USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 883 hydrogens (36 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 110 HECFE :(H bumps) USER MOD NoAdj-H: A 105 IMD HN3 : A 105 IMD N3 : A 110 HECFE :(H bumps) USER MOD NoAdj-H: A 110 HEC HAC : A 110 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 110 HEC HAB : A 110 HEC CAB : A 14 CYS SG :(H bumps) USER MOD NoAdj-H: A 110 HEC H2A : A 110 HEC O2A : A 110 HEC CGA :(short bond) USER MOD Set 1.1: A 52 ASN : amide:sc= -1.09! C(o=1.7!,f=-8!) USER MOD Set 1.2: A 55 LYS NZ :NH3+ 152:sc= 0.509 (180deg=-0.013) USER MOD Set 1.3: A 67 TYR OH : rot -143:sc= 2.26 USER MOD Single : A 1 GLY N :NH3+ -151:sc= 1.04 (180deg=-0.12!) USER MOD Single : A 5 LYS NZ :NH3+ 160:sc= 1.19 (180deg=0.736) USER MOD Single : A 7 LYS NZ :NH3+ 168:sc= 0.648 (180deg=0.0443) USER MOD Single : A 8 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.202) USER MOD Single : A 12 GLN : amide:sc= -0.196 X(o=-0.2,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 THR OG1 : rot -3:sc= 0.473 USER MOD Single : A 22 LYS NZ :NH3+ 135:sc= 1.01 (180deg=0.143!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.0246 X(o=-0.025,f=-0.0079) USER MOD Single : A 27 LYS NZ :NH3+ -119:sc= 1.08 (180deg=0.00187) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0349 USER MOD Single : A 31 ASN : amide:sc= 0.101 K(o=0.1,f=-7.3!) USER MOD Single : A 33 HIS : no HD1:sc= -0.912 X(o=-0.91,f=-0.51) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 139:sc= 1.48 USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 35:sc= 0.522 USER MOD Single : A 53 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00755) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.0563 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -166:sc= 0.641 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= -0.0215 X(o=-0.021,f=-0.45) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 140:sc= 1.26 USER MOD Single : A 78 THR OG1 : rot 91:sc= -0.134 USER MOD Single : A 79 LYS NZ :NH3+ -170:sc= -0.0101 (180deg=-0.0892) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 171:sc= 1.23 (180deg=1.01) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0609 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -131:sc= 1.15 (180deg=0.888) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -69:sc= 1.25 USER MOD Single : A 103 ASN : amide:sc= 0.651 K(o=0.65,f=-0.19) USER MOD Single : A 110 HEC O2D : rot -110:sc= -0.243 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.106 -3.974 -16.260 1.00 10.00 N ATOM 2 CA GLY A 1 -3.970 -4.111 -15.363 1.00 10.00 C ATOM 3 C GLY A 1 -3.437 -5.519 -15.547 1.00 10.00 C ATOM 4 O GLY A 1 -4.189 -6.470 -15.340 1.00 10.00 O ATOM 0 H1 GLY A 1 -5.201 -2.980 -16.551 1.00 10.00 H new ATOM 0 H2 GLY A 1 -4.958 -4.568 -17.101 1.00 10.00 H new ATOM 0 H3 GLY A 1 -5.973 -4.276 -15.771 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.202 -3.373 -15.595 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -4.271 -3.943 -14.329 1.00 10.00 H new ATOM 10 N ASP A 2 -2.203 -5.659 -16.018 1.00 10.00 N ATOM 11 CA ASP A 2 -1.551 -6.951 -16.139 1.00 10.00 C ATOM 12 C ASP A 2 -1.083 -7.434 -14.766 1.00 10.00 C ATOM 13 O ASP A 2 -0.342 -6.731 -14.079 1.00 10.00 O ATOM 14 CB ASP A 2 -0.324 -6.839 -17.037 1.00 10.00 C ATOM 15 CG ASP A 2 0.377 -8.180 -17.187 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.220 -9.219 -16.825 1.00 10.00 O ATOM 17 OD2 ASP A 2 1.565 -8.134 -17.560 1.00 10.00 O ATOM 0 H ASP A 2 -1.628 -4.875 -16.327 1.00 10.00 H new ATOM 0 HA ASP A 2 -2.269 -7.653 -16.564 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.622 -6.470 -18.019 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.369 -6.109 -16.619 1.00 10.00 H new ATOM 22 N VAL A 3 -1.450 -8.657 -14.395 1.00 10.00 N ATOM 23 CA VAL A 3 -0.909 -9.317 -13.220 1.00 10.00 C ATOM 24 C VAL A 3 0.604 -9.498 -13.353 1.00 10.00 C ATOM 25 O VAL A 3 1.327 -9.268 -12.383 1.00 10.00 O ATOM 26 CB VAL A 3 -1.641 -10.657 -13.001 1.00 10.00 C ATOM 27 CG1 VAL A 3 -0.992 -11.510 -11.903 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.109 -10.411 -12.630 1.00 10.00 C ATOM 0 H VAL A 3 -2.133 -9.217 -14.905 1.00 10.00 H new ATOM 0 HA VAL A 3 -1.075 -8.696 -12.340 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.572 -11.203 -13.942 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.547 -12.441 -11.790 1.00 10.00 H new ATOM 0 HG12 VAL A 3 0.039 -11.733 -12.177 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -1.007 -10.963 -10.961 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.611 -11.367 -12.479 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.159 -9.826 -11.712 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.601 -9.866 -13.435 1.00 10.00 H new ATOM 38 N GLU A 4 1.103 -9.914 -14.522 1.00 10.00 N ATOM 39 CA GLU A 4 2.528 -10.183 -14.653 1.00 10.00 C ATOM 40 C GLU A 4 3.322 -8.898 -14.481 1.00 10.00 C ATOM 41 O GLU A 4 4.168 -8.796 -13.593 1.00 10.00 O ATOM 42 CB GLU A 4 2.868 -10.857 -15.986 1.00 10.00 C ATOM 43 CG GLU A 4 2.738 -12.389 -15.915 1.00 10.00 C ATOM 44 CD GLU A 4 3.561 -13.024 -14.801 1.00 10.00 C ATOM 45 OE1 GLU A 4 4.812 -12.946 -14.833 1.00 10.00 O ATOM 46 OE2 GLU A 4 2.959 -13.555 -13.841 1.00 10.00 O ATOM 0 H GLU A 4 0.553 -10.067 -15.367 1.00 10.00 H new ATOM 0 HA GLU A 4 2.805 -10.881 -13.863 1.00 10.00 H new ATOM 0 HB2 GLU A 4 2.207 -10.474 -16.763 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.886 -10.594 -16.275 1.00 10.00 H new ATOM 0 HG2 GLU A 4 1.689 -12.649 -15.773 1.00 10.00 H new ATOM 0 HG3 GLU A 4 3.046 -12.815 -16.870 1.00 10.00 H new ATOM 53 N LYS A 5 3.064 -7.898 -15.316 1.00 10.00 N ATOM 54 CA LYS A 5 3.747 -6.634 -15.176 1.00 10.00 C ATOM 55 C LYS A 5 3.503 -6.076 -13.779 1.00 10.00 C ATOM 56 O LYS A 5 4.447 -5.609 -13.155 1.00 10.00 O ATOM 57 CB LYS A 5 3.352 -5.656 -16.271 1.00 10.00 C ATOM 58 CG LYS A 5 4.014 -5.968 -17.620 1.00 10.00 C ATOM 59 CD LYS A 5 3.861 -4.768 -18.562 1.00 10.00 C ATOM 60 CE LYS A 5 2.404 -4.605 -19.028 1.00 10.00 C ATOM 61 NZ LYS A 5 2.038 -3.191 -19.229 1.00 10.00 N ATOM 0 H LYS A 5 2.395 -7.944 -16.085 1.00 10.00 H new ATOM 0 HA LYS A 5 4.818 -6.795 -15.295 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.269 -5.672 -16.392 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.624 -4.646 -15.964 1.00 10.00 H new ATOM 0 HG2 LYS A 5 5.070 -6.195 -17.474 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.557 -6.852 -18.064 1.00 10.00 H new ATOM 0 HD2 LYS A 5 4.186 -3.860 -18.054 1.00 10.00 H new ATOM 0 HD3 LYS A 5 4.510 -4.898 -19.428 1.00 10.00 H new ATOM 0 HE2 LYS A 5 2.259 -5.152 -19.960 1.00 10.00 H new ATOM 0 HE3 LYS A 5 1.736 -5.050 -18.290 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 1.203 -3.133 -19.846 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 1.821 -2.755 -18.310 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 2.832 -2.687 -19.673 1.00 10.00 H new ATOM 75 N GLY A 6 2.283 -6.185 -13.251 1.00 10.00 N ATOM 76 CA GLY A 6 1.993 -5.822 -11.877 1.00 10.00 C ATOM 77 C GLY A 6 2.976 -6.440 -10.877 1.00 10.00 C ATOM 78 O GLY A 6 3.490 -5.757 -9.988 1.00 10.00 O ATOM 0 H GLY A 6 1.474 -6.528 -13.769 1.00 10.00 H new ATOM 0 HA2 GLY A 6 2.018 -4.737 -11.780 1.00 10.00 H new ATOM 0 HA3 GLY A 6 0.981 -6.141 -11.628 1.00 10.00 H new ATOM 82 N LYS A 7 3.242 -7.740 -11.027 1.00 10.00 N ATOM 83 CA LYS A 7 4.150 -8.498 -10.194 1.00 10.00 C ATOM 84 C LYS A 7 5.527 -7.860 -10.324 1.00 10.00 C ATOM 85 O LYS A 7 6.147 -7.494 -9.325 1.00 10.00 O ATOM 86 CB LYS A 7 4.099 -9.963 -10.644 1.00 10.00 C ATOM 87 CG LYS A 7 4.930 -10.943 -9.811 1.00 10.00 C ATOM 88 CD LYS A 7 4.750 -12.378 -10.342 1.00 10.00 C ATOM 89 CE LYS A 7 5.472 -12.575 -11.685 1.00 10.00 C ATOM 90 NZ LYS A 7 5.057 -13.794 -12.407 1.00 10.00 N ATOM 0 H LYS A 7 2.811 -8.304 -11.760 1.00 10.00 H new ATOM 0 HA LYS A 7 3.881 -8.484 -9.138 1.00 10.00 H new ATOM 0 HB2 LYS A 7 3.060 -10.292 -10.629 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.436 -10.018 -11.679 1.00 10.00 H new ATOM 0 HG2 LYS A 7 5.983 -10.663 -9.849 1.00 10.00 H new ATOM 0 HG3 LYS A 7 4.625 -10.893 -8.766 1.00 10.00 H new ATOM 0 HD2 LYS A 7 5.137 -13.089 -9.612 1.00 10.00 H new ATOM 0 HD3 LYS A 7 3.688 -12.592 -10.463 1.00 10.00 H new ATOM 0 HE2 LYS A 7 5.287 -11.707 -12.318 1.00 10.00 H new ATOM 0 HE3 LYS A 7 6.547 -12.616 -11.507 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 5.422 -13.762 -13.380 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 5.437 -14.631 -11.921 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 4.019 -13.848 -12.429 1.00 10.00 H new ATOM 104 N LYS A 8 6.002 -7.701 -11.563 1.00 10.00 N ATOM 105 CA LYS A 8 7.341 -7.183 -11.779 1.00 10.00 C ATOM 106 C LYS A 8 7.477 -5.754 -11.238 1.00 10.00 C ATOM 107 O LYS A 8 8.509 -5.398 -10.671 1.00 10.00 O ATOM 108 CB LYS A 8 7.784 -7.288 -13.247 1.00 10.00 C ATOM 109 CG LYS A 8 7.466 -8.622 -13.945 1.00 10.00 C ATOM 110 CD LYS A 8 7.677 -9.919 -13.141 1.00 10.00 C ATOM 111 CE LYS A 8 9.128 -10.423 -13.137 1.00 10.00 C ATOM 112 NZ LYS A 8 10.014 -9.598 -12.291 1.00 10.00 N ATOM 0 H LYS A 8 5.484 -7.921 -12.413 1.00 10.00 H new ATOM 0 HA LYS A 8 8.023 -7.816 -11.212 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.311 -6.483 -13.809 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.860 -7.121 -13.296 1.00 10.00 H new ATOM 0 HG2 LYS A 8 6.425 -8.592 -14.267 1.00 10.00 H new ATOM 0 HG3 LYS A 8 8.076 -8.683 -14.846 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.358 -9.752 -12.112 1.00 10.00 H new ATOM 0 HD3 LYS A 8 7.034 -10.697 -13.552 1.00 10.00 H new ATOM 0 HE2 LYS A 8 9.150 -11.454 -12.782 1.00 10.00 H new ATOM 0 HE3 LYS A 8 9.509 -10.429 -14.158 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 10.888 -10.123 -12.088 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 10.248 -8.716 -12.790 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 9.531 -9.373 -11.398 1.00 10.00 H new ATOM 126 N ILE A 9 6.432 -4.940 -11.394 1.00 10.00 N ATOM 127 CA ILE A 9 6.368 -3.600 -10.858 1.00 10.00 C ATOM 128 C ILE A 9 6.529 -3.683 -9.345 1.00 10.00 C ATOM 129 O ILE A 9 7.481 -3.118 -8.818 1.00 10.00 O ATOM 130 CB ILE A 9 5.066 -2.912 -11.318 1.00 10.00 C ATOM 131 CG1 ILE A 9 5.132 -2.577 -12.821 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.794 -1.625 -10.534 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.755 -2.240 -13.403 1.00 10.00 C ATOM 0 H ILE A 9 5.594 -5.210 -11.909 1.00 10.00 H new ATOM 0 HA ILE A 9 7.177 -2.975 -11.235 1.00 10.00 H new ATOM 0 HB ILE A 9 4.253 -3.613 -11.129 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.805 -1.733 -12.974 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.555 -3.424 -13.361 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.868 -1.172 -10.889 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.701 -1.858 -9.473 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.619 -0.928 -10.681 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.855 -2.011 -14.464 1.00 10.00 H new ATOM 0 HD12 ILE A 9 3.088 -3.093 -13.277 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.342 -1.376 -12.883 1.00 10.00 H new ATOM 145 N PHE A 10 5.641 -4.392 -8.646 1.00 10.00 N ATOM 146 CA PHE A 10 5.718 -4.506 -7.193 1.00 10.00 C ATOM 147 C PHE A 10 7.137 -4.883 -6.749 1.00 10.00 C ATOM 148 O PHE A 10 7.743 -4.173 -5.938 1.00 10.00 O ATOM 149 CB PHE A 10 4.675 -5.510 -6.695 1.00 10.00 C ATOM 150 CG PHE A 10 4.658 -5.674 -5.188 1.00 10.00 C ATOM 151 CD1 PHE A 10 4.138 -4.650 -4.373 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.169 -6.845 -4.596 1.00 10.00 C ATOM 153 CE1 PHE A 10 4.079 -4.817 -2.979 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.085 -7.023 -3.205 1.00 10.00 C ATOM 155 CZ PHE A 10 4.531 -6.013 -2.397 1.00 10.00 C ATOM 0 H PHE A 10 4.860 -4.896 -9.066 1.00 10.00 H new ATOM 0 HA PHE A 10 5.493 -3.538 -6.745 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.688 -5.190 -7.028 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.868 -6.479 -7.155 1.00 10.00 H new ATOM 0 HD1 PHE A 10 3.783 -3.733 -4.821 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.625 -7.606 -5.211 1.00 10.00 H new ATOM 0 HE1 PHE A 10 3.687 -4.027 -2.356 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.446 -7.936 -2.755 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.453 -6.157 -1.330 1.00 10.00 H new ATOM 165 N VAL A 11 7.671 -5.961 -7.342 1.00 10.00 N ATOM 166 CA VAL A 11 9.032 -6.457 -7.138 1.00 10.00 C ATOM 167 C VAL A 11 10.057 -5.327 -7.240 1.00 10.00 C ATOM 168 O VAL A 11 10.934 -5.197 -6.391 1.00 10.00 O ATOM 169 CB VAL A 11 9.321 -7.593 -8.137 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.799 -8.005 -8.164 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.486 -8.827 -7.781 1.00 10.00 C ATOM 0 H VAL A 11 7.142 -6.531 -8.002 1.00 10.00 H new ATOM 0 HA VAL A 11 9.117 -6.859 -6.128 1.00 10.00 H new ATOM 0 HB VAL A 11 9.058 -7.209 -9.123 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.939 -8.809 -8.887 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.410 -7.149 -8.450 1.00 10.00 H new ATOM 0 HG13 VAL A 11 11.099 -8.350 -7.174 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.696 -9.626 -8.492 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.740 -9.161 -6.775 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.427 -8.574 -7.822 1.00 10.00 H new ATOM 181 N GLN A 12 9.967 -4.532 -8.305 1.00 10.00 N ATOM 182 CA GLN A 12 10.943 -3.496 -8.612 1.00 10.00 C ATOM 183 C GLN A 12 10.663 -2.174 -7.893 1.00 10.00 C ATOM 184 O GLN A 12 11.490 -1.269 -7.976 1.00 10.00 O ATOM 185 CB GLN A 12 11.007 -3.305 -10.133 1.00 10.00 C