USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1047 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 103 SER OG : rot -40:sc= 0.959 USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0.836 USER MOD Set 2.1: A 95 GLN : amide:sc= 1.18 K(o=1.9,f=0.51) USER MOD Set 2.2: A 102 THR OG1 : rot -20:sc= 0.715 USER MOD Set 3.1: A 82 SER OG : rot -166:sc= 0.872 USER MOD Set 3.2: A 93 HIS : no HE2:sc= 0.271 K(o=1.1,f=-7.5!) USER MOD Single : A 1 VAL N :NH3+ -179:sc= -0.287 (180deg=-0.31) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0139 USER MOD Single : A 9 LYS NZ :NH3+ 142:sc= -0.181 (180deg=-1.1) USER MOD Single : A 13 SER OG : rot -130:sc= 0.639 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 1.31 K(o=1.3,f=-0.29) USER MOD Single : A 19 TYR OH : rot 30:sc= -0.0731 USER MOD Single : A 20 MET CE :methyl 159:sc= -0.313 (180deg=-1.66) USER MOD Single : A 21 LYS NZ :NH3+ 163:sc= 1.61 (180deg=0.571) USER MOD Single : A 22 SER OG : rot 33:sc= 1.2 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.943 K(o=-0.94,f=-7.5!) USER MOD Single : A 34 ASN : amide:sc= 0.723 K(o=0.72,f=-7.6!) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0139 USER MOD Single : A 37 LYS NZ :NH3+ 140:sc= 1.2 (180deg=0.759) USER MOD Single : A 39 THR OG1 : rot 84:sc= 0.687 USER MOD Single : A 40 THR OG1 : rot 128:sc= 0.955 USER MOD Single : A 45 ASN : amide:sc= 1.1 K(o=1.1,f=-2.5!) USER MOD Single : A 48 THR OG1 : rot -91:sc= 1.13 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 GLN :FLIP amide:sc= -0.181 F(o=-0.86,f=-0.18) USER MOD Single : A 55 SER OG : rot -55:sc= 0.452 USER MOD Single : A 56 THR OG1 : rot -122:sc= 0.248 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -0.0863 K(o=-0.086,f=-2!) USER MOD Single : A 60 THR OG1 : rot 180:sc=-0.00423 USER MOD Single : A 63 SER OG : rot 35:sc= 0.173 USER MOD Single : A 65 LYS NZ :NH3+ -169:sc= 1.28 (180deg=1.11) USER MOD Single : A 73 THR OG1 : rot 126:sc= 1.25 USER MOD Single : A 74 THR OG1 : rot -175:sc= 1.01 USER MOD Single : A 79 LYS NZ :NH3+ 163:sc= 0.634 (180deg=-0.579) USER MOD Single : A 81 LYS NZ :NH3+ -134:sc= -0.0944 (180deg=-1.08) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 155:sc= 0.258 (180deg=-2.31!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -1.49 X(o=-1.5,f=-1.5) USER MOD Single : A 100 GLN : amide:sc= -0.576! C(o=-0.58!,f=-8.8!) USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -173:sc= 1.1 (180deg=1.01) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -1.26 X(o=-1.3,f=-1.1) USER MOD Single : A 121 THR OG1 : rot 79:sc= 1.07 USER MOD Single : A 124 CYS SG : rot 66:sc= 0.671 USER MOD Single : A 125 THR OG1 : rot 35:sc= 0.0492 USER MOD Single : A 127 THR OG1 : rot 23:sc= 0.419 USER MOD Single : A 128 TYR OH : rot 165:sc= 1.15 USER MOD Single : A 130 LYS NZ :NH3+ 126:sc= 2.38 (180deg=-0.546) USER MOD Single : A 131 GLN : amide:sc= -0.348 X(o=-0.35,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.507 -12.981 -4.415 1.00 0.00 N ATOM 2 CA VAL A 1 10.443 -12.160 -3.216 1.00 0.00 C ATOM 3 C VAL A 1 11.718 -11.321 -3.050 1.00 0.00 C ATOM 4 O VAL A 1 11.663 -10.182 -2.577 1.00 0.00 O ATOM 5 CB VAL A 1 10.110 -13.047 -2.000 1.00 0.00 C ATOM 6 CG1 VAL A 1 11.180 -14.102 -1.696 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.850 -12.214 -0.740 1.00 0.00 C ATOM 0 H1 VAL A 1 9.625 -13.524 -4.511 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.630 -12.370 -5.248 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.312 -13.636 -4.345 1.00 0.00 H new ATOM 0 HA VAL A 1 9.636 -11.433 -3.305 1.00 0.00 H new ATOM 0 HB VAL A 1 9.199 -13.574 -2.283 1.00 0.00 H new ATOM 0 HG11 VAL A 1 10.877 -14.688 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 1 11.296 -14.761 -2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.129 -13.608 -1.487 1.00 0.00 H new ATOM 0 HG21 VAL A 1 9.619 -12.877 0.093 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.737 -11.628 -0.502 1.00 0.00 H new ATOM 0 HG23 VAL A 1 9.008 -11.544 -0.914 1.00 0.00 H new ATOM 19 N ASP A 2 12.854 -11.886 -3.472 1.00 0.00 N ATOM 20 CA ASP A 2 14.227 -11.428 -3.281 1.00 0.00 C ATOM 21 C ASP A 2 14.545 -10.217 -4.164 1.00 0.00 C ATOM 22 O ASP A 2 15.502 -10.211 -4.936 1.00 0.00 O ATOM 23 CB ASP A 2 15.183 -12.594 -3.605 1.00 0.00 C ATOM 24 CG ASP A 2 14.715 -13.934 -3.054 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.680 -14.405 -3.584 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.366 -14.436 -2.115 1.00 0.00 O ATOM 0 H ASP A 2 12.829 -12.756 -4.005 1.00 0.00 H new ATOM 0 HA ASP A 2 14.355 -11.113 -2.245 1.00 0.00 H new ATOM 0 HB2 ASP A 2 15.293 -12.673 -4.687 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.169 -12.368 -3.200 1.00 0.00 H new ATOM 31 N ALA A 3 13.728 -9.175 -4.055 1.00 0.00 N ATOM 32 CA ALA A 3 13.795 -7.987 -4.883 1.00 0.00 C ATOM 33 C ALA A 3 13.076 -6.860 -4.159 1.00 0.00 C ATOM 34 O ALA A 3 13.636 -5.778 -3.989 1.00 0.00 O ATOM 35 CB ALA A 3 13.148 -8.258 -6.246 1.00 0.00 C ATOM 0 H ALA A 3 12.978 -9.138 -3.364 1.00 0.00 H new ATOM 0 HA ALA A 3 14.833 -7.706 -5.058 1.00 0.00 H new ATOM 0 HB1 ALA A 3 13.204 -7.359 -6.860 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.676 -9.071 -6.744 1.00 0.00 H new ATOM 0 HB3 ALA A 3 12.104 -8.536 -6.104 1.00 0.00 H new ATOM 41 N PHE A 4 11.840 -7.129 -3.727 1.00 0.00 N ATOM 42 CA PHE A 4 10.961 -6.159 -3.093 1.00 0.00 C ATOM 43 C PHE A 4 11.612 -5.564 -1.850 1.00 0.00 C ATOM 44 O PHE A 4 11.617 -4.343 -1.696 1.00 0.00 O ATOM 45 CB PHE A 4 9.615 -6.824 -2.787 1.00 0.00 C ATOM 46 CG PHE A 4 8.969 -7.451 -4.009 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.823 -6.698 -5.190 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.670 -8.824 -4.022 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.469 -7.329 -6.393 1.00 0.00 C ATOM 50 CE2 PHE A 4 8.304 -9.454 -5.225 1.00 0.00 C ATOM 51 CZ PHE A 4 8.224 -8.712 -6.414 1.00 0.00 C ATOM 0 H PHE A 4 11.418 -8.054 -3.814 1.00 0.00 H new ATOM 0 HA PHE A 4 10.782 -5.326 -3.772 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.760 -7.591 -2.026 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.937 -6.082 -2.366 1.00 0.00 H new ATOM 0 HD1 PHE A 4 8.984 -5.630 -5.170 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.721 -9.396 -3.107 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.385 -6.752 -7.302 1.00 0.00 H new ATOM 0 HE2 PHE A 4 8.084 -10.511 -5.234 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.975 -9.203 -7.343 1.00 0.00 H new ATOM 61 N VAL A 5 12.176 -6.442 -1.015 1.00 0.00 N ATOM 62 CA VAL A 5 12.867 -6.131 0.230 1.00 0.00 C ATOM 63 C VAL A 5 13.703 -4.850 0.116 1.00 0.00 C ATOM 64 O VAL A 5 14.699 -4.823 -0.606 1.00 0.00 O ATOM 65 CB VAL A 5 13.693 -7.362 0.665 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.804 -7.774 -0.308 1.00 0.00 C ATOM 67 CG2 VAL A 5 14.309 -7.157 2.051 1.00 0.00 C ATOM 0 H VAL A 5 12.159 -7.444 -1.205 1.00 0.00 H new ATOM 0 HA VAL A 5 12.136 -5.920 1.011 1.00 0.00 H new ATOM 0 HB VAL A 5 12.966 -8.174 0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.326 -8.646 0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 5 14.367 -8.018 -1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 5 15.509 -6.951 -0.425 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.884 -8.041 2.328 1.00 0.00 H new ATOM 0 HG22 VAL A 5 14.966 -6.288 2.032 1.00 0.00 H new ATOM 0 HG23 VAL A 5 13.516 -6.996 2.781 1.00 0.00 H new ATOM 77 N GLY A 6 13.297 -3.773 0.791 1.00 0.00 N ATOM 78 CA GLY A 6 14.045 -2.523 0.836 1.00 0.00 C ATOM 79 C GLY A 6 13.106 -1.334 0.672 1.00 0.00 C ATOM 80 O GLY A 6 11.970 -1.382 1.137 1.00 0.00 O ATOM 0 H GLY A 6 12.429 -3.748 1.327 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.578 -2.445 1.784 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.796 -2.513 0.046 1.00 0.00 H new ATOM 84 N THR A 7 13.584 -0.264 0.027 1.00 0.00 N ATOM 85 CA THR A 7 12.833 0.969 -0.156 1.00 0.00 C ATOM 86 C THR A 7 12.875 1.415 -1.615 1.00 0.00 C ATOM 87 O THR A 7 13.943 1.434 -2.233 1.00 0.00 O ATOM 88 CB THR A 7 13.383 2.062 0.770 1.00 0.00 C ATOM 89 OG1 THR A 7 13.457 1.577 2.092 1.00 0.00 O ATOM 90 CG2 THR A 7 12.473 3.294 0.767 1.00 0.00 C ATOM 0 H THR A 7 14.516 -0.236 -0.386 1.00 0.00 H new ATOM 0 HA THR A 7 11.791 0.787 0.106 1.00 0.00 H new ATOM 0 HB THR A 7 14.372 2.339 0.405 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.810 2.278 2.678 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.886 4.053 1.431 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.406 3.695 -0.245 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.478 3.012 1.112 1.00 0.00 H new ATOM 98 N TRP A 8 11.707 1.803 -2.132 1.00 0.00 N ATOM 99 CA TRP A 8 11.499 2.302 -3.477 1.00 0.00 C ATOM 100 C TRP A 8 10.966 3.734 -3.420 1.00 0.00 C ATOM 101 O TRP A 8 10.484 4.174 -2.374 1.00 0.00 O ATOM 102 CB TRP A 8 10.527 1.376 -4.215 1.00 0.00 C ATOM 103 CG TRP A 8 10.849 -0.087 -4.190 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.628 -0.931 -3.155 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.444 -0.902 -5.244 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.050 -2.200 -3.490 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.554 -2.241 -4.775 1.00 0.00 C ATOM 108 CE3 TRP A 8 11.889 -0.644 -6.558 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.087 -3.268 -5.569 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.464 -1.659 -7.348 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.557 -2.970 -6.856 1.00 0.00 C ATOM 0 H TRP A 8 10.843 1.773 -1.590 1.00 0.00 H new ATOM 0 HA TRP A 8 12.444 2.316 -4.021 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.534 1.514 -3.788 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.474 1.696 -5.256 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.187 -0.652 -2.209 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.997 -3.006 -2.868 1.00 0.00 H new ATOM 0 HE3 TRP A 8 11.787 0.351 -6.966 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.135 -4.279 -5.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 12.834 -1.427 -8.336 1.00 0.00 H new ATOM 0 HH2 TRP A 8 12.990 -3.748 -7.468 1.00 0.00 H new ATOM 122 N LYS A 9 11.061 4.465 -4.533 1.00 0.00 N ATOM 123 CA LYS A 9 10.564 5.830 -4.673 1.00 0.00 C ATOM 124 C LYS A 9 9.860 5.958 -6.026 1.00 0.00 C ATOM 125 O LYS A 9 10.401 5.487 -7.025 1.00 0.00 O ATOM 126 CB LYS A 9 11.751 6.801 -4.570 1.00 0.00 C ATOM 127 CG LYS A 9 11.338 8.147 -3.963 1.00 0.00 C ATOM 128 CD LYS A 9 12.415 9.238 -4.094 1.00 0.00 C ATOM 129 CE LYS A 9 13.821 8.826 -3.621 1.00 0.00 C ATOM 130 NZ LYS A 9 14.584 8.086 -4.652 1.00 0.00 N ATOM 0 H LYS A 9 11.498 4.111 -5.384 1.00 0.00 H new ATOM 0 HA LYS A 9 9.850 6.070 -3.885 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.535 6.353 -3.959 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.173 6.964 -5.561 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.424 8.490 -4.448 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.104 8.004 -2.908 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.475 9.544 -5.138 1.00 0.00 H new ATOM 0 HD3 LYS A 9 12.098 10.111 -3.523 1.00 0.00 H new ATOM 0 HE2 LYS A 9 14.378 9.718 -3.335 1.00 0.00 H new ATOM 0 HE3 LYS A 9 13.731 8.206 -2.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 15.583 8.372 -4.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.510 7.064 -4.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 14.195 8.301 -5.592 1.00 0.00 H new ATOM 144 N LEU A 10 8.660 6.547 -6.062 1.00 0.00 N ATOM 145 CA LEU A 10 7.882 6.669 -7.294 1.00 0.00 C ATOM 146 C LEU A 10 8.610 7.487 -8.363 1.00 0.00 C ATOM 147 O LEU A 10 9.288 8.460 -8.030 1.00 0.00 O ATOM 148 CB LEU A 10 6.534 7.318 -6.970 1.00 0.00 C ATOM 149 CG LEU A 10 5.616 7.442 -8.199 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.188 7.073 -7.813 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.612 8.855 -8.797 1.00 0.00 C ATOM 0 H LEU A 10 8.205 6.949 -5.242 1.00 0.00 H new ATOM 0 HA LEU A 10 7.737 5.668 -7.701 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.029 6.730 -6.204 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.706 8.309 -6.550 1.00 0.00 H new ATOM 0 HG LEU A 10 6.007 6.760 -8.954 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.541 7.162 -8.685 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.164 6.047 -7.446 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.837 7.746 -7.031 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.948 8.883 -9.661 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.263 9.566 -8.048 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.622 9.121 -9.108 1.00 0.00 H new ATOM 163 N VAL A 11 8.388 7.149 -9.641 1.00 0.00 N ATOM 164 CA VAL A 11 8.729 8.021 -10.762 1.00 0.00 C ATOM 165 C VAL A 11 7.551 8.160 -11.739 1.00 0.00 C ATOM 166 O VAL A 11 6.949 9.231 -11.809 1.00 0.00 O ATOM 167 CB VAL A 11 10.065 7.593 -11.398 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.084 6.150 -11.910 1.00 0.00 C ATOM 169 CG2 VAL A 11 10.479 8.544 -12.527 1.00 0.00 C ATOM 0 H VAL A 11 7.967 6.263 -9.921 1.00 0.00 H new ATOM 0 HA VAL A 11 8.900 9.034 -10.399 1.00 0.00 H new ATOM 0 HB VAL A 11 10.788 7.648 -10.584 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.060 5.930 -12.342 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.892 5.468 -11.082 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.314 6.024 -12.671 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.426 8.212 -12.953 1.00 0.00 H new ATOM 0 HG22 VAL A 11 9.712 8.544 -13.302 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.594 9.552 -12.130 1.00 0.00 H new ATOM 179 N ASP A 12 7.208 7.104 -12.485 1.00 0.00 N ATOM 180 CA ASP A 12 6.212 7.168 -13.556 1.00 0.00 C ATOM 181 C ASP A 12 4.852 6.773 -12.984 1.00 0.00 C ATOM 182 O ASP A 12 4.787 5.903 -12.114 1.00 0.00 O ATOM 183 CB ASP A 12 6.590 6.259 -14.742 1.00 0.00 C ATOM 184 CG ASP A 12 8.015 6.475 -15.244 1.00 0.00 C ATOM 185 OD1 ASP A 12 8.293 7.606 -15.686 1.00 0.00 O ATOM 186 OD2 ASP A 12 8.815 5.513 -15.174 1.00 0.00 O ATOM 0 H ASP A 12 7.616 6.178 -12.361 1.00 0.00 H new ATOM 0 HA ASP A 12 6.172 8.187 -13.941 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.472 5.217 -14.443 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.894 6.436 -15.562 1.00 0.00 H new ATOM 191 N SER A 13 3.761 7.399 -13.450 1.00 0.00 N ATOM 192 CA SER A 13 2.422 7.182 -12.901 1.00 0.00 C ATOM 193 C SER A 13 1.323 7.864 -13.734 1.00 0.00 C ATOM 194 O SER A 13 0.406 8.452 -13.157 1.00 0.00 O ATOM 195 CB SER A 13 2.385 7.663 -11.437 1.00 0.00 C ATOM 196 OG SER A 13 1.144 7.336 -10.837 1.00 0.00 O ATOM 0 H SER A 13 3.786 8.069 -14.218 1.00 0.00 H new ATOM 0 HA SER A 13 2.213 6.113 -12.940 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.199 7.203 -10.876 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.541 8.741 -11.398 1.00 0.00 H new ATOM 0 HG SER A 13 0.772 8.131 -10.400 1.00 0.00 H new ATOM 202 N LYS A 14 1.374 7.782 -15.068 1.00 0.00 N ATOM 203 CA LYS A 14 0.400 8.486 -15.905 1.00 0.00 C ATOM 204 C LYS A 14 -1.030 7.960 -15.707 1.00 0.00 C ATOM 205 O LYS A 14 -1.229 6.817 -15.292 1.00 0.00 O ATOM 206 CB LYS A 14 0.820 8.496 -17.384 1.00 0.00 C ATOM 207 CG LYS A 14 0.924 7.103 -18.021 1.00 0.00 C ATOM 208 CD LYS A 14 0.866 7.167 -19.556 1.00 0.00 C ATOM 209 CE LYS A 14 2.008 8.004 -20.157 1.00 0.00 C ATOM 210 NZ LYS A 14 1.970 8.021 -21.635 1.00 0.00 N ATOM 0 H LYS A 14 2.069 7.243 -15.584 1.00 0.00 H new ATOM 0 HA LYS A 14 0.390 9.524 -15.572 1.00 0.00 H new ATOM 0 HB2 LYS A 14 0.101 9.089 -17.950 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.785 8.996 -17.472 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.857 6.632 -17.713 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.113 6.474 -17.653 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.910 6.156 -19.960 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.090 7.591 -19.862 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.944 9.025 -19.782 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.965 7.602 -19.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.757 8.597 -21.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.057 7.049 -21.