.325 1.00 0.00 O ATOM 1504 CB VAL A 94 -6.525 -12.787 -1.745 1.00 0.00 C ATOM 1505 CG1 VAL A 94 -8.020 -12.761 -2.023 1.00 0.00 C ATOM 1506 CG2 VAL A 94 -5.777 -13.477 -2.876 1.00 0.00 C ATOM 0 H VAL A 94 -4.330 -12.304 -0.664 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.816 -10.897 -2.507 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.360 -13.356 -0.830 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.381 -13.779 -2.169 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.539 -12.309 -1.178 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.213 -12.176 -2.922 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.170 -14.485 -3.010 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.908 -12.910 -3.798 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.716 -13.531 -2.631 1.00 0.00 H new ATOM 1516 N ARG A 95 -7.175 -10.853 0.517 1.00 0.00 N ATOM 1517 CA ARG A 95 -8.133 -10.152 1.363 1.00 0.00 C ATOM 1518 C ARG A 95 -7.859 -8.651 1.365 1.00 0.00 C ATOM 1519 O ARG A 95 -8.752 -7.845 1.100 1.00 0.00 O ATOM 1520 CB ARG A 95 -8.077 -10.694 2.793 1.00 0.00 C ATOM 1521 CG ARG A 95 -8.966 -9.938 3.766 1.00 0.00 C ATOM 1522 CD ARG A 95 -9.468 -10.841 4.881 1.00 0.00 C ATOM 1523 NE ARG A 95 -10.726 -11.497 4.529 1.00 0.00 N ATOM 1524 CZ ARG A 95 -11.222 -12.536 5.190 1.00 0.00 C ATOM 1525 NH1 ARG A 95 -10.571 -13.037 6.231 1.00 0.00 N ATOM 1526 NH2 ARG A 95 -12.372 -13.077 4.810 1.00 0.00 N ATOM 0 H ARG A 95 -6.646 -11.582 0.995 1.00 0.00 H new ATOM 0 HA ARG A 95 -9.130 -10.322 0.957 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -8.370 -11.744 2.786 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.047 -10.653 3.148 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.411 -9.104 4.195 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.815 -9.514 3.230 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.714 -11.597 5.103 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.607 -10.254 5.789 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.251 -11.137 3.732 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.686 -12.624 6.526 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -10.955 -13.835 6.737 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -12.876 -12.695 4.010 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -12.753 -13.875 5.318 1.00 0.00 H new ATOM 1540 N LEU A 96 -6.618 -8.282 1.666 1.00 0.00 N ATOM 1541 CA LEU A 96 -6.226 -6.877 1.704 1.00 0.00 C ATOM 1542 C LEU A 96 -6.748 -6.133 0.479 1.00 0.00 C ATOM 1543 O LEU A 96 -7.385 -5.087 0.601 1.00 0.00 O ATOM 1544 CB LEU A 96 -4.703 -6.756 1.778 1.00 0.00 C ATOM 1545 CG LEU A 96 -4.075 -7.008 3.150 1.00 0.00 C ATOM 1546 CD1 LEU A 96 -2.571 -7.190 3.022 1.00 0.00 C ATOM 1547 CD2 LEU A 96 -4.398 -5.867 4.102 1.00 0.00 C ATOM 0 H LEU A 96 -5.867 -8.936 1.887 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.665 -6.426 2.594 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.268 -7.458 1.067 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.422 -5.755 1.450 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.498 -7.925 3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.141 -7.368 4.008 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.361 -8.042 