ATOM 186 CG GLN A 12 11.586 -4.539 -10.839 1.00 10.00 C ATOM 187 CD GLN A 12 13.106 -4.617 -10.725 1.00 10.00 C ATOM 188 OE1 GLN A 12 13.815 -4.183 -11.625 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.625 -5.171 -9.633 1.00 10.00 N ATOM 0 H GLN A 12 9.207 -4.592 -8.983 1.00 10.00 H new ATOM 0 HA GLN A 12 11.913 -3.827 -8.241 1.00 10.00 H new ATOM 0 HB2 GLN A 12 10.007 -3.103 -10.516 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.619 -2.433 -10.364 1.00 10.00 H new ATOM 0 HG2 GLN A 12 11.146 -5.439 -10.410 1.00 10.00 H new ATOM 0 HG3 GLN A 12 11.304 -4.517 -11.892 1.00 10.00 H new ATOM 0 HE21 GLN A 12 13.011 -5.524 -8.899 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.637 -5.243 -9.529 1.00 10.00 H new ATOM 198 N LYS A 13 9.495 -2.017 -7.262 1.00 10.00 N ATOM 199 CA LYS A 13 9.075 -0.759 -6.653 1.00 10.00 C ATOM 200 C LYS A 13 9.114 -0.862 -5.127 1.00 10.00 C ATOM 201 O LYS A 13 9.831 -0.098 -4.485 1.00 10.00 O ATOM 202 CB LYS A 13 7.681 -0.362 -7.178 1.00 10.00 C ATOM 203 CG LYS A 13 7.669 0.343 -8.551 1.00 10.00 C ATOM 204 CD LYS A 13 8.733 -0.153 -9.538 1.00 10.00 C ATOM 205 CE LYS A 13 8.554 0.389 -10.957 1.00 10.00 C ATOM 206 NZ LYS A 13 9.620 -0.125 -11.843 1.00 10.00 N ATOM 0 H LYS A 13 8.812 -2.768 -7.161 1.00 10.00 H new ATOM 0 HA LYS A 13 9.770 0.032 -6.935 1.00 10.00 H new ATOM 0 HB2 LYS A 13 7.067 -1.260 -7.244 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.209 0.294 -6.447 1.00 10.00 H new ATOM 0 HG2 LYS A 13 6.686 0.212 -9.002 1.00 10.00 H new ATOM 0 HG3 LYS A 13 7.808 1.413 -8.396 1.00 10.00 H new ATOM 0 HD2 LYS A 13 9.719 0.133 -9.171 1.00 10.00 H new ATOM 0 HD3 LYS A 13 8.708 -1.242 -9.569 1.00 10.00 H new ATOM 0 HE2 LYS A 13 7.578 0.097 -11.344 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.578 1.479 -10.943 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 9.485 0.252 -12.803 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 10.547 0.175 -11.480 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 9.578 -1.164 -11.870 1.00 10.00 H new ATOM 220 N CYS A 14 8.314 -1.761 -4.543 1.00 10.00 N ATOM 221 CA CYS A 14 7.918 -1.660 -3.132 1.00 10.00 C ATOM 222 C CYS A 14 8.071 -2.976 -2.363 1.00 10.00 C ATOM 223 O CYS A 14 8.040 -2.985 -1.127 1.00 10.00 O ATOM 224 CB CYS A 14 6.509 -1.113 -3.065 1.00 10.00 C ATOM 225 SG CYS A 14 6.549 0.564 -3.773 1.00 10.00 S ATOM 0 H CYS A 14 7.926 -2.570 -5.027 1.00 10.00 H new ATOM 0 HA CYS A 14 8.599 -0.973 -2.630 1.00 10.00 H new ATOM 0 HB2 CYS A 14 5.822 -1.750 -3.622 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.155 -1.087 -2.034 1.00 10.00 H new ATOM 230 N ALA A 15 8.247 -4.087 -3.085 1.00 10.00 N ATOM 231 CA ALA A 15 8.147 -5.430 -2.544 1.00 10.00 C ATOM 232 C ALA A 15 8.885 -5.663 -1.233 1.00 10.00 C ATOM 233 O ALA A 15 8.337 -6.306 -0.346 1.00 10.00 O ATOM 234 CB ALA A 15 8.585 -6.436 -3.600 1.00 10.00 C ATOM 0 H ALA A 15 8.467 -4.069 -4.081 1.00 10.00 H new ATOM 0 HA ALA A 15 7.097 -5.569 -2.288 1.00 10.00 H new ATOM 0 HB1 ALA A 15 8.510 -7.445 -3.194 1.00 10.00 H new ATOM 0 HB2 ALA A 15 7.941 -6.348 -4.475 1.00 10.00 H new ATOM 0 HB3 ALA A 15 9.617 -6.236 -3.887 1.00 10.00 H new ATOM 240 N GLN A 16 10.124 -5.185 -1.093 1.00 10.00 N ATOM 241 CA GLN A 16 10.876 -5.447 0.118 1.00 10.00 C ATOM 242 C GLN A 16 10.283 -4.769 1.354 1.00 10.00 C ATOM 243 O GLN A 16 10.532 -5.274 2.451 1.00 10.00 O ATOM 244 CB GLN A 16 12.348 -5.057 -0.053 1.00 10.00 C ATOM 245 CG GLN A 16 13.165 -6.109 -0.820 1.00 10.00 C ATOM 246 CD GLN A 16 14.563 -6.244 -0.219 1.00 10.00 C ATOM 247 OE1 GLN A 16 15.314 -5.278 -0.160 1.00 10.00 O ATOM 248 NE2 GLN A 16 14.914 -7.429 0.277 1.00 10.00 N ATOM 0 H GLN A 16 10.613 -4.626 -1.793 1.00 10.00 H new ATOM 0 HA GLN A 16 10.810 -6.522 0.288 1.00 10.00 H new ATOM 0 HB2 GLN A 16 12.407 -4.105 -0.580 1.00 10.00 H new ATOM 0 HB3 GLN A 16 12.794 -4.905 0.930 1.00 10.00 H new ATOM 0 HG2 GLN A 16 12.654 -7.071 -0.786 1.00 10.00 H new ATOM 0 HG3 GLN A 16 13.240 -5.825 -1.870 1.00 10.00 H new ATOM 0 HE21 GLN A 16 14.271 -8.218 0.216 1.00 10.00 H new ATOM 0 HE22 GLN A 16 15.826 -7.547 0.718 1.00 10.00 H new ATOM 257 N CYS A 17 9.573 -3.640 1.219 1.00 10.00 N ATOM 258 CA CYS A 17 9.038 -2.945 2.389 1.00 10.00 C ATOM 259 C CYS A 17 7.748 -3.616 2.852 1.00 10.00 C ATOM 260 O CYS A 17 7.563 -3.820 4.052 1.00 10.00 O ATOM 261 CB CYS A 17 8.846 -1.468 2.134 1.00 10.00 C ATOM 262 SG CYS A 17 8.525 -0.685 3.747 1.00 10.00 S ATOM 0 H CYS A 17 9.360 -3.197 0.325 1.00 10.00 H new ATOM 0 HA CYS A 17 9.770 -3.020 3.193 1.00 10.00 H new ATOM 0 HB2 CYS A 17 9.733 -1.039 1.667 1.00 10.00 H new ATOM 0 HB3 CYS A 17 8.013 -1.300 1.451 1.00 10.00 H new ATOM 267 N HIS A 18 6.869 -3.946 1.899 1.00 10.00 N ATOM 268 CA HIS A 18 5.642 -4.692 2.154 1.00 10.00 C ATOM 269 C HIS A 18 5.928 -6.190 2.038 1.00 10.00 C ATOM 270 O HIS A 18 7.079 -6.610 2.158 1.00 10.00 O ATOM 271 CB HIS A 18 4.559 -4.181 1.191 1.00 10.00 C ATOM 272 CG HIS A 18 3.923 -2.923 1.702 1.00 10.00 C ATOM 273 ND1 HIS A 18 2.966 -2.857 2.691 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.136 -1.659 1.227 1.00 10.00 C ATOM 275 CE1 HIS A 18 2.582 -1.571 2.769 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.276 -0.802 1.912 1.00 10.00 N ATOM 0 H HIS A 18 6.996 -3.697 0.918 1.00 10.00 H new ATOM 0 HA HIS A 18 5.269 -4.536 3.166 1.00 10.00 H new ATOM 0 HB2 HIS A 18 4.999 -3.996 0.211 1.00 10.00 H new ATOM 0 HB3 HIS A 18 3.796 -4.948 1.058 1.00 10.00 H new ATOM 0 HD1 HIS A 18 2.617 -3.633 3.254 1.00 10.00 H new ATOM 0 HD2 HIS A 18 4.842 -1.376 0.460 1.00 10.00 H new ATOM 0 HE1 HIS A 18 1.815 -1.203 3.434 1.00 10.00 H new ATOM 284 N THR A 19 4.896 -7.019 1.840 1.00 10.00 N ATOM 285 CA THR A 19 5.069 -8.441 1.597 1.00 10.00 C ATOM 286 C THR A 19 3.949 -9.009 0.718 1.00 10.00 C ATOM 287 O THR A 19 4.233 -9.657 -0.285 1.00 10.00 O ATOM 288 CB THR A 19 5.256 -9.192 2.924 1.00 10.00 C ATOM 289 OG1 THR A 19 6.354 -8.722 3.679 1.00 10.00 O ATOM 290 CG2 THR A 19 5.500 -10.654 2.607 1.00 10.00 C ATOM 0 H THR A 19 3.922 -6.715 1.845 1.00 10.00 H new ATOM 0 HA THR A 19 5.983 -8.591 1.022 1.00 10.00 H new ATOM 0 HB THR A 19 4.356 -9.034 3.518 1.00 10.00 H new ATOM 0 HG1 THR A 19 6.826 -8.028 3.173 1.00 10.00 H new ATOM 0 HG21 THR A 19 5.636 -11.210 3.535 1.00 10.00 H new ATOM 0 HG22 THR A 19 4.644 -11.057 2.065 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.395 -10.749 1.993 1.00 10.00 H new ATOM 298 N VAL A 20 2.691 -8.760 1.091 1.00 10.00 N ATOM 299 CA VAL A 20 1.490 -9.235 0.404 1.00 10.00 C ATOM 300 C VAL A 20 1.472 -10.757 0.286 1.00 10.00 C ATOM 301 O VAL A 20 1.067 -11.285 -0.747 1.00 10.00 O ATOM 302 CB VAL A 20 1.208 -8.519 -0.943 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.118 -7.004 -0.754 1.00 10.00 C ATOM 304 CG2 VAL A 20 2.163 -8.787 -2.114 1.00 10.00 C ATOM 0 H VAL A 20 2.474 -8.198 1.914 1.00 10.00 H new ATOM 0 HA VAL A 20 0.651 -8.953 1.040 1.00 10.00 H new ATOM 0 HB VAL A 20 0.259 -8.970 -1.234 1.00 10.00 H new ATOM 0 HG11 VAL A 20 0.920 -6.529 -1.715 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.310 -6.771 -0.060 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.060 -6.631 -0.352 1.00 10.00 H new ATOM 0 HG21 VAL A 20 1.839 -8.218 -2.986 1.00 10.00 H new ATOM 0 HG22 VAL A 20 3.172 -8.483 -1.837 1.00 10.00 H new ATOM 0 HG23 VAL A 20 2.157 -9.851 -2.352 1.00 10.00 H new ATOM 314 N GLU A 21 1.895 -11.466 1.339 1.00 10.00 N ATOM 315 CA GLU A 21 1.979 -12.919 1.279 1.00 10.00 C ATOM 316 C GLU A 21 1.564 -13.579 2.599 1.00 10.00 C ATOM 317 O GLU A 21 1.446 -12.916 3.631 1.00 10.00 O ATOM 318 CB GLU A 21 3.344 -13.326 0.694 1.00 10.00 C ATOM 319 CG GLU A 21 4.407 -13.755 1.712 1.00 10.00 C ATOM 320 CD GLU A 21 4.523 -15.268 1.852 1.00 10.00 C ATOM 321 OE1 GLU A 21 3.531 -15.947 1.510 1.00 10.00 O ATOM 322 OE2 GLU A 21 5.589 -15.711 2.324 1.00 10.00 O ATOM 0 H GLU A 21 2.180 -11.058 2.230 1.00 10.00 H new ATOM 0 HA GLU A 21 1.239 -13.320 0.586 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.187 -14.146 -0.007 1.00 10.00 H new ATOM 0 HB3 GLU A 21 3.736 -12.487 0.120 1.00 10.00 H new ATOM 0 HG2 GLU A 21 5.373 -13.348 1.413 1.00 10.00 H new ATOM 0 HG3 GLU A 21 4.166 -13.323 2.684 1.00 10.00 H new ATOM 329 N LYS A 22 1.362 -14.897 2.581 1.00 10.00 N ATOM 330 CA LYS A 22 0.920 -15.666 3.739 1.00 10.00 C ATOM 331 C LYS A 22 2.100 -16.112 4.611 1.00 10.00 C ATOM 332 O LYS A 22 2.042 -17.140 5.282 1.00 10.00 O ATOM 333 CB LYS A 22 0.014 -16.832 3.315 1.00 10.00 C ATOM 334 CG LYS A 22 0.649 -17.920 2.438 1.00 10.00 C ATOM 335 CD LYS A 22 0.728 -17.577 0.944 1.00 10.00 C ATOM 336 CE LYS A 22 0.634 -18.867 0.114 1.00 10.00 C ATOM 337 NZ LYS A 22 0.700 -18.613 -1.338 1.00 10.00 N ATOM 0 H LYS A 22 1.504 -15.467 1.747 1.00 10.00 H new ATOM 0 HA LYS A 22 0.315 -15.011 4.367 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -0.373 -17.306 4.217 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.841 -16.420 2.779 1.00 10.00 H new ATOM 0 HG2 LYS A 22 1.656 -18.120 2.804 1.00 10.00 H new ATOM 0 HG3 LYS A 22 0.078 -18.841 2.555 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -0.081 -16.898 0.673 1.00 10.00 H new ATOM 0 HD3 LYS A 22 1.663 -17.061 0.728 1.00 10.00 H new ATOM 0 HE2 LYS A 22 1.444 -19.538 0.399 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -0.300 -19.378 0.348 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 1.347 -19.297 -1.781 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -0.249 -18.716 -1.752 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 1.048 -17.648 -1.506 1.00 10.00 H new ATOM 351 N GLY A 23 3.154 -15.302 4.625 1.00 10.00 N ATOM 352 CA GLY A 23 4.353 -15.480 5.425 1.00 10.00 C ATOM 353 C GLY A 23 4.995 -14.119 5.671 1.00 10.00 C ATOM 354 O GLY A 23 6.217 -13.971 5.635 1.00 10.00 O ATOM 0 H GLY A 23 3.193 -14.462 4.048 1.00 10.00 H new ATOM 0 HA2 GLY A 23 4.105 -15.956 6.374 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.053 -16.139 4.912 1.00 10.00 H new ATOM 358 N GLY A 24 4.151 -13.114 5.930 1.00 10.00 N ATOM 359 CA GLY A 24 4.581 -11.782 6.299 1.00 10.00 C ATOM 360 C GLY A 24 5.554 -11.807 7.471 1.00 10.00 C ATOM 361 O GLY A 24 5.518 -12.710 8.305 1.00 10.00 O ATOM 0 H GLY A 24 3.137 -13.216 5.885 1.00 10.00 H new ATOM 0 HA2 GLY A 24 5.055 -11.303 5.443 1.00 10.00 H new ATOM 0 HA3 GLY A 24 3.712 -11.179 6.561 1.00 10.00 H new ATOM 365 N LYS A 25 6.414 -10.793 7.535 1.00 10.00 N ATOM 366 CA LYS A 25 7.343 -10.596 8.633 1.00 10.00 C ATOM 367 C LYS A 25 7.250 -9.156 9.116 1.00 10.00 C ATOM 368 O LYS A 25 6.588 -8.334 8.482 1.00 10.00 O ATOM 369 CB LYS A 25 8.763 -10.979 8.204 1.00 10.00 C ATOM 370 CG LYS A 25 8.827 -12.484 7.920 1.00 10.00 C ATOM 371 CD LYS A 25 10.277 -12.937 7.721 1.00 10.00 C ATOM 372 CE LYS A 25 10.335 -14.471 7.720 1.00 10.00 C ATOM 373 NZ LYS A 25 11.713 -14.975 7.546 1.00 10.00 N ATOM 0 H LYS A 25 6.482 -10.077 6.812 1.00 10.00 H new ATOM 0 HA LYS A 25 7.081 -11.247 9.467 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.048 -10.418 7.314 1.00 10.00 H new ATOM 0 HB3 LYS A 25 9.474 -10.716 8.988 1.00 10.00 H new ATOM 0 HG2 LYS A 25 8.379 -13.034 8.747 1.00 10.00 H new ATOM 0 HG3 LYS A 25 8.243 -12.716 7.029 1.00 10.00 H new ATOM 0 HD2 LYS A 25 10.666 -12.547 6.781 1.00 10.00 H new ATOM 0 HD3 LYS A 25 10.907 -12.539 8.516 1.00 10.00 H new ATOM 0 HE2 LYS A 25 9.927 -14.849 8.657 1.00 10.00 H new ATOM 0 HE3 LYS A 25 9.705 -14.857 6.919 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 11.706 -16.015 7.551 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 12.095 -14.636 6.640 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 12.310 -14.629 8.324 1.00 10.00 H new ATOM 387 N HIS A 26 7.889 -8.865 10.252 1.00 10.00 N ATOM 388 CA HIS A 26 7.685 -7.619 10.976 1.00 10.00 C ATOM 389 C HIS A 26 8.467 -6.474 10.323 1.00 10.00 C ATOM 390 O HIS A 26 9.379 -5.904 10.919 1.00 10.00 O ATOM 391 CB HIS A 26 8.077 -7.798 12.458 1.00 10.00 C ATOM 392 CG HIS A 26 7.709 -9.120 13.089 1.00 10.00 C ATOM 393 ND1 HIS A 26 8.558 -9.910 13.832 1.00 10.00 N ATOM 394 CD2 HIS A 26 6.510 -9.776 12.995 1.00 10.00 C ATOM 395 CE1 HIS A 26 7.885 -11.022 14.171 1.00 10.00 C ATOM 396 NE2 HIS A 26 6.638 -10.990 13.677 1.00 10.00 N ATOM 0 H HIS A 26 8.563 -9.492 10.692 1.00 10.00 H new ATOM 0 HA HIS A 26 6.628 -7.356 10.933 1.00 10.00 H new ATOM 0 HB2 HIS A 26 9.155 -7.665 12.546 1.00 10.00 H new ATOM 0 HB3 HIS A 26 7.609 -7.001 13.035 1.00 10.00 H new ATOM 0 HD2 HIS A 26 5.626 -9.420 12.486 1.00 10.00 H new ATOM 0 HE1 HIS A 26 8.292 -11.831 14.760 1.00 10.00 H new ATOM 0 HE2 HIS A 26 5.923 -11.710 13.779 1.00 10.00 H new ATOM 404 N LYS A 27 8.124 -6.160 9.077 1.00 10.00 N ATOM 405 CA LYS A 27 8.771 -5.128 8.293 1.00 10.00 C ATOM 406 C LYS A 27 8.014 -3.810 8.405 1.00 10.00 C ATOM 407 O LYS A 27 6.881 -3.761 8.879 1.00 10.00 O ATOM 408 CB LYS A 27 8.835 -5.582 6.835 1.00 10.00 C ATOM 409 CG LYS A 27 9.833 -6.730 6.663 1.00 10.00 C ATOM 410 CD LYS A 27 9.836 -7.126 5.184 1.00 10.00 C ATOM 411 CE LYS A 27 11.108 -7.885 4.774 1.00 10.00 C ATOM 412 NZ LYS A 27 11.860 -7.147 3.740 1.00 10.00 N ATOM 0 H LYS A 27 7.369 -6.631 8.578 1.00 10.00 H new ATOM 0 HA LYS A 27 9.780 -4.966 8.673 1.00 10.00 H new ATOM 0 HB2 LYS A 27 7.846 -5.902 6.506 1.00 10.00 H new ATOM 0 HB3 LYS A 27 9.126 -4.744 6.202 1.00 10.00 H new ATOM 0 HG2 LYS A 27 10.830 -6.421 6.978 1.00 10.00 H new ATOM 0 HG3 LYS A 27 9.551 -7.579 7.286 1.00 10.00 H new ATOM 0 HD2 LYS A 27 8.965 -7.748 4.977 1.00 10.00 H new ATOM 0 HD3 LYS A 27 9.740 -6.229 4.572 1.00 10.00 H new ATOM 0 HE2 LYS A 27 11.741 -8.038 5.648 1.00 10.00 H new ATOM 0 HE3 LYS A 27 10.840 -8.872 4.398 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 11.924 -7.725 2.878 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 11.369 -6.256 3.523 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 12.817 -6.939 4.089 1.00 10.00 H new ATOM 426 N THR A 28 8.664 -2.741 7.948 1.00 10.00 N ATOM 427 CA THR A 28 8.130 -1.397 7.929 1.00 10.00 C ATOM 428 C THR A 28 6.776 -1.334 7.219 1.00 10.00 C ATOM 429 O THR A 28 5.855 -0.719 7.746 1.00 10.00 O ATOM 430 CB THR A 28 9.182 -0.481 7.298 1.00 10.00 C ATOM 431 OG1 THR A 28 10.428 -0.738 7.914 1.00 10.00 O ATOM 432 CG2 THR A 28 8.814 0.996 7.462 1.00 10.00 C ATOM 0 H THR A 28 9.609 -2.798 7.569 1.00 10.00 H new ATOM 0 HA THR A 28 7.928 -1.056 8.944 1.00 10.00 H new ATOM 0 HB THR A 28 9.234 -0.688 6.229 1.00 10.00 H new ATOM 0 HG1 THR A 28 11.114 -0.160 7.519 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.584 1.616 7.002 1.00 10.00 H new ATOM 0 HG22 THR A 28 7.856 1.188 6.979 1.00 10.00 H new ATOM 0 HG23 THR A 28 8.740 1.237 8.522 1.00 10.00 H new ATOM 440 N GLY A 29 6.635 -1.932 6.033 1.00 10.00 N ATOM 441 CA GLY A 29 5.345 -2.004 5.374 1.00 10.00 C ATOM 442 C GLY A 29 4.589 -3.194 5.953 1.00 10.00 C ATOM 443 O GLY A 29 5.134 -4.297 5.956 1.00 10.00 O ATOM 0 H GLY A 29 7.399 -2.369 5.518 1.00 10.00 H new ATOM 0 HA2 GLY A 29 4.784 -1.083 5.531 1.00 10.00 H new ATOM 0 HA3 GLY A 29 5.472 -2.120 4.298 1.00 10.00 H new ATOM 447 N PRO A 30 3.354 -3.020 6.451 1.00 10.00 N ATOM 448 CA PRO A 30 2.599 -4.142 6.966 1.00 10.00 C ATOM 449 C PRO A 30 2.392 -5.168 5.849 1.00 10.00 C ATOM 450 O PRO A 30 2.284 -4.819 4.666 1.00 10.00 O ATOM 451 CB PRO A 30 1.291 -3.561 7.512 1.00 10.00 C ATOM 452 CG PRO A 30 1.122 -2.255 6.736 1.00 10.00 C ATOM 453 CD PRO A 30 2.566 -1.801 6.511 1.00 10.00 C ATOM 0 HA PRO A 30 3.112 -4.674 7.767 1.00 10.00 H new ATOM 0 HB2 PRO A 30 0.452 -4.237 7.345 1.00 10.00 H new ATOM 0 HB3 PRO A 30 1.349 -3.384 8.586 1.00 10.00 H new ATOM 0 HG2 PRO A 30 0.596 -2.410 5.794 1.00 10.00 H new ATOM 0 HG3 PRO A 30 0.551 -1.519 7.303 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.658 -1.229 5.588 1.00 10.00 H new ATOM 0 HD3 PRO A 30 2.904 -1.155 7.321 1.00 10.00 H new ATOM 461 N ASN A 31 2.378 -6.446 6.234 1.00 10.00 N ATOM 462 CA ASN A 31 2.198 -7.547 5.307 1.00 10.00 C ATOM 463 C ASN A 31 0.811 -7.463 4.703 1.00 10.00 C ATOM 464 O ASN A 31 -0.153 -7.901 5.330 1.00 10.00 O ATOM 465 CB ASN A 31 2.335 -8.885 6.030 1.00 10.00 C ATOM 466 CG ASN A 31 1.902 -10.027 5.108 1.00 10.00 C ATOM 467 OD1 ASN A 31 2.191 -10.017 3.911 1.00 10.00 O ATOM 468 ND2 ASN A 31 1.183 -11.001 5.651 1.00 10.00 N ATOM 0 H ASN A 31 2.492 -6.739 7.204 1.00 10.00 H new ATOM 0 HA ASN A 31 2.961 -7.480 4.531 1.00 10.00 H new ATOM 0 HB2 ASN A 31 3.368 -9.033 6.345 1.00 10.00 H new ATOM 0 HB3 ASN A 31 1.724 -8.884 6.932 1.00 10.00 H new ATOM 0 HD21 ASN A 31 0.851 -11.773 5.073 1.00 10.00 H new ATOM 0 HD22 ASN A 31 0.962 -10.978 6.646 1.00 10.00 H new ATOM 475 N LEU A 32 0.696 -6.921 3.490 1.00 10.00 N ATOM 476 CA LEU A 32 -0.608 -6.548 2.970 1.00 10.00 C ATOM 477 C LEU A 32 -1.445 -7.730 2.425 1.00 10.00 C ATOM 478 O LEU A 32 -2.206 -7.595 1.467 1.00 10.00 O ATOM 479 CB LEU A 32 -0.477 -5.339 2.024 1.00 10.00 C ATOM 480 CG LEU A 32 -0.669 -3.993 2.740 1.00 10.00 C ATOM 481 CD1 LEU A 32 -0.477 -2.883 1.701 1.00 10.00 C ATOM 482 CD2 LEU A 32 -2.046 -3.889 3.413 1.00 10.00 C ATOM 0 H LEU A 32 1.479 -6.735 2.863 1.00 10.00 H new ATOM 0 HA LEU A 32 -1.219 -6.222 3.811 1.00 10.00 H new ATOM 0 HB2 LEU A 32 0.506 -5.357 1.554 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -1.214 -5.428 1.226 1.00 10.00 H new ATOM 0 HG LEU A 32 0.064 -3.898 3.541 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -0.607 -1.912 2.178 1.00 10.00 H new ATOM 0 HD12 LEU A 32 0.526 -2.949 1.279 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -1.213 -2.998 0.905 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -2.138 -2.922 3.907 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -2.828 -3.987 2.660 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -2.151 -4.684 4.151 1.00 10.00 H new ATOM 494 N HIS A 33 -1.351 -8.894 3.069 1.00 10.00 N ATOM 495 CA HIS A 33 -2.031 -10.134 2.721 1.00 10.00 C ATOM 496 C HIS A 33 -3.487 -10.071 3.201 1.00 10.00 C ATOM 497 O HIS A 33 -3.892 -10.762 4.133 1.00 10.00 O ATOM 498 CB HIS A 33 -1.215 -11.270 3.346 1.00 10.00 C ATOM 499 CG HIS A 33 -1.782 -12.662 3.239 1.00 10.00 C ATOM 500 ND1 HIS A 33 -2.054 -13.393 2.100 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.079 -13.450 4.315 1.00 10.00 C ATOM 502 CE1 HIS A 33 -2.595 -14.558 2.498 1.00 10.00 C ATOM 503 NE2 HIS A 33 -2.608 -14.650 3.839 1.00 10.00 N ATOM 0 H HIS A 33 -0.763 -8.998 3.896 1.00 10.00 H new ATOM 0 HA HIS A 33 -2.088 -10.303 1.646 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -0.227 -11.271 2.885 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -1.073 -11.043 4.403 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -1.930 -13.189 5.353 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -2.969 -15.319 1.829 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -2.938 -15.438 4.396 1.00 10.00 H new ATOM 511 N GLY A 34 -4.255 -9.188 2.562 1.00 10.00 N ATOM 512 CA GLY A 34 -5.688 -9.008 2.773 1.00 10.00 C ATOM 513 C GLY A 34 -6.054 -7.527 2.743 1.00 10.00 C ATOM 514 O GLY A 34 -6.778 -7.035 3.604 1.00 10.00 O ATOM 0 H GLY A 34 -3.879 -8.555 1.856 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.244 -9.541 2.002 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -5.977 -9.440 3.731 1.00 10.00 H new ATOM 518 N LEU A 35 -5.527 -6.809 1.749 1.00 10.00 N ATOM 519 CA LEU A 35 -5.661 -5.374 1.604 1.00 10.00 C ATOM 520 C LEU A 35 -7.096 -5.040 1.215 1.00 10.00 C ATOM 521 O LEU A 35 -7.786 -4.287 1.901 1.00 10.00 O ATOM 522 CB LEU A 35 -4.666 -4.912 0.523 1.00 10.00 C ATOM 523 CG LEU A 35 -4.722 -3.433 0.097 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.415 -2.443 1.222 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.733 -3.262 -1.051 1.00 10.00 C ATOM 0 H LEU A 35 -4.978 -7.234 1.002 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.439 -4.860 2.539 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.658 -5.122 0.881 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.824 -5.525 -0.365 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.744 -3.201 -0.202 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.476 -1.425 0.837 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.139 -2.571 2.027 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -3.411 -2.627 1.605 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -3.740 -2.225 -1.386 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -2.732 -3.527 -0.711 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.019 -3.912 -1.878 1.00 10.00 H new ATOM 537 N PHE A 36 -7.541 -5.621 0.098 1.00 10.00 N ATOM 538 CA PHE A 36 -8.833 -5.367 -0.520 1.00 10.00 C ATOM 539 C PHE A 36 -9.964 -6.077 0.226 1.00 10.00 C ATOM 540 O PHE A 36 -10.703 -6.870 -0.352 1.00 10.00 O ATOM 541 CB PHE A 36 -8.758 -5.778 -1.997 1.00 10.00 C ATOM 542 CG PHE A 36 -7.665 -5.083 -2.791 1.00 10.00 C ATOM 543 CD1 PHE A 36 -7.573 -3.682 -2.766 1.00 10.00 C ATOM 544 CD2 PHE A 36 -6.841 -5.809 -3.669 1.00 10.00 C ATOM 545 CE1 PHE A 36 -6.773 -3.003 -3.695 1.00 10.00 C ATOM 546 CE2 PHE A 36 -6.013 -5.125 -4.577 1.00 10.00 C ATOM 547 CZ PHE A 36 -5.991 -3.724 -4.607 1.00 10.00 C ATOM 0 H PHE A 36 -6.986 -6.306 -0.415 1.00 10.00 H new ATOM 0 HA PHE A 36 -9.065 -4.304 -0.462 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -8.601 -6.855 -2.053 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -9.719 -5.571 -2.468 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -8.124 -3.123 -2.024 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -6.844 -6.889 -3.646 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -6.759 -1.923 -3.708 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -5.388 -5.685 -5.257 1.00 10.00 H new ATOM 0 HZ PHE A 36 -5.376 -3.204 -5.327 1.00 10.00 H new ATOM 557 N GLY A 37 -10.100 -5.761 1.512 1.00 10.00 N ATOM 558 CA GLY A 37 -11.159 -6.243 2.382 1.00 10.00 C ATOM 559 C GLY A 37 -10.848 -5.902 3.836 1.00 10.00 C ATOM 560 O GLY A 37 -11.080 -6.714 4.726 1.00 10.00 O ATOM 0 H GLY A 37 -9.449 -5.138 1.990 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.109 -5.795 2.092 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.268 -7.322 2.270 1.00 10.00 H new ATOM 564 N ARG A 38 -10.325 -4.696 4.075 1.00 10.00 N ATOM 565 CA ARG A 38 -9.910 -4.213 5.379 1.00 10.00 C ATOM 566 C ARG A 38 -9.956 -2.692 5.358 1.00 10.00 C ATOM 567 O ARG A 38 -10.050 -2.081 4.292 1.00 10.00 O ATOM 568 CB ARG A 38 -8.495 -4.725 5.716 1.00 10.00 C ATOM 569 CG ARG A 38 -8.550 -5.972 6.608 1.00 10.00 C ATOM 570 CD ARG A 38 -7.150 -6.430 7.028 1.00 10.00 C ATOM 571 NE ARG A 38 -7.246 -7.608 7.902 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.214 -8.208 8.515 1.00 10.00 C ATOM 573 NH1 ARG A 38 -4.977 -7.719 8.372 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.426 -9.300 9.259 1.00 10.00 N ATOM 0 H ARG A 38 -10.177 -4.011 3.334 1.00 10.00 H new ATOM 0 HA ARG A 38 -10.581 -4.586 6.153 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -7.961 -4.958 4.795 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -7.932 -3.939 6.220 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -9.145 -5.758 7.496 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -9.052 -6.779 6.075 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -6.557 -6.670 6.145 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -6.635 -5.622 7.548 1.00 10.00 H new ATOM 0 HE ARG A 38 -8.174 -8.002 8.055 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -4.819 -6.891 7.798 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -4.192 -8.174 8.837 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.370 -9.674 9.359 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -5.644 -9.759 9.726 1.00 10.00 H new ATOM 588 N LYS A 39 -9.903 -2.098 6.551 1.00 10.00 N ATOM 589 CA LYS A 39 -9.601 -0.690 6.715 1.00 10.00 C ATOM 590 C LYS A 39 -8.083 -0.498 6.658 1.00 10.00 C ATOM 591 O LYS A 39 -7.327 -1.464 6.667 1.00 10.00 O ATOM 592 CB LYS A 39 -10.123 -0.191 8.069 1.00 10.00 C ATOM 593 CG LYS A 39 -11.617 0.149 8.107 1.00 10.00 C ATOM 594 CD LYS A 39 -12.497 -1.097 8.275 1.00 10.00 C ATOM 595 CE LYS A 39 -13.766 -0.785 9.084 1.00 10.00 C ATOM 596 NZ LYS A 39 -14.652 0.192 8.415 1.00 10.00 N ATOM 0 H LYS A 39 -10.070 -2.589 7.429 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.083 -0.123 5.918 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -9.921 -0.953 8.822 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -9.557 0.696 8.354 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -11.809 0.839 8.928 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -11.893 0.664 7.187 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -12.775 -1.482 7.294 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -11.928 -1.881 8.776 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -14.317 -1.709 9.255 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -13.481 -0.398 10.062 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -15.490 0.363 9.007 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -14.140 1.086 8.274 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -14.950 -0.185 7.493 1.00 10.00 H new ATOM 610 N THR A 40 -7.662 0.765 6.654 1.00 10.00 N ATOM 611 CA THR A 40 -6.284 1.206 6.800 1.00 10.00 C ATOM 612 C THR A 40 -5.555 0.587 8.002 1.00 10.00 C ATOM 613 O THR A 40 -4.823 -0.386 7.861 1.00 10.00 O ATOM 614 CB THR A 40 -6.313 2.733 6.901 1.00 10.00 C ATOM 615 OG1 THR A 40 -7.171 3.155 7.949 1.00 10.00 O ATOM 616 CG2 THR A 40 -6.830 3.372 5.615 1.00 10.00 C ATOM 0 H THR A 40 -8.309 1.546 6.543 1.00 10.00 H new ATOM 0 HA THR A 40 -5.715 0.869 5.934 1.00 10.00 H new ATOM 0 HB THR A 40 -5.286 3.046 7.090 1.00 10.00 H new ATOM 0 HG1 THR A 40 -6.756 3.900 8.432 1.00 10.00 H new ATOM 0 HG21 THR A 40 -6.836 4.456 5.725 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.181 3.095 4.784 1.00 10.00 H new ATOM 0 HG23 THR A 40 -7.843 3.022 5.416 1.00 10.00 H new ATOM 624 N GLY A 41 -5.742 1.195 9.181 1.00 10.00 N ATOM 625 CA GLY A 41 -4.901 1.043 10.363 1.00 10.00 C ATOM 626 C GLY A 41 -4.450 -0.397 10.625 1.00 10.00 C ATOM 627 O GLY A 41 -3.256 -0.646 10.754 1.00 10.00 O ATOM 0 H GLY A 41 -6.521 1.834 9.338 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -4.020 1.675 10.253 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.447 1.406 11.234 1.00 10.00 H new ATOM 631 N GLN A 42 -5.435 -1.303 10.736 1.00 10.00 N ATOM 632 CA GLN A 42 -5.345 -2.765 10.784 1.00 10.00 C ATOM 633 C GLN A 42 -3.921 -3.306 10.969 1.00 10.00 C ATOM 634 O GLN A 42 -3.313 -3.827 10.036 1.00 10.00 O ATOM 635 CB GLN A 42 -6.000 -3.348 9.521 1.00 10.00 C ATOM 636 CG GLN A 42 -7.532 -3.269 9.556 1.00 10.00 C ATOM 637 CD GLN A 42 -8.135 -4.345 10.456 1.00 10.00 C ATOM 638 OE1 GLN A 42 -7.891 -5.532 10.260 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.933 -3.953 11.446 1.00 10.00 N ATOM 0 H GLN A 42 -6.406 -0.997 10.800 1.00 10.00 H new ATOM 0 HA GLN A 42 -5.881 -3.088 11.676 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -5.633 -2.812 8.646 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -5.697 -4.389 9.407 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.837 -2.285 9.912 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.925 -3.379 8.545 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -9.120 -2.960 11.588 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.358 -4.645 12.063 1.00 10.00 H new ATOM 648 N ALA A 43 -3.421 -3.218 12.202 