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.068 8.429 -21.954 1.00 0.00 H new ATOM 224 N ASN A 15 -2.024 8.808 -15.996 1.00 0.00 N ATOM 225 CA ASN A 15 -3.456 8.508 -15.896 1.00 0.00 C ATOM 226 C ASN A 15 -3.861 8.104 -14.470 1.00 0.00 C ATOM 227 O ASN A 15 -4.836 7.386 -14.260 1.00 0.00 O ATOM 228 CB ASN A 15 -3.855 7.462 -16.953 1.00 0.00 C ATOM 229 CG ASN A 15 -5.327 7.557 -17.367 1.00 0.00 C ATOM 230 OD1 ASN A 15 -5.623 8.067 -18.442 1.00 0.00 O ATOM 231 ND2 ASN A 15 -6.248 7.098 -16.529 1.00 0.00 N ATOM 0 H ASN A 15 -1.845 9.759 -16.318 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.016 9.418 -16.110 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.227 7.588 -17.835 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.658 6.464 -16.561 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.237 7.164 -16.772 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.967 6.679 -15.642 1.00 0.00 H new ATOM 238 N PHE A 16 -3.105 8.554 -13.464 1.00 0.00 N ATOM 239 CA PHE A 16 -3.430 8.293 -12.069 1.00 0.00 C ATOM 240 C PHE A 16 -4.594 9.177 -11.633 1.00 0.00 C ATOM 241 O PHE A 16 -5.554 8.674 -11.053 1.00 0.00 O ATOM 242 CB PHE A 16 -2.190 8.509 -11.201 1.00 0.00 C ATOM 243 CG PHE A 16 -2.372 8.224 -9.721 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.264 6.908 -9.234 1.00 0.00 C ATOM 245 CD2 PHE A 16 -2.531 9.288 -8.816 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.254 6.666 -7.849 1.00 0.00 C ATOM 247 CE2 PHE A 16 -2.486 9.049 -7.433 1.00 0.00 C ATOM 248 CZ PHE A 16 -2.345 7.739 -6.947 1.00 0.00 C ATOM 0 H PHE A 16 -2.257 9.105 -13.598 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.742 7.256 -11.948 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.388 7.875 -11.579 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.862 9.542 -11.317 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.189 6.082 -9.926 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -2.688 10.291 -9.185 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.176 5.655 -7.478 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -2.560 9.875 -6.741 1.00 0.00 H new ATOM 0 HZ PHE A 16 -2.307 7.557 -5.883 1.00 0.00 H new ATOM 258 N ASP A 17 -4.501 10.483 -11.905 1.00 0.00 N ATOM 259 CA ASP A 17 -5.538 11.447 -11.558 1.00 0.00 C ATOM 260 C ASP A 17 -6.906 10.925 -11.992 1.00 0.00 C ATOM 261 O ASP A 17 -7.783 10.652 -11.167 1.00 0.00 O ATOM 262 CB ASP A 17 -5.239 12.798 -12.218 1.00 0.00 C ATOM 263 CG ASP A 17 -6.451 13.718 -12.118 1.00 0.00 C ATOM 264 OD1 ASP A 17 -6.549 14.406 -11.081 1.00 0.00 O ATOM 265 OD2 ASP A 17 -7.266 13.688 -13.062 1.00 0.00 O ATOM 0 H ASP A 17 -3.697 10.899 -12.375 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.550 11.585 -10.477 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.380 13.264 -11.735 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -4.974 12.648 -13.265 1.00 0.00 H new ATOM 270 N ASP A 18 -7.016 10.730 -13.307 1.00 0.00 N ATOM 271 CA ASP A 18 -8.189 10.262 -14.014 1.00 0.00 C ATOM 272 C ASP A 18 -8.838 9.062 -13.320 1.00 0.00 C ATOM 273 O ASP A 18 -10.043 9.043 -13.080 1.00 0.00 O ATOM 274 CB ASP A 18 -7.785 9.920 -15.444 1.00 0.00 C ATOM 275 CG ASP A 18 -8.939 9.243 -16.156 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.990 9.919 -16.237 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.759 8.066 -16.539 1.00 0.00 O ATOM 0 H ASP A 18 -6.235 10.908 -13.938 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.940 11.052 -14.019 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.498 10.826 -15.977 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.914 9.264 -15.439 1.00 0.00 H new ATOM 282 N TYR A 19 -8.015 8.071 -12.974 1.00 0.00 N ATOM 283 CA TYR A 19 -8.439 6.849 -12.308 1.00 0.00 C ATOM 284 C TYR A 19 -9.200 7.158 -11.007 1.00 0.00 C ATOM 285 O TYR A 19 -10.244 6.562 -10.729 1.00 0.00 O ATOM 286 CB TYR A 19 -7.187 5.991 -12.077 1.00 0.00 C ATOM 287 CG TYR A 19 -7.415 4.521 -11.794 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.613 4.090 -10.472 1.00 0.00 C ATOM 289 CD2 TYR A 19 -7.170 3.574 -12.805 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.531 2.724 -10.153 1.00 0.00 C ATOM 291 CE2 TYR A 19 -7.118 2.207 -12.488 1.00 0.00 C ATOM 292 CZ TYR A 19 -7.274 1.785 -11.162 1.00 0.00 C ATOM 293 OH TYR A 19 -7.115 0.472 -10.842 1.00 0.00 O ATOM 0 H TYR A 19 -7.012 8.101 -13.156 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.144 6.294 -12.928 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.550 6.074 -12.958 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.632 6.417 -11.241 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.829 4.811 -9.698 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -7.022 3.898 -13.825 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.666 2.398 -9.132 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.957 1.479 -13.269 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.645 0.263 -10.045 1.00 0.00 H new ATOM 303 N MET A 20 -8.686 8.093 -10.196 1.00 0.00 N ATOM 304 CA MET A 20 -9.376 8.525 -8.983 1.00 0.00 C ATOM 305 C MET A 20 -10.540 9.456 -9.315 1.00 0.00 C ATOM 306 O MET A 20 -11.580 9.392 -8.661 1.00 0.00 O ATOM 307 CB MET A 20 -8.406 9.165 -7.985 1.00 0.00 C ATOM 308 CG MET A 20 -7.446 8.119 -7.414 1.00 0.00 C ATOM 309 SD MET A 20 -5.926 7.841 -8.355 1.00 0.00 S ATOM 310 CE MET A 20 -5.529 6.170 -7.773 1.00 0.00 C ATOM 0 H MET A 20 -7.795 8.561 -10.362 1.00 0.00 H new ATOM 0 HA MET A 20 -9.792 7.639 -8.503 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.839 9.955 -8.477 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.966 9.632 -7.175 1.00 0.00 H new ATOM 0 HG2 MET A 20 -7.174 8.419 -6.402 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.979 7.171 -7.334 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.864 5.684 -8.487 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.037 6.230 -6.802 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.447 5.590 -7.679 1.00 0.00 H new ATOM 320 N LYS A 21 -10.410 10.263 -10.367 1.00 0.00 N ATOM 321 CA LYS A 21 -11.472 11.077 -10.945 1.00 0.00 C ATOM 322 C LYS A 21 -12.452 10.169 -11.710 1.00 0.00 C ATOM 323 O LYS A 21 -12.736 10.399 -12.886 1.00 0.00 O ATOM 324 CB LYS A 21 -10.791 12.091 -11.873 1.00 0.00 C ATOM 325 CG LYS A 21 -11.679 13.199 -12.450 1.00 0.00 C ATOM 326 CD LYS A 21 -11.101 13.672 -13.798 1.00 0.00 C ATOM 327 CE LYS A 21 -11.726 12.973 -15.024 1.00 0.00 C ATOM 328 NZ LYS A 21 -11.577 11.499 -15.042 1.00 0.00 N ATOM 0 H LYS A 21 -9.523 10.370 -10.859 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.050 11.602 -10.185 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.975 12.560 -11.324 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.344 11.545 -12.704 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.695 12.830 -12.587 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -11.735 14.035 -11.753 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.251 14.748 -13.889 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.025 13.499 -13.802 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.788 13.217 -15.062 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.273 13.381 -15.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.252 11.090 -15.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.608 11.252 -15.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.767 11.119 -14.093 1.00 0.00 H new ATOM 342 N SER A 22 -12.939 9.118 -11.047 1.00 0.00 N ATOM 343 CA SER A 22 -13.774 8.038 -11.553 1.00 0.00 C ATOM 344 C SER A 22 -14.077 7.115 -10.373 1.00 0.00 C ATOM 345 O SER A 22 -15.235 6.942 -10.005 1.00 0.00 O ATOM 346 CB SER A 22 -13.085 7.252 -12.681 1.00 0.00 C ATOM 347 OG SER A 22 -13.170 7.945 -13.905 1.00 0.00 O ATOM 0 H SER A 22 -12.738 8.995 -10.055 1.00 0.00 H new ATOM 0 HA SER A 22 -14.687 8.452 -11.981 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.039 7.085 -12.426 1.00 0.00 H new ATOM 0 HB3 SER A 22 -13.549 6.271 -12.782 1.00 0.00 H new ATOM 0 HG SER A 22 -13.147 8.910 -13.737 1.00 0.00 H new ATOM 353 N LEU A 23 -13.039 6.537 -9.753 1.00 0.00 N ATOM 354 CA LEU A 23 -13.240 5.694 -8.576 1.00 0.00 C ATOM 355 C LEU A 23 -13.636 6.492 -7.333 1.00 0.00 C ATOM 356 O LEU A 23 -14.139 5.909 -6.376 1.00 0.00 O ATOM 357 CB LEU A 23 -11.990 4.858 -8.291 1.00 0.00 C ATOM 358 CG LEU A 23 -11.767 3.725 -9.301 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.525 2.940 -8.879 1.00 0.00 C ATOM 360 CD2 LEU A 23 -12.963 2.765 -9.338 1.00 0.00 C ATOM 0 H LEU A 23 -12.067 6.638 -10.045 1.00 0.00 H new ATOM 0 HA LEU A 23 -14.074 5.032 -8.808 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.118 5.512 -8.292 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.068 4.432 -7.291 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.644 4.161 -10.292 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.350 2.129 -9.586 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.661 3.605 -8.868 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.677 2.526 -7.882 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.773 1.974 -10.064 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.107 2.325 -8.351 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.860 3.313 -9.626 1.00 0.00 H new ATOM 372 N GLY A 24 -13.362 7.798 -7.309 1.00 0.00 N ATOM 373 CA GLY A 24 -13.736 8.686 -6.220 1.00 0.00 C ATOM 374 C GLY A 24 -12.640 8.812 -5.161 1.00 0.00 C ATOM 375 O GLY A 24 -12.635 9.801 -4.428 1.00 0.00 O ATOM 0 H GLY A 24 -12.864 8.271 -8.063 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -13.962 9.673 -6.623 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.648 8.316 -5.751 1.00 0.00 H new ATOM 379 N VAL A 25 -11.732 7.824 -5.082 1.00 0.00 N ATOM 380 CA VAL A 25 -10.836 7.547 -3.956 1.00 0.00 C ATOM 381 C VAL A 25 -9.781 8.630 -3.692 1.00 0.00 C ATOM 382 O VAL A 25 -8.572 8.397 -3.804 1.00 0.00 O ATOM 383 CB VAL A 25 -10.218 6.141 -4.090 1.00 0.00 C ATOM 384 CG1 VAL A 25 -11.305 5.068 -4.161 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.332 5.961 -5.331 1.00 0.00 C ATOM 0 H VAL A 25 -11.600 7.163 -5.847 1.00 0.00 H new ATOM 0 HA VAL A 25 -11.460 7.570 -3.062 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.598 6.033 -3.200 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -10.841 4.086 -4.255 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.907 5.099 -3.253 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.943 5.253 -5.026 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.936 4.946 -5.351 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.924 6.138 -6.229 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.506 6.672 -5.295 1.00 0.00 H new ATOM 395 N GLY A 26 -10.266 9.801 -3.290 1.00 0.00 N ATOM 396 CA GLY A 26 -9.528 11.034 -3.115 1.00 0.00 C ATOM 397 C GLY A 26 -9.648 11.910 -4.363 1.00 0.00 C ATOM 398 O GLY A 26 -8.648 12.484 -4.797 1.00 0.00 O ATOM 0 H GLY A 26 -11.254 9.914 -3.064 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.908 11.573 -2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.479 10.812 -2.918 1.00 0.00 H new ATOM 402 N PHE A 27 -10.872 12.018 -4.904 1.00 0.00 N ATOM 403 CA PHE A 27 -11.241 12.744 -6.123 1.00 0.00 C ATOM 404 C PHE A 27 -10.458 14.045 -6.336 1.00 0.00 C ATOM 405 O PHE A 27 -10.039 14.323 -7.457 1.00 0.00 O ATOM 406 CB PHE A 27 -12.753 13.027 -6.118 1.00 0.00 C ATOM 407 CG PHE A 27 -13.299 13.574 -7.427 1.00 0.00 C ATOM 408 CD1 PHE A 27 -13.303 14.961 -7.672 1.00 0.00 C ATOM 409 CD2 PHE A 27 -13.812 12.697 -8.400 1.00 0.00 C ATOM 410 CE1 PHE A 27 -13.798 15.463 -8.887 1.00 0.00 C ATOM 411 CE2 PHE A 27 -14.325 13.201 -9.608 1.00 0.00 C ATOM 412 CZ PHE A 27 -14.312 14.584 -9.855 1.00 0.00 C ATOM 0 H PHE A 27 -11.680 11.571 -4.471 1.00 0.00 H new ATOM 0 HA PHE A 27 -10.976 12.098 -6.960 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -13.281 12.105 -5.877 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -12.974 13.738 -5.322 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -12.924 15.641 -6.923 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -13.812 11.632 -8.218 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -13.783 16.526 -9.077 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -14.729 12.525 -10.347 1.00 0.00 H new ATOM 0 HZ PHE A 27 -14.696 14.971 -10.787 1.00 0.00 H new ATOM 422 N ALA A 28 -10.284 14.842 -5.273 1.00 0.00 N ATOM 423 CA ALA A 28 -9.538 16.098 -5.294 1.00 0.00 C ATOM 424 C ALA A 28 -8.488 16.127 -4.175 1.00 0.00 C ATOM 425 O ALA A 28 -8.344 17.128 -3.480 1.00 0.00 O ATOM 426 CB ALA A 28 -10.518 17.273 -5.191 1.00 0.00 C ATOM 0 H ALA A 28 -10.669 14.622 -4.355 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.997 16.185 -6.236 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.964 18.211 -5.206 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.209 17.246 -6.034 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.079 17.198 -4.259 1.00 0.00 H new ATOM 432 N THR A 29 -7.747 15.029 -3.987 1.00 0.00 N ATOM 433 CA THR A 29 -6.646 14.974 -3.022 1.00 0.00 C ATOM 434 C THR A 29 -5.581 13.959 -3.454 1.00 0.00 C ATOM 435 O THR A 29 -4.390 14.280 -3.478 1.00 0.00 O ATOM 436 CB THR A 29 -7.170 14.780 -1.585 1.00 0.00 C ATOM 437 OG1 THR A 29 -6.102 14.591 -0.678 1.00 0.00 O ATOM 438 CG2 THR A 29 -8.127 13.600 -1.435 1.00 0.00 C ATOM 0 H THR A 29 -7.894 14.158 -4.497 1.00 0.00 H new ATOM 0 HA THR A 29 -6.136 15.937 -3.011 1.00 0.00 H new ATOM 0 HB THR A 29 -7.719 15.695 -1.360 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.459 14.472 0.227 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.454 13.526 -0.398 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.994 13.750 -2.079 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.618 12.680 -1.721 1.00 0.00 H new ATOM 446 N ARG A 30 -5.981 12.764 -3.907 1.00 0.00 N ATOM 447 CA ARG A 30 -5.035 11.846 -4.541 1.00 0.00 C ATOM 448 C ARG A 30 -4.328 12.545 -5.711 1.00 0.00 C ATOM 449 O ARG A 30 -3.192 12.226 -6.049 1.00 0.00 O ATOM 450 CB ARG A 30 -5.751 10.572 -5.021 1.00 0.00 C ATOM 451 CG ARG A 30 -4.928 9.307 -4.723 1.00 0.00 C ATOM 452 CD ARG A 30 -5.184 8.800 -3.300 1.00 0.00 C ATOM 453 NE ARG A 30 -4.592 7.467 -3.084 1.00 0.00 N ATOM 454 CZ ARG A 30 -5.253 6.314 -2.857 1.00 0.00 C ATOM 455 NH1 ARG A 30 -6.588 6.231 -2.953 1.00 0.00 N ATOM 456 NH2 ARG A 30 -4.565 5.221 -2.504 1.00 0.00 N ATOM 0 H ARG A 30 -6.938 12.417 -3.847 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.286 11.553 -3.805 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -6.723 10.496 -4.534 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -5.936 10.641 -6.093 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.183 8.527 -5.441 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -3.867 9.522 -4.849 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.766 9.505 -2.581 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -6.258 8.756 -3.116 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.574 7.411 -3.109 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -7.133 7.055 -3.204 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -7.058 5.343 -2.775 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.550 5.266 -2.409 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -5.055 4.344 -2.330 1.00 0.00 H new ATOM 470 N GLN A 31 -5.017 13.524 -6.299 1.00 0.00 N ATOM 471 CA GLN A 31 -4.584 14.273 -7.460 1.00 0.00 C ATOM 472 C GLN A 31 -3.384 15.177 -7.161 1.00 0.00 C ATOM 473 O GLN A 31 -2.690 15.567 -8.099 1.00 0.00 O ATOM 474 CB GLN A 31 -5.760 15.090 -8.010 1.00 0.00 C ATOM 475 CG GLN A 31 -7.149 14.426 -7.946 1.00 0.00 C ATOM 476 CD GLN A 31 -7.264 13.000 -8.500 1.00 0.00 C ATOM 477 OE1 GLN A 31 -6.372 12.169 -8.353 1.00 0.00 O ATOM 478 NE2 GLN A 31 -8.416 12.667 -9.072 1.00 0.00 N ATOM 0 H GLN A 31 -5.931 13.823 -5.958 1.00 0.00 H new ATOM 0 HA GLN A 31 -4.251 13.559 -8.213 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.807 16.032 -7.463 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -5.547 15.336 -9.050 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -7.470 14.412 -6.905 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -7.852 15.058 -8.488 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.149 13.367 -9.188 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -8.568 11.711 -9.395 1.00 0.00 H new ATOM 487 N VAL A 32 -3.136 15.506 -5.883 1.00 0.00 N ATOM 488 CA VAL A 32 -1.894 16.146 -5.448 1.00 0.00 C ATOM 489 C VAL A 32 -0.979 15.122 -4.764 1.00 0.00 C ATOM 490 O VAL A 32 0.246 15.231 -4.851 1.00 0.00 O ATOM 491 CB VAL A 32 -2.182 17.409 -4.607 1.00 0.00 C ATOM 492 CG1 VAL A 32 -2.644 17.134 -3.173 1.00 0.00 C ATOM 493 CG2 VAL A 32 -0.941 18.308 -4.551 1.00 0.00 C ATOM 0 H VAL A 32 -3.796 15.333 -5.124 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.344 16.506 -6.317 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.010 17.900 -5.118 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.822 18.079 -2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.566 16.553 -3.193 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.873 16.573 -2.644 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.160 19.194 -3.955 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.115 17.760 -4.097 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -0.665 18.610 -5.561 1.00 0.00 H new ATOM 503 N GLY A 33 -1.556 14.099 -4.117 1.00 0.00 N ATOM 504 CA GLY A 33 -0.825 12.967 -3.557 1.00 0.00 C ATOM 505 C GLY A 33 -0.256 12.055 -4.651 1.00 0.00 C ATOM 506 O GLY A 33 -0.632 10.887 -4.758 1.00 0.00 O ATOM 0 H GLY A 33 -2.563 14.040 -3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.012 13.334 -2.931 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.488 12.390 -2.912 1.00 0.00 H new ATOM 510 N ASN A 34 0.659 12.595 -5.459 1.00 0.00 N ATOM 511 CA ASN A 34 1.224 11.965 -6.647 1.00 0.00 C ATOM 512 C ASN A 34 2.525 12.667 -7.059 1.00 0.00 C ATOM 513 O ASN A 34 3.551 12.015 -7.239 1.00 0.00 O ATOM 514 CB ASN A 34 0.190 11.918 -7.793 1.00 0.00 C ATOM 515 CG ASN A 34 -0.485 13.253 -8.121 1.00 0.00 C ATOM 516 OD1 ASN A 34 -0.114 14.305 -7.613 1.00 0.00 O ATOM 517 ND2 ASN A 34 -1.499 13.242 -8.976 1.00 0.00 N ATOM 0 H ASN A 34 1.041 13.526 -5.292 1.00 0.00 H new ATOM 0 HA ASN A 34 1.476 10.931 -6.411 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.685 11.549 -8.692 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -0.582 11.193 -7.534 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.975 14.112 -9.214 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.803 12.363 -9.395 1.00 0.00 H new ATOM 524 N MET A 35 2.493 13.997 -7.189 1.00 0.00 N ATOM 525 CA MET A 35 3.629 14.828 -7.562 1.00 0.00 C ATOM 526 C MET A 35 4.779 14.613 -6.578 1.00 0.00 C ATOM 527 O MET A 35 5.929 14.415 -6.988 1.00 0.00 O ATOM 528 CB MET A 35 3.183 16.297 -7.576 1.00 0.00 C ATOM 529 CG MET A 35 2.335 16.616 -8.814 1.00 0.00 C ATOM 530 SD MET A 35 1.577 18.265 -8.802 1.00 0.00 S ATOM 531 CE MET A 35 1.492 18.575 -10.585 1.00 0.00 C ATOM 0 H MET A 35 1.643 14.538 -7.031 1.00 0.00 H new ATOM 0 HA MET A 35 3.984 14.554 -8.555 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.609 16.512 -6.675 1.00 0.00 H new ATOM 0 HB3 MET A 35 4.060 16.945 -7.558 1.00 0.00 H new ATOM 0 HG2 MET A 35 2.961 16.524 -9.701 1.00 0.00 H new ATOM 0 HG3 MET A 35 1.547 15.868 -8.902 1.00 0.00 H new ATOM 0 HE1 MET A 35 1.048 19.554 -10.763 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.497 18.550 -11.007 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.880 17.807 -11.059 1.00 0.00 H new ATOM 541 N THR A 36 4.445 14.654 -5.288 1.00 0.00 N ATOM 542 CA THR A 36 5.312 14.406 -4.149 1.00 0.00 C ATOM 543 C THR A 36 5.725 12.927 -4.102 1.00 0.00 C ATOM 544 O THR A 36 5.312 12.211 -3.196 1.00 0.00 O ATOM 545 CB THR A 36 4.522 14.826 -2.895 1.00 0.00 C ATOM 546 OG1 THR A 36 3.853 16.045 -3.163 1.00 0.00 O ATOM 547 CG2 THR A 36 5.409 15.001 -1.659 1.00 0.00 C ATOM 0 H THR A 36 3.493 14.878 -4.997 1.00 0.00 H new ATOM 0 HA THR A 36 6.238 14.978 -4.216 1.00 0.00 H new ATOM 0 HB THR A 36 3.816 14.026 -2.672 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.345 16.321 -2.371 1.00 0.00 H new ATOM 0 HG21 THR A 36 4.794 15.297 -0.809 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.910 14.059 -1.434 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.155 15.771 -1.853 1.00 0.00 H new ATOM 555 N LYS A 37 6.515 12.492 -5.094 1.00 0.00 N ATOM 556 CA LYS A 37 7.012 11.133 -5.322 1.00 0.00 C ATOM 557 C LYS A 37 6.940 10.237 -4.078 1.00 0.00 C ATOM 558 O LYS A 37 7.891 10.232 -3.297 1.00 0.00 O ATOM 559 CB LYS A 37 8.464 11.170 -5.834 1.00 0.00 C ATOM 560 CG LYS A 37 8.623 11.871 -7.188 1.00 0.00 C ATOM 561 CD LYS A 37 9.123 13.314 -7.011 1.00 0.00 C ATOM 562 CE LYS A 37 9.137 14.094 -8.332 1.00 0.00 C ATOM 563 NZ LYS A 37 7.793 14.172 -8.941 1.00 0.00 N ATOM 0 H LYS A 37 6.848 13.134 -5.813 1.00 0.00 H new ATOM 0 HA LYS A 37 6.353 10.697 -6.073 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.087 11.677 -5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 37 8.836 10.149 -5.918 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.324 11.314 -7.809 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.667 11.876 -7.712 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.486 13.831 -6.294 1.00 0.00 H new ATOM 0 HD3 LYS A 37 10.129 13.298 -6.591 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.514 15.101 -8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.824 13.615 -9.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 7.648 15.121 -9.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 7.712 13.461 -9.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.072 13.989 -8.214 1.00 0.00 H new ATOM 577 N PRO A 38 5.847 9.482 -3.868 1.00 0.00 N ATOM 578 CA PRO A 38 5.694 8.709 -2.655 1.00 0.00 C ATOM 579 C PRO A 38 6.811 7.675 -2.526 1.00 0.00 C ATOM 580 O PRO A 38 7.188 7.009 -3.496 1.00 0.00 O ATOM 581 CB PRO A 38 4.294 8.088 -2.706 1.00 0.00 C ATOM 582 CG PRO A 38 3.920 8.147 -4.185 1.00 0.00 C ATOM 583 CD PRO A 38 4.638 9.408 -4.672 1.00 0.00 C ATOM 0 HA PRO A 38 5.781 9.329 -1.763 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.298 7.063 -2.335 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.587 8.646 -2.092 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.255 7.259 -4.722 1.00 0.00 H new ATOM 0 HG3 PRO A 38 2.841 8.217 -4.326 1.00 0.00 H new ATOM 0 HD2 PRO A 38 4.873 9.344 -5.734 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.018 10.294 -4.536 1.00 0.00 H new ATOM 591 N THR A 39 7.336 7.569 -1.308 1.00 0.00 N ATOM 592 CA THR A 39 8.342 6.600 -0.928 1.00 0.00 C ATOM 593 C THR A 39 7.603 5.341 -0.497 1.00 0.00 C ATOM 594 O THR A 39 6.558 5.455 0.139 1.00 0.00 O ATOM 595 CB THR A 39 9.166 7.154 0.243 1.00 0.00 C ATOM 596 OG1 THR A 39 9.279 8.558 0.172 1.00 0.00 O ATOM 597 CG2 THR A 39 10.568 6.558 0.240 1.00 0.00 C ATOM 0 H THR A 39 7.059 8.178 -0.538 1.00 0.00 H new ATOM 0 HA THR A 39 9.021 6.386 -1.754 1.00 0.00 H new ATOM 0 HB THR A 39 8.644 6.880 1.160 1.00 0.00 H new ATOM 0 HG1 THR A 39 8.483 8.971 0.568 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.137 6.962 1.077 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.503 5.474 0.336 1.00 0.00 H new ATOM 0 HG23 THR A 39 11.069 6.810 -0.695 1.00 0.00 H new ATOM 605 N THR A 40 8.121 4.159 -0.827 1.00 0.00 N ATOM 606 CA THR A 40 7.512 2.895 -0.440 1.00 0.00 C ATOM 607 C THR A 40 8.588 2.002 0.170 1.00 0.00 C ATOM 608 O THR A 40 9.388 1.421 -0.561 1.00 0.00 O ATOM 609 CB THR A 40 6.823 2.252 -1.654 1.00 0.00 C ATOM 610 OG1 THR A 40 6.044 3.209 -2.336 1.00 0.00 O ATOM 611 CG2 THR A 40 5.857 1.157 -1.222 1.00 0.00 C ATOM 0 H THR A 40 8.977 4.055 -1.372 1.00 0.00 H new ATOM 0 HA THR A 40 6.738 3.050 0.312 1.00 0.00 H new ATOM 0 HB THR A 40 7.614 1.847 -2.286 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.285 3.210 -3.286 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.385 0.721 -2.102 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.402 0.383 -0.681 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.092 1.582 -0.573 1.00 0.00 H new ATOM 619 N ILE A 41 8.618 1.893 1.502 1.00 0.00 N ATOM 620 CA ILE A 41 9.348 0.819 2.155 1.00 0.00 C ATOM 621 C ILE A 41 8.526 -0.440 1.893 1.00 0.00 C ATOM 622 O ILE A 41 7.308 -0.420 2.074 1.00 0.00 O ATOM 623 CB ILE A 41 9.527 1.121 3.656 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.611 2.189 3.876 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.881 -0.147 4.447 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.485 2.893 5.232 1.00 0.00 C ATOM 0 H ILE A 41 8.146 2.534 2.140 1.00 0.00 H new ATOM 0 HA ILE A 41 10.360 0.699 1.769 1.00 0.00 H new ATOM 0 HB ILE A 41 8.574 1.501 4.023 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.594 1.723 3.804 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.551 2.931 3.080 1.00 0.00 H new ATOM 0 HG21 ILE A 41 10.000 0.103 5.501 1.00 0.00 H new ATOM 0 HG22 ILE A 41 9.082 -0.880 4.336 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.813 -0.565 4.066 1.00 0.00 H new ATOM 0 HD11 ILE A 41 11.276 3.636 5.331 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.515 3.385 5.298 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.574 2.159 6.033 1.00 0.00 H new ATOM 638 N ILE A 42 9.175 -1.510 1.438 1.00 0.00 N ATOM 639 CA ILE A 42 8.578 -2.826 1.333 1.00 0.00 C ATOM 640 C ILE A 42 9.507 -3.769 2.088 1.00 0.00 C ATOM 641 O ILE A 42 10.580 -4.108 1.588 1.00 0.00 O ATOM 642 CB ILE A 42 8.367 -3.246 -0.133 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.584 -2.161 -0.891 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.606 -4.580 -0.141 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.252 -2.536 -2.338 1.00 0.00 C ATOM 0 H ILE A 42 10.146 -1.479 1.129 1.00 0.00 H new ATOM 0 HA ILE A 42 7.578 -2.845 1.767 1.00 0.00 H new ATOM 0 HB ILE A 42 9.327 -3.367 -0.635 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.656 -1.955 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.165 -1.238 -0.889 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.443 -4.900 -1.170 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.190 -5.335 0.386 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.644 -4.453 0.356 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.700 -1.722 -2.807 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.176 -2.713 -2.889 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.644 -3.441 -2.349 1.00 0.00 H new ATOM 657 N GLU A 43 9.113 -4.161 3.299 1.00 0.00 N ATOM 658 CA GLU A 43 9.852 -5.135 4.085 1.00 0.00 C ATOM 659 C GLU A 43 9.183 -6.488 3.861 1.00 0.00 C ATOM 660 O GLU A 43 7.955 -6.578 3.877 1.00 0.00 O ATOM 661 CB GLU A 43 9.857 -4.709 5.558 1.00 0.00 C ATOM 662 CG GLU A 43 10.579 -5.699 6.479 1.00 0.00 C ATOM 663 CD GLU A 43 10.365 -5.314 7.935 1.00 0.00 C ATOM 664 OE1 GLU A 43 9.223 -5.522 8.404 1.00 0.00 O ATOM 665 OE2 GLU A 43 11.334 -4.815 8.543 1.00 0.00 O ATOM 0 H GLU A 43 8.273 -3.810 3.758 1.00 0.00 H new ATOM 0 HA GLU A 43 10.897 -5.203 3.783 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.333 -3.732 5.644 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.828 -4.593 5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.206 -6.708 6.304 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.645 -5.709 6.251 1.00 0.00 H new ATOM 672 N VAL A 44 9.987 -7.526 3.622 1.00 0.00 N ATOM 673 CA VAL A 44 9.517 -8.899 3.548 1.00 0.00 C ATOM 674 C VAL A 44 9.687 -9.508 4.938 1.00 0.00 C ATOM 675 O VAL A 44 10.790 -9.532 5.480 1.00 0.00 O ATOM 676 CB VAL A 44 10.233 -9.675 2.429 1.00 0.00 C ATOM 677 CG1 VAL A 44 10.051 -8.947 1.090 1.00 0.00 C ATOM 678 CG2 VAL A 44 11.726 -9.897 2.698 1.00 0.00 C ATOM 0 H VAL A 44 10.992 -7.430 3.474 1.00 0.00 H new ATOM 0 HA VAL A 44 8.463 -8.948 3.274 1.00 0.00 H new ATOM 0 HB VAL A 44 9.772 -10.662 2.393 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.560 -9.502 0.302 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.989 -8.876 0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 44 10.474 -7.945 1.160 1.00 0.00 H new ATOM 0 HG21 VAL A 44 12.167 -10.450 1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 44 12.225 -8.933 2.797 1.00 0.00 H new ATOM 0 HG23 VAL A 44 11.849 -10.466 3.620 1.00 0.00 H new ATOM 688 N ASN A 45 8.579 -9.936 5.537 1.00 0.00 N ATOM 689 CA ASN A 45 8.546 -10.551 6.855 1.00 0.00 C ATOM 690 C ASN A 45 8.583 -12.070 6.685 1.00 0.00 C ATOM 691 O ASN A 45 8.442 -12.564 5.569 1.00 0.00 O ATOM 692 CB ASN A 45 7.291 -10.078 7.601 1.00 0.00 C ATOM 693 CG ASN A 45 7.245 -8.558 7.720 1.00 0.00 C ATOM 694 OD1 ASN A 45 6.353 -7.920 7.168 1.00 0.00 O ATOM 695 ND2 ASN A 45 8.219 -7.982 8.418 1.00 0.00 N ATOM 0 H ASN A 45 7.658 -9.862 5.106 1.00 0.00 H new ATOM 0 HA ASN A 45 9.410 -10.257 7.450 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.402 -10.429 7.077 1.00 0.00 H new ATOM 0 HB3 ASN A 45 7.270 -10.522 8.596 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.247 -6.967 8.513 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.938 -8.555 8.859 1.00 0.00 H new ATOM 702 N GLY A 46 8.792 -12.802 7.786 1.00 0.00 N ATOM 703 CA GLY A 46 9.058 -14.242 7.822 1.00 0.00 C ATOM 704 C GLY A 46 8.427 -15.036 6.677 1.00 0.00 C ATOM 705 O GLY A 46 9.137 -15.676 5.904 1.00 0.00 O ATOM 0 H GLY A 46 8.779 -12.386 8.717 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.136 -14.399 7.804 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.693 -14.642 8.768 1.00 0.00 H new ATOM 709 N ASP A 47 7.097 -14.992 6.582 1.00 0.00 N ATOM 710 CA ASP A 47 6.295 -15.621 5.543 1.00 0.00 C ATOM 711 C ASP A 47 5.371 -14.581 4.894 1.00 0.00 C ATOM 712 O ASP A 47 4.320 -14.935 4.363 1.00 0.00 O ATOM 713 CB ASP A 47 5.446 -16.718 6.205 1.00 0.00 C ATOM 714 CG ASP A 47 4.344 -16.129 7.082 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.598 -15.076 7.705 1.00 0.00 O ATOM 716 OD2 ASP A 47 3.244 -16.730 7.076 1.00 0.00 O ATOM 0 H ASP A 47 6.527 -14.491 7.263 1.00 0.00 H new ATOM 0 HA ASP A 47 6.939 -16.044 4.772 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.000 -17.347 5.435 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.088 -17.360 6.809 1.00 0.00 H new ATOM 721 N THR A 48 5.716 -13.298 4.994 1.00 0.00 N ATOM 722 CA THR A 48 4.764 -12.197 4.954 1.00 0.00 C ATOM 723 C THR A 48 5.440 -10.960 4.358 1.00 0.00 C ATOM 724 O THR A 48 6.603 -11.019 3.963 1.00 0.00 O ATOM 725 CB THR A 48 4.226 -11.946 6.382 1.00 0.00 C ATOM 726 OG1 THR A 48 5.085 -12.494 7.369 1.00 0.00 O ATOM 727 CG2 THR A 48 2.840 -12.563 6.570 1.00 0.00 C ATOM 0 H THR A 48 6.683 -12.993 5.107 1.00 0.00 H new ATOM 0 HA THR A 48 3.914 -12.441 4.316 1.00 0.00 H new ATOM 0 HB THR A 48 4.173 -10.864 6.501 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.807 -13.412 7.572 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.490 -12.369 7.584 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.145 -12.122 5.856 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.895 -13.639 6.405 1.00 0.00 H new ATOM 735 N VAL A 49 4.735 -9.831 4.261 1.00 0.00 N ATOM 736 CA VAL A 49 5.293 -8.624 3.673 1.00 0.00 C ATOM 737 C VAL A 49 4.502 -7.417 4.173 1.00 0.00 C ATOM 738 O VAL A 49 3.317 -7.536 4.475 1.00 0.00 O ATOM 739 CB VAL A 49 5.312 -8.770 2.136 1.00 0.00 C ATOM 740 CG1 VAL A 49 3.961 -9.237 1.585 1.00 0.00 C ATOM 741 CG2 VAL A 49 5.740 -7.487 1.411 1.00 0.00 C ATOM 0 H VAL A 49 3.773 -9.733 4.585 1.00 0.00 H new ATOM 0 HA VAL A 49 6.327 -8.468 3.980 1.00 0.00 H new ATOM 0 HB VAL A 49 6.063 -9.534 1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.021 -9.326 0.500 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.708 -10.206 2.015 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.191 -8.512 1.847 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.732 -7.658 0.334 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.047 -6.682 1.656 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.745 -7.209 1.727 1.00 0.00 H new ATOM 751 N ILE A 50 5.150 -6.257 4.276 1.00 0.00 N ATOM 752 CA ILE A 50 4.512 -5.025 4.711 1.00 0.00 C ATOM 753 C ILE A 50 4.913 -3.895 3.769 1.00 0.00 C ATOM 754 O ILE A 50 6.103 -3.684 3.523 1.00 0.00 O ATOM 755 CB ILE A 50 4.814 -4.760 6.201 1.00 0.00 C ATOM 756 CG1 ILE A 50 4.116 -3.483 6.695 1.00 0.00 C ATOM 757 CG2 ILE A 50 6.315 -4.690 6.494 1.00 0.00 C ATOM 758 CD1 ILE A 50 4.258 -3.289 8.207 1.00 0.00 C ATOM 0 H ILE A 50 6.140 -6.150 4.057 1.00 0.00 H new ATOM 0 HA ILE A 50 3.426 -5.104 4.652 1.00 0.00 H new ATOM 0 HB ILE A 50 4.414 -5.613 6.749 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.536 -2.620 6.179 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.058 -3.526 6.435 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.470 -4.502 7.556 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.784 -5.636 6.221 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.762 -3.883 5.914 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.748 -2.373 8.506 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.813 -4.138 8.726 1.00 0.00 H new ATOM 0 HD13 ILE A 50 5.314 -3.217 8.467 1.00 0.00 H new ATOM 770 N ILE A 51 3.907 -3.197 3.228 1.00 0.00 N ATOM 771 CA ILE A 51 4.081 -1.976 2.457 1.00 0.00 C ATOM 772 C ILE A 51 3.938 -0.836 3.457 1.00 0.00 C ATOM 773 O ILE A 51 2.955 -0.786 4.197 1.00 0.00 O ATOM 774 CB ILE A 51 3.044 -1.900 1.316 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.552 -2.736 0.126 1.00 0.00 C ATOM 776 CG2 ILE A 51 2.798 -0.451 0.862 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.470 -3.019 -0.923 1.00 0.00 C ATOM 0 H ILE A 51 2.931 -3.478 3.320 1.00 0.00 H new ATOM 0 HA ILE A 51 5.053 -1.930 1.966 1.00 0.00 H new ATOM 0 HB ILE A 51 2.097 -2.294 1.686 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.381 -2.212 -0.350 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.945 -3.683 0.497 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.062 -0.442 0.058 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.425 0.135 1.702 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.732 -0.018 0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.895 -3.612 -1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.651 -3.570 -0.461 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.094 -2.077 -1.321 1.00 0.00 H new ATOM 789 N LYS A 52 4.928 0.056 3.485 1.00 0.00 N ATOM 790 CA LYS A 52 5.007 1.162 4.415 1.00 0.00 C ATOM 791 C LYS A 52 5.368 2.416 3.616 1.00 0.00 C ATOM 792 O LYS A 52 6.534 2.709 3.346 1.00 0.00 O ATOM 793 CB LYS A 52 5.965 0.761 5.546 1.00 0.00 C ATOM 794 CG LYS A 52 5.815 1.602 6.815 1.00 0.00 C ATOM 795 CD LYS A 52 6.823 2.747 6.921 1.00 0.00 C ATOM 796 CE LYS A 52 6.644 3.386 8.306 1.00 0.00 C ATOM 797 NZ LYS A 52 7.661 4.411 8.599 1.00 0.00 N ATOM 0 H LYS A 52 5.716 0.020 2.839 1.00 0.00 H new ATOM 0 HA LYS A 52 4.068 1.402 4.914 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.798 -0.287 5.795 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.991 0.844 5.186 1.00 0.00 H new ATOM 0 HG2 LYS A 52 4.807 2.014 6.849 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.924 0.953 7.684 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.840 2.376 6.798 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.654 3.482 6.134 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.653 3.836 8.368 1.00 0.00 H new ATOM 0 HE3 LYS A 52 6.689 2.608 9.