2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.131 -6.291 2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -3.943 -6.063 5.073 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.004 -4.934 3.699 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.479 -5.784 4.218 1.00 0.00 H new ATOM 1559 N ARG A 97 -6.475 -6.681 -0.700 1.00 0.00 N ATOM 1560 CA ARG A 97 -6.918 -6.069 -1.947 1.00 0.00 C ATOM 1561 C ARG A 97 -8.438 -5.934 -1.977 1.00 0.00 C ATOM 1562 O ARG A 97 -8.972 -4.945 -2.477 1.00 0.00 O ATOM 1563 CB ARG A 97 -6.446 -6.898 -3.143 1.00 0.00 C ATOM 1564 CG ARG A 97 -6.808 -6.290 -4.488 1.00 0.00 C ATOM 1565 CD ARG A 97 -6.343 -7.168 -5.640 1.00 0.00 C ATOM 1566 NE ARG A 97 -6.695 -6.598 -6.938 1.00 0.00 N ATOM 1567 CZ ARG A 97 -6.118 -5.515 -7.447 1.00 0.00 C ATOM 1568 NH1 ARG A 97 -5.166 -4.888 -6.770 1.00 0.00 N ATOM 1569 NH2 ARG A 97 -6.493 -5.058 -8.635 1.00 0.00 N ATOM 0 H ARG A 97 -5.949 -7.547 -0.818 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.480 -5.073 -2.008 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -5.364 -7.017 -3.087 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.880 -7.896 -3.076 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.888 -6.152 -4.547 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.355 -5.303 -4.576 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -5.262 -7.299 -5.583 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -6.790 -8.158 -5.545 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.424 -7.057 -7.484 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -4.875 -5.237 -5.857 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -4.724 -4.057 -7.162 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.225 -5.538 -9.158 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -6.049 -4.226 -9.025 1.00 0.00 H new ATOM 1583 N GLU A 98 -9.126 -6.936 -1.440 1.00 0.00 N ATOM 1584 CA GLU A 98 -10.584 -6.930 -1.406 1.00 0.00 C ATOM 1585 C GLU A 98 -11.100 -5.917 -0.389 1.00 0.00 C ATOM 1586 O GLU A 98 -11.722 -4.919 -0.751 1.00 0.00 O ATOM 1587 CB GLU A 98 -11.116 -8.324 -1.069 1.00 0.00 C ATOM 1588 CG GLU A 98 -11.059 -9.296 -2.237 1.00 0.00 C ATOM 1589 CD GLU A 98 -12.007 -8.916 -3.358 1.00 0.00 C ATOM 1590 OE1 GLU A 98 -11.692 -7.966 -4.104 1.00 0.00 O ATOM 1591 OE2 GLU A 98 -13.064 -9.569 -3.488 1.00 0.00 O ATOM 0 H GLU A 98 -8.698 -7.762 -1.023 1.00 0.00 H new ATOM 0 HA GLU A 98 -10.943 -6.642 -2.394 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.540 -8.733 -0.239 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -12.148 -8.238 -0.729 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -10.041 -9.334 -2.624 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.303 -10.298 -1.884 1.00 0.00 H new ATOM 1598 N GLN A 99 -10.837 -6.183 0.887 1.00 0.00 N ATOM 1599 CA GLN A 99 -11.277 -5.296 1.958 1.00 0.00 C ATOM 1600 C GLN A 99 -10.607 -3.931 1.842 1.00 0.00 C ATOM 1601 O GLN A 99 -11.277 -2.899 1.818 1.00 0.00 O ATOM 1602 CB GLN A 99 -10.966 -5.915 3.322 1.00 0.00 C ATOM 1603 CG GLN A 99 -11.668 -7.242 3.561 1.00 0.00 C ATOM 1604 CD GLN A 99 -11.753 -7.601 5.031 1.00 0.00 C ATOM 1605 OE1 GLN A 99 -11.637 -6.736 5.901 1.00 0.00 O ATOM 1606 NE2 GLN A 99 -11.956 -8.881 5.318 1.00 0.00 N ATOM 0 H GLN A 99 -10.322 -7.004 