1.00 10.00 N ATOM 649 CA ALA A 43 -2.041 -3.518 12.547 1.00 10.00 C ATOM 650 C ALA A 43 -1.976 -4.713 13.499 1.00 10.00 C ATOM 651 O ALA A 43 -1.902 -4.516 14.713 1.00 10.00 O ATOM 652 CB ALA A 43 -1.465 -2.269 13.208 1.00 10.00 C ATOM 0 H ALA A 43 -3.982 -2.929 13.004 1.00 10.00 H new ATOM 0 HA ALA A 43 -1.467 -3.782 11.659 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -0.426 -2.450 13.485 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -1.514 -1.433 12.511 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -2.042 -2.031 14.101 1.00 10.00 H new ATOM 658 N PRO A 44 -2.007 -5.958 12.997 1.00 10.00 N ATOM 659 CA PRO A 44 -2.040 -7.123 13.865 1.00 10.00 C ATOM 660 C PRO A 44 -0.653 -7.380 14.465 1.00 10.00 C ATOM 661 O PRO A 44 0.075 -8.258 14.011 1.00 10.00 O ATOM 662 CB PRO A 44 -2.533 -8.266 12.972 1.00 10.00 C ATOM 663 CG PRO A 44 -1.990 -7.875 11.597 1.00 10.00 C ATOM 664 CD PRO A 44 -2.104 -6.353 11.596 1.00 10.00 C ATOM 0 HA PRO A 44 -2.700 -7.001 14.724 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -2.148 -9.231 13.300 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -3.620 -8.340 12.972 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -0.959 -8.201 11.464 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -2.573 -8.323 10.792 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -1.309 -5.900 11.004 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -3.050 -6.030 11.161 1.00 10.00 H new ATOM 672 N GLY A 45 -0.289 -6.604 15.490 1.00 10.00 N ATOM 673 CA GLY A 45 1.008 -6.709 16.142 1.00 10.00 C ATOM 674 C GLY A 45 2.084 -6.132 15.226 1.00 10.00 C ATOM 675 O GLY A 45 2.966 -6.838 14.745 1.00 10.00 O ATOM 0 H GLY A 45 -0.892 -5.884 15.888 1.00 10.00 H new ATOM 0 HA2 GLY A 45 0.995 -6.171 17.090 1.00 10.00 H new ATOM 0 HA3 GLY A 45 1.230 -7.752 16.370 1.00 10.00 H new ATOM 679 N PHE A 46 1.984 -4.827 14.974 1.00 10.00 N ATOM 680 CA PHE A 46 2.837 -4.076 14.071 1.00 10.00 C ATOM 681 C PHE A 46 2.835 -2.628 14.586 1.00 10.00 C ATOM 682 O PHE A 46 1.898 -2.244 15.286 1.00 10.00 O ATOM 683 CB PHE A 46 2.262 -4.205 12.652 1.00 10.00 C ATOM 684 CG PHE A 46 2.771 -3.173 11.671 1.00 10.00 C ATOM 685 CD1 PHE A 46 4.126 -3.178 11.291 1.00 10.00 C ATOM 686 CD2 PHE A 46 1.936 -2.110 11.274 1.00 10.00 C ATOM 687 CE1 PHE A 46 4.659 -2.085 10.590 1.00 10.00 C ATOM 688 CE2 PHE A 46 2.465 -1.031 10.550 1.00 10.00 C ATOM 689 CZ PHE A 46 3.835 -1.004 10.239 1.00 10.00 C ATOM 0 H PHE A 46 1.273 -4.245 15.416 1.00 10.00 H new ATOM 0 HA PHE A 46 3.864 -4.439 14.035 1.00 10.00 H new ATOM 0 HB2 PHE A 46 2.495 -5.198 12.268 1.00 10.00 H new ATOM 0 HB3 PHE A 46 1.176 -4.131 12.706 1.00 10.00 H new ATOM 0 HD1 PHE A 46 4.754 -4.021 11.538 1.00 10.00 H new ATOM 0 HD2 PHE A 46 0.886 -2.126 11.528 1.00 10.00 H new ATOM 0 HE1 PHE A 46 5.705 -2.076 10.320 1.00 10.00 H new ATOM 0 HE2 PHE A 46 1.821 -0.224 10.233 1.00 10.00 H new ATOM 0 HZ PHE A 46 4.255 -0.150 9.729 1.00 10.00 H new ATOM 699 N THR A 47 3.873 -1.841 14.286 1.00 10.00 N ATOM 700 CA THR A 47 4.022 -0.472 14.776 1.00 10.00 C ATOM 701 C THR A 47 3.402 0.509 13.776 1.00 10.00 C ATOM 702 O THR A 47 3.997 0.793 12.739 1.00 10.00 O ATOM 703 CB THR A 47 5.510 -0.181 15.023 1.00 10.00 C ATOM 704 OG1 THR A 47 6.002 -1.101 15.977 1.00 10.00 O ATOM 705 CG2 THR A 47 5.744 1.233 15.564 1.00 10.00 C ATOM 0 H THR A 47 4.642 -2.143 13.688 1.00 10.00 H new ATOM 0 HA THR A 47 3.494 -0.350 15.722 1.00 10.00 H new ATOM 0 HB THR A 47 6.026 -0.272 14.067 1.00 10.00 H new ATOM 0 HG1 THR A 47 6.952 -0.925 16.141 1.00 10.00 H new ATOM 0 HG21 THR A 47 6.811 1.390 15.722 1.00 10.00 H new ATOM 0 HG22 THR A 47 5.372 1.964 14.846 1.00 10.00 H new ATOM 0 HG23 THR A 47 5.215 1.353 16.510 1.00 10.00 H new ATOM 713 N TYR A 48 2.217 1.032 14.100 1.00 10.00 N ATOM 714 CA TYR A 48 1.445 1.942 13.264 1.00 10.00 C ATOM 715 C TYR A 48 1.542 3.376 13.791 1.00 10.00 C ATOM 716 O TYR A 48 2.006 3.612 14.904 1.00 10.00 O ATOM 717 CB TYR A 48 -0.017 1.474 13.235 1.00 10.00 C ATOM 718 CG TYR A 48 -0.672 1.399 14.604 1.00 10.00 C ATOM 719 CD1 TYR A 48 -0.557 0.225 15.371 1.00 10.00 C ATOM 720 CD2 TYR A 48 -1.299 2.532 15.157 1.00 10.00 C ATOM 721 CE1 TYR A 48 -1.054 0.184 16.683 1.00 10.00 C ATOM 722 CE2 TYR A 48 -1.785 2.495 16.476 1.00 10.00 C ATOM 723 CZ TYR A 48 -1.655 1.322 17.241 1.00 10.00 C ATOM 724 OH TYR A 48 -2.113 1.281 18.524 1.00 10.00 O ATOM 0 H TYR A 48 1.756 0.823 14.985 1.00 10.00 H new ATOM 0 HA TYR A 48 1.849 1.934 12.252 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -0.592 2.153 12.606 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -0.063 0.490 12.768 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -0.084 -0.649 14.948 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -1.407 3.430 14.567 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -0.974 -0.724 17.263 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -2.258 3.368 16.902 1.00 10.00 H new ATOM 0 HH TYR A 48 -2.501 2.149 18.761 1.00 10.00 H new ATOM 734 N THR A 49 1.066 4.326 12.985 1.00 10.00 N ATOM 735 CA THR A 49 1.025 5.750 13.277 1.00 10.00 C ATOM 736 C THR A 49 -0.425 6.169 13.536 1.00 10.00 C ATOM 737 O THR A 49 -1.295 5.784 12.744 1.00 10.00 O ATOM 738 CB THR A 49 1.524 6.472 12.018 1.00 10.00 C ATOM 739 OG1 THR A 49 0.813 5.952 10.907 1.00 10.00 O ATOM 740 CG2 THR A 49 3.020 6.245 11.786 1.00 10.00 C ATOM 0 H THR A 49 0.681 4.107 12.066 1.00 10.00 H new ATOM 0 HA THR A 49 1.633 5.991 14.149 1.00 10.00 H new ATOM 0 HB THR A 49 1.360 7.542 12.143 1.00 10.00 H new ATOM 0 HG1 THR A 49 -0.104 5.736 11.177 1.00 10.00 H new ATOM 0 HG21 THR A 49 3.333 6.773 10.885 1.00 10.00 H new ATOM 0 HG22 THR A 49 3.582 6.621 12.641 1.00 10.00 H new ATOM 0 HG23 THR A 49 3.212 5.179 11.667 1.00 10.00 H new ATOM 748 N ASP A 50 -0.687 6.996 14.559 1.00 10.00 N ATOM 749 CA ASP A 50 -2.011 7.575 14.789 1.00 10.00 C ATOM 750 C ASP A 50 -2.328 8.628 13.727 1.00 10.00 C ATOM 751 O ASP A 50 -2.258 9.833 13.952 1.00 10.00 O ATOM 752 CB ASP A 50 -2.145 8.151 16.200 1.00 10.00 C ATOM 753 CG ASP A 50 -3.579 8.610 16.471 1.00 10.00 C ATOM 754 OD1 ASP A 50 -4.483 8.179 15.716 1.00 10.00 O ATOM 755 OD2 ASP A 50 -3.751 9.356 17.456 1.00 10.00 O ATOM 0 H ASP A 50 0.012 7.279 15.245 1.00 10.00 H new ATOM 0 HA ASP A 50 -2.743 6.772 14.705 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -1.856 7.398 16.933 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -1.462 8.992 16.320 1.00 10.00 H new ATOM 760 N ALA A 51 -2.630 8.127 12.535 1.00 10.00 N ATOM 761 CA ALA A 51 -2.987 8.885 11.354 1.00 10.00 C ATOM 762 C ALA A 51 -3.542 7.890 10.344 1.00 10.00 C ATOM 763 O ALA A 51 -4.626 8.073 9.794 1.00 10.00 O ATOM 764 CB ALA A 51 -1.767 9.620 10.786 1.00 10.00 C ATOM 0 H ALA A 51 -2.631 7.122 12.363 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.728 9.648 11.593 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.061 10.182 9.900 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -1.373 10.306 11.536 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -0.998 8.895 10.518 1.00 10.00 H new ATOM 770 N ASN A 52 -2.813 6.790 10.132 1.00 10.00 N ATOM 771 CA ASN A 52 -3.246 5.781 9.186 1.00 10.00 C ATOM 772 C ASN A 52 -4.596 5.189 9.586 1.00 10.00 C ATOM 773 O ASN A 52 -5.519 5.152 8.775 1.00 10.00 O ATOM 774 CB ASN A 52 -2.202 4.680 9.000 1.00 10.00 C ATOM 775 CG ASN A 52 -2.653 3.804 7.836 1.00 10.00 C ATOM 776 OD1 ASN A 52 -3.165 4.331 6.851 1.00 10.00 O ATOM 777 ND2 ASN A 52 -2.527 2.491 7.942 1.00 10.00 N ATOM 0 H ASN A 52 -1.931 6.585 10.602 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.365 6.280 8.224 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -1.223 5.113 8.796 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -2.105 4.087 9.910 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -2.860 1.885 7.192 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -2.097 2.085 8.773 1.00 10.00 H new ATOM 784 N LYS A 53 -4.734 4.758 10.845 1.00 10.00 N ATOM 785 CA LYS A 53 -6.026 4.314 11.356 1.00 10.00 C ATOM 786 C LYS A 53 -7.044 5.430 11.166 1.00 10.00 C ATOM 787 O LYS A 53 -8.128 5.196 10.636 1.00 10.00 O ATOM 788 CB LYS A 53 -5.922 3.887 12.831 1.00 10.00 C ATOM 789 CG LYS A 53 -7.082 2.967 13.269 1.00 10.00 C ATOM 790 CD LYS A 53 -8.377 3.685 13.699 1.00 10.00 C ATOM 791 CE LYS A 53 -8.314 4.316 15.099 1.00 10.00 C ATOM 792 NZ LYS A 53 -8.308 3.306 16.179 1.00 10.00 N ATOM 0 H LYS A 53 -3.971 4.709 11.520 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.355 3.437 10.798 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -4.975 3.371 12.990 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -5.910 4.776 13.462 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.318 2.293 12.445 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -6.738 2.349 14.098 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.605 4.464 12.972 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -9.201 2.972 13.671 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -7.417 4.930 15.176 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -9.168 4.980 15.233 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.316 3.785 17.102 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -9.151 2.702 16.095 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.453 2.719 16.101 1.00 10.00 H new ATOM 806 N ASN A 54 -6.665 6.639 11.586 1.00 10.00 N ATOM 807 CA ASN A 54 -7.497 7.831 11.520 1.00 10.00 C ATOM 808 C ASN A 54 -8.079 8.044 10.120 1.00 10.00 C ATOM 809 O ASN A 54 -9.189 8.551 9.991 1.00 10.00 O ATOM 810 CB ASN A 54 -6.695 9.055 11.984 1.00 10.00 C ATOM 811 CG ASN A 54 -7.599 10.052 12.694 1.00 10.00 C ATOM 812 OD1 ASN A 54 -8.203 10.916 12.069 1.00 10.00 O ATOM 813 ND2 ASN A 54 -7.698 9.930 14.014 1.00 10.00 N ATOM 0 H ASN A 54 -5.746 6.815 11.991 1.00 10.00 H new ATOM 0 HA ASN A 54 -8.344 7.692 12.192 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.896 8.740 12.655 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -6.222 9.532 11.126 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -8.293 10.569 14.542 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -7.179 9.198 14.499 1.00 10.00 H new ATOM 820 N LYS A 55 -7.351 7.622 9.076 1.00 10.00 N ATOM 821 CA LYS A 55 -7.822 7.695 7.699 1.00 10.00 C ATOM 822 C LYS A 55 -9.157 6.963 7.551 1.00 10.00 C ATOM 823 O LYS A 55 -10.086 7.469 6.931 1.00 10.00 O ATOM 824 CB LYS A 55 -6.756 7.097 6.766 1.00 10.00 C ATOM 825 CG LYS A 55 -6.873 7.636 5.333 1.00 10.00 C ATOM 826 CD LYS A 55 -5.543 7.610 4.554 1.00 10.00 C ATOM 827 CE LYS A 55 -5.081 6.246 4.010 1.00 10.00 C ATOM 828 NZ LYS A 55 -3.982 5.606 4.778 1.00 10.00 N ATOM 0 H LYS A 55 -6.418 7.221 9.171 1.00 10.00 H new ATOM 0 HA LYS A 55 -7.985 8.737 7.425 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -5.764 7.323 7.158 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -6.854 6.011 6.753 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.613 7.047 4.791 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -7.244 8.660 5.368 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -5.629 8.299 3.714 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -4.760 7.998 5.206 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -5.935 5.569 3.994 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -4.756 6.374 2.977 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -4.046 4.573 4.680 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -3.066 5.933 4.411 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -4.064 5.864 5.782 1.00 10.00 H new ATOM 842 N GLY A 56 -9.228 5.760 8.123 1.00 10.00 N ATOM 843 CA GLY A 56 -10.431 4.957 8.208 1.00 10.00 C ATOM 844 C GLY A 56 -11.152 4.748 6.873 1.00 10.00 C ATOM 845 O GLY A 56 -12.380 4.797 6.825 1.00 10.00 O ATOM 0 H GLY A 56 -8.419 5.311 8.551 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.174 3.983 8.624 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.120 5.430 8.908 1.00 10.00 H new ATOM 849 N ILE A 57 -10.399 4.456 5.809 1.00 10.00 N ATOM 850 CA ILE A 57 -10.927 4.165 4.479 1.00 10.00 C ATOM 851 C ILE A 57 -10.682 2.702 4.126 1.00 10.00 C ATOM 852 O ILE A 57 -9.822 2.045 4.715 1.00 10.00 O ATOM 853 CB ILE A 57 -10.340 5.112 3.412 1.00 10.00 C ATOM 854 CG1 ILE A 57 -8.831 4.924 3.192 1.00 10.00 C ATOM 855 CG2 ILE A 57 -10.721 6.559 3.735 1.00 10.00 C ATOM 856 CD1 ILE A 57 -8.267 5.846 2.107 1.00 10.00 C ATOM 0 H ILE A 57 -9.381 4.415 5.853 1.00 10.00 H new ATOM 0 HA ILE A 57 -12.003 4.339 4.494 1.00 10.00 H new ATOM 0 HB ILE A 57 -10.785 4.848 2.453 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -8.306 5.111 4.129 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -8.635 3.887 2.918 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -10.304 7.223 2.978 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -11.807 6.656 3.744 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -10.324 6.830 4.714 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -7.197 5.667 1.997 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -8.768 5.643 1.160 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -8.434 6.885 2.390 1.00 10.00 H new ATOM 868 N THR A 58 -11.461 2.210 3.163 1.00 10.00 N ATOM 869 CA THR A 58 -11.371 0.886 2.582 1.00 10.00 C ATOM 870 C THR A 58 -10.427 0.898 1.374 1.00 10.00 C ATOM 871 O THR A 58 -10.106 1.955 0.823 1.00 10.00 O ATOM 872 CB THR A 58 -12.787 0.477 2.152 1.00 10.00 C ATOM 873 OG1 THR A 58 -13.365 1.540 1.416 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.667 0.190 3.372 1.00 10.00 C ATOM 0 H THR A 58 -12.212 2.762 2.749 1.00 10.00 H new ATOM 0 HA THR A 58 -10.971 0.175 3.305 1.00 10.00 H new ATOM 0 HB THR A 58 -12.721 -0.426 1.545 1.00 10.00 H new ATOM 0 HG1 THR A 58 -14.270 1.289 1.135 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.665 -0.098 3.041 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.229 -0.622 3.953 1.00 10.00 H new ATOM 0 HG23 THR A 58 -13.734 1.085 3.991 1.00 10.00 H new ATOM 882 N TRP A 59 -10.043 -0.292 0.917 1.00 10.00 N ATOM 883 CA TRP A 59 -9.201 -0.484 -0.252 1.00 10.00 C ATOM 884 C TRP A 59 -9.966 -1.297 -1.287 1.00 10.00 C ATOM 885 O TRP A 59 -10.823 -2.102 -0.927 1.00 10.00 O ATOM 886 CB TRP A 59 -7.917 -1.173 0.188 1.00 10.00 C ATOM 887 CG TRP A 59 -7.241 -0.431 1.291 1.00 10.00 C ATOM 888 CD1 TRP A 59 -7.356 -0.713 2.606 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.495 0.819 1.207 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.648 0.221 3.331 1.00 10.00 N ATOM 891 CE2 TRP A 59 -6.110 1.204 2.522 1.00 10.00 C ATOM 892 CE3 TRP A 59 -6.126 1.676 0.151 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -5.353 2.366 2.761 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -5.393 2.852 0.383 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.991 3.191 1.685 1.00 10.00 C ATOM 0 H TRP A 59 -10.317 -1.167 1.363 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.936 0.468 -0.712 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -8.143 -2.187 0.517 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -7.240 -1.257 -0.662 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.914 -1.538 3.023 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -6.535 0.190 4.344 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.413 1.423 -0.859 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -5.052 2.621 3.766 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -5.138 3.498 -0.444 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -4.406 4.082 1.858 1.00 10.00 H new ATOM 906 N LYS A 60 -9.660 -1.068 -2.565 1.00 10.00 N ATOM 907 CA LYS A 60 -10.331 -1.705 -3.692 1.00 10.00 C ATOM 908 C LYS A 60 -9.465 -1.557 -4.945 1.00 10.00 C ATOM 909 O LYS A 60 -9.056 -2.549 -5.537 1.00 10.00 O ATOM 910 CB LYS A 60 -11.757 -1.145 -3.847 1.00 10.00 C ATOM 911 CG LYS A 60 -11.860 0.392 -3.853 1.00 10.00 C ATOM 912 CD LYS A 60 -13.256 0.829 -3.394 1.00 10.00 C ATOM 913 CE LYS A 60 -13.361 2.362 -3.395 1.00 10.00 C ATOM 914 NZ LYS A 60 -14.654 2.834 -2.856 1.00 10.00 N ATOM 0 H LYS A 60 -8.924 -0.421 -2.848 1.00 10.00 H new ATOM 0 HA LYS A 60 -10.450 -2.774 -3.517 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -12.181 -1.525 -4.776 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -12.372 -1.531 -3.035 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -11.103 0.817 -3.195 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -11.662 0.773 -4.855 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -14.013 0.405 -4.054 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -13.454 0.445 -2.394 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -12.548 2.780 -2.802 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -13.237 2.732 -4.413 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -14.680 3.873 -2.876 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -15.430 2.457 -3.436 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -14.763 2.504 -1.876 1.00 10.00 H new ATOM 928 N GLU A 61 -9.117 -0.306 -5.266 1.00 10.00 N ATOM 929 CA GLU A 61 -8.173 0.091 -6.305 1.00 10.00 C ATOM 930 C GLU A 61 -8.115 1.623 -6.371 1.00 10.00 C ATOM 931 O GLU A 61 -7.035 2.208 -6.353 1.00 10.00 O ATOM 932 CB GLU A 61 -8.450 -0.583 -7.663 1.00 10.00 C ATOM 933 CG GLU A 61 -9.927 -0.651 -8.096 1.00 10.00 C ATOM 934 CD GLU A 61 -10.372 -2.075 -8.437 1.00 10.00 C ATOM 935 OE1 GLU A 61 -9.692 -2.719 -9.271 1.00 10.00 O ATOM 936 OE2 GLU A 61 -11.396 -2.510 -7.872 1.00 10.00 O ATOM 0 H GLU A 61 -9.511 0.498 -4.778 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.181 -0.272 -6.038 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -7.891 -0.049 -8.432 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.055 -1.598 -7.629 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.555 -0.259 -7.296 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -10.078 -0.009 -8.964 1.00 10.00 H new ATOM 943 N GLU A 62 -9.285 2.266 -6.372 1.00 10.00 N ATOM 944 CA GLU A 62 -9.434 3.718 -6.429 1.00 10.00 C ATOM 945 C GLU A 62 -8.616 4.435 -5.341 1.00 10.00 C ATOM 946 O GLU A 62 -7.758 5.259 -5.649 1.00 10.00 O ATOM 947 CB GLU A 62 -10.932 4.064 -6.327 1.00 10.00 C ATOM 948 CG GLU A 62 -11.270 5.392 -7.012 1.00 10.00 C ATOM 949 CD GLU A 62 -11.501 5.201 -8.507 1.00 10.00 C ATOM 950 OE1 GLU A 62 -10.492 5.148 -9.242 1.00 10.00 O ATOM 951 OE2 GLU A 62 -12.688 5.077 -8.875 1.00 10.00 O ATOM 0 H GLU A 62 -10.178 1.775 -6.332 1.00 10.00 H new ATOM 0 HA GLU A 62 -9.038 4.073 -7.380 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.519 3.265 -6.780 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.220 4.116 -5.277 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -12.162 5.822 -6.556 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -10.458 6.102 -6.855 1.00 10.00 H new ATOM 958 N THR A 63 -8.860 4.123 -4.061 1.00 10.00 N ATOM 959 CA THR A 63 -8.158 4.771 -2.957 1.00 10.00 C ATOM 960 C THR A 63 -6.645 4.613 -3.136 1.00 10.00 C ATOM 961 O THR A 63 -5.885 5.578 -3.041 1.00 10.00 O ATOM 962 CB THR A 63 -8.647 4.199 -1.612 1.00 10.00 C ATOM 963 OG1 THR A 63 -8.898 2.807 -1.701 1.00 10.00 O ATOM 964 CG2 THR A 63 -9.951 4.859 -1.160 1.00 10.00 C ATOM 0 H THR A 63 -9.542 3.423 -3.769 1.00 10.00 H new ATOM 0 HA THR A 63 -8.379 5.838 -2.957 1.00 10.00 H new ATOM 0 HB THR A 63 -7.850 4.400 -0.896 1.00 10.00 H new ATOM 0 HG1 THR A 63 -9.402 2.515 -0.913 1.00 10.00 H new ATOM 0 HG21 THR A 63 -10.265 4.430 -0.208 1.00 10.00 H new ATOM 0 HG22 THR A 63 -9.794 5.931 -1.041 1.00 10.00 H new ATOM 0 HG23 THR A 63 -10.725 4.687 -1.908 1.00 10.00 H new ATOM 972 N LEU A 64 -6.212 3.388 -3.446 1.00 10.00 N ATOM 973 CA LEU A 64 -4.825 3.112 -3.775 1.00 10.00 C ATOM 974 C LEU A 64 -4.308 4.017 -4.884 1.00 10.00 C ATOM 975 O LEU A 64 -3.229 4.582 -4.736 1.00 10.00 O ATOM 976 CB LEU A 64 -4.619 1.642 -4.168 1.00 10.00 C ATOM 977 CG LEU A 64 -4.100 0.804 -2.997 1.00 10.00 C ATOM 978 CD1 LEU A 64 -5.100 -0.275 -2.582 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.798 0.116 -3.447 1.00 10.00 C ATOM 0 H LEU A 64 -6.817 2.567 -3.474 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.251 3.318 -2.871 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -5.562 1.226 -4.522 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -3.913 1.583 -4.997 1.00 10.00 H new ATOM 0 HG LEU A 64 -3.939 1.462 -2.143 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -4.693 -0.847 -1.748 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -6.036 0.194 -2.278 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -5.285 -0.942 -3.424 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.405 -0.489 -2.630 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -3.002 -0.523 -4.306 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.064 0.872 -3.724 1.00 10.00 H new ATOM 991 N MET A 65 -5.032 4.145 -5.997 1.00 10.00 N ATOM 992 CA MET A 65 -4.561 4.959 -7.105 1.00 10.00 C ATOM 993 C MET A 65 -4.147 6.360 -6.645 1.00 10.00 C ATOM 994 O MET A 65 -3.130 6.871 -7.115 1.00 10.00 O ATOM 995 CB MET A 65 -5.591 5.025 -8.241 1.00 10.00 C ATOM 996 CG MET A 65 -5.520 3.820 -9.186 1.00 10.00 C ATOM 997 SD MET A 65 -5.903 4.240 -10.905 1.00 10.00 S ATOM 998 CE MET A 65 -5.523 2.672 -11.712 1.00 10.00 C ATOM 0 H MET A 65 -5.936 3.699 -6.149 1.00 10.00 H new ATOM 0 HA MET A 65 -3.671 4.471 -7.501 1.00 10.00 H new ATOM 0 HB2 MET A 65 -6.592 5.086 -7.813 1.00 10.00 H new ATOM 0 HB3 MET A 65 -5.433 5.939 -8.814 1.00 10.00 H new ATOM 0 HG2 MET A 65 -4.521 3.387 -9.138 1.00 10.00 H new ATOM 0 HG3 MET A 65 -6.216 3.055 -8.842 1.00 10.00 H new ATOM 0 HE1 MET A 65 -5.707 2.760 -12.783 1.00 10.00 H new ATOM 0 HE2 MET A 65 -4.476 2.420 -11.543 1.00 10.00 H new ATOM 0 HE3 MET A 65 -6.156 1.887 -11.299 1.00 10.00 H new ATOM 1008 N GLU A 66 -4.899 6.960 -5.721 1.00 10.00 N ATOM 1009 CA GLU A 66 -4.549 8.261 -5.184 1.00 10.00 C ATOM 1010 C GLU A 66 -3.373 8.102 -4.226 1.00 10.00 C ATOM 1011 O GLU A 66 -2.382 8.817 -4.333 1.00 10.00 O ATOM 1012 CB GLU A 66 -5.750 8.860 -4.455 1.00 10.00 C ATOM 1013 CG GLU A 66 -6.824 9.427 -5.382 1.00 10.00 C ATOM 1014 CD GLU A 66 -7.901 10.101 -4.543 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -8.312 9.465 -3.545 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -8.249 11.253 -4.875 1.00 10.00 O ATOM 0 H GLU A 66 -5.753 6.560 -5.333 1.00 10.00 H new ATOM 0 HA GLU A 66 -4.266 8.933 -5.995 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.198 8.092 -3.824 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -5.401 9.653 -3.793 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -6.383 10.144 -6.074 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -7.260 8.630 -5.984 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.488 7.169 -3.279 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.505 6.985 -2.221 1.00 10.00 C ATOM 1025 C TYR A 67 -1.099 6.827 -2.806 1.00 10.00 C ATOM 1026 O TYR A 67 -0.163 7.510 -2.393 1.00 10.00 O ATOM 1027 CB TYR A 67 -2.928 5.790 -1.352 1.00 10.00 C ATOM 1028 CG TYR A 67 -2.324 5.762 0.046 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.544 6.850 0.910 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -1.647 4.625 0.534 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -2.099 6.813 2.238 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -1.226 4.579 1.879 1.00 10.00 C ATOM 1033 CZ TYR A 67 -1.453 5.673 2.732 1.00 10.00 C ATOM 1034 OH TYR A 67 -1.372 5.541 4.086 1.00 10.00 O ATOM 0 H TYR A 67 -4.272 6.518 -3.228 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.467 7.869 -1.584 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.014 5.793 -1.262 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -2.653 4.870 -1.868 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -3.062 7.725 0.545 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -1.451 3.790 -0.122 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -2.255 7.666 2.882 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -0.727 3.699 2.256 1.00 10.00 H new ATOM 0 HH TYR A 67 -0.508 5.145 4.325 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.967 5.954 -3.806 1.00 10.00 N ATOM 1045 CA LEU A 68 0.289 5.718 -4.494 1.00 10.00 C ATOM 1046 C LEU A 68 0.726 6.940 -5.304 1.00 10.00 C ATOM 1047 O LEU A 68 1.910 7.260 -5.297 1.00 10.00 O ATOM 1048 CB LEU A 68 0.196 4.487 -5.403 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.216 3.179 -4.712 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.053 2.033 -5.718 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.574 2.891 -3.431 1.00 10.00 C ATOM 0 H LEU A 68 -1.740 5.389 -4.159 1.00 10.00 H new ATOM 0 HA LEU A 68 1.044 5.531 -3.730 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.520 4.698 -6.197 1.00 10.00 H new ATOM 0 HB3 LEU A 68 1.165 4.336 -5.879 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.255 3.276 -4.397 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -0.341 1.093 -5.248 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -0.690 2.215 -6.584 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.987 1.975 -6.038 1.00 10.00 H new ATOM 0 HD21 LEU A 68 0.231 1.952 -2.995 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.635 2.815 -3.667 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.418 3.700 -2.718 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.188 7.612 -6.021 1.00 10.00 N ATOM 1064 CA GLU A 69 0.173 8.784 -6.823 1.00 10.00 C ATOM 1065 C GLU A 69 0.249 10.067 -5.980 1.00 10.00 C ATOM 1066 O GLU A 69 0.364 11.157 -6.536 1.00 10.00 O ATOM 1067 CB GLU A 69 -0.759 8.935 -8.043 1.00 10.00 C ATOM 1068 CG GLU A 69 -0.041 9.536 -9.274 1.00 10.00 C ATOM 1069 CD GLU A 69 -1.013 10.198 -10.249 1.00 10.00 C ATOM 1070 OE1 GLU A 69 -1.600 9.441 -11.059 1.00 10.00 O ATOM 1071 OE2 GLU A 69 -1.162 11.432 -10.176 1.00 10.00 O ATOM 0 H GLU A 69 -1.176 7.363 -6.060 1.00 10.00 H new ATOM 0 HA GLU A 69 1.180 8.617 -7.206 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -1.167 7.959 -8.306 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -1.603 9.571 -7.774 1.00 10.00 H new ATOM 0 HG2 GLU A 69 0.692 10.271 -8.941 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.508 8.749 -9.791 1.00 10.00 H new ATOM 1078 N ASN A 70 0.151 9.987 -4.646 1.00 10.00 N ATOM 1079 CA ASN A 70 0.060 11.195 -3.834 1.00 10.00 C ATOM 1080 C ASN A 70 0.350 10.926 -2.351 1.00 10.00 C ATOM 1081 O ASN A 70 -0.467 11.242 -1.484 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.315 11.853 -4.092 1.00 10.00 C ATOM 1083 CG ASN A 70 -1.179 13.301 -4.550 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.400 14.074 -3.995 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -1.947 13.690 -5.565 1.00 10.00 N ATOM 0 H ASN A 70 0.133 9.113 -4.120 1.00 10.00 H new ATOM 0 HA ASN A 70 0.838 11.899 -4.130 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -1.853 11.283 -4.849 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -1.911 11.816 -3.180 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -1.899 14.652 -5.902 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -2.584 13.027 -6.006 1.00 10.00 H new ATOM 1092 N PRO A 71 1.542 10.414 -1.998 1.00 10.00 N ATOM 1093 CA PRO A 71 1.842 9.988 -0.637 1.00 10.00 C ATOM 1094 C PRO A 71 2.192 11.156 0.304 1.00 10.00 C ATOM 1095 O PRO A 71 2.940 10.972 1.261 1.00 10.00 O ATOM 1096 CB PRO A 71 3.000 8.996 -0.804 