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.491 4.808 9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 8.607 3.980 8.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.603 5.170 7.890 1.00 0.00 H new ATOM 811 N THR A 53 4.340 3.132 3.172 1.00 0.00 N ATOM 812 CA THR A 53 4.444 4.283 2.300 1.00 0.00 C ATOM 813 C THR A 53 4.812 5.510 3.131 1.00 0.00 C ATOM 814 O THR A 53 4.170 5.756 4.150 1.00 0.00 O ATOM 815 CB THR A 53 3.097 4.478 1.593 1.00 0.00 C ATOM 816 OG1 THR A 53 2.658 3.249 1.057 1.00 0.00 O ATOM 817 CG2 THR A 53 3.180 5.472 0.435 1.00 0.00 C ATOM 0 H THR A 53 3.376 2.913 3.423 1.00 0.00 H new ATOM 0 HA THR A 53 5.220 4.134 1.549 1.00 0.00 H new ATOM 0 HB THR A 53 2.407 4.864 2.344 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.797 3.377 0.608 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.199 5.572 -0.030 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.504 6.442 0.811 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.896 5.111 -0.303 1.00 0.00 H new ATOM 825 N GLN A 54 5.816 6.284 2.702 1.00 0.00 N ATOM 826 CA GLN A 54 6.127 7.588 3.271 1.00 0.00 C ATOM 827 C GLN A 54 5.937 8.668 2.205 1.00 0.00 C ATOM 828 O GLN A 54 6.668 8.717 1.213 1.00 0.00 O ATOM 829 CB GLN A 54 7.533 7.661 3.890 1.00 0.00 C ATOM 830 CG GLN A 54 8.048 6.355 4.512 1.00 0.00 C ATOM 831 CD GLN A 54 8.949 5.606 3.532 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.431 4.605 2.830 1.00 0.00 O flip ATOM 833 NE2 GLN A 54 10.118 5.941 3.382 1.00 0.00 N flip ATOM 0 H GLN A 54 6.439 6.014 1.941 1.00 0.00 H new ATOM 0 HA GLN A 54 5.434 7.758 4.095 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.235 7.978 3.119 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.533 8.434 4.658 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.600 6.575 5.426 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.205 5.724 4.793 1.00 0.00 H new ATOM 0 HE21 GLN A 54 10.502 6.712 3.929 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.707 5.449 2.711 1.00 0.00 H new ATOM 842 N SER A 55 4.953 9.541 2.424 1.00 0.00 N ATOM 843 CA SER A 55 4.733 10.755 1.652 1.00 0.00 C ATOM 844 C SER A 55 4.307 11.842 2.639 1.00 0.00 C ATOM 845 O SER A 55 3.240 12.438 2.482 1.00 0.00 O ATOM 846 CB SER A 55 3.672 10.494 0.574 1.00 0.00 C ATOM 847 OG SER A 55 3.367 11.680 -0.135 1.00 0.00 O ATOM 0 H SER A 55 4.267 9.414 3.169 1.00 0.00 H new ATOM 0 HA SER A 55 5.634 11.078 1.131 1.00 0.00 H new ATOM 0 HB2 SER A 55 4.032 9.734 -0.119 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.767 10.100 1.037 1.00 0.00 H new ATOM 0 HG SER A 55 3.093 12.378 0.497 1.00 0.00 H new ATOM 853 N THR A 56 5.130 12.047 3.677 1.00 0.00 N ATOM 854 CA THR A 56 4.809 12.861 4.844 1.00 0.00 C ATOM 855 C THR A 56 3.345 12.636 5.257 1.00 0.00 C ATOM 856 O THR A 56 2.964 11.504 5.548 1.00 0.00 O ATOM 857 CB THR A 56 5.265 14.326 4.647 1.00 0.00 C ATOM 858 OG1 THR A 56 4.797 15.126 5.704 1.00 0.00 O ATOM 859 CG2 THR A 56 4.835 15.011 3.347 1.00 0.00 C ATOM 0 H THR A 56 6.063 11.637 3.723 1.00 0.00 H new ATOM 0 HA THR A 56 5.385 12.541 5.712 1.00 0.00 H new ATOM 0 HB THR A 56 6.351 14.243 4.611 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.252 15.857 5.345 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.217 16.032 3.330 1.00 0.00 H new ATOM 0 HG22 THR A 56 5.235 14.460 2.496 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.747 15.030 3.288 1.00 0.00 H new ATOM 867 N PHE A 57 2.518 13.679 5.229 1.00 0.00 N ATOM 868 CA PHE A 57 1.111 13.664 5.608 1.00 0.00 C ATOM 869 C PHE A 57 0.235 12.665 4.830 1.00 0.00 C ATOM 870 O PHE A 57 -0.924 12.487 5.196 1.00 0.00 O ATOM 871 CB PHE A 57 0.554 15.090 5.482 1.00 0.00 C ATOM 872 CG PHE A 57 1.423 16.153 6.133 1.00 0.00 C ATOM 873 CD1 PHE A 57 1.630 16.127 7.524 1.00 0.00 C ATOM 874 CD2 PHE A 57 2.113 17.094 5.344 1.00 0.00 C ATOM 875 CE1 PHE A 57 2.521 17.032 8.123 1.00 0.00 C ATOM 876 CE2 PHE A 57 3.000 18.003 5.945 1.00 0.00 C ATOM 877 CZ PHE A 57 3.209 17.969 7.334 1.00 0.00 C ATOM 0 H PHE A 57 2.829 14.602 4.926 1.00 0.00 H new ATOM 0 HA PHE A 57 1.070 13.312 6.639 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.434 15.330 4.426 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.439 15.122 5.931 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.102 15.409 8.133 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.960 17.117 4.275 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.678 17.008 9.191 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.522 18.729 5.339 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.897 18.662 7.794 1.00 0.00 H new ATOM 887 N LYS A 58 0.741 12.032 3.763 1.00 0.00 N ATOM 888 CA LYS A 58 0.072 10.924 3.082 1.00 0.00 C ATOM 889 C LYS A 58 0.914 9.641 3.153 1.00 0.00 C ATOM 890 O LYS A 58 0.865 8.801 2.255 1.00 0.00 O ATOM 891 CB LYS A 58 -0.281 11.340 1.641 1.00 0.00 C ATOM 892 CG LYS A 58 -1.505 12.270 1.593 1.00 0.00 C ATOM 893 CD LYS A 58 -2.820 11.478 1.709 1.00 0.00 C ATOM 894 CE LYS A 58 -4.032 12.422 1.766 1.00 0.00 C ATOM 895 NZ LYS A 58 -5.312 11.692 1.905 1.00 0.00 N ATOM 0 H LYS A 58 1.638 12.281 3.346 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.863 10.692 3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.574 11.843 1.189 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.479 10.449 1.045 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.444 12.996 2.404 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.499 12.833 0.660 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.919 10.805 0.857 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.796 10.857 2.605 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.915 13.108 2.605 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.059 13.028 0.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.098 12.372 1.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.439 11.056 1.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.300 11.134 2.782 1.00 0.00 H new ATOM 909 N ASN A 59 1.666 9.461 4.239 1.00 0.00 N ATOM 910 CA ASN A 59 2.216 8.164 4.612 1.00 0.00 C ATOM 911 C ASN A 59 1.090 7.166 4.918 1.00 0.00 C ATOM 912 O ASN A 59 -0.046 7.566 5.160 1.00 0.00 O ATOM 913 CB ASN A 59 3.181 8.316 5.800 1.00 0.00 C ATOM 914 CG ASN A 59 2.528 8.828 7.084 1.00 0.00 C ATOM 915 OD1 ASN A 59 1.424 9.361 7.082 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.226 8.680 8.206 1.00 0.00 N ATOM 0 H ASN A 59 1.909 10.213 4.884 1.00 0.00 H new ATOM 0 HA ASN A 59 2.784 7.766 3.771 1.00 0.00 H new ATOM 0 HB2 ASN A 59 3.643 7.350 6.002 1.00 0.00 H new ATOM 0 HB3 ASN A 59 3.982 8.999 5.517 1.00 0.00 H new ATOM 0 HD21 ASN A 59 2.845 9.013 9.091 1.00 0.00 H new ATOM 0 HD22 ASN A 59 4.143 8.233 8.181 1.00 0.00 H new ATOM 923 N THR A 60 1.385 5.864 4.869 1.00 0.00 N ATOM 924 CA THR A 60 0.431 4.780 5.120 1.00 0.00 C ATOM 925 C THR A 60 1.225 3.494 5.382 1.00 0.00 C ATOM 926 O THR A 60 2.400 3.430 5.026 1.00 0.00 O ATOM 927 CB THR A 60 -0.557 4.598 3.942 1.00 0.00 C ATOM 928 OG1 THR A 60 -0.082 5.207 2.760 1.00 0.00 O ATOM 929 CG2 THR A 60 -1.935 5.202 4.219 1.00 0.00 C ATOM 0 H THR A 60 2.321 5.525 4.647 1.00 0.00 H new ATOM 0 HA THR A 60 -0.176 5.028 5.991 1.00 0.00 H new ATOM 0 HB THR A 60 -0.641 3.518 3.822 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.731 5.070 2.038 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.582 5.042 3.357 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.373 4.723 5.095 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.833 6.272 4.403 1.00 0.00 H new ATOM 937 N GLU A 61 0.614 2.487 6.019 1.00 0.00 N ATOM 938 CA GLU A 61 1.304 1.276 6.449 1.00 0.00 C ATOM 939 C GLU A 61 0.308 0.116 6.494 1.00 0.00 C ATOM 940 O GLU A 61 -0.691 0.222 7.203 1.00 0.00 O ATOM 941 CB GLU A 61 1.949 1.555 7.816 1.00 0.00 C ATOM 942 CG GLU A 61 2.840 0.413 8.318 1.00 0.00 C ATOM 943 CD GLU A 61 3.669 0.843 9.526 1.00 0.00 C ATOM 944 OE1 GLU A 61 4.308 1.915 9.426 1.00 0.00 O ATOM 945 OE2 GLU A 61 3.665 0.090 10.521 1.00 0.00 O ATOM 0 H GLU A 61 -0.380 2.495 6.249 1.00 0.00 H new ATOM 0 HA GLU A 61 2.092 0.993 5.751 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.544 2.466 7.749 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.163 1.741 8.548 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.221 -0.443 8.586 1.00 0.00 H new ATOM 0 HG3 GLU A 61 3.503 0.088 7.517 1.00 0.00 H new ATOM 952 N ILE A 62 0.541 -0.954 5.717 1.00 0.00 N ATOM 953 CA ILE A 62 -0.338 -2.121 5.647 1.00 0.00 C ATOM 954 C ILE A 62 0.500 -3.399 5.485 1.00 0.00 C ATOM 955 O ILE A 62 1.295 -3.522 4.549 1.00 0.00 O ATOM 956 CB ILE A 62 -1.389 -1.974 4.520 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.236 -0.700 4.718 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.298 -3.215 4.486 1.00 0.00 C ATOM 959 CD1 ILE A 62 -3.384 -0.535 3.716 1.00 0.00 C ATOM 0 H ILE A 62 1.359 -1.029 5.113 1.00 0.00 H new ATOM 0 HA ILE A 62 -0.894 -2.194 6.582 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.864 -1.888 3.569 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.650 -0.708 5.726 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.582 0.170 4.648 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.035 -3.104 3.691 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.694 -4.103 4.300 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.810 -3.318 5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.925 0.387 3.931 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.981 -0.492 2.704 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.064 -1.383 3.799 1.00 0.00 H new ATOM 971 N SER A 63 0.300 -4.352 6.403 1.00 0.00 N ATOM 972 CA SER A 63 0.888 -5.682 6.425 1.00 0.00 C ATOM 973 C SER A 63 -0.023 -6.671 5.695 1.00 0.00 C ATOM 974 O SER A 63 -1.241 -6.591 5.849 1.00 0.00 O ATOM 975 CB SER A 63 1.007 -6.091 7.894 1.00 0.00 C ATOM 976 OG SER A 63 -0.232 -5.828 8.534 1.00 0.00 O ATOM 0 H SER A 63 -0.319 -4.197 7.199 1.00 0.00 H new ATOM 0 HA SER A 63 1.860 -5.683 5.931 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.258 -7.149 7.974 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.810 -5.535 8.379 1.00 0.00 H new ATOM 0 HG SER A 63 -0.966 -5.994 7.906 1.00 0.00 H new ATOM 982 N PHE A 64 0.548 -7.622 4.953 1.00 0.00 N ATOM 983 CA PHE A 64 -0.183 -8.653 4.232 1.00 0.00 C ATOM 984 C PHE A 64 0.739 -9.854 3.997 1.00 0.00 C ATOM 985 O PHE A 64 1.869 -9.889 4.487 1.00 0.00 O ATOM 986 CB PHE A 64 -0.764 -8.073 2.929 1.00 0.00 C ATOM 987 CG PHE A 64 0.252 -7.509 1.952 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.829 -6.250 2.194 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.626 -8.235 0.805 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.830 -5.757 1.344 1.00 0.00 C ATOM 991 CE2 PHE A 64 1.598 -7.718 -0.069 1.00 0.00 C ATOM 992 CZ PHE A 64 2.211 -6.484 0.207 1.00 0.00 C ATOM 0 H PHE A 64 1.559 -7.694 4.837 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.031 -9.005 4.820 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.331 -8.856 2.425 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.470 -7.284 3.187 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.500 -5.660 3.037 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.166 -9.190 0.597 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.309 -4.815 1.566 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.874 -8.271 -0.955 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.973 -6.097 -0.454 1.00 0.00 H new ATOM 1002 N LYS A 65 0.252 -10.861 3.267 1.00 0.00 N ATOM 1003 CA LYS A 65 1.014 -12.046 2.914 1.00 0.00 C ATOM 1004 C LYS A 65 0.995 -12.203 1.401 1.00 0.00 C ATOM 1005 O LYS A 65 -0.007 -11.906 0.751 1.00 0.00 O ATOM 1006 CB LYS A 65 0.433 -13.273 3.629 1.00 0.00 C ATOM 1007 CG LYS A 65 1.191 -14.569 3.320 1.00 0.00 C ATOM 1008 CD LYS A 65 0.922 -15.605 4.417 1.00 0.00 C ATOM 1009 CE LYS A 65 1.622 -16.933 4.098 1.00 0.00 C ATOM 1010 NZ LYS A 65 1.670 -17.816 5.279 1.00 0.00 N ATOM 0 H LYS A 65 -0.700 -10.869 2.902 1.00 0.00 H new ATOM 0 HA LYS A 65 2.050 -11.948 3.237 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.448 -13.099 4.705 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.611 -13.393 3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.878 -14.962 2.352 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.260 -14.368 3.252 1.00 0.00 H new ATOM 0 HD2 LYS A 65 1.274 -15.225 5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.151 -15.769 4.513 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.097 -17.437 3.287 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.635 -16.736 3.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.305 -18.617 5.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.024 -17.281 6.