1.204 1.00 0.00 H new ATOM 0 HA GLN A 99 -12.355 -5.162 1.865 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -9.889 -6.062 3.408 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.256 -5.214 4.105 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -12.674 -7.197 3.143 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -11.137 -8.031 3.028 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -12.046 -9.564 4.566 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -12.022 -9.181 6.291 1.00 0.00 H new ATOM 1615 N GLY A 100 -9.280 -3.931 1.773 1.00 0.00 N ATOM 1616 CA GLY A 100 -8.541 -2.687 1.660 1.00 0.00 C ATOM 1617 C GLY A 100 -9.140 -1.749 0.631 1.00 0.00 C ATOM 1618 O GLY A 100 -9.169 -0.536 0.830 1.00 0.00 O ATOM 0 H GLY A 100 -8.702 -4.771 1.793 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.520 -2.191 2.630 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.508 -2.905 1.391 1.00 0.00 H new ATOM 1622 N GLY A 101 -9.615 -2.313 -0.475 1.00 0.00 N ATOM 1623 CA GLY A 101 -10.207 -1.503 -1.525 1.00 0.00 C ATOM 1624 C GLY A 101 -11.188 -0.481 -0.985 1.00 0.00 C ATOM 1625 O GLY A 101 -11.294 0.626 -1.513 1.00 0.00 O ATOM 0 H GLY A 101 -9.601 -3.315 -0.663 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.417 -0.990 -2.073 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.718 -2.152 -2.236 1.00 0.00 H new ATOM 1629 N ALA A 102 -11.909 -0.853 0.067 1.00 0.00 N ATOM 1630 CA ALA A 102 -12.885 0.039 0.678 1.00 0.00 C ATOM 1631 C ALA A 102 -12.202 1.236 1.331 1.00 0.00 C ATOM 1632 O ALA A 102 -12.726 2.350 1.310 1.00 0.00 O ATOM 1633 CB ALA A 102 -13.724 -0.714 1.700 1.00 0.00 C ATOM 0 H ALA A 102 -11.835 -1.767 0.514 1.00 0.00 H new ATOM 0 HA ALA A 102 -13.540 0.412 -0.109 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -14.449 -0.034 2.148 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -14.250 -1.532 1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -13.075 -1.116 2.478 1.00 0.00 H new ATOM 1639 N VAL A 103 -11.031 0.999 1.912 1.00 0.00 N ATOM 1640 CA VAL A 103 -10.276 2.058 2.571 1.00 0.00 C ATOM 1641 C VAL A 103 -9.770 3.082 1.562 1.00 0.00 C ATOM 1642 O VAL A 103 -9.834 4.288 1.800 1.00 0.00 O ATOM 1643 CB VAL A 103 -9.078 1.488 3.354 1.00 0.00 C ATOM 1644 CG1 VAL A 103 -8.214 2.614 3.902 1.00 0.00 C ATOM 1645 CG2 VAL A 103 -9.558 0.579 4.475 1.00 0.00 C ATOM 0 H VAL A 103 -10.584 0.083 1.940 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.957 2.546 3.268 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.469 0.894 2.672 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.373 2.192 4.452 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.841 3.221 3.077 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.809 3.237 4.570 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.698 0.185 5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.190 1.147 5.158 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.130 -0.247 4.054 1.00 0.00 H new ATOM 1655 N LEU A 104 -9.264 2.592 0.435 1.00 0.00 N ATOM 1656 CA LEU A 104 -8.747 3.466 -0.614 1.00 0.00 C ATOM 1657 C LEU A 104 -9.885 4.134 -1.379 1.00 0.00 C ATOM 1658 O LEU A 104 -9.749 5.261 -1.854 1.00 0.00 O ATOM 1659 CB LEU A 104 -7.866 2.670 -1.578 1.00 0.00 C ATOM 1660 CG LEU A 104 -6.525 