1.00 10.00 C ATOM 1097 CG PRO A 71 3.773 9.586 -1.984 1.00 10.00 C ATOM 1098 CD PRO A 71 2.651 10.097 -2.888 1.00 10.00 C ATOM 0 HA PRO A 71 0.975 9.537 -0.155 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.615 8.935 0.094 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.644 7.988 -1.016 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.441 10.389 -1.672 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.387 8.836 -2.483 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.969 10.977 -3.447 1.00 10.00 H new ATOM 0 HD3 PRO A 71 2.363 9.342 -3.619 1.00 10.00 H new ATOM 1106 N LYS A 72 1.630 12.347 0.062 1.00 10.00 N ATOM 1107 CA LYS A 72 1.730 13.521 0.923 1.00 10.00 C ATOM 1108 C LYS A 72 0.522 14.418 0.661 1.00 10.00 C ATOM 1109 O LYS A 72 0.651 15.603 0.359 1.00 10.00 O ATOM 1110 CB LYS A 72 3.088 14.235 0.791 1.00 10.00 C ATOM 1111 CG LYS A 72 3.683 14.389 -0.619 1.00 10.00 C ATOM 1112 CD LYS A 72 3.019 15.528 -1.402 1.00 10.00 C ATOM 1113 CE LYS A 72 3.868 15.931 -2.616 1.00 10.00 C ATOM 1114 NZ LYS A 72 3.324 17.125 -3.295 1.00 10.00 N ATOM 0 H LYS A 72 1.072 12.521 -0.774 1.00 10.00 H new ATOM 0 HA LYS A 72 1.702 13.217 1.969 1.00 10.00 H new ATOM 0 HB2 LYS A 72 2.986 15.231 1.222 1.00 10.00 H new ATOM 0 HB3 LYS A 72 3.811 13.695 1.403 1.00 10.00 H new ATOM 0 HG2 LYS A 72 4.754 14.578 -0.542 1.00 10.00 H new ATOM 0 HG3 LYS A 72 3.563 13.454 -1.167 1.00 10.00 H new ATOM 0 HD2 LYS A 72 2.029 15.216 -1.734 1.00 10.00 H new ATOM 0 HD3 LYS A 72 2.880 16.390 -0.749 1.00 10.00 H new ATOM 0 HE2 LYS A 72 4.890 16.130 -2.294 1.00 10.00 H new ATOM 0 HE3 LYS A 72 3.912 15.101 -3.321 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 3.925 17.365 -4.109 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 2.358 16.927 -3.624 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 3.306 17.924 -2.630 1.00 10.00 H new ATOM 1128 N LYS A 73 -0.664 13.814 0.744 1.00 10.00 N ATOM 1129 CA LYS A 73 -1.922 14.465 0.413 1.00 10.00 C ATOM 1130 C LYS A 73 -3.037 13.941 1.314 1.00 10.00 C ATOM 1131 O LYS A 73 -3.716 14.730 1.964 1.00 10.00 O ATOM 1132 CB LYS A 73 -2.223 14.257 -1.082 1.00 10.00 C ATOM 1133 CG LYS A 73 -2.346 15.589 -1.831 1.00 10.00 C ATOM 1134 CD LYS A 73 -3.689 16.271 -1.544 1.00 10.00 C ATOM 1135 CE LYS A 73 -3.781 17.592 -2.324 1.00 10.00 C ATOM 1136 NZ LYS A 73 -5.181 18.013 -2.537 1.00 10.00 N ATOM 0 H LYS A 73 -0.774 12.846 1.047 1.00 10.00 H new ATOM 0 HA LYS A 73 -1.851 15.538 0.591 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -1.430 13.659 -1.532 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -3.149 13.692 -1.191 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -1.531 16.250 -1.537 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -2.246 15.416 -2.903 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -4.510 15.612 -1.829 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -3.789 16.462 -0.475 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -3.247 18.372 -1.781 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -3.286 17.479 -3.288 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -5.198 18.908 -3.067 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -5.685 17.281 -3.078 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -5.647 18.147 -1.617 1.00 10.00 H new ATOM 1150 N TYR A 74 -3.222 12.618 1.354 1.00 10.00 N ATOM 1151 CA TYR A 74 -4.271 11.998 2.161 1.00 10.00 C ATOM 1152 C TYR A 74 -4.177 12.390 3.638 1.00 10.00 C ATOM 1153 O TYR A 74 -5.137 12.896 4.211 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.218 10.471 2.019 1.00 10.00 C ATOM 1155 CG TYR A 74 -5.253 9.910 1.070 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -6.587 9.762 1.496 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -4.876 9.467 -0.207 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -7.526 9.126 0.666 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -5.793 8.755 -0.992 1.00 10.00 C ATOM 1160 CZ TYR A 74 -7.134 8.638 -0.591 1.00 10.00 C ATOM 1161 OH TYR A 74 -8.041 8.006 -1.384 1.00 10.00 O ATOM 0 H TYR A 74 -2.652 11.953 0.831 1.00 10.00 H new ATOM 0 HA TYR A 74 -5.225 12.367 1.786 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.226 10.182 1.672 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.356 10.019 3.001 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -6.889 10.138 2.462 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -3.885 9.674 -0.583 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -8.548 9.013 0.995 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -5.466 8.293 -1.912 1.00 10.00 H new ATOM 0 HH TYR A 74 -7.912 8.285 -2.315 1.00 10.00 H new ATOM 1171 N ILE A 75 -3.034 12.094 4.260 1.00 10.00 N ATOM 1172 CA ILE A 75 -2.780 12.334 5.674 1.00 10.00 C ATOM 1173 C ILE A 75 -1.404 13.002 5.783 1.00 10.00 C ATOM 1174 O ILE A 75 -0.417 12.419 5.337 1.00 10.00 O ATOM 1175 CB ILE A 75 -2.863 11.018 6.481 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -2.341 9.805 5.688 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -4.311 10.769 6.930 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.057 8.591 6.580 1.00 10.00 C ATOM 0 H ILE A 75 -2.242 11.670 3.778 1.00 10.00 H new ATOM 0 HA ILE A 75 -3.537 12.991 6.102 1.00 10.00 H new ATOM 0 HB ILE A 75 -2.219 11.133 7.353 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -3.074 9.530 4.930 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.428 10.086 5.162 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -4.361 9.840 7.498 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -4.645 11.596 7.557 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -4.956 10.694 6.054 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.692 7.767 5.967 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.303 8.853 7.322 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -2.974 8.289 7.086 1.00 10.00 H new ATOM 1190 N PRO A 76 -1.301 14.227 6.323 1.00 10.00 N ATOM 1191 CA PRO A 76 -0.043 14.959 6.373 1.00 10.00 C ATOM 1192 C PRO A 76 0.830 14.444 7.525 1.00 10.00 C ATOM 1193 O PRO A 76 1.145 15.180 8.456 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.458 16.427 6.532 1.00 10.00 C ATOM 1195 CG PRO A 76 -1.745 16.330 7.350 1.00 10.00 C ATOM 1196 CD PRO A 76 -2.394 15.054 6.813 1.00 10.00 C ATOM 0 HA PRO A 76 0.571 14.830 5.482 1.00 10.00 H new ATOM 0 HB2 PRO A 76 0.306 17.009 7.048 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.627 16.906 5.568 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -1.541 16.261 8.418 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -2.384 17.201 7.203 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -2.952 14.540 7.596 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -3.100 15.281 6.015 1.00 10.00 H new ATOM 1204 N GLY A 77 1.228 13.171 7.461 1.00 10.00 N ATOM 1205 CA GLY A 77 2.043 12.539 8.488 1.00 10.00 C ATOM 1206 C GLY A 77 2.188 11.056 8.175 1.00 10.00 C ATOM 1207 O GLY A 77 1.690 10.208 8.913 1.00 10.00 O ATOM 0 H GLY A 77 0.989 12.550 6.688 1.00 10.00 H new ATOM 0 HA2 GLY A 77 3.025 13.011 8.531 1.00 10.00 H new ATOM 0 HA3 GLY A 77 1.582 12.672 9.467 1.00 10.00 H new ATOM 1211 N THR A 78 2.844 10.755 7.053 1.00 10.00 N ATOM 1212 CA THR A 78 3.059 9.396 6.574 1.00 10.00 C ATOM 1213 C THR A 78 4.563 9.171 6.394 1.00 10.00 C ATOM 1214 O THR A 78 5.287 9.114 7.384 1.00 10.00 O ATOM 1215 CB THR A 78 2.195 9.177 5.320 1.00 10.00 C ATOM 1216 OG1 THR A 78 0.880 9.558 5.640 1.00 10.00 O ATOM 1217 CG2 THR A 78 2.150 7.717 4.872 1.00 10.00 C ATOM 0 H THR A 78 3.247 11.466 6.443 1.00 10.00 H new ATOM 0 HA THR A 78 2.737 8.637 7.287 1.00 10.00 H new ATOM 0 HB THR A 78 2.630 9.763 4.510 1.00 10.00 H new ATOM 0 HG1 THR A 78 0.754 10.506 5.428 1.00 10.00 H new ATOM 0 HG21 THR A 78 1.525 7.628 3.983 1.00 10.00 H new ATOM 0 HG22 THR A 78 3.159 7.376 4.641 1.00 10.00 H new ATOM 0 HG23 THR A 78 1.734 7.104 5.671 1.00 10.00 H new ATOM 1225 N LYS A 79 5.049 9.063 5.155 1.00 10.00 N ATOM 1226 CA LYS A 79 6.452 8.826 4.846 1.00 10.00 C ATOM 1227 C LYS A 79 6.641 9.025 3.347 1.00 10.00 C ATOM 1228 O LYS A 79 6.934 8.080 2.618 1.00 10.00 O ATOM 1229 CB LYS A 79 6.889 7.425 5.307 1.00 10.00 C ATOM 1230 CG LYS A 79 6.025 6.290 4.726 1.00 10.00 C ATOM 1231 CD LYS A 79 5.292 5.477 5.803 1.00 10.00 C ATOM 1232 CE LYS A 79 6.210 4.842 6.855 1.00 10.00 C ATOM 1233 NZ LYS A 79 7.348 4.140 6.236 1.00 10.00 N ATOM 0 H LYS A 79 4.462 9.140 4.325 1.00 10.00 H new ATOM 0 HA LYS A 79 7.086 9.531 5.384 1.00 10.00 H new ATOM 0 HB2 LYS A 79 7.928 7.264 5.019 1.00 10.00 H new ATOM 0 HB3 LYS A 79 6.849 7.380 6.395 1.00 10.00 H new ATOM 0 HG2 LYS A 79 5.293 6.714 4.039 1.00 10.00 H new ATOM 0 HG3 LYS A 79 6.659 5.621 4.143 1.00 10.00 H new ATOM 0 HD2 LYS A 79 4.577 6.127 6.308 1.00 10.00 H new ATOM 0 HD3 LYS A 79 4.717 4.688 5.317 1.00 10.00 H new ATOM 0 HE2 LYS A 79 6.582 5.615 7.527 1.00 10.00 H new ATOM 0 HE3 LYS A 79 5.637 4.141 7.462 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 7.848 3.585 6.959 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 7.000 3.504 5.491 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 8.000 4.835 5.821 1.00 10.00 H new ATOM 1247 N MET A 80 6.401 10.250 2.881 1.00 10.00 N ATOM 1248 CA MET A 80 6.556 10.583 1.476 1.00 10.00 C ATOM 1249 C MET A 80 7.985 10.296 1.037 1.00 10.00 C ATOM 1250 O MET A 80 8.918 10.541 1.802 1.00 10.00 O ATOM 1251 CB MET A 80 6.132 12.031 1.234 1.00 10.00 C ATOM 1252 CG MET A 80 6.998 13.110 1.900 1.00 10.00 C ATOM 1253 SD MET A 80 8.338 13.788 0.887 1.00 10.00 S ATOM 1254 CE MET A 80 8.848 15.159 1.948 1.00 10.00 C ATOM 0 H MET A 80 6.097 11.029 3.465 1.00 10.00 H new ATOM 0 HA MET A 80 5.904 9.960 0.864 1.00 10.00 H new ATOM 0 HB2 MET A 80 6.126 12.211 0.159 1.00 10.00 H new ATOM 0 HB3 MET A 80 5.106 12.151 1.583 1.00 10.00 H new ATOM 0 HG2 MET A 80 6.349 13.931 2.206 1.00 10.00 H new ATOM 0 HG3 MET A 80 7.432 12.691 2.808 1.00 10.00 H new ATOM 0 HE1 MET A 80 9.673 15.695 1.479 1.00 10.00 H new ATOM 0 HE2 MET A 80 8.009 15.839 2.092 1.00 10.00 H new ATOM 0 HE3 MET A 80 9.171 14.771 2.914 1.00 10.00 H new ATOM 1264 N ILE A 81 8.139 9.730 -0.163 1.00 10.00 N ATOM 1265 CA ILE A 81 9.423 9.215 -0.611 1.00 10.00 C ATOM 1266 C ILE A 81 9.733 9.540 -2.069 1.00 10.00 C ATOM 1267 O ILE A 81 10.878 9.832 -2.405 1.00 10.00 O ATOM 1268 CB ILE A 81 9.543 7.693 -0.337 1.00 10.00 C ATOM 1269 CG1 ILE A 81 8.189 6.962 -0.478 1.00 10.00 C ATOM 1270 CG2 ILE A 81 10.164 7.434 1.041 1.00 10.00 C ATOM 1271 CD1 ILE A 81 8.310 5.433 -0.489 1.00 10.00 C ATOM 0 H ILE A 81 7.384 9.619 -0.839 1.00 10.00 H new ATOM 0 HA ILE A 81 10.178 9.734 -0.021 1.00 10.00 H new ATOM 0 HB ILE A 81 10.206 7.283 -1.099 1.00 10.00 H new ATOM 0 HG12 ILE A 81 7.538 7.260 0.344 1.00 10.00 H new ATOM 0 HG13 ILE A 81 7.706 7.286 -1.400 1.00 10.00 H new ATOM 0 HG21 ILE A 81 10.238 6.360 1.211 1.00 10.00 H new ATOM 0 HG22 ILE A 81 11.159 7.877 1.081 1.00 10.00 H new ATOM 0 HG23 ILE A 81 9.537 7.881 1.812 1.00 10.00 H new ATOM 0 HD11 ILE A 81 7.319 4.990 -0.591 1.00 10.00 H new ATOM 0 HD12 ILE A 81 8.934 5.123 -1.328 1.00 10.00 H new ATOM 0 HD13 ILE A 81 8.763 5.097 0.444 1.00 10.00 H new ATOM 1283 N PHE A 82 8.734 9.483 -2.943 1.00 10.00 N ATOM 1284 CA PHE A 82 8.860 9.874 -4.333 1.00 10.00 C ATOM 1285 C PHE A 82 7.476 10.339 -4.770 1.00 10.00 C ATOM 1286 O PHE A 82 6.519 10.177 -4.011 1.00 10.00 O ATOM 1287 CB PHE A 82 9.436 8.727 -5.184 1.00 10.00 C ATOM 1288 CG PHE A 82 8.597 7.461 -5.279 1.00 10.00 C ATOM 1289 CD1 PHE A 82 8.459 6.619 -4.160 1.00 10.00 C ATOM 1290 CD2 PHE A 82 8.094 7.036 -6.523 1.00 10.00 C ATOM 1291 CE1 PHE A 82 7.704 5.435 -4.248 1.00 10.00 C ATOM 1292 CE2 PHE A 82 7.424 5.804 -6.630 1.00 10.00 C ATOM 1293 CZ PHE A 82 7.180 5.029 -5.485 1.00 10.00 C ATOM 0 H PHE A 82 7.799 9.157 -2.696 1.00 10.00 H new ATOM 0 HA PHE A 82 9.572 10.688 -4.470 1.00 10.00 H new ATOM 0 HB2 PHE A 82 9.602 9.102 -6.194 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.412 8.459 -4.779 1.00 10.00 H new ATOM 0 HD1 PHE A 82 8.936 6.883 -3.228 1.00 10.00 H new ATOM 0 HD2 PHE A 82 8.223 7.657 -7.397 1.00 10.00 H new ATOM 0 HE1 PHE A 82 7.528 4.839 -3.365 1.00 10.00 H new ATOM 0 HE2 PHE A 82 7.096 5.453 -7.597 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.592 4.126 -5.556 1.00 10.00 H new ATOM 1303 N ALA A 83 7.382 10.955 -5.952 1.00 10.00 N ATOM 1304 CA ALA A 83 6.140 11.536 -6.447 1.00 10.00 C ATOM 1305 C ALA A 83 4.996 10.524 -6.370 1.00 10.00 C ATOM 1306 O ALA A 83 3.921 10.829 -5.860 1.00 10.00 O ATOM 1307 CB ALA A 83 6.343 12.027 -7.883 1.00 10.00 C ATOM 0 H ALA A 83 8.170 11.063 -6.591 1.00 10.00 H new ATOM 0 HA ALA A 83 5.869 12.384 -5.819 1.00 10.00 H new ATOM 0 HB1 ALA A 83 5.415 12.462 -8.254 1.00 10.00 H new ATOM 0 HB2 ALA A 83 7.130 12.781 -7.902 1.00 10.00 H new ATOM 0 HB3 ALA A 83 6.630 11.188 -8.517 1.00 10.00 H new ATOM 1313 N GLY A 84 5.251 9.317 -6.872 1.00 10.00 N ATOM 1314 CA GLY A 84 4.310 8.221 -6.872 1.00 10.00 C ATOM 1315 C GLY A 84 4.723 7.239 -7.955 1.00 10.00 C ATOM 1316 O GLY A 84 5.780 7.415 -8.565 1.00 10.00 O ATOM 0 H GLY A 84 6.146 9.078 -7.300 1.00 10.00 H new ATOM 0 HA2 GLY A 84 4.298 7.730 -5.899 1.00 10.00 H new ATOM 0 HA3 GLY A 84 3.300 8.587 -7.056 1.00 10.00 H new ATOM 1320 N ILE A 85 3.908 6.211 -8.209 1.00 10.00 N ATOM 1321 CA ILE A 85 4.185 5.285 -9.296 1.00 10.00 C ATOM 1322 C ILE A 85 4.292 6.054 -10.608 1.00 10.00 C ATOM 1323 O ILE A 85 3.669 7.097 -10.791 1.00 10.00 O ATOM 1324 CB ILE A 85 3.134 4.163 -9.368 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.470 3.014 -8.415 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.926 3.554 -10.761 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.644 