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.715 -18.173 5.485 1.00 0.00 H new ATOM 1024 N LEU A 66 2.101 -12.703 0.853 1.00 0.00 N ATOM 1025 CA LEU A 66 2.255 -13.034 -0.553 1.00 0.00 C ATOM 1026 C LEU A 66 1.492 -14.326 -0.879 1.00 0.00 C ATOM 1027 O LEU A 66 2.064 -15.281 -1.399 1.00 0.00 O ATOM 1028 CB LEU A 66 3.755 -13.117 -0.889 1.00 0.00 C ATOM 1029 CG LEU A 66 4.580 -13.997 0.074 1.00 0.00 C ATOM 1030 CD1 LEU A 66 5.554 -14.885 -0.706 1.00 0.00 C ATOM 1031 CD2 LEU A 66 5.402 -13.144 1.051 1.00 0.00 C ATOM 0 H LEU A 66 2.941 -12.894 1.399 1.00 0.00 H new ATOM 0 HA LEU A 66 1.821 -12.255 -1.180 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.866 -13.505 -1.901 1.00 0.00 H new ATOM 0 HB3 LEU A 66 4.171 -12.110 -0.887 1.00 0.00 H new ATOM 0 HG LEU A 66 3.868 -14.607 0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.126 -15.497 -0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.995 -15.531 -1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.235 -14.259 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.970 -13.796 1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 66 6.088 -12.509 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.732 -12.521 1.643 1.00 0.00 H new ATOM 1043 N GLY A 67 0.196 -14.357 -0.557 1.00 0.00 N ATOM 1044 CA GLY A 67 -0.663 -15.517 -0.731 1.00 0.00 C ATOM 1045 C GLY A 67 -1.754 -15.531 0.336 1.00 0.00 C ATOM 1046 O GLY A 67 -1.853 -16.491 1.098 1.00 0.00 O ATOM 0 H GLY A 67 -0.291 -13.554 -0.159 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.115 -15.498 -1.723 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.071 -16.430 -0.668 1.00 0.00 H new ATOM 1050 N VAL A 68 -2.565 -14.470 0.404 1.00 0.00 N ATOM 1051 CA VAL A 68 -3.743 -14.399 1.267 1.00 0.00 C ATOM 1052 C VAL A 68 -4.597 -13.224 0.796 1.00 0.00 C ATOM 1053 O VAL A 68 -4.073 -12.350 0.098 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.345 -14.262 2.756 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -3.093 -12.803 3.173 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -4.401 -14.880 3.682 1.00 0.00 C ATOM 0 H VAL A 68 -2.417 -13.625 -0.148 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.318 -15.322 1.194 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.409 -14.810 2.861 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.817 -12.768 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.284 -12.388 2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.999 -12.218 3.015 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.087 -14.765 4.720 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.355 -14.375 3.533 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.511 -15.940 3.452 1.00 0.00 H new ATOM 1066 N GLU A 69 -5.876 -13.191 1.196 1.00 0.00 N ATOM 1067 CA GLU A 69 -6.716 -12.009 1.093 1.00 0.00 C ATOM 1068 C GLU A 69 -6.740 -11.274 2.433 1.00 0.00 C ATOM 1069 O GLU A 69 -6.598 -11.898 3.484 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.117 -12.352 0.565 1.00 0.00 C ATOM 1071 CG GLU A 69 -8.941 -13.294 1.452 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.317 -13.557 0.844 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -10.891 -12.594 0.287 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -10.773 -14.713 0.948 1.00 0.00 O ATOM 0 H GLU A 69 -6.353 -13.996 1.603 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.288 -11.330 0.355 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.674 -11.425 0.433 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.014 -12.806 -0.421 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -8.409 -14.237 1.579 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.056 -12.857 2.444 1.00 0.00 H new ATOM 1081 N PHE A 70 -6.866 -9.946 2.401 1.00 0.00 N ATOM 1082 CA PHE A 70 -6.773 -9.098 3.577 1.00 0.00 C ATOM 1083 C PHE A 70 -7.542 -7.796 3.353 1.00 0.00 C ATOM 1084 O PHE A 70 -7.620 -7.284 2.233 1.00 0.00 O ATOM 1085 CB PHE A 70 -5.303 -8.820 3.924 1.00 0.00 C ATOM 1086 CG PHE A 70 -4.531 -8.095 2.838 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.045 -8.805 1.725 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -4.360 -6.699 2.906 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.370 -8.128 0.699 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -3.681 -6.024 1.880 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.167 -6.741 0.787 1.00 0.00 C ATOM 0 H PHE A 70 -7.038 -9.427 1.540 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.225 -9.618 4.422 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -5.264 -8.228 4.838 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -4.807 -9.767 4.136 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.192 -9.873 1.661 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.752 -6.148 3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.006 -8.673 -0.159 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -3.554 -4.953 1.931 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.616 -6.226 0.014 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.133 -7.294 4.438 1.00 0.00 N ATOM 1102 CA ASP A 71 -8.863 -6.039 4.502 1.00 0.00 C ATOM 1103 C ASP A 71 -7.862 -4.889 4.333 1.00 0.00 C ATOM 1104 O ASP A 71 -6.783 -4.936 4.925 1.00 0.00 O ATOM 1105 CB ASP A 71 -9.563 -6.015 5.865 1.00 0.00 C ATOM 1106 CG ASP A 71 -10.569 -4.893 6.021 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.602 -4.910 5.315 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -10.419 -4.081 6.959 1.00 0.00 O ATOM 0 H ASP A 71 -8.111 -7.779 5.335 1.00 0.00 H new ATOM 0 HA ASP A 71 -9.610 -5.934 3.715 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.070 -6.968 6.019 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -8.810 -5.925 6.647 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.172 -3.904 3.486 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.231 -2.880 3.043 1.00 0.00 C ATOM 1115 C GLU A 72 -7.992 -1.556 2.909 1.00 0.00 C ATOM 1116 O GLU A 72 -9.066 -1.526 2.319 1.00 0.00 O ATOM 1117 CB GLU A 72 -6.623 -3.350 1.710 1.00 0.00 C ATOM 1118 CG GLU A 72 -5.452 -2.506 1.186 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.030 -2.987 -0.196 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.833 -2.786 -1.135 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -3.957 -3.608 -0.333 1.00 0.00 O ATOM 0 H GLU A 72 -9.103 -3.797 3.083 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.418 -2.724 3.752 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.283 -4.379 1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.409 -3.359 0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.743 -1.457 1.140 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.610 -2.573 1.875 1.00 0.00 H new ATOM 1128 N THR A 73 -7.465 -0.466 3.471 1.00 0.00 N ATOM 1129 CA THR A 73 -8.090 0.852 3.426 1.00 0.00 C ATOM 1130 C THR A 73 -7.364 1.709 2.384 1.00 0.00 C ATOM 1131 O THR A 73 -6.148 1.877 2.477 1.00 0.00 O ATOM 1132 CB THR A 73 -8.116 1.467 4.842 1.00 0.00 C ATOM 1133 OG1 THR A 73 -8.562 2.803 4.797 1.00 0.00 O ATOM 1134 CG2 THR A 73 -6.771 1.441 5.582 1.00 0.00 C ATOM 0 H THR A 73 -6.579 -0.477 3.977 1.00 0.00 H new ATOM 0 HA THR A 73 -9.131 0.788 3.111 1.00 0.00 H new ATOM 0 HB THR A 73 -8.804 0.831 5.399 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.319 2.916 5.410 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.889 1.894 6.566 1.00 0.00 H new ATOM 0 HG22 THR A 73 -6.438 0.409 5.695 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.031 2.001 5.011 1.00 0.00 H new ATOM 1142 N THR A 74 -8.081 2.211 1.368 1.00 0.00 N ATOM 1143 CA THR A 74 -7.532 3.210 0.446 1.00 0.00 C ATOM 1144 C THR A 74 -7.891 4.611 0.945 1.00 0.00 C ATOM 1145 O THR A 74 -8.624 4.765 1.914 1.00 0.00 O ATOM 1146 CB THR A 74 -7.945 2.922 -1.009 1.00 0.00 C ATOM 1147 OG1 THR A 74 -7.244 3.724 -1.956 1.00 0.00 O ATOM 1148 CG2 THR A 74 -9.432 3.123 -1.285 1.00 0.00 C ATOM 0 H THR A 74 -9.043 1.940 1.166 1.00 0.00 H new ATOM 0 HA THR A 74 -6.444 3.151 0.434 1.00 0.00 H new ATOM 0 HB THR A 74 -7.689 1.869 -1.128 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.600 3.556 -2.854 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.641 2.900 -2.331 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.014 2.456 -0.648 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.705 4.157 -1.073 1.00 0.00 H new ATOM 1156 N ALA A 75 -7.322 5.640 0.312 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.121 6.961 0.910 1.00 0.00 C ATOM 1158 C ALA A 75 -8.392 7.738 1.272 1.00 0.00 C ATOM 1159 O ALA A 75 -8.280 8.803 1.879 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.246 7.809 -0.017 1.00 0.00 C ATOM 0 H ALA A 75 -6.982 5.577 -0.648 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.636 6.766 1.866 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.095 8.793 0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.281 7.320 -0.154 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.738 7.918 -0.983 1.00 0.00 H new ATOM 1166 N ASP A 76 -9.568 7.248 0.880 1.00 0.00 N ATOM 1167 CA ASP A 76 -10.882 7.787 1.212 1.00 0.00 C ATOM 1168 C ASP A 76 -11.593 6.917 2.264 1.00 0.00 C ATOM 1169 O ASP A 76 -12.791 7.074 2.490 1.00 0.00 O ATOM 1170 CB ASP A 76 -11.704 7.811 -0.079 1.00 0.00 C ATOM 1171 CG ASP A 76 -11.973 6.411 -0.622 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -11.210 5.482 -0.262 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -12.901 6.306 -1.448 1.00 0.00 O ATOM 0 H ASP A 76 -9.630 6.418 0.290 1.00 0.00 H new ATOM 0 HA ASP A 76 -10.775 8.787 1.633 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -12.653 8.314 0.107 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.175 8.395 -0.833 1.00 0.00 H new ATOM 1178 N ASP A 77 -10.855 5.982 2.865 1.00 0.00 N ATOM 1179 CA ASP A 77 -11.333 4.824 3.600 1.00 0.00 C ATOM 1180 C ASP A 77 -12.482 4.099 2.901 1.00 0.00 C ATOM 1181 O ASP A 77 -13.446 3.681 3.542 1.00 0.00 O ATOM 1182 CB ASP A 77 -11.601 5.134 5.081 1.00 0.00 C ATOM 1183 CG ASP A 77 -11.768 3.857 5.908 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -11.091 2.857 5.569 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -12.530 3.913 6.896 1.00 0.00 O ATOM 0 H ASP A 77 -9.836 6.023 2.846 1.00 0.00 H new ATOM 0 HA ASP A 77 -10.514 4.105 3.600 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -10.777 5.723 5.484 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -12.501 5.743 5.168 1.00 0.00 H new ATOM 1190 N ARG A 78 -12.348 3.841 1.593 1.00 0.00 N ATOM 1191 CA ARG A 78 -12.984 2.636 1.084 1.00 0.00 C ATOM 1192 C ARG A 78 -12.165 1.462 1.612 1.00 0.00 C ATOM 1193 O ARG A 78 -11.003 1.279 1.245 1.00 0.00 O ATOM 1194 CB ARG A 78 -13.162 2.615 -0.442 1.00 0.00 C ATOM 1195 CG ARG A 78 -14.438 3.373 -0.846 1.00 0.00 C ATOM 1196 CD ARG A 78 -14.970 2.964 -2.229 1.00 0.00 C ATOM 1197 NE ARG A 78 -13.942 3.078 -3.271 1.00 0.00 N ATOM 1198 CZ ARG A 78 -14.082 2.637 -4.532 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -15.277 2.221 -4.968 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -13.023 2.601 -5.342 1.00 0.00 N ATOM 0 H ARG A 78 -11.841 4.410 0.915 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.013 2.582 1.440 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.295 3.069 -0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.217 1.585 -0.793 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -15.211 3.195 -0.099 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -14.233 4.444 -0.844 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -15.332 1.937 -2.188 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.822 3.592 -2.490 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.059 3.523 -3.020 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.083 2.239 -4.343 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -15.382 1.886 -5.926 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.111 2.908 -5.003 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.125 2.267 -6.300 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.777 0.702 2.520 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.178 -0.457 3.148 1.00 0.00 C ATOM 1216 C LYS A 79 -12.405 -1.660 2.230 1.00 0.00 C ATOM 1217 O LYS A 79 -13.390 -2.387 2.358 1.00 0.00 O ATOM 1218 CB LYS A 79 -12.761 -0.605 4.560 1.00 0.00 C ATOM 1219 CG LYS A 79 -11.753 -1.288 5.489 1.00 0.00 C ATOM 1220 CD LYS A 79 -12.223 -1.235 6.949 1.00 0.00 C ATOM 1221 CE LYS A 79 -13.370 -2.205 7.251 1.00 0.00 C ATOM 1222 NZ LYS A 79 -12.934 -3.605 7.105 1.00 0.00 N ATOM 0 H LYS A 79 -13.727 0.887 2.842 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.100 -0.363 3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.022 0.376 4.956 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -13.681 -1.188 4.520 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -11.618 -2.326 5.185 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.782 -0.801 5.398 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -11.381 -1.463 7.603 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.543 -0.220 7.184 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -13.734 -2.038 8.265 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -14.204 -2.008 6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.614 -4.232 7.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.885 -3.850 6.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -11.995 -3.723 7.536 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.520 -1.808 1.248 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.577 -2.840 0.229 1.00 0.00 C ATOM 1238 C VAL A 80 -10.972 -4.136 0.778 1.00 0.00 C ATOM 1239 O VAL A 80 -10.496 -4.173 1.913 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.875 -2.337 -1.050 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -11.416 -0.965 -1.482 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -9.349 -2.232 -0.929 1.00 0.00 C ATOM 0 H VAL A 80 -10.717 -1.188 1.140 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.610 -3.062 -0.040 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.099 -3.096 -1.799 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.901 -0.639 -2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.485 -1.042 -1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -11.246 -0.240 -0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.933 -1.872 -1.870 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.094 -1.536 -0.130 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.934 -3.214 -0.701 1.00 0.00 H new ATOM 1252 N LYS A 81 -10.968 -5.202 -0.028 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.258 -6.431 0.282 1.00 0.00 C ATOM 1254 C LYS A 81 -9.311 -6.744 -0.872 1.00 0.00 C ATOM 1255 O LYS A 81 -9.740 -6.932 -2.012 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.244 -7.564 0.589 1.00 0.00 C ATOM 1257 CG LYS A 81 -10.489 -8.831 1.018 1.00 0.00 C ATOM 1258 CD LYS A 81 -11.347 -9.932 1.658 1.00 0.00 C ATOM 1259 CE LYS A 81 -12.009 -9.524 2.983 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.354 -8.942 2.795 1.00 0.00 N ATOM 0 H LYS A 81 -11.463 -5.229 -0.919 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.658 -6.316 1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.927 -7.255 1.380 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.850 -7.775 -0.292 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.989 -9.248 0.144 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.710 -8.546 1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.124 -10.228 0.953 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -10.723 -10.809 1.831 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.083 -10.397 3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -11.373 -8.801 3.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.442 -8.079 3.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.493 -8.706 1.