2.190 -1.022 1.00 0.00 C ATOM 1661 CD1 LEU A 104 -5.889 1.177 -1.962 1.00 0.00 C ATOM 1662 CD2 LEU A 104 -5.590 3.368 -0.793 1.00 0.00 C ATOM 0 H LEU A 104 -9.201 1.596 0.224 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.148 4.244 -0.142 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.428 1.800 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.673 3.287 -2.455 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.704 1.703 -0.064 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.936 0.847 -1.550 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.552 0.319 -2.075 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.723 1.638 -2.936 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.641 3.007 -0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.417 3.884 -1.737 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.042 4.058 -0.080 1.00 0.00 H new ATOM 1674 N ARG A 105 -11.006 3.430 -1.492 1.00 0.00 N ATOM 1675 CA ARG A 105 -12.168 3.955 -2.199 1.00 0.00 C ATOM 1676 C ARG A 105 -12.847 5.055 -1.387 1.00 0.00 C ATOM 1677 O ARG A 105 -13.383 6.011 -1.948 1.00 0.00 O ATOM 1678 CB ARG A 105 -13.167 2.832 -2.487 1.00 0.00 C ATOM 1679 CG ARG A 105 -12.869 2.067 -3.767 1.00 0.00 C ATOM 1680 CD ARG A 105 -13.987 1.093 -4.107 1.00 0.00 C ATOM 1681 NE ARG A 105 -13.923 -0.119 -3.295 1.00 0.00 N ATOM 1682 CZ ARG A 105 -14.517 -1.258 -3.628 1.00 0.00 C ATOM 1683 NH1 ARG A 105 -15.216 -1.342 -4.751 1.00 0.00 N ATOM 1684 NH2 ARG A 105 -14.413 -2.319 -2.836 1.00 0.00 N ATOM 0 H ARG A 105 -11.134 2.496 -1.104 1.00 0.00 H new ATOM 0 HA ARG A 105 -11.826 4.380 -3.143 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.169 2.135 -1.649 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -14.169 3.256 -2.552 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -12.735 2.770 -4.589 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -11.931 1.522 -3.657 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -14.950 1.580 -3.956 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -13.927 0.826 -5.162 1.00 0.00 H new ATOM 0 HE ARG A 105 -13.393 -0.088 -2.424 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -15.299 -0.530 -5.362 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -15.671 -2.219 -5.004 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -13.876 -2.259 -1.971 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -14.870 -3.194 -3.093 1.00 0.00 H new ATOM 1698 N GLN A 106 -12.820 4.912 -0.067 1.00 0.00 N ATOM 1699 CA GLN A 106 -13.432 5.894 0.820 1.00 0.00 C ATOM 1700 C GLN A 106 -12.517 7.099 1.014 1.00 0.00 C ATOM 1701 O GLN A 106 -12.981 8.205 1.289 1.00 0.00 O ATOM 1702 CB GLN A 106 -13.751 5.259 2.175 1.00 0.00 C ATOM 1703 CG GLN A 106 -12.565 5.221 3.124 1.00 0.00 C ATOM 1704 CD GLN A 106 -12.955 4.810 4.530 1.00 0.00 C ATOM 1705 OE1 GLN A 106 -14.138 4.688 4.848 1.00 0.00 O ATOM 1706 NE2 GLN A 106 -11.960 4.594 5.382 1.00 0.00 N ATOM 0 H GLN A 106 -12.381 4.126 0.412 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.358 6.235 0.358 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.563 5.814 2.644 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -14.110 4.242 2.015 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -11.819 4.525 2.740 