2.122 -8.841 1.00 10.00 C ATOM 0 H ILE A 85 3.061 6.005 -7.679 1.00 10.00 H new ATOM 0 HA ILE A 85 5.140 4.795 -9.106 1.00 10.00 H new ATOM 0 HB ILE A 85 2.211 4.667 -9.081 1.00 10.00 H new ATOM 0 HG12 ILE A 85 3.692 3.433 -7.434 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.584 2.389 -8.301 1.00 10.00 H new ATOM 0 HG21 ILE A 85 2.167 2.773 -10.707 1.00 10.00 H new ATOM 0 HG22 ILE A 85 2.599 4.331 -11.453 1.00 10.00 H new ATOM 0 HG23 ILE A 85 3.864 3.125 -11.114 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.796 1.341 -8.096 1.00 10.00 H new ATOM 0 HD12 ILE A 85 4.423 1.665 -9.806 1.00 10.00 H new ATOM 0 HD13 ILE A 85 5.548 2.725 -8.924 1.00 10.00 H new ATOM 1339 N LYS A 86 5.082 5.464 -11.505 1.00 10.00 N ATOM 1340 CA LYS A 86 5.424 5.926 -12.842 1.00 10.00 C ATOM 1341 C LYS A 86 4.303 6.752 -13.474 1.00 10.00 C ATOM 1342 O LYS A 86 4.543 7.869 -13.924 1.00 10.00 O ATOM 1343 CB LYS A 86 5.790 4.715 -13.720 1.00 10.00 C ATOM 1344 CG LYS A 86 6.858 3.847 -13.027 1.00 10.00 C ATOM 1345 CD LYS A 86 7.685 2.942 -13.957 1.00 10.00 C ATOM 1346 CE LYS A 86 8.461 3.706 -15.042 1.00 10.00 C ATOM 1347 NZ LYS A 86 8.014 3.314 -16.397 1.00 10.00 N ATOM 0 H LYS A 86 5.535 4.575 -11.293 1.00 10.00 H new ATOM 0 HA LYS A 86 6.285 6.590 -12.766 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.899 4.118 -13.916 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.162 5.058 -14.685 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.540 4.504 -12.488 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.365 3.220 -12.284 1.00 10.00 H new ATOM 0 HD2 LYS A 86 8.390 2.368 -13.356 1.00 10.00 H new ATOM 0 HD3 LYS A 86 7.019 2.226 -14.437 1.00 10.00 H new ATOM 0 HE2 LYS A 86 8.321 4.778 -14.906 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.528 3.508 -14.937 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 8.442 3.949 -17.101 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 8.308 2.335 -16.590 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 6.978 3.382 -16.454 1.00 10.00 H new ATOM 1361 N LYS A 87 3.094 6.184 -13.508 1.00 10.00 N ATOM 1362 CA LYS A 87 1.879 6.791 -14.014 1.00 10.00 C ATOM 1363 C LYS A 87 0.701 5.839 -13.759 1.00 10.00 C ATOM 1364 O LYS A 87 0.860 4.780 -13.149 1.00 10.00 O ATOM 1365 CB LYS A 87 2.041 7.118 -15.501 1.00 10.00 C ATOM 1366 CG LYS A 87 2.384 5.863 -16.304 1.00 10.00 C ATOM 1367 CD LYS A 87 2.606 6.130 -17.796 1.00 10.00 C ATOM 1368 CE LYS A 87 1.460 6.949 -18.406 1.00 10.00 C ATOM 1369 NZ LYS A 87 1.472 6.904 -19.881 1.00 10.00 N ATOM 0 H LYS A 87 2.938 5.237 -13.162 1.00 10.00 H new ATOM 0 HA LYS A 87 1.678 7.729 -13.496 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.120 7.558 -15.883 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.827 7.862 -15.630 1.00 10.00 H new ATOM 0 HG2 LYS A 87 3.283 5.410 -15.887 1.00 10.00 H new ATOM 0 HG3 LYS A 87 1.579 5.137 -16.189 1.00 10.00 H new ATOM 0 HD2 LYS A 87 3.547 6.663 -17.934 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.697 5.181 -18.325 1.00 10.00 H new ATOM 0 HE2 LYS A 87 0.507 6.568 -18.039 1.00 10.00 H new ATOM 0 HE3 LYS A 87 1.538 7.984 -18.074 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 0.682 7.470 -20.252 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 2.371 7.292 -20.233 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 1.372 5.919 -20.199 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.482 6.203 -14.257 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.710 5.448 -14.062 1.00 10.00 C ATOM 1385 C LYS A 88 -1.570 4.036 -14.630 1.00 10.00 C ATOM 1386 O LYS A 88 -1.986 3.077 -13.989 1.00 10.00 O ATOM 1387 CB LYS A 88 -2.897 6.198 -14.686 1.00 10.00 C ATOM 1388 CG LYS A 88 -4.230 5.609 -14.202 1.00 10.00 C ATOM 1389 CD LYS A 88 -5.427 6.275 -14.895 1.00 10.00 C ATOM 1390 CE LYS A 88 -6.735 5.769 -14.263 1.00 10.00 C ATOM 1391 NZ LYS A 88 -7.938 6.206 -15.003 1.00 10.00 N ATOM 0 H LYS A 88 -0.610 7.046 -14.816 1.00 10.00 H new ATOM 0 HA LYS A 88 -1.901 5.350 -12.993 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -2.844 7.254 -14.423 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.841 6.137 -15.773 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -4.247 4.537 -14.397 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -4.315 5.738 -13.123 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -5.360 7.359 -14.798 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -5.415 6.049 -15.961 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -6.715 4.680 -14.222 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -6.798 6.125 -13.235 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -8.788 5.836 -14.532 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -7.976 7.245 -15.021 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -7.897 5.844 -15.977 1.00 10.00 H new ATOM 1405 N THR A 89 -0.994 3.920 -15.830 1.00 10.00 N ATOM 1406 CA THR A 89 -0.782 2.665 -16.532 1.00 10.00 C ATOM 1407 C THR A 89 -0.164 1.630 -15.586 1.00 10.00 C ATOM 1408 O THR A 89 -0.819 0.664 -15.189 1.00 10.00 O ATOM 1409 CB THR A 89 0.100 2.970 -17.757 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.385 4.139 -18.399 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.100 1.806 -18.745 1.00 10.00 C ATOM 0 H THR A 89 -0.654 4.728 -16.351 1.00 10.00 H new ATOM 0 HA THR A 89 -1.720 2.229 -16.876 1.00 10.00 H new ATOM 0 HB THR A 89 1.124 3.123 -17.417 1.00 10.00 H new ATOM 0 HG1 THR A 89 0.174 4.340 -19.179 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.732 2.053 -19.598 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.486 0.912 -18.254 1.00 10.00 H new ATOM 0 HG23 THR A 89 -0.918 1.620 -19.089 1.00 10.00 H new ATOM 1419 N GLU A 90 1.078 1.877 -15.174 1.00 10.00 N ATOM 1420 CA GLU A 90 1.753 1.105 -14.163 1.00 10.00 C ATOM 1421 C GLU A 90 0.910 0.875 -12.915 1.00 10.00 C ATOM 1422 O GLU A 90 0.851 -0.261 -12.462 1.00 10.00 O ATOM 1423 CB GLU A 90 3.038 1.827 -13.785 1.00 10.00 C ATOM 1424 CG GLU A 90 4.173 1.513 -14.772 1.00 10.00 C ATOM 1425 CD GLU A 90 4.290 2.518 -15.912 1.00 10.00 C ATOM 1426 OE1 GLU A 90 3.228 3.023 -16.335 1.00 10.00 O ATOM 1427 OE2 GLU A 90 5.446 2.795 -16.312 1.00 10.00 O ATOM 0 H GLU A 90 1.645 2.638 -15.549 1.00 10.00 H new ATOM 0 HA GLU A 90 1.957 0.120 -14.582 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.860 2.902 -13.764 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.338 1.534 -12.779 1.00 10.00 H new ATOM 0 HG2 GLU A 90 5.117 1.482 -14.228 1.00 10.00 H new ATOM 0 HG3 GLU A 90 4.014 0.519 -15.191 1.00 10.00 H new ATOM 1434 N ARG A 91 0.298 1.908 -12.318 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.508 1.681 -11.126 1.00 10.00 C ATOM 1436 C ARG A 91 -1.559 0.603 -11.392 1.00 10.00 C ATOM 1437 O ARG A 91 -1.802 -0.245 -10.541 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.241 2.951 -10.692 1.00 10.00 C ATOM 1439 CG ARG A 91 -0.333 3.915 -9.937 1.00 10.00 C ATOM 1440 CD ARG A 91 -1.157 4.829 -9.028 1.00 10.00 C ATOM 1441 NE ARG A 91 -2.283 5.484 -9.713 1.00 10.00 N ATOM 1442 CZ ARG A 91 -2.154 6.612 -10.421 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -0.962 6.956 -10.903 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -3.188 7.428 -10.623 1.00 10.00 N ATOM 0 H ARG A 91 0.346 2.877 -12.634 1.00 10.00 H new ATOM 0 HA ARG A 91 0.175 1.368 -10.337 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -1.647 3.451 -11.571 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -2.087 2.681 -10.059 1.00 10.00 H new ATOM 0 HG2 ARG A 91 0.387 3.354 -9.341 1.00 10.00 H new ATOM 0 HG3 ARG A 91 0.238 4.516 -10.645 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -1.542 4.245 -8.192 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -0.504 5.594 -8.608 1.00 10.00 H new ATOM 0 HE ARG A 91 -3.207 5.057 -9.645 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -0.152 6.361 -10.732 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -0.859 7.815 -11.443 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -4.103 7.198 -10.234 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -3.065 8.282 -11.166 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.196 0.660 -12.560 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.290 -0.232 -12.917 1.00 10.00 C ATOM 1460 C GLU A 92 -2.756 -1.670 -12.984 1.00 10.00 C ATOM 1461 O GLU A 92 -3.276 -2.573 -12.323 1.00 10.00 O ATOM 1462 CB GLU A 92 -3.938 0.279 -14.219 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.459 0.077 -14.292 1.00 10.00 C ATOM 1464 CD GLU A 92 -5.823 -1.287 -14.842 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -5.785 -1.438 -16.083 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.074 -2.217 -14.052 1.00 10.00 O ATOM 0 H GLU A 92 -1.963 1.334 -13.290 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.081 -0.241 -12.167 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -3.719 1.341 -14.327 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.475 -0.229 -15.065 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -5.889 0.194 -13.297 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -5.898 0.851 -14.921 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.654 -1.864 -13.720 1.00 10.00 N ATOM 1474 CA ASP A 93 -0.920 -3.130 -13.724 1.00 10.00 C ATOM 1475 C ASP A 93 -0.639 -3.574 -12.269 1.00 10.00 C ATOM 1476 O ASP A 93 -0.967 -4.691 -11.871 1.00 10.00 O ATOM 1477 CB ASP A 93 0.370 -3.009 -14.576 1.00 10.00 C ATOM 1478 CG ASP A 93 0.176 -2.994 -16.098 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.937 -3.331 -16.555 1.00 10.00 O ATOM 1480 OD2 ASP A 93 1.163 -2.685 -16.812 1.00 10.00 O ATOM 0 H ASP A 93 -1.250 -1.150 -14.326 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.526 -3.907 -14.190 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.887 -2.094 -14.287 1.00 10.00 H new ATOM 0 HB3 ASP A 93 1.028 -3.840 -14.322 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.082 -2.683 -11.443 1.00 10.00 N ATOM 1486 CA LEU A 94 0.217 -2.921 -10.028 1.00 10.00 C ATOM 1487 C LEU A 94 -1.008 -3.467 -9.276 1.00 10.00 C ATOM 1488 O LEU A 94 -0.940 -4.525 -8.644 1.00 10.00 O ATOM 1489 CB LEU A 94 0.752 -1.626 -9.380 1.00 10.00 C ATOM 1490 CG LEU A 94 1.962 -1.831 -8.461 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.521 -0.482 -8.016 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.645 -2.672 -7.241 1.00 10.00 C ATOM 0 H LEU A 94 0.181 -1.747 -11.751 1.00 10.00 H new ATOM 0 HA LEU A 94 0.991 -3.686 -9.961 1.00 10.00 H new ATOM 0 HB2 LEU A 94 1.025 -0.925 -10.169 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.051 -1.163 -8.806 1.00 10.00 H new ATOM 0 HG LEU A 94 2.705 -2.374 -9.045 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.380 -0.641 -7.364 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.831 0.090 -8.891 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.752 0.070 -7.475 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.542 -2.781 -6.631 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.865 -2.185 -6.656 1.00 10.00 H new ATOM 0 HD23 LEU A 94 1.300 -3.656 -7.557 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.132 -2.745 -9.348 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.403 -3.134 -8.763 1.00 10.00 C ATOM 1506 C ILE A 95 -3.773 -4.555 -9.177 1.00 10.00 C ATOM 1507 O ILE A 95 -4.230 -5.329 -8.341 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.493 -2.098 -9.125 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -4.626 -1.053 -8.015 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -5.882 -2.721 -9.313 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.488 -0.045 -7.961 1.00 10.00 C ATOM 0 H ILE A 95 -2.175 -1.848 -9.832 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.317 -3.141 -7.676 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.169 -1.656 -10.067 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.565 -0.516 -8.149 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.687 -1.566 -7.055 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -6.600 -1.940 -9.565 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -5.846 -3.455 -10.118 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.189 -3.211 -8.389 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -3.663 0.658 -7.146 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.546 -0.568 -7.794 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.438 0.499 -8.904 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.600 -4.901 -10.454 1.00 10.00 N ATOM 1524 CA ALA A 96 -3.918 -6.243 -10.926 1.00 10.00 C ATOM 1525 C ALA A 96 -3.143 -7.313 -10.162 1.00 10.00 C ATOM 1526 O ALA A 96 -3.736 -8.277 -9.678 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.678 -6.366 -12.423 1.00 10.00 C ATOM 0 H ALA A 96 -3.243 -4.272 -11.174 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.978 -6.409 -10.734 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.923 -7.377 -12.749 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.308 -5.651 -12.952 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.631 -6.158 -12.642 1.00 10.00 H new ATOM 1533 N TYR A 97 -1.823 -7.148 -10.038 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.024 -8.069 -9.237 1.00 10.00 C ATOM 1535 C TYR A 97 -1.567 -8.130 -7.824 1.00 10.00 C ATOM 1536 O TYR A 97 -1.928 -9.205 -7.346 1.00 10.00 O ATOM 1537 CB TYR A 97 0.440 -7.647 -9.210 1.00 10.00 C ATOM 1538 CG TYR A 97 1.279 -8.382 -8.184 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.497 -9.766 -8.313 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.758 -7.703 -7.048 1.00 10.00 C ATOM 1541 CE1 TYR A 97 2.246 -10.454 -7.343 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.463 -8.403 -6.056 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.730 -9.773 -6.215 1.00 10.00 C ATOM 1544 OH TYR A 97 3.440 -10.451 -5.270 1.00 10.00 O ATOM 0 H TYR A 97 -1.294 -6.395 -10.477 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.086 -9.057 -9.694 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.871 -7.808 -10.198 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.495 -6.577 -9.009 1.00 10.00 H new ATOM 0 HD1 TYR A 97 1.088 -10.300 -9.158 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.583 -6.643 -6.939 1.00 10.00 H new ATOM 0 HE1 TYR A 97 2.449 -11.508 -7.466 1.00 10.00 H new ATOM 0 HE2 TYR A 97 2.801 -7.887 -5.169 1.00 10.00 H new ATOM 0 HH TYR A 97 3.703 -9.835 -4.555 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.611 -6.969 -7.169 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.139 -6.864 -5.815 1.00 10.00 C ATOM 1556 C LEU A 98 -3.456 -7.635 -5.673 1.00 10.00 C ATOM 1557 O LEU A 98 -3.599 -8.386 -4.714 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.290 -5.405 -5.367 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.140 -4.953 -4.447 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.143 -4.101 -5.204 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.699 -4.174 -3.265 1.00 10.00 C ATOM 0 H LEU A 98 -1.284 -6.085 -7.560 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.410 -7.325 -5.148 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -2.325 -4.760 -6.245 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.239 -5.284 -4.845 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.623 -5.841 -4.083 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.659 -3.795 -4.532 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.276 -4.677 -6.029 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.644 -3.216 -5.597 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -0.881 -3.857 -2.618 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.235 -3.297 -3.628 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.382 -4.809 -2.701 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.403 -7.480 -6.604 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.685 -8.179 -6.553 1.00 10.00 C ATOM 1575 C LYS A 99 -5.524 -9.671 -6.299 1.00 10.00 C ATOM 1576 O LYS A 99 -6.184 -10.181 -5.399 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.575 -7.859 -7.771 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.468 -6.644 -7.472 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.591 -6.416 -8.499 1.00 10.00 C ATOM 1580 CE LYS A 99 -8.119 -5.589 -9.702 1.00 10.00 C ATOM 1581 NZ LYS A 99 -9.241 -4.979 -10.444 1.00 10.00 N ATOM 0 H LYS A 99 -4.300 -6.866 -7.412 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.220 -7.791 -5.686 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -5.952 -7.656 -8.642 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -7.193 -8.723 -8.015 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -7.914 -6.769 -6.485 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.844 -5.751 -7.429 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.964 -7.379 -8.847 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -9.425 -5.907 -8.016 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -7.446 -4.804 -9.358 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -7.546 -6.227 -10.375 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -9.131 -5.171 -11.460 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -10.139 -5.384 -10.110 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -9.245 -3.951 -10.285 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.653 -10.378 -7.020 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.435 -11.770 -6.709 1.00 10.00 C ATOM 1597 C LYS A 100 -3.521 -11.909 -5.486 1.00 10.00 C ATOM 1598 O LYS A 100 -3.752 -12.775 -4.654 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.921 -12.503 -7.952 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.631 -13.957 -7.574 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.125 -15.002 -8.580 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.419 -14.910 -9.937 1.00 10.00 C ATOM 1603 NZ LYS A 100 -3.755 -16.068 -10.792 1.00 10.00 N ATOM 0 H LYS A 100 -4.106 -10.013 -7.800 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.376 -12.247 -6.433 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.662 -12.460 -8.750 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -3.018 -12.022 -8.329 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.555 -14.076 -7.449 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -4.088 -14.163 -6.606 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -3.973 -15.998 -8.165 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -5.198 -14.878 -8.726 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -3.709 -13.987 -10.439 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -2.340 -14.866 -9.787 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -3.264 -15.980 -11.704 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -3.456 -16.946 -10.321 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -4.782 -16.094 -10.953 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.471 -11.098 -5.368 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.423 -11.328 -4.382 1.00 10.00 C ATOM 1619 C ALA A 101 -1.974 -11.209 -2.962 1.00 10.00 C ATOM 1620 O ALA A 101 -1.743 -12.064 -2.112 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.280 -10.339 -4.616 1.00 10.00 C ATOM 0 H ALA A 101 -2.326 -10.272 -5.948 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.041 -12.342 -4.497 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.505 -10.509 -3.879 1.00 10.00 H new ATOM 0 HB2 ALA A 101 0.125 -10.482 -5.618 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.655 -9.320 -4.518 1.00 10.00 H new ATOM 1627 N THR A 102 -2.702 -10.124 -2.712 1.00 10.00 N ATOM 1628 CA THR A 102 -3.224 -9.816 -1.397 1.00 10.00 C ATOM 1629 C THR A 102 -4.382 -10.742 -1.030 1.00 10.00 C ATOM 1630 O THR A 102 -4.427 -11.263 0.082 1.00 10.00 O ATOM 1631 CB THR A 102 -3.649 -8.350 -1.339 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.693 -8.053 -2.242 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.476 -7.406 -1.588 1.00 10.00 C ATOM 0 H THR A 102 -2.944 -9.435 -3.424 1.00 10.00 H new ATOM 0 HA THR A 102 -2.436 -9.980 -0.662 1.00 10.00 H new ATOM 0 HB THR A 102 -4.019 -8.192 -0.326 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.356 -8.105 -3.161 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.823 -6.374 -1.538 1.00 10.00 H new ATOM 0 HG22 THR A 102 -1.710 -7.569 -0.829 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.056 -7.600 -2.575 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.323 -10.912 -1.964 1.00 10.00 N ATOM 1642 CA ASN A 103 -6.457 -11.816 -1.827 1.00 10.00 C ATOM 1643 C ASN A 103 -5.968 -13.233 -1.570 1.00 10.00 C ATOM 1644 O ASN A 103 -6.486 -13.918 -0.691 1.00 10.00 O ATOM 1645 CB ASN A 103 -7.274 -11.779 -3.117 1.00 10.00 C ATOM 1646 CG ASN A 103 -8.482 -12.702 -3.083 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -9.505 -12.370 -2.492 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -8.403 -13.838 -3.763 1.00 10.00 N ATOM 0 H ASN A 103 -5.313 -10.412 -2.853 1.00 10.00 H new ATOM 0 HA ASN A 103 -7.075 -11.502 -0.986 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.609 -10.758 -3.299 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.634 -12.058 -3.954 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -9.207 -14.464 -3.805 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -7.538 -14.086 -4.244 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.961 -13.630 -2.348 1.00 10.00 N ATOM 1656 CA GLU A 104 -4.434 -14.970 -2.412 1.00 10.00 C ATOM 1657 C GLU A 104 -5.547 -15.881 -2.952 1.00 10.00 C ATOM 1658 O GLU A 104 -6.250 -15.398 -3.878 1.00 10.00 O ATOM 1659 CB GLU A 104 -3.797 -15.312 -1.050 1.00 10.00 C ATOM 1660 CG GLU A 104 -2.329 -15.757 -1.146 1.00 10.00 C ATOM 1661 CD GLU A 104 -2.168 -17.264 -1.176 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -2.358 -17.891 -0.115 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -1.631 -17.758 -2.194 1.00 10.00 O ATOM 1664 OXT GLU A 104 -5.681 -17.025 -2.469 1.00 10.00 O ATOM 0 H GLU A 104 -4.476 -12.988 -2.975 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.611 -15.110 -3.113 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -3.861 -14.439 -0.400 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -4.377 -16.104 -0.577 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -1.884 -15.332 -2.046 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -1.777 -15.355 -0.297 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 N1 IMD A 105 3.266 5.174 0.779 1.00 10.00 N HETATM 1673 C2 IMD A 105 3.590 3.884 0.575 1.00 10.00 C HETATM 1674 N3 IMD A 105 2.959 3.080 1.447 1.00 10.00 N HETATM 1675 C4 IMD A 105 2.186 3.935 2.234 1.00 10.00 C HETATM 1676 C5 IMD A 105 2.377 5.226 1.828 1.00 10.00 C HETATM 0 HN1 IMD A 105 3.617 5.972 0.250 1.00 10.00 H new HETATM 0 H5 IMD A 105 1.917 6.119 2.251 1.00 10.00 H new HETATM 0 H4 IMD A 105 1.531 3.622 3.047 1.00 10.00 H new HETATM 0 H2 IMD A 105 4.276 3.536 -0.198 1.00 10.00 H new HETATM 1681 FE HEC A 110 3.065 1.110 1.618 1.00 10.00 FE HETATM 1682 CHA HEC A 110 0.511 1.370 3.871 1.00 10.00 C HETATM 1683 CHB HEC A 110 0.880 0.250 -0.830 1.00 10.00 C HETATM 1684 CHC HEC A 110 5.584 1.358 -0.650 1.00 10.00 C HETATM 1685 CHD HEC A 110 5.354 1.276 4.173 1.00 10.00 C HETATM 1686 NA HEC A 110 1.085 0.897 1.530 1.00 10.00 N HETATM 1687 C1A HEC A 110 0.217 1.078 2.566 1.00 10.00 C HETATM 1688 C2A HEC A 110 -1.125 0.883 2.068 1.00 10.00 C HETATM 1689 C3A HEC A 110 -1.012 0.528 0.747 1.00 10.00 C HETATM 1690 C4A HEC A 110 0.394 0.541 0.423 1.00 10.00 C HETATM 1691 CMA HEC A 110 -2.129 0.228 -0.224 1.00 10.00 C HETATM 1692 CAA HEC A 110 -2.406 1.031 2.857 1.00 10.00 C HETATM 1693 CBA HEC A 110 -2.607 -0.016 3.960 1.00 10.00 C HETATM 1694 CGA HEC A 110 -2.629 0.617 5.351 1.00 10.00 C HETATM 1695 O1A HEC A 110 -3.429 1.557 5.567 1.00 10.00 O HETATM 1696 O2A HEC A 110 -1.767 0.248 6.172 1.00 10.00 O HETATM 1697 NB HEC A 110 3.214 0.832 -0.347 1.00 10.00 N HETATM 1698 C1B HEC A 110 2.200 0.449 -1.159 1.00 10.00 C HETATM 1699 C2B HEC A 110 2.741 0.248 -2.485 1.00 10.00 C HETATM 1700 C3B HEC A 110 4.024 0.748 -2.472 1.00 10.00 C HETATM 1701 C4B HEC A 110 4.341 0.991 -1.084 1.00 10.00 C HETATM 1702 CMB HEC A 110 2.055 -0.477 -3.622 1.00 10.00 C HETATM 1703 CAB HEC A 110 4.861 1.229 -3.652 1.00 10.00 C HETATM 1704 CBB HEC A 110 4.236 1.146 -5.045 1.00 10.00 C HETATM 1705 NC HEC A 110 5.085 1.292 1.732 1.00 10.00 N HETATM 1706 C1C HEC A 110 5.916 1.390 0.672 1.00 10.00 C HETATM 1707 C2C HEC A 110 7.271 1.526 1.149 1.00 10.00 C HETATM 1708 C3C HEC A 110 7.221 1.347 2.513 1.00 10.00 C HETATM 1709 C4C HEC A 110 5.816 1.302 2.874 1.00 10.00 C HETATM 1710 CMC HEC A 110 8.505 1.745 0.295 1.00 10.00 C HETATM 1711 CAC HEC A 110 8.386 1.100 3.461 1.00 10.00 C HETATM 1712 CBC HEC A 110 9.761 1.679 3.106 1.00 10.00 C HETATM 1713 ND HEC A 110 2.952 1.303 3.632 1.00 10.00 N HETATM 1714 C1D HEC A 110 4.012 1.356 4.480 1.00 10.00 C HETATM 1715 C2D HEC A 110 3.497 1.526 5.821 1.00 10.00 C HETATM 1716 C3D HEC A 110 2.133 1.595 5.727 1.00 10.00 C HETATM 1717 C4D HEC A 110 1.794 1.417 4.340 1.00 10.00 C HETATM 1718 CMD HEC A 110 4.261 1.697 7.108 1.00 10.00 C HETATM 1719 CAD HEC A 110 1.192 1.915 6.866 1.00 10.00 C HETATM 1720 CBD HEC A 110 0.540 3.301 6.752 1.00 10.00 C HETATM 1721 CGD HEC A 110 1.425 4.337 6.052 1.00 10.00 C HETATM 1722 O1D HEC A 110 0.966 4.854 5.005 1.00 10.00 O HETATM 1723 O2D HEC A 110 2.558 4.565 6.530 1.00 10.00 O HETATM 0 HMD3 HEC A 110 4.894 0.825 7.274 1.00 10.00 H new HETATM 0 HMD2 HEC A 110 4.883 2.590 7.046 1.00 10.00 H new HETATM 0 HMD1 HEC A 110 3.560 1.800 7.936 1.00 10.00 H new HETATM 0 HMC3 HEC A 110 8.621 0.911 -0.398 1.00 10.00 H new HETATM 0 HMC2 HEC A 110 8.398 2.672 -0.268 1.00 10.00 H new HETATM 0 HMC1 HEC A 110 9.384 1.809 0.936 1.00 10.00 H new HETATM 0 HMB3 HEC A 110 1.852 -1.507 -3.327 1.00 10.00 H new HETATM 0 HMB2 HEC A 110 1.117 0.024 -3.859 1.00 10.00 H new HETATM 0 HMB1 HEC A 110 2.701 -0.471 -4.500 1.00 10.00 H new HETATM 0 HMA3 HEC A 110 -2.716 -0.613 0.145 1.00 10.00 H new HETATM 0 HMA2 HEC A 110 -2.771 1.103 -0.321 1.00 10.00 H new HETATM 0 HMA1 HEC A 110 -1.707 -0.023 -1.197 1.00 10.00 H new HETATM 0 HBD2 HEC A 110 -0.399 3.208 6.206 1.00 10.00 H new HETATM 0 HBD1 HEC A 110 0.293 3.661 7.751 1.00 10.00 H new HETATM 0 HBC3 HEC A 110 10.092 1.271 2.151 1.00 10.00 H new HETATM 0 HBC2 HEC A 110 9.691 2.764 3.033 1.00 10.00 H new HETATM 0 HBC1 HEC A 110 10.479 1.414 3.882 1.00 10.00 H new HETATM 0 HBB3 HEC A 110 3.990 0.109 -5.272 1.00 10.00 H new HETATM 0 HBB2 HEC A 110 3.328 1.749 -5.073 1.00 10.00 H new HETATM 0 HBB1 HEC A 110 4.944 1.521 -5.784 1.00 10.00 H new HETATM 0 HBA2 HEC A 110 -3.543 -0.548 3.789 1.00 10.00 H new HETATM 0 HBA1 HEC A 110 -1.807 -0.754 3.910 1.00 10.00 H new HETATM 0 HAD2 HEC A 110 0.410 1.157 6.905 1.00 10.00 H new HETATM 0 HAD1 HEC A 110 1.740 1.856 7.807 1.00 10.00 H new HETATM 0 HAA2 HEC A 110 -2.425 2.023 3.309 1.00 10.00 H new HETATM 0 HAA1 HEC A 110 -3.249 0.978 2.168 1.00 10.00 H new HETATM 0 HHD HEC A 110 6.075 1.189 4.986 1.00 10.00 H new HETATM 0 HHC HEC A 110 6.337 1.635 -1.388 1.00 10.00 H new HETATM 0 HHB HEC A 110 0.200 -0.149 -1.583 1.00 10.00 H new HETATM 0 HHA HEC A 110 -0.308 1.572 4.561 1.00 10.00 H new HETATM 0 H2D HEC A 110 2.572 5.462 6.925 1.00 10.00 H new