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.075 -9.631 3.092 1.00 0.00 H new ATOM 1274 N SER A 82 -8.016 -6.795 -0.568 1.00 0.00 N ATOM 1275 CA SER A 82 -7.001 -7.152 -1.539 1.00 0.00 C ATOM 1276 C SER A 82 -6.589 -8.597 -1.345 1.00 0.00 C ATOM 1277 O SER A 82 -6.770 -9.145 -0.263 1.00 0.00 O ATOM 1278 CB SER A 82 -5.803 -6.212 -1.425 1.00 0.00 C ATOM 1279 OG SER A 82 -6.038 -5.090 -2.251 1.00 0.00 O ATOM 0 H SER A 82 -7.647 -6.589 0.360 1.00 0.00 H new ATOM 0 HA SER A 82 -7.411 -7.046 -2.543 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.663 -5.899 -0.390 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.889 -6.723 -1.730 1.00 0.00 H new ATOM 0 HG SER A 82 -5.205 -4.586 -2.363 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.038 -9.197 -2.399 1.00 0.00 N ATOM 1286 CA ILE A 83 -5.502 -10.544 -2.396 1.00 0.00 C ATOM 1287 C ILE A 83 -4.254 -10.518 -3.273 1.00 0.00 C ATOM 1288 O ILE A 83 -4.321 -10.101 -4.430 1.00 0.00 O ATOM 1289 CB ILE A 83 -6.603 -11.549 -2.804 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -6.259 -13.034 -2.593 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.166 -11.314 -4.207 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -5.135 -13.608 -3.460 1.00 0.00 C ATOM 0 H ILE A 83 -5.953 -8.738 -3.306 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.192 -10.891 -1.410 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.393 -11.325 -2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.988 -13.175 -1.547 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.160 -13.621 -2.771 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.933 -12.058 -4.421 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.603 -10.317 -4.261 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.364 -11.399 -4.940 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.989 -14.660 -3.217 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -5.402 -13.513 -4.512 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -4.212 -13.060 -3.269 1.00 0.00 H new ATOM 1304 N VAL A 84 -3.105 -10.877 -2.692 1.00 0.00 N ATOM 1305 CA VAL A 84 -1.826 -10.898 -3.387 1.00 0.00 C ATOM 1306 C VAL A 84 -1.420 -12.345 -3.626 1.00 0.00 C ATOM 1307 O VAL A 84 -1.450 -13.145 -2.692 1.00 0.00 O ATOM 1308 CB VAL A 84 -0.756 -10.134 -2.594 1.00 0.00 C ATOM 1309 CG1 VAL A 84 0.619 -10.265 -3.257 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -1.079 -8.642 -2.563 1.00 0.00 C ATOM 0 H VAL A 84 -3.042 -11.163 -1.715 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.924 -10.394 -4.348 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.744 -10.560 -1.591 1.00 0.00 H new ATOM 0 HG11 VAL A 84 1.358 -9.714 -2.675 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.903 -11.316 -3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.576 -9.857 -4.267 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.311 -8.115 -1.997 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -1.109 -8.255 -3.582 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.048 -8.489 -2.088 1.00 0.00 H new ATOM 1320 N THR A 85 -1.026 -12.660 -4.863 1.00 0.00 N ATOM 1321 CA THR A 85 -0.408 -13.926 -5.231 1.00 0.00 C ATOM 1322 C THR A 85 0.915 -13.628 -5.942 1.00 0.00 C ATOM 1323 O THR A 85 0.930 -12.932 -6.954 1.00 0.00 O ATOM 1324 CB THR A 85 -1.369 -14.741 -6.112 1.00 0.00 C ATOM 1325 OG1 THR A 85 -2.076 -13.906 -7.001 1.00 0.00 O ATOM 1326 CG2 THR A 85 -2.408 -15.456 -5.251 1.00 0.00 C ATOM 0 H THR A 85 -1.133 -12.022 -5.652 1.00 0.00 H new ATOM 0 HA THR A 85 -0.199 -14.528 -4.347 1.00 0.00 H new ATOM 0 HB THR A 85 -0.760 -15.456 -6.665 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.679 -14.449 -7.551 1.00 0.00 H new ATOM 0 HG21 THR A 85 -3.080 -16.028 -5.891 1.00 0.00 H new ATOM 0 HG22 THR A 85 -1.905 -16.131 -4.559 1.00 0.00 H new ATOM 0 HG23 THR A 85 -2.982 -14.720 -4.688 1.00 0.00 H new ATOM 1334 N LEU A 86 2.033 -14.112 -5.392 1.00 0.00 N ATOM 1335 CA LEU A 86 3.339 -14.029 -6.031 1.00 0.00 C ATOM 1336 C LEU A 86 3.471 -15.234 -6.962 1.00 0.00 C ATOM 1337 O LEU A 86 3.642 -16.354 -6.482 1.00 0.00 O ATOM 1338 CB LEU A 86 4.425 -13.972 -4.947 1.00 0.00 C ATOM 1339 CG LEU A 86 5.699 -13.223 -5.368 1.00 0.00 C ATOM 1340 CD1 LEU A 86 6.695 -13.253 -4.203 1.00 0.00 C ATOM 1341 CD2 LEU A 86 6.356 -13.805 -6.622 1.00 0.00 C ATOM 0 H LEU A 86 2.051 -14.575 -4.483 1.00 0.00 H new ATOM 0 HA LEU A 86 3.454 -13.126 -6.630 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.012 -13.492 -4.060 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.693 -14.990 -4.663 1.00 0.00 H new ATOM 0 HG LEU A 86 5.411 -12.201 -5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.605 -12.725 -4.488 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.252 -12.769 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.938 -14.287 -3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.250 -13.230 -6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.631 -14.844 -6.440 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.656 -13.756 -7.456 1.00 0.00 H new ATOM 1353 N ASP A 87 3.327 -15.019 -8.272 1.00 0.00 N ATOM 1354 CA ASP A 87 3.454 -16.083 -9.260 1.00 0.00 C ATOM 1355 C ASP A 87 4.921 -16.260 -9.659 1.00 0.00 C ATOM 1356 O ASP A 87 5.822 -15.727 -9.011 1.00 0.00 O ATOM 1357 CB ASP A 87 2.506 -15.838 -10.448 1.00 0.00 C ATOM 1358 CG ASP A 87 2.861 -14.646 -11.327 1.00 0.00 C ATOM 1359 OD1 ASP A 87 4.065 -14.331 -11.454 1.00 0.00 O ATOM 1360 OD2 ASP A 87 1.906 -14.077 -11.896 1.00 0.00 O ATOM 0 H ASP A 87 3.120 -14.104 -8.673 1.00 0.00 H new ATOM 0 HA ASP A 87 3.140 -17.032 -8.825 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.488 -16.734 -11.069 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.496 -15.697 -10.063 1.00 0.00 H new ATOM 1365 N GLY A 88 5.181 -17.010 -10.731 1.00 0.00 N ATOM 1366 CA GLY A 88 6.529 -17.224 -11.237 1.00 0.00 C ATOM 1367 C GLY A 88 7.062 -15.992 -11.974 1.00 0.00 C ATOM 1368 O GLY A 88 7.492 -16.104 -13.121 1.00 0.00 O ATOM 0 H GLY A 88 4.458 -17.485 -11.271 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.194 -17.468 -10.408 1.00 0.00 H new ATOM 0 HA3 GLY A 88 6.533 -18.081 -11.911 1.00 0.00 H new ATOM 1372 N GLY A 89 7.062 -14.829 -11.319 1.00 0.00 N ATOM 1373 CA GLY A 89 7.555 -13.589 -11.885 1.00 0.00 C ATOM 1374 C GLY A 89 7.072 -12.392 -11.074 1.00 0.00 C ATOM 1375 O GLY A 89 7.885 -11.604 -10.594 1.00 0.00 O ATOM 0 H GLY A 89 6.712 -14.730 -10.366 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.645 -13.603 -11.907 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.216 -13.495 -12.917 1.00 0.00 H new ATOM 1379 N LYS A 90 5.751 -12.248 -10.932 1.00 0.00 N ATOM 1380 CA LYS A 90 5.122 -11.001 -10.526 1.00 0.00 C ATOM 1381 C LYS A 90 4.194 -11.216 -9.324 1.00 0.00 C ATOM 1382 O LYS A 90 3.657 -12.305 -9.126 1.00 0.00 O ATOM 1383 CB LYS A 90 4.418 -10.353 -11.737 1.00 0.00 C ATOM 1384 CG LYS A 90 3.372 -11.215 -12.462 1.00 0.00 C ATOM 1385 CD LYS A 90 3.902 -12.171 -13.550 1.00 0.00 C ATOM 1386 CE LYS A 90 4.101 -11.577 -14.953 1.00 0.00 C ATOM 1387 NZ LYS A 90 5.361 -10.826 -15.114 1.00 0.00 N ATOM 0 H LYS A 90 5.088 -13.005 -11.099 1.00 0.00 H new ATOM 0 HA LYS A 90 5.885 -10.300 -10.186 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.932 -9.438 -11.400 1.00 0.00 H new ATOM 0 HB3 LYS A 90 5.180 -10.061 -12.459 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.842 -11.807 -11.716 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.640 -10.550 -12.920 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.857 -12.574 -13.213 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.212 -13.011 -13.631 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.075 -12.384 -15.685 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.264 -10.915 -15.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.637 -10.822 -16.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 5.226 -9.848 -14.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.109 -11.278 -14.551 1.00 0.00 H new ATOM 1401 N LEU A 91 4.010 -10.169 -8.510 1.00 0.00 N ATOM 1402 CA LEU A 91 3.047 -10.167 -7.420 1.00 0.00 C ATOM 1403 C LEU A 91 1.735 -9.585 -7.941 1.00 0.00 C ATOM 1404 O LEU A 91 1.601 -8.377 -8.142 1.00 0.00 O ATOM 1405 CB LEU A 91 3.626 -9.544 -6.135 1.00 0.00 C ATOM 1406 CG LEU A 91 3.615 -8.010 -6.032 1.00 0.00 C ATOM 1407 CD1 LEU A 91 2.366 -7.515 -5.296 1.00 0.00 C ATOM 1408 CD2 LEU A 91 4.808 -7.543 -5.205 1.00 0.00 C ATOM 0 H LEU A 91 4.532 -9.297 -8.596 1.00 0.00 H new ATOM 0 HA LEU A 91 2.816 -11.179 -7.088 1.00 0.00 H new ATOM 0 HB2 LEU A 91 3.071 -9.944 -5.286 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.657 -9.882 -6.030 1.00 0.00 H new ATOM 0 HG LEU A 91 3.642 -7.618 -7.049 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.385 -6.427 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.475 -7.834 -5.836 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.348 -7.932 -4.289 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.798 -6.455 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.748 -7.973 -4.205 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.732 -7.866 -5.684 1.00 0.00 H new ATOM 1420 N VAL A 92 0.774 -10.465 -8.211 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.546 -10.110 -8.685 1.00 0.00 C ATOM 1422 C VAL A 92 -1.356 -9.673 -7.465 1.00 0.00 C ATOM 1423 O VAL A 92 -1.879 -10.518 -6.739 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.172 -11.311 -9.422 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -2.518 -10.919 -10.031 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -0.294 -11.804 -10.578 1.00 0.00 C ATOM 0 H VAL A 92 0.903 -11.471 -8.101 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.520 -9.291 -9.404 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.280 -12.099 -8.677 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.947 -11.777 -10.548 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.195 -10.596 -9.240 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.373 -10.104 -10.740 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.777 -12.651 -11.066 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.157 -10.999 -11.300 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.677 -12.114 -10.191 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.424 -8.358 -7.215 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.278 -7.775 -6.187 1.00 0.00 C ATOM 1438 C HIS A 93 -3.630 -7.488 -6.833 1.00 0.00 C ATOM 1439 O HIS A 93 -3.766 -6.476 -7.516 1.00 0.00 O ATOM 1440 CB HIS A 93 -1.608 -6.498 -5.645 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.192 -5.873 -4.395 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -1.454 -5.486 -3.289 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.476 -5.431 -4.213 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -2.273 -4.824 -2.453 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -3.504 -4.783 -2.990 1.00 0.00 N ATOM 0 H HIS A 93 -0.879 -7.667 -7.730 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.424 -8.447 -5.341 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.561 -6.727 -5.448 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.627 -5.748 -6.436 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.463 -5.671 -3.135 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.305 -5.563 -4.892 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.988 -4.395 -1.504 1.00 0.00 H new ATOM 1454 N VAL A 94 -4.628 -8.348 -6.633 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.003 -8.008 -6.980 1.00 0.00 C ATOM 1456 C VAL A 94 -6.564 -7.200 -5.808 1.00 0.00 C ATOM 1457 O VAL A 94 -6.213 -7.476 -4.659 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.825 -9.268 -7.297 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.217 -8.901 -7.815 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.150 -10.106 -8.383 1.00 0.00 C ATOM 0 H VAL A 94 -4.509 -9.279 -6.235 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.050 -7.410 -7.890 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.898 -9.832 -6.367 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.776 -9.811 -8.031 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.746 -8.321 -7.058 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.122 -8.309 -8.725 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.753 -10.991 -8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.055 -9.514 -9.293 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.160 -10.412 -8.044 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.376 -6.180 -6.097 1.00 0.00 N ATOM 1471 CA GLN A 95 -7.980 -5.286 -5.122 1.00 0.00 C ATOM 1472 C GLN A 95 -9.469 -5.182 -5.445 1.00 0.00 C ATOM 1473 O GLN A 95 -9.866 -4.466 -6.367 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.248 -3.940 -5.156 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.818 -2.936 -4.149 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.114 -1.584 -4.245 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -7.381 -0.791 -5.142 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -6.209 -1.287 -3.320 1.00 0.00 N ATOM 0 H GLN A 95 -7.637 -5.950 -7.056 1.00 0.00 H new ATOM 0 HA GLN A 95 -7.888 -5.660 -4.102 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.191 -4.100 -4.946 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.313 -3.520 -6.160 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.885 -2.805 -4.329 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -7.711 -3.332 -3.139 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -5.997 -1.956 -2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -5.725 -0.389 -3.349 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.284 -5.930 -4.696 1.00 0.00 N ATOM 1488 CA LYS A 96 -11.708 -6.089 -4.933 1.00 0.00 C ATOM 1489 C LYS A 96 -12.467 -5.468 -3.765 1.00 0.00 C ATOM 1490 O LYS A 96 -11.925 -5.336 -2.671 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.000 -7.590 -5.085 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.441 -7.887 -5.525 1.00 0.00 C ATOM 1493 CD LYS A 96 -13.605 -9.336 -6.010 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.336 -10.363 -4.898 1.00 0.00 C ATOM 1495 NZ LYS A 96 -13.503 -11.752 -5.374 1.00 0.00 N ATOM 0 H LYS A 96 -9.954 -6.454 -3.886 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.029 -5.584 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.310 -8.015 -5.814 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.807 -8.089 -4.135 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.120 -7.704 -4.692 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.725 -7.202 -6.324 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.616 -9.476 -6.392 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.923 -9.517 -6.840 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.323 -10.229 -4.519 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.015 -10.181 -4.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -13.312 -12.412 -4.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.477 -11.888 -5.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -12.837 -11.935 -6.152 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.726 -5.084 -3.974 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.558 -4.641 -2.865 1.00 0.00 C ATOM 1511 C TRP A 97 -15.986 -5.152 -3.018 1.00 0.00 C ATOM 1512 O TRP A 97 -16.434 -5.945 -2.192 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.433 -3.127 -2.689 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.432 -2.290 -3.928 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.535 -1.764 -4.495 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.302 -1.794 -4.716 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.170 -0.958 -5.540 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.809 -0.923 -5.719 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.902 -1.973 -4.685 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.984 -0.229 -6.617 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.061 -1.233 -5.542 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.595 -0.339 -6.480 1.00 0.00 C ATOM 0 H TRP A 97 -14.183 -5.072 -4.886 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.204 -5.079 -1.932 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.255 -2.792 -2.056 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.510 -2.926 -2.145 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.550 -1.949 -4.175 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.833 -0.443 -6.119 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.470 -2.685 -3.997 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.413 0.379 -7.400 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.990 -1.357 -5.474 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.939 0.261 -7.093 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.688 -4.747 -4.079 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.057 -5.193 -4.316 1.00 0.00 C ATOM 1535 C ASN A 98 -18.502 -4.853 -5.734 1.00 0.00 C ATOM 1536 O ASN A 98 -18.442 -5.705 -6.613 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.045 -4.717 -3.228 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.030 -3.218 -2.946 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.088 -2.693 -2.363 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.065 -2.499 -3.371 1.00 0.00 N ATOM 0 H ASN A 98 -16.327 -4.109 -4.788 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.066 -6.280 -4.234 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.054 -5.004 -3.525 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.823 -5.247 -2.302 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.085 -1.491 -3.214 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -20.839 -2.955 -3.854 1.00 0.00 H new ATOM 1547 N GLY A 99 -18.951 -3.620 -5.978 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.531 -3.258 -7.261 1.00 0.00 C ATOM 1549 C GLY A 99 -18.469 -3.086 -8.343 1.00 0.00 C ATOM 1550 O GLY A 99 -18.805 -3.023 -9.521 1.00 0.00 O ATOM 0 H GLY A 99 -18.921 -2.859 -5.300 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.239 -4.027 -7.568 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.094 -2.330 -7.155 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.201 -2.933 -7.947 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.078 -2.900 -8.859 1.00 0.00 C ATOM 1556 C GLN A 100 -14.966 -3.768 -8.270 1.00 0.00 C ATOM 1557 O GLN A 100 -14.975 -4.078 -7.073 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.571 -1.470 -9.111 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.631 -0.358 -9.213 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.969 0.239 -7.847 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -16.171 0.978 -7.263 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -18.104 -0.128 -7.261 1.00 0.00 N ATOM 0 H GLN A 100 -16.934 -2.828 -6.968 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.397 -3.286 -9.827 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.883 -1.209 -8.307 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -14.994 -1.474 -10.036 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.267 0.430 -9.873 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.537 -0.761 -9.666 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.757 -0.739 -7.752 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -18.322 0.201 -6.321 1.00 0.00 H new ATOM 1571 N GLU A 101 -14.012 -4.119 -9.131 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.780 -4.812 -8.820 1.00 0.00 C ATOM 1573 C GLU A 101 -11.678 -4.091 -9.594 1.00 0.00 C ATOM 1574 O GLU A 101 -11.972 -3.446 -10.607 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.924 -6.287 -9.219 1.00 0.00 C ATOM 1576 CG GLU A 101 -11.723 -7.162 -8.819 1.00 0.00 C ATOM 1577 CD GLU A 101 -10.789 -7.462 -9.989 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -10.516 -6.520 -10.764 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -10.386 -8.640 -10.087 1.00 0.00 O ATOM 0 H GLU A 101 -14.092 -3.910 -10.126 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.538 -4.801 -7.757 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -13.825 -6.691 -8.758 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -13.063 -6.349 -10.298 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -11.161 -6.660 -8.032 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -12.087 -8.101 -8.402 1.00 0.00 H new ATOM 1586 N THR A 102 -10.452 -4.122 -9.072 1.00 0.00 N ATOM 1587 CA THR A 102 -9.272 -3.599 -9.738 1.00 0.00 C ATOM 1588 C THR A 102 -8.118 -4.580 -9.558 1.00 0.00 C ATOM 1589 O THR A 102 -8.178 -5.459 -8.695 1.00 0.00 O ATOM 1590 CB THR A 102 -8.924 -2.228 -9.147 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.731 -2.308 -7.757 1.00 0.00 O ATOM 1592 CG2 THR A 102 -10.064 -1.244 -9.351 1.00 0.00 C ATOM 0 H THR A 102 -10.253 -4.521 -8.155 1.00 0.00 H new ATOM 0 HA THR A 102 -9.462 -3.478 -10.805 1.00 0.00 H new ATOM 0 HB THR A 102 -8.017 -1.900 -9.654 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.154 -3.123 -7.414 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.793 -0.279 -8.923 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.257 -1.127 -10.417 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.961 -1.620 -8.859 1.00 0.00 H new ATOM 1600 N SER A 103 -7.038 -4.397 -10.323 1.00 0.00 N ATOM 1601 CA SER A 103 -5.800 -5.126 -10.097 1.00 0.00 C ATOM 1602 C SER A 103 -4.621 -4.162 -10.142 1.00 0.00 C ATOM 1603 O SER A 103 -4.710 -3.091 -10.738 1.00 0.00 O ATOM 1604 CB SER A 103 -5.671 -6.292 -11.085 1.00 0.00 C ATOM 1605 OG SER A 103 -5.282 -5.852 -12.370 1.00 0.00 O ATOM 0 H SER A 103 -7.003 -3.745 -11.107 1.00 0.00 H new ATOM 0 HA SER A 103 -5.808 -5.574 -9.103 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.939 -7.007 -10.709 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.624 -6.817 -11.154 1.00 0.00 H new ATOM 0 HG SER A 103 -5.744 -5.014 -12.583 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.531 -4.525 -9.470 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.304 -3.756 -9.420 1.00 0.00 C ATOM 1613 C LEU A 104 -1.133 -4.725 -9.295 1.00 0.00 C ATOM 1614 O LEU A 104 -0.474 -4.819 -8.260 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.360 -2.658 -8.346 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.107 -3.010 -7.046 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -2.367 -2.461 -5.827 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -4.518 -2.414 -7.040 1.00 0.00 C ATOM 0 H LEU A 104 -3.483 -5.390 -8.931 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.161 -3.196 -10.344 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.338 -2.380 -8.088 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.830 -1.777 -8.782 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.161 -4.098 -6.999 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.914 -2.722 -4.921 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.367 -2.892 -5.784 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.292 -1.376 -5.905 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.021 -2.679 -6.110 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.455 -1.329 -7.122 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.084 -2.809 -7.884 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.894 -5.471 -10.374 1.00 0.00 N ATOM 1631 CA VAL A 105 0.196 -6.430 -10.444 1.00 0.00 C ATOM 1632 C VAL A 105 1.525 -5.672 -10.444 1.00 0.00 C ATOM 1633 O VAL A 105 1.644 -4.690 -11.176 1.00 0.00 O ATOM 1634 CB VAL A 105 0.009 -7.355 -11.663 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.150 -6.601 -12.992 1.00 0.00 C ATOM 1636 CG2 VAL A 105 1.157 -8.362 -11.786 1.00 0.00 C ATOM 0 H VAL A 105 -1.456 -5.423 -11.224 1.00 0.00 H new ATOM 0 HA VAL A 105 0.199 -7.083 -9.571 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.926 -7.883 -11.475 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.277 -7.317 -13.804 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.025 -5.953 -12.940 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.739 -5.997 -13.176 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.992 -8.997 -12.656 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.100 -7.827 -11.901 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.197 -8.979 -10.888 1.00 0.00 H new ATOM 1646 N ARG A 106 2.497 -6.085 -9.617 1.00 0.00 N ATOM 1647 CA ARG A 106 3.822 -5.467 -9.578 1.00 0.00 C ATOM 1648 C ARG A 106 4.909 -6.503 -9.838 1.00 0.00 C ATOM 1649 O ARG A 106 4.725 -7.679 -9.530 1.00 0.00 O ATOM 1650 CB ARG A 106 4.112 -4.772 -8.239 1.00 0.00 C ATOM 1651 CG ARG A 106 2.910 -4.071 -7.598 1.00 0.00 C ATOM 1652 CD ARG A 106 3.438 -3.120 -6.510 1.00 0.00 C ATOM 1653 NE ARG A 106 2.511 -2.932 -5.381 1.00 0.00 N ATOM 1654 CZ ARG A 106 1.360 -2.245 -5.415 1.00 0.00 C ATOM 1655 NH1 ARG A 106 0.870 -1.831 -6.585 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.708 -1.973 -4.278 1.00 0.00 N ATOM 0 H ARG A 106 2.383 -6.856 -8.959 1.00 0.00 H new ATOM 0 HA ARG A 106 3.827 -4.711 -10.363 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.497 -5.513 -7.538 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.902 -4.037 -8.392 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.348 -3.516 -8.349 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.228 -4.803 -7.166 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.384 -3.507 -6.130 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.648 -2.150 -6.960 1.00 0.00 H new ATOM 0 HE ARG A 106 2.768 -3.363 -4.493 1.00 0.00 H new ATOM 0 HH11 ARG A 106 1.371 -2.037 -7.449 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.005 -1.308 -6.615 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.087 -2.288 -3.385 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.168 -1.450 -4.305 1.00 0.00 H new ATOM 1670 N GLU A 107 6.048 -6.058 -10.365 1.00 0.00 N ATOM 1671 CA GLU A 107 7.195 -6.892 -10.682 1.00 0.00 C ATOM 1672 C GLU A 107 8.418 -5.983 -10.714 1.00 0.00 C ATOM 1673 O GLU A 107 8.254 -4.778 -10.888 1.00 0.00 O ATOM 1674 CB GLU A 107 6.929 -7.513 -12.055 1.00 0.00 C ATOM 1675 CG GLU A 107 7.949 -8.560 -12.518 1.00 0.00 C ATOM 1676 CD GLU A 107 7.374 -9.321 -13.701 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.602 -8.706 -14.472 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.546 -10.558 -13.784 1.00 0.00 O ATOM 0 H GLU A 107 6.198 -5.074 -10.589 1.00 0.00 H new ATOM 0 HA GLU A 107 7.362 -7.686 -9.955 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.942 -7.976 -12.040 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.895 -6.713 -12.795 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.884 -8.076 -12.800 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.179 -9.247 -11.704 1.00 0.00 H new ATOM 1685 N MET A 108 9.628 -6.530 -10.573 1.00 0.00 N ATOM 1686 CA MET A 108 10.829 -5.833 -11.004 1.00 0.00 C ATOM 1687 C MET A 108 11.543 -6.704 -12.025 1.00 0.00 C ATOM 1688 O MET A 108 11.977 -7.807 -11.706 1.00 0.00 O ATOM 1689 CB MET A 108 11.765 -5.457 -9.844 1.00 0.00 C ATOM 1690 CG MET A 108 12.856 -4.476 -10.326 1.00 0.00 C ATOM 1691 SD MET A 108 14.577 -4.845 -9.877 1.00 0.00 S ATOM 1692 CE MET A 108 14.882 -6.351 -10.831 1.00 0.00 C ATOM 0 H MET A 108 9.795 -7.450 -10.165 1.00 0.00 H new ATOM 0 HA MET A 108 10.532 -4.884 -11.450 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.190 -5.003 -9.037 1.00 0.00 H new ATOM 0 HB3 MET A 108 12.229 -6.356 -9.438 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.798 -4.416 -11.413 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.613 -3.486 -9.939 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.902 -6.694 -10.654 1.00 0.00 H new ATOM 0 HE2 MET A 108 14.180 -7.126 -10.522 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.748 -6.143 -11.893 1.00 0.00 H new ATOM 1702 N VAL A 109 11.719 -6.155 -13.221 1.00 0.00 N ATOM 1703 CA VAL A 109 12.762 -6.548 -14.148 1.00 0.00 C ATOM 1704 C VAL A 109 13.463 -5.245 -14.518 1.00 0.00 C ATOM 1705 O VAL A 109 13.026 -4.179 -14.069 1.00 0.00 O ATOM 1706 CB VAL A 109 12.201 -7.337 -15.344 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.732 -8.727 -14.900 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.047 -6.613 -16.046 1.00 0.00 C ATOM 0 H VAL A 109 11.124 -5.407 -13.577 1.00 0.00 H new ATOM 0 HA VAL A 109 13.475 -7.248 -13.713 1.00 0.00 H new ATOM 0 HB VAL A 109 13.018 -7.429 -16.060 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.339 -9.270 -15.759 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.573 -9.277 -14.477 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.951 -8.624 -14.147 1.00 0.00 H new ATOM 0 HG21 VAL A 109 10.693 -7.217 -16.881 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.232 -6.457 -15.339 1.00 0.00 H new ATOM 0 HG23 VAL A 109 11.395 -5.649 -16.418 1.00 0.00 H new ATOM 1718 N ASP A 110 14.578 -5.328 -15.247 1.00 0.00 N ATOM 1719 CA ASP A 110 15.480 -4.196 -15.401 1.00 0.00 C ATOM 1720 C ASP A 110 15.819 -3.676 -13.990 1.00 0.00 C ATOM 1721 O ASP A 110 16.290 -4.456 -13.159 1.00 0.00 O ATOM 1722 CB ASP A 110 14.849 -3.188 -16.378 1.00 0.00 C ATOM 1723 CG ASP A 110 15.697 -1.944 -16.575 1.00 0.00 C ATOM 1724 OD1 ASP A 110 16.670 -2.024 -17.350 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.357 -0.952 -15.893 1.00 0.00 O ATOM 0 H ASP A 110 14.874 -6.171 -15.739 1.00 0.00 H new ATOM 0 HA ASP A 110 16.437 -4.450 -15.857 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.695 -3.672 -17.342 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.866 -2.897 -16.007 1.00 0.00 H new ATOM 1730 N GLY A 111 15.513 -2.421 -13.669 1.00 0.00 N ATOM 1731 CA GLY A 111 15.764 -1.811 -12.375 1.00 0.00 C ATOM 1732 C GLY A 111 14.559 -1.006 -11.897 1.00 0.00 C ATOM 1733 O GLY A 111 14.710 -0.142 -11.036 1.00 0.00 O ATOM 0 H GLY A 111 15.068 -1.783 -14.329 1.00 0.00 H new ATOM 0 HA2 GLY A 111 15.999 -2.586 -11.645 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.636 -1.160 -12.441 1.00 0.00 H new ATOM 1737 N LYS A 112 13.363 -1.302 -12.420 1.00 0.00 N ATOM 1738 CA LYS A 112 12.141 -0.587 -12.085 1.00 0.00 C ATOM 1739 C LYS A 112 11.114 -1.568 -11.534 1.00 0.00 C ATOM 1740 O LYS A 112 10.926 -2.646 -12.100 1.00 0.00 O ATOM 1741 CB LYS A 112 11.600 0.140 -13.326 1.00 0.00 C ATOM 1742 CG LYS A 112 12.411 1.408 -13.630 1.00 0.00 C ATOM 1743 CD LYS A 112 11.656 2.362 -14.577 1.00 0.00 C ATOM 1744 CE LYS A 112 12.029 3.815 -14.234 1.00 0.00 C ATOM 1745 NZ LYS A 112 11.322 4.842 -15.031 1.00 0.00 N ATOM 0 H LYS A 112 13.223 -2.054 -13.094 1.00 0.00 H new ATOM 0 HA LYS A 112 12.352 0.161 -11.321 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.633 -0.530 -14.185 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.554 0.404 -13.168 1.00 0.00 H new ATOM 0 HG2 LYS A 112 12.637 1.926 -12.698 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.364 1.130 -14.080 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.912 2.143 -15.614 1.00 0.00 H new ATOM 0 HD3 LYS A 112 10.580 2.217 -14.477 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.822 3.989 -13.178 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.102 3.942 -14.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.718 5.780 -14.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.440 4.638 -16.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.310 4.831 -14.792 1.00 0.00 H new ATOM 1759 N LEU A 113 10.455 -1.195 -10.431 1.00 0.00 N ATOM 1760 CA LEU A 113 9.299 -1.909 -9.917 1.00 0.00 C ATOM 1761 C LEU A 113 8.132 -1.583 -10.842 1.00 0.00 C ATOM 1762 O LEU A 113 7.347 -0.677 -10.569 1.00 0.00 O ATOM 1763 CB LEU A 113 9.001 -1.489 -8.472 1.00 0.00 C ATOM 1764 CG LEU A 113 7.885 -2.311 -7.807 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.390 -3.691 -7.381 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.424 -1.594 -6.541 1.00 0.00 C ATOM 0 H LEU A 113 10.717 -0.383 -9.872 1.00 0.00 H new ATOM 0 HA LEU A 113 9.479 -2.984 -9.897 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.912 -1.584 -7.880 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.721 -0.436 -8.460 1.00 0.00 H new ATOM 0 HG LEU A 113 7.077 -2.421 -8.531 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.577 -4.248 -6.914 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.746 -4.234 -8.256 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.207 -3.576 -6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.632 -2.171 -6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.264 -1.493 -5.854 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.046 -0.605 -6.800 1.00 0.00 H new ATOM 1778 N ILE A 114 8.070 -2.252 -11.987 1.00 0.00 N ATOM 1779 CA ILE A 114 7.023 -2.078 -12.978 1.00 0.00 C ATOM 1780 C ILE A 114 5.695 -2.518 -12.358 1.00 0.00 C ATOM 1781 O ILE A 114 5.620 -3.599 -11.770 1.00 0.00 O ATOM 1782 CB ILE A 114 7.395 -2.906 -14.224 1.00 0.00 C ATOM 1783 CG1 ILE A 114 8.618 -2.278 -14.920 1.00 0.00 C ATOM 1784 CG2 ILE A 114 6.227 -3.006 -15.217 1.00 0.00 C ATOM 1785 CD1 ILE A 114 9.416 -3.307 -15.725 1.00 0.00 C ATOM 0 H ILE A 114 8.766 -2.948 -12.256 1.00 0.00 H new ATOM 0 HA ILE A 114 6.919 -1.038 -13.286 1.00 0.00 H new ATOM 0 HB ILE A 114 7.634 -3.916 -13.891 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.286 -1.479 -15.583 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.266 -1.823 -14.171 1.00 0.00 H new ATOM 0 HG21 ILE A 114 6.533 -3.598 -16.080 1.00 0.00 H new ATOM 0 HG22 ILE A 114 5.377 -3.485 -14.731 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.942 -2.006 -15.545 1.00 0.00 H new ATOM 0 HD11 ILE A 114 10.268 -2.818 -16.197 1.00 0.00 H new ATOM 0 HD12 ILE A 114 9.772 -4.093 -15.059 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.777 -3.744 -16.493 1.00 0.00 H new ATOM 1797 N LEU A 115 4.640 -1.706 -12.503 1.00 0.00 N ATOM 1798 CA LEU A 115 3.284 -2.155 -12.244 1.00 0.00 C ATOM 1799 C LEU A 115 2.310 -1.517 -13.231 1.00 0.00 C ATOM 1800 O LEU A 115 2.578 -0.457 -13.804 1.00 0.00 O ATOM 1801 CB LEU A 115 2.859 -1.919 -10.781 1.00 0.00 C ATOM 1802 CG LEU A 115 2.806 -0.448 -10.340 1.00 0.00 C ATOM 1803 CD1 LEU A 115 1.708 -0.180 -9.299 1.00 0.00 C ATOM 1804 CD2 LEU A 115 4.155 -0.033 -9.747 1.00 0.00 C ATOM 0 H LEU A 115 4.710 -0.733 -12.800 1.00 0.00 H new ATOM 0 HA LEU A 115 3.259 -3.234 -12.396 1.00 0.00 H new ATOM 0 HB2 LEU A 115 1.874 -2.362 -10.630 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.551 -2.452 -10.129 1.00 0.00 H new ATOM 0 HG LEU A 115 2.576 0.138 -11.230 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.717 0.875 -9.024 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.736 -0.437 -9.721 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.891 -0.787 -8.413 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.110 1.011 -9.437 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.381 -0.659 -8.884 1.00 0.00 H new ATOM 0 HD23 LEU A 115 4.936 -0.155 -10.498 1.00 0.00 H new ATOM 1816 N THR A 116 1.155 -2.157 -13.403 1.00 0.00 N ATOM 1817 CA THR A 116 0.010 -1.568 -14.070 1.00 0.00 C ATOM 1818 C THR A 116 -1.165 -1.700 -13.108 1.00 0.00 C ATOM 1819 O THR A 116 -1.397 -2.777 -12.559 1.00 0.00 O ATOM 1820 CB THR A 116 -0.214 -2.199 -15.453 1.00 0.00 C ATOM 1821 OG1 THR A 116 -1.268 -1.530 -16.114 1.00 0.00 O ATOM 1822 CG2 THR A 116 -0.523 -3.695 -15.419 1.00 0.00 C ATOM 0 H THR A 116 0.992 -3.110 -13.077 1.00 0.00 H new ATOM 0 HA THR A 116 0.159 -0.512 -14.293 1.00 0.00 H new ATOM 0 HB THR A 116 0.730 -2.088 -15.987 1.00 0.00 H new ATOM 0 HG1 THR A 116 -1.408 -1.932 -16.996 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.667 -4.060 -16.436 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.308 -4.228 -14.957 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.431 -3.866 -14.840 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.826 -0.572 -12.844 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.901 -0.402 -11.887 1.00 0.00 C ATOM 1832 C LEU A 117 -4.169 -0.194 -12.718 1.00 0.00 C ATOM 1833 O LEU A 117 -4.293 0.829 -13.394 1.00 0.00 O ATOM 1834 CB LEU A 117 -2.512 0.784 -10.986 1.00 0.00 C ATOM 1835 CG LEU A 117 -3.464 1.043 -9.808 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -2.671 1.188 -8.508 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -4.206 2.363 -10.012 1.00 0.00 C ATOM 0 H LEU A 117 -1.605 0.298 -13.328 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.079 -1.249 -11.224 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.511 0.609 -10.593 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.462 1.685 -11.598 1.00 0.00 H new ATOM 0 HG LEU A 117 -4.157 0.203 -9.755 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.358 1.371 -7.681 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.112 0.272 -8.319 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.978 2.025 -8.596 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.878 2.536 -9.171 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.486 3.179 -10.076 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.784 2.317 -10.935 1.00 0.00 H new ATOM 1849 N THR A 118 -5.039 -1.207 -12.765 1.00 0.00 N ATOM 1850 CA THR A 118 -6.086 -1.354 -13.765 1.00 0.00 C ATOM 1851 C THR A 118 -7.460 -1.501 -13.102 1.00 0.00 C ATOM 1852 O THR A 118 -7.611 -2.206 -12.101 1.00 0.00 O ATOM 1853 CB THR A 118 -5.763 -2.557 -14.669 1.00 0.00 C ATOM 1854 OG1 THR A 118 -5.906 -3.768 -13.948 1.00 0.00 O ATOM 1855 CG2 THR A 118 -4.330 -2.463 -15.214 1.00 0.00 C ATOM 0 H THR A 118 -5.029 -1.967 -12.085 1.00 0.00 H new ATOM 0 HA THR A 118 -6.124 -0.456 -14.381 1.00 0.00 H new ATOM 0 HB THR A 118 -6.464 -2.543 -15.504 1.00 0.00 H new ATOM 0 HG1 THR A 118 -5.699 -4.525 -14.535 1.00 0.00 H new ATOM 0 HG21 THR A 118 -4.125 -3.324 -15.850 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.221 -1.548 -15.796 1.00 0.00 H new ATOM 0 HG23 THR A 118 -3.625 -2.450 -14.383 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.465 -0.832 -13.677 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.859 -0.882 -13.277 1.00 0.00 C ATOM 1865 C HIS A 119 -10.702 -1.045 -14.538 1.00 0.00 C ATOM 1866 O HIS A 119 -10.441 -0.388 -15.542 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.213 0.443 -12.579 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.691 0.676 -12.356 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.376 1.834 -12.679 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.605 -0.239 -11.907 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.684 1.619 -12.438 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.845 0.364 -11.979 1.00 0.00 N ATOM 0 H HIS A 119 -8.311 -0.213 -14.473 1.00 0.00 H new ATOM 0 HA HIS A 119 -10.046 -1.711 -12.595 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.707 0.474 -11.614 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.817 1.266 -13.174 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -12.396 -1.241 -11.562 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.476 2.338 -12.589 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -14.734 -0.069 -11.727 1.00 0.00 H new ATOM 1881 N GLY A 120 -11.766 -1.846 -14.478 1.00 0.00 N ATOM 1882 CA GLY A 120 -12.798 -1.821 -15.502 1.00 0.00 C ATOM 1883 C GLY A 120 -13.381 -0.410 -15.619 1.00 0.00 C ATOM 1884 O GLY A 120 -14.305 -0.084 -14.878 1.00 0.00 O ATOM 0 H GLY A 120 -11.931 -2.518 -13.729 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.380 -2.132 -16.460 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.587 -2.531 -15.253 1.00 0.00 H new ATOM 1888 N THR A 121 -12.800 0.409 -16.509 1.00 0.00 N ATOM 1889 CA THR A 121 -13.124 1.784 -16.918 1.00 0.00 C ATOM 1890 C THR A 121 -11.856 2.651 -17.022 1.00 0.00 C ATOM 1891 O THR A 121 -11.861 3.614 -17.783 1.00 0.00 O ATOM 1892 CB THR A 121 -14.217 2.469 -16.066 1.00 0.00 C ATOM 1893 OG1 THR A 121 -15.463 1.834 -16.249 1.00 0.00 O ATOM 1894 CG2 THR A 121 -14.459 3.938 -16.426 1.00 0.00 C ATOM 0 H THR A 121 -11.985 0.078 -17.026 1.00 0.00 H new ATOM 0 HA THR A 121 -13.563 1.691 -17.911 1.00 0.00 H new ATOM 0 HB THR A 121 -13.844 2.396 -15.044 1.00 0.00 H new ATOM 0 HG1 THR A 121 -15.492 1.011 -15.717 1.00 0.00 H new ATOM 0 HG21 THR A 121 -15.240 4.346 -15.784 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.539 4.504 -16.283 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.771 4.011 -17.468 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.778 2.356 -16.278 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.603 3.230 -16.239 1.00 0.00 C ATOM 1904 C ALA A 122 -8.322 2.425 -16.018 1.00 0.00 C ATOM 1905 O ALA A 122 -8.355 1.355 -15.416 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.780 4.294 -15.150 1.00 0.00 C ATOM 0 H ALA A 122 -10.699 1.521 -15.698 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.510 3.729 -17.203 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.903 4.940 -15.127 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.665 4.892 -15.366 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.898 3.808 -14.182 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.187 2.933 -16.505 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.930 2.200 -16.557 1.00 0.00 C ATOM 1914 C VAL A 123 -4.776 3.151 -16.243 1.00 0.00 C ATOM 1915 O VAL A 123 -4.749 4.266 -16.755 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.800 1.543 -17.946 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -5.752 2.547 -19.105 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.572 0.634 -18.034 1.00 0.00 C ATOM 0 H VAL A 123 -7.120 3.880 -16.879 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.903 1.407 -15.810 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.710 0.952 -18.053 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -5.660 2.009 -20.049 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.667 3.139 -19.112 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.894 3.208 -18.979 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.518 0.191 -19.028 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.672 1.220 -17.848 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.651 -0.157 -17.288 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.830 2.729 -15.398 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.662 3.521 -15.041 1.00 0.00 C ATOM 1930 C CYS A 124 -1.419 2.638 -14.926 1.00 0.00 C ATOM 1931 O CYS A 124 -1.225 1.972 -13.913 1.00 0.00 O ATOM 1932 CB CYS A 124 -2.941 4.260 -13.726 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.408 4.955 -13.048 1.00 0.00 S ATOM 0 H CYS A 124 -3.859 1.818 -14.941 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.466 4.252 -15.826 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.664 5.058 -13.897 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.387 3.575 -13.005 1.00 0.00 H new ATOM 0 HG CYS A 124 -0.963 5.883 -13.843 1.00 0.00 H new ATOM 1939 N THR A 125 -0.513 2.730 -15.899 1.00 0.00 N ATOM 1940 CA THR A 125 0.871 2.304 -15.746 1.00 0.00 C ATOM 1941 C THR A 125 1.490 3.085 -14.584 1.00 0.00 C ATOM 1942 O THR A 125 1.152 4.264 -14.428 1.00 0.00 O ATOM 1943 CB THR A 125 1.594 2.670 -17.048 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.217 3.992 -17.391 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.187 1.740 -18.192 1.00 0.00 C ATOM 0 H THR A 125 -0.725 3.106 -16.823 1.00 0.00 H new ATOM 0 HA THR A 125 0.948 1.235 -15.546 1.00 0.00 H new ATOM 0 HB THR A 125 2.669 2.577 -16.897 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.102 4.522 -16.574 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.717 2.027 -19.100 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.440 0.712 -17.933 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.113 1.818 -18.359 1.00 0.00 H new ATOM 1953 N ARG A 126 2.370 2.478 -13.783 1.00 0.00 N ATOM 1954 CA ARG A 126 3.038 3.176 -12.692 1.00 0.00 C ATOM 1955 C ARG A 126 4.348 2.458 -12.371 1.00 0.00 C ATOM 1956 O ARG A 126 4.477 1.270 -12.667 1.00 0.00 O ATOM 1957 CB ARG A 126 2.067 3.251 -11.502 1.00 0.00 C ATOM 1958 CG ARG A 126 2.583 3.973 -10.251 1.00 0.00 C ATOM 1959 CD ARG A 126 1.418 4.106 -9.260 1.00 0.00 C ATOM 1960 NE ARG A 126 1.828 4.690 -7.974 1.00 0.00 N ATOM 1961 CZ ARG A 126 1.396 5.853 -7.461 1.00 0.00 C ATOM 1962 NH1 ARG A 126 0.817 6.782 -8.228 1.00 0.00 N ATOM 1963 NH2 ARG A 126 1.570 6.072 -6.156 1.00 0.00 N ATOM 0 H ARG A 126 2.635 1.497 -13.875 1.00 0.00 H new ATOM 0 HA ARG A 126 3.302 4.199 -12.959 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.156 3.749 -11.834 1.00 0.00 H new ATOM 0 HB3 ARG A 126 1.790 2.235 -11.221 1.00 0.00 H new ATOM 0 HG2 ARG A 126 3.403 3.414 -9.801 1.00 0.00 H new ATOM 0 HG3 ARG A 126 2.973 4.956 -10.513 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.639 4.726 -9.703 1.00 0.00 H new ATOM 0 HD3 ARG A 126 0.982 3.123 -9.085 1.00 0.00 H new ATOM 0 HE ARG A 126 2.503 4.163 -7.421 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.695 6.615 -9.227 1.00 0.00 H new ATOM 0 HH12 ARG A 126 0.497 7.658 -7.814 1.00 0.00 H new ATOM 0 HH21 ARG A 126 2.021 5.365 -5.576 1.00 0.00 H new ATOM 0 HH22 ARG A 126 1.252 6.947 -5.739 1.00 0.00 H new ATOM 1977 N THR A 127 5.335 3.160 -11.802 1.00 0.00 N ATOM 1978 CA THR A 127 6.579 2.517 -11.409 1.00 0.00 C ATOM 1979 C THR A 127 7.332 3.291 -10.330 1.00 0.00 C ATOM 1980 O THR A 127 7.151 4.502 -10.159 1.00 0.00 O ATOM 1981 CB THR A 127 7.447 2.205 -12.637 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.324 1.147 -12.341 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.291 3.393 -13.080 1.00 0.00 C ATOM 0 H THR A 127 5.292 4.160 -11.608 1.00 0.00 H new ATOM 0 HA THR A 127 6.320 1.565 -10.946 1.00 0.00 H new ATOM 0 HB THR A 127 6.760 1.947 -13.443 1.00 0.00 H new ATOM 0 HG1 THR A 127 7.963 0.621 -11.597 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.883 3.114 -13.951 1.00 0.00 H new ATOM 0 HG22 THR A 127 7.638 4.227 -13.337 1.00 0.00 H new ATOM 0 HG23 THR A 127 8.956 3.689 -12.269 1.00 0.00 H new ATOM 1991 N TYR A 128 8.172 2.549 -9.604 1.00 0.00 N ATOM 1992 CA TYR A 128 9.024 3.032 -8.535 1.00 0.00 C ATOM 1993 C TYR A 128 10.429 2.475 -8.764 1.00 0.00 C ATOM 1994 O TYR A 128 10.576 1.386 -9.321 1.00 0.00 O ATOM 1995 CB TYR A 128 8.498 2.571 -7.163 1.00 0.00 C ATOM 1996 CG TYR A 128 7.097 3.005 -6.760 1.00 0.00 C ATOM 1997 CD1 TYR A 128 5.966 2.461 -7.394 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.923 3.830 -5.630 1.00 0.00 C ATOM 1999 CE1 TYR A 128 4.672 2.823 -6.972 1.00 0.00 C ATOM 2000 CE2 TYR A 128 5.634 4.196 -5.212 1.00 0.00 C ATOM 2001 CZ TYR A 128 4.510 3.690 -5.882 1.00 0.00 C ATOM 2002 OH TYR A 128 3.257 4.027 -5.449 1.00 0.00 O ATOM 0 H TYR A 128 8.275 1.546 -9.760 1.00 0.00 H new ATOM 0 HA TYR A 128 9.035 4.122 -8.539 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.531 1.482 -7.140 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.191 2.927 -6.401 1.00 0.00 H new ATOM 0 HD1 TYR A 128 6.090 1.762 -8.208 1.00 0.00 H new ATOM 0 HD2 TYR A 128 7.785 4.182 -5.084 1.00 0.00 H new ATOM 0 HE1 TYR A 128 3.806 2.434 -7.487 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.508 4.867 -4.375 1.00 0.00 H new ATOM 0 HH TYR A 128 3.316 4.430 -4.558 1.00 0.00 H new ATOM 2012 N GLU A 129 11.448 3.209 -8.321 1.00 0.00 N ATOM 2013 CA GLU A 129 12.853 2.851 -8.447 1.00 0.00 C ATOM 2014 C GLU A 129 13.400 2.572 -7.049 1.00 0.00 C ATOM 2015 O GLU A 129 13.086 3.311 -6.114 1.00 0.00 O ATOM 2016 CB GLU A 129 13.617 4.005 -9.108 1.00 0.00 C ATOM 2017 CG GLU A 129 12.944 4.441 -10.416 1.00 0.00 C ATOM 2018 CD GLU A 129 13.734 5.514 -11.157 1.00 0.00 C ATOM 2019 OE1 GLU A 129 14.437 6.283 -10.467 1.00 0.00 O ATOM 2020 OE2 GLU A 129 13.594 5.553 -12.401 1.00 0.00 O ATOM 0 H GLU A 129 11.309 4.102 -7.848 1.00 0.00 H new ATOM 0 HA GLU A 129 12.972 1.963 -9.069 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.667 4.851 -8.422 1.00 0.00 H new ATOM 0 HB3 GLU A 129 14.643 3.697 -9.309 1.00 0.00 H new ATOM 0 HG2 GLU A 129 12.823 3.573 -11.064 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.945 4.818 -10.197 1.00 0.00 H new ATOM 2027 N LYS A 130 14.182 1.500 -6.893 1.00 0.00 N ATOM 2028 CA LYS A 130 14.771 1.135 -5.612 1.00 0.00 C ATOM 2029 C LYS A 130 15.795 2.196 -5.215 1.00 0.00 C ATOM 2030 O LYS A 130 16.756 2.414 -5.946 1.00 0.00 O ATOM 2031 CB LYS A 130 15.394 -0.268 -5.680 1.00 0.00 C ATOM 2032 CG LYS A 130 16.237 -0.571 -4.432 1.00 0.00 C ATOM 2033 CD LYS A 130 16.380 -2.079 -4.185 1.00 0.00 C ATOM 2034 CE LYS A 130 15.213 -2.588 -3.325 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.316 -4.030 -3.036 1.00 0.00 N ATOM 0 H LYS A 130 14.421 0.864 -7.654 1.00 0.00 H new ATOM 0 HA LYS A 130 13.996 1.098 -4.846 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.605 -1.013 -5.777 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.018 -0.347 -6.570 1.00 0.00 H new ATOM 0 HG2 LYS A 130 17.226 -0.127 -4.546 1.00 0.00 H new ATOM 0 HG3 LYS A 130 15.777 -0.103 -3.562 1.00 0.00 H new ATOM 0 HD2 LYS A 130 16.399 -2.611 -5.136 1.00 0.00 H new ATOM 0 HD3 LYS A 130 17.327 -2.285 -3.685 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.187 -2.033 -2.387 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.273 -2.389 -3.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 15.264 -4.183 -2.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 14.534 -4.534 -3.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.223 -4.392 -3.395 1.00 0.00 H new ATOM 2049 N GLN A 131 15.613 2.826 -4.049 1.00 0.00 N ATOM 2050 CA GLN A 131 16.604 3.755 -3.522 1.00 0.00 C ATOM 2051 C GLN A 131 17.660 3.005 -2.708 1.00 0.00 C ATOM 2052 O GLN A 131 18.836 3.347 -2.765 1.00 0.00 O ATOM 2053 CB GLN A 131 15.944 4.903 -2.747 1.00 0.00 C ATOM 2054 CG GLN A 131 15.306 4.498 -1.416 1.00 0.00 C ATOM 2055 CD GLN A 131 14.732 5.716 -0.709 1.00 0.00 C ATOM 2056 OE1 GLN A 131 15.385 6.320 0.132 1.00 0.00 O ATOM 2057 NE2 GLN A 131 13.509 6.102 -1.055 1.00 0.00 N ATOM 0 H GLN A 131 14.790 2.706 -3.458 1.00 0.00 H new ATOM 0 HA GLN A 131 17.123 4.225 -4.357 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.693 5.671 -2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.179 5.355 -3.378 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.517 3.767 -1.592 1.00 0.00 H new ATOM 0 HG3 GLN A 131 16.050 4.018 -0.780 1.00 0.00 H new ATOM 0 HE21 GLN A 131 12.989 5.578 -1.759 1.00 0.00 H new ATOM 0 HE22 GLN A 131 13.090 6.922 -0.616 1.00 0.00 H new ATOM 2066 N ALA A 132 17.244 1.987 -1.944 1.00 0.00 N ATOM 2067 CA ALA A 132 18.141 1.217 -1.090 1.00 0.00 C ATOM 2068 C ALA A 132 17.468 -0.087 -0.673 1.00 0.00 C ATOM 2069 O ALA A 132 16.268 -0.262 -0.882 1.00 0.00 O ATOM 2070 CB ALA A 132 18.531 2.036 0.145 1.00 0.00 C ATOM 2071 OXT ALA A 132 18.209 -1.076 -0.059 1.00 0.00 O ATOM 0 H ALA A 132 16.273 1.678 -1.905 1.00 0.00 H new ATOM 0 HA ALA A 132 19.047 0.982 -1.648 1.00 0.00 H new ATOM 0 HB1 ALA A 132 19.201 1.449 0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 132 19.035 2.950 -0.169 1.00 0.00 H new ATOM 0 HB3 ALA A 132 17.635 2.292 0.710 1.00 0.00 H new