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -12.097 6.205 3.154 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -10.993 4.707 5.076 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -12.162 4.315 6.342 1.00 0.00 H new ATOM 1715 N ALA A 107 -11.216 6.877 0.866 1.00 0.00 N ATOM 1716 CA ALA A 107 -10.236 7.946 1.024 1.00 0.00 C ATOM 1717 C ALA A 107 -10.013 8.683 -0.292 1.00 0.00 C ATOM 1718 O ALA A 107 -9.627 9.852 -0.302 1.00 0.00 O ATOM 1719 CB ALA A 107 -8.922 7.384 1.545 1.00 0.00 C ATOM 0 H ALA A 107 -10.815 5.967 0.637 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.626 8.660 1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -8.200 8.193 1.658 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.088 6.908 2.511 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -8.536 6.649 0.839 1.00 0.00 H new ATOM 1725 N ARG A 108 -10.259 7.993 -1.401 1.00 0.00 N ATOM 1726 CA ARG A 108 -10.082 8.583 -2.723 1.00 0.00 C ATOM 1727 C ARG A 108 -10.917 9.851 -2.868 1.00 0.00 C ATOM 1728 O ARG A 108 -10.415 10.891 -3.294 1.00 0.00 O ATOM 1729 CB ARG A 108 -10.470 7.578 -3.809 1.00 0.00 C ATOM 1730 CG ARG A 108 -10.129 8.039 -5.216 1.00 0.00 C ATOM 1731 CD ARG A 108 -10.347 6.931 -6.234 1.00 0.00 C ATOM 1732 NE ARG A 108 -10.183 7.406 -7.605 1.00 0.00 N ATOM 1733 CZ ARG A 108 -11.055 8.202 -8.216 1.00 0.00 C ATOM 1734 NH1 ARG A 108 -12.146 8.607 -7.582 1.00 0.00 N ATOM 1735 NH2 ARG A 108 -10.836 8.593 -9.465 1.00 0.00 N ATOM 0 H ARG A 108 -10.581 7.025 -1.411 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.030 8.845 -2.839 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -9.965 6.632 -3.614 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -11.541 7.386 -3.748 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -10.744 8.900 -5.477 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -9.090 8.367 -5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -9.642 6.121 -6.044 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -11.348 6.518 -6.111 1.00 0.00 H new ATOM 0 HE ARG A 108 -9.355 7.111 -8.122 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -12.319 8.308 -6.622 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.813 9.218 -8.054 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -9.998 8.283 -9.957 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -11.506 9.204 -9.933 1.00 0.00 H new ATOM 1749 N ARG A 109 -12.194 9.758 -2.511 1.00 0.00 N ATOM 1750 CA ARG A 109 -13.098 10.898 -2.602 1.00 0.00 C ATOM 1751 C ARG A 109 -12.525 12.108 -1.870 1.00 0.00 C ATOM 1752 O ARG A 109 -12.732 13.249 -2.281 1.00 0.00 O ATOM 1753 CB ARG A 109 -14.466 10.538 -2.021 1.00 0.00 C ATOM 1754 CG ARG A 109 -14.432 10.218 -0.535 1.00 0.00 C ATOM 1755 CD ARG A 109 -15.645 9.403 -0.113 1.00 0.00 C ATOM 1756 NE ARG A 109 -15.534 8.006 -0.522 1.00 0.00 N ATOM 1757 CZ ARG A 109 -16.556 7.156 -0.520 1.00 0.00 C ATOM 1758 NH1 ARG A 109 -17.758 7.560 -0.131 1.00 0.00 N ATOM 1759 NH2 ARG A 109 -16.377 5.900 -0.906 1.00 0.00 N ATOM 0 H ARG A 109 -12.626 8.905 -2.156 1.00 0.00 H new ATOM 0 HA ARG A 109 -13.213 11.154 -3.655 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.153 11.368 -2.190 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -14.866 9.679 -2.560 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -13.522 9.666 -0.301 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -14.398 11.145 0.037 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -15.759 9.456 0.970 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -16.544 9.838 -0.549 1.00 0.00 H new ATOM 0 HE ARG A 109 -14.623 7.663 -0.826 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -17.900 8.525 0.168 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -18.541 6.906 -0.130 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -15.454 5.585 -1.205 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -17.162 5.249 -0.904 1.00 0.00 H new ATOM 1773 N GLN A 110 -11.804 11.848 -0.784 1.00 0.00 N ATOM 1774 CA GLN A 110 -11.202 12.916 0.005 1.00 0.00 C ATOM 1775 C GLN A 110 -10.116 13.634 -0.788 1.00 0.00 C ATOM 1776 O GLN A 110 -10.154 14.854 -0.949 1.00 0.00 O ATOM 1777 CB GLN A 110 -10.615 12.352 1.300 1.00 0.00 C ATOM 1778 CG GLN A 110 -11.611 11.548 2.121 1.00 0.00 C ATOM 1779 CD GLN A 110 -11.242 11.485 3.589 1.00 0.00 C ATOM 1780 OE1 GLN A 110 -10.972 10.411 4.128 1.00 0.00 O ATOM 1781 NE2 GLN A 110 -11.230 12.638 4.247 1.00 0.00 N ATOM 0 H GLN A 110 -11.623 10.908 -0.431 1.00 0.00 H new ATOM 0 HA GLN A 110 -11.983 13.636 0.250 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.762 11.718 1.057 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -10.238 13.175 1.907 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -12.602 11.991 2.018 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -11.671 10.536 1.722 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -11.460 13.505 3.761 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -10.990 12.657 5.238 1.00 0.00 H new ATOM 1790 N ALA A 111 -9.148 12.869 -1.283 1.00 0.00 N ATOM 1791 CA ALA A 111 -8.052 13.433 -2.062 1.00 0.00 C ATOM 1792 C ALA A 111 -8.577 14.236 -3.247 1.00 0.00 C ATOM 1793 O ALA A 111 -7.835 14.995 -3.870 1.00 0.00 O ATOM 1794 CB ALA A 111 -7.123 12.327 -2.541 1.00 0.00 C ATOM 0 H ALA A 111 -9.101 11.858 -1.158 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.491 14.111 -1.418 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.309 12.761 -3.121 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.713 11.798 -1.681 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -7.681 11.628 -3.165 1.00 0.00 H new ATOM 1800 N GLU A 112 -9.859 14.063 -3.553 1.00 0.00 N ATOM 1801 CA GLU A 112 -10.481 14.771 -4.664 1.00 0.00 C ATOM 1802 C GLU A 112 -11.282 15.971 -4.165 1.00 0.00 C ATOM 1803 O GLU A 112 -11.206 17.062 -4.731 1.00 0.00 O ATOM 1804 CB GLU A 112 -11.393 13.830 -5.453 1.00 0.00 C ATOM 1805 CG GLU A 112 -10.660 12.651 -6.072 1.00 0.00 C ATOM 1806 CD GLU A 112 -11.319 12.159 -7.346 1.00 0.00 C ATOM 1807 OE1 GLU A 112 -12.505 11.773 -7.290 1.00 0.00 O ATOM 1808 OE2 GLU A 112 -10.647 12.159 -8.398 1.00 0.00 O ATOM 0 H GLU A 112 -10.487 13.438 -3.047 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.688 15.131 -5.319 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.174 13.455 -4.792 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.888 14.395 -6.243 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.631 12.940 -6.288 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.617 11.835 -5.351 1.00 0.00 H new ATOM 1815 N LYS A 113 -12.049 15.762 -3.101 1.00 0.00 N ATOM 1816 CA LYS A 113 -12.863 16.824 -2.523 1.00 0.00 C ATOM 1817 C LYS A 113 -12.003 18.024 -2.142 1.00 0.00 C ATOM 1818 O LYS A 113 -12.463 19.165 -2.174 1.00 0.00 O ATOM 1819 CB LYS A 113 -13.613 16.308 -1.292 1.00 0.00 C ATOM 1820 CG LYS A 113 -12.823 16.438 -0.002 1.00 0.00 C ATOM 1821 CD LYS A 113 -13.635 15.977 1.197 1.00 0.00 C ATOM 1822 CE LYS A 113 -14.497 17.100 1.754 1.00 0.00 C ATOM 1823 NZ LYS A 113 -13.715 18.019 2.627 1.00 0.00 N ATOM 0 H LYS A 113 -12.124 14.865 -2.621 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.586 17.142 -3.274 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -14.550 16.856 -1.191 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -13.871 15.260 -1.447 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -11.909 15.848 -0.073 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -12.522 17.476 0.139 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.270 15.140 0.907 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -12.963 15.613 1.974 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -14.934 17.665 0.931 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -15.324 16.675 2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -14.338 18.770 2.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -13.319 17.485 3.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -12.941 18.444 2.078 1.00 0.00 H new ATOM 1837 N MET A 114 -10.751 17.757 -1.783 1.00 0.00 N ATOM 1838 CA MET A 114 -9.825 18.816 -1.397 1.00 0.00 C ATOM 1839 C MET A 114 -9.927 20.002 -2.354 1.00 0.00 C ATOM 1840 O MET A 114 -10.203 21.125 -1.937 1.00 0.00 O ATOM 1841 CB MET A 114 -8.391 18.286 -1.375 1.00 0.00 C ATOM 1842 CG MET A 114 -8.219 17.032 -0.535 1.00 0.00 C ATOM 1843 SD MET A 114 -6.568 16.892 0.176 1.00 0.00 S ATOM 1844 CE MET A 114 -6.855 15.676 1.461 1.00 0.00 C ATOM 0 H MET A 114 -10.355 16.818 -1.751 1.00 0.00 H new ATOM 0 HA MET A 114 -10.095 19.154 -0.396 1.00 0.00 H new ATOM 0 HB2 MET A 114 -8.075 18.075 -2.397 1.00 0.00 H new ATOM 0 HB3 MET A 114 -7.731 19.064 -0.991 1.00 0.00 H new ATOM 0 HG2 MET A 114 -8.957 17.033 0.267 1.00 0.00 H new ATOM 0 HG3 MET A 114 -8.420 16.156 -1.152 1.00 0.00 H new ATOM 0 HE1 MET A 114 -6.495 16.062 2.414 1.00 0.00 H new ATOM 0 HE2 MET A 114 -7.923 15.468 1.534 1.00 0.00 H new ATOM 0 HE3 MET A 114 -6.322 14.757 1.217 1.00 0.00 H new ATOM 1854 N GLY A 115 -9.701 19.742 -3.638 1.00 0.00 N ATOM 1855 CA GLY A 115 -9.771 20.796 -4.632 1.00 0.00 C ATOM 1856 C GLY A 115 -8.767 20.607 -5.752 1.00 0.00 C ATOM 1857 O GLY A 115 -7.564 20.773 -5.550 1.00 0.00 O ATOM 0 H GLY A 115 -9.471 18.820 -4.007 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -10.776 20.829 -5.052 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -9.595 21.758 -4.150 1.00 0.00 H new ATOM 1861 N SER A 116 -9.261 20.254 -6.934 1.00 0.00 N ATOM 1862 CA SER A 116 -8.397 20.036 -8.089 1.00 0.00 C ATOM 1863 C SER A 116 -9.039 20.585 -9.359 1.00 0.00 C ATOM 1864 O SER A 116 -10.226 20.375 -9.609 1.00 0.00 O ATOM 1865 CB SER A 116 -8.102 18.545 -8.256 1.00 0.00 C ATOM 1866 OG SER A 116 -7.285 18.065 -7.201 1.00 0.00 O ATOM 0 H SER A 116 -10.254 20.113 -7.118 1.00 0.00 H new ATOM 0 HA SER A 116 -7.461 20.568 -7.918 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.038 17.986 -8.279 1.00 0.00 H new ATOM 0 HB3 SER A 116 -7.606 18.374 -9.211 1.00 0.00 H new ATOM 0 HG SER A 116 -7.112 17.109 -7.330 1.00 0.00 H new ATOM 1872 N GLY A 117 -8.246 21.290 -10.160 1.00 0.00 N ATOM 1873 CA GLY A 117 -8.753 21.859 -11.394 1.00 0.00 C ATOM 1874 C GLY A 117 -7.957 21.417 -12.606 1.00 0.00 C ATOM 1875 O GLY A 117 -8.389 20.567 -13.384 1.00 0.00 O ATOM 0 H GLY A 117 -7.260 21.477 -9.976 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.796 21.569 -11.523 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -8.731 22.947 -11.325 1.00 0.00 H new ATOM 1879 N PRO A 118 -6.763 22.004 -12.780 1.00 0.00 N ATOM 1880 CA PRO A 118 -5.880 21.683 -13.905 1.00 0.00 C ATOM 1881 C PRO A 118 -5.285 20.283 -13.793 1.00 0.00 C ATOM 1882 O PRO A 118 -4.552 19.837 -14.677 1.00 0.00 O ATOM 1883 CB PRO A 118 -4.778 22.741 -13.805 1.00 0.00 C ATOM 1884 CG PRO A 118 -4.761 23.135 -12.369 1.00 0.00 C ATOM 1885 CD PRO A 118 -6.184 23.026 -11.892 1.00 0.00 C ATOM 0 HA PRO A 118 -6.413 21.691 -14.856 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -3.814 22.339 -14.117 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -4.990 23.596 -14.448 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -4.105 22.482 -11.793 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.386 24.151 -12.248 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -6.235 22.725 -10.846 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -6.710 23.977 -11.976 1.00 0.00 H new ATOM 1893 N SER A 119 -5.605 19.593 -12.703 1.00 0.00 N ATOM 1894 CA SER A 119 -5.101 18.245 -12.476 1.00 0.00 C ATOM 1895 C SER A 119 -5.927 17.218 -13.242 1.00 0.00 C ATOM 1896 O SER A 119 -5.385 16.385 -13.968 1.00 0.00 O ATOM 1897 CB SER A 119 -5.117 17.918 -10.981 1.00 0.00 C ATOM 1898 OG SER A 119 -4.092 16.996 -10.650 1.00 0.00 O ATOM 0 H SER A 119 -6.212 19.946 -11.963 1.00 0.00 H new ATOM 0 HA SER A 119 -4.074 18.202 -12.840 1.00 0.00 H new ATOM 0 HB2 SER A 119 -4.987 18.833 -10.404 1.00 0.00 H new ATOM 0 HB3 SER A 119 -6.087 17.503 -10.707 1.00 0.00 H new ATOM 0 HG SER A 119 -4.122 16.804 -9.689 1.00 0.00 H new ATOM 1904 N SER A 120 -7.244 17.284 -13.075 1.00 0.00 N ATOM 1905 CA SER A 120 -8.148 16.359 -13.748 1.00 0.00 C ATOM 1906 C SER A 120 -7.789 16.226 -15.224 1.00 0.00 C ATOM 1907 O SER A 120 -7.458 15.140 -15.699 1.00 0.00 O ATOM 1908 CB SER A 120 -9.596 16.830 -13.603 1.00 0.00 C ATOM 1909 OG SER A 120 -9.995 16.844 -12.244 1.00 0.00 O ATOM 0 H SER A 120 -7.709 17.969 -12.479 1.00 0.00 H new ATOM 0 HA SER A 120 -8.044 15.381 -13.277 1.00 0.00 H new ATOM 0 HB2 SER A 120 -9.701 17.829 -14.026 1.00 0.00 H new ATOM 0 HB3 SER A 120 -10.254 16.173 -14.171 1.00 0.00 H new ATOM 0 HG SER A 120 -10.924 17.150 -12.179 1.00 0.00 H new ATOM 1915 N GLY A 121 -7.859 17.339 -15.946 1.00 0.00 N ATOM 1916 CA GLY A 121 -7.540 17.328 -17.362 1.00 0.00 C ATOM 1917 C GLY A 121 -8.471 18.206 -18.175 1.00 0.00 C ATOM 1918 O GLY A 121 -8.791 17.890 -19.320 1.00 0.00 O ATOM 0 H GLY A 121 -8.131 18.250 -15.576 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -6.513 17.666 -17.502 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -7.593 16.305 -17.735 1.00 0.00 H new TER 1922 GLY A 121