USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 78 THR OG1 : rot -84:sc= 1.27 USER MOD Set 1.2: A 105 HEC O2D : rot 45:sc= 0.605 USER MOD Set 2.1: A 40 THR OG1 : rot 180:sc= 1.06 USER MOD Set 2.2: A 105 HEC O2A : rot 162:sc= 2.04 USER MOD Set 3.1: A 54 ASN : amide:sc= 0.276 K(o=2.2,f=-4.3) USER MOD Set 3.2: A 55 LYS NZ :NH3+ -169:sc= 1.95 (180deg=1.1) USER MOD Set 4.1: A 19 THR OG1 : rot -22:sc= 2.11 USER MOD Set 4.2: A 27 LYS NZ :NH3+ -152:sc= 1.13 (180deg=0) USER MOD Set 5.1: A 26 HIS : no HE2:sc= -1.28 K(o=-0.34,f=-1.3) USER MOD Set 5.2: A 31 ASN : amide:sc= 0.939 K(o=-0.34,f=-2.6) USER MOD Single : A 1 GLY N :NH3+ -173:sc= 2.45 (180deg=2.16) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -175:sc= 0.356 (180deg=0.316) USER MOD Single : A 8 LYS NZ :NH3+ 169:sc= 1.37 (180deg=0.9) USER MOD Single : A 12 GLN : amide:sc= 0.709 K(o=0.71,f=-0.017) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0.92 K(o=0.92,f=-0.017) USER MOD Single : A 22 LYS NZ :NH3+ -166:sc= 0.295 (180deg=0.225) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -29:sc= 0.792 USER MOD Single : A 33 HIS : no HE2:sc= -0.249 K(o=-0.25,f=-2.8) USER MOD Single : A 39 LYS NZ :NH3+ -129:sc= 1.25 (180deg=-0.422) USER MOD Single : A 42 GLN : amide:sc= 1.92 K(o=1.9,f=-4.1!) USER MOD Single : A 47 THR OG1 : rot -3:sc= 1.04 USER MOD Single : A 48 TYR OH : rot 130:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.459 USER MOD Single : A 52 ASN : amide:sc= 0.631 K(o=0.63,f=-5.5!) USER MOD Single : A 53 LYS NZ :NH3+ -144:sc= 1.89 (180deg=-0.94!) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -156:sc= 0.581 (180deg=-1.85!) USER MOD Single : A 63 THR OG1 : rot 173:sc= 1.18 USER MOD Single : A 65 MET CE :methyl -153:sc=-0.00431 (180deg=-0.595) USER MOD Single : A 67 TYR OH : rot -117:sc= 1.27 USER MOD Single : A 70 ASN : amide:sc=-0.00828 K(o=-0.0083,f=-6.3!) USER MOD Single : A 72 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.08) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 9:sc= 0.933 USER MOD Single : A 79 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0061) USER MOD Single : A 80 MET CE :methyl 160:sc= -0.143 (180deg=-1.11) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 169:sc= 2.37 (180deg=2.32) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0106 USER MOD Single : A 97 TYR OH : rot 146:sc= 0.0987 USER MOD Single : A 99 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.13) USER MOD Single : A 100 LYS NZ :NH3+ 151:sc= 1.21 (180deg=0.698) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.045 X(o=-0.045,f=-0.0099) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.041 0.450 0.232 1.00 10.00 N ATOM 2 CA GLY A 1 1.989 1.384 1.363 1.00 10.00 C ATOM 3 C GLY A 1 1.075 0.859 2.449 1.00 10.00 C ATOM 4 O GLY A 1 1.565 0.219 3.374 1.00 10.00 O ATOM 0 H1 GLY A 1 2.761 0.768 -0.448 1.00 10.00 H new ATOM 0 H2 GLY A 1 2.286 -0.500 0.577 1.00 10.00 H new ATOM 0 H3 GLY A 1 1.113 0.419 -0.236 1.00 10.00 H new ATOM 0 HA2 GLY A 1 2.991 1.532 1.765 1.00 10.00 H new ATOM 0 HA3 GLY A 1 1.635 2.357 1.022 1.00 10.00 H new ATOM 10 N ASP A 2 -0.230 1.128 2.357 1.00 10.00 N ATOM 11 CA ASP A 2 -1.091 1.216 3.549 1.00 10.00 C ATOM 12 C ASP A 2 -2.420 0.459 3.424 1.00 10.00 C ATOM 13 O ASP A 2 -2.882 0.152 2.324 1.00 10.00 O ATOM 14 CB ASP A 2 -1.353 2.694 3.868 1.00 10.00 C ATOM 15 CG ASP A 2 -0.049 3.474 4.047 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.470 3.457 5.184 1.00 10.00 O ATOM 17 OD2 ASP A 2 0.432 4.031 3.033 1.00 10.00 O ATOM 0 H ASP A 2 -0.716 1.289 1.475 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.553 0.728 4.362 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.937 3.142 3.064 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -1.950 2.770 4.777 1.00 10.00 H new ATOM 22 N VAL A 3 -3.059 0.176 4.570 1.00 10.00 N ATOM 23 CA VAL A 3 -4.266 -0.648 4.619 1.00 10.00 C ATOM 24 C VAL A 3 -5.462 0.050 3.971 1.00 10.00 C ATOM 25 O VAL A 3 -6.186 -0.578 3.202 1.00 10.00 O ATOM 26 CB VAL A 3 -4.600 -1.128 6.048 1.00 10.00 C ATOM 27 CG1 VAL A 3 -3.412 -1.841 6.696 1.00 10.00 C ATOM 28 CG2 VAL A 3 -5.077 -0.057 7.033 1.00 10.00 C ATOM 0 H VAL A 3 -2.751 0.513 5.482 1.00 10.00 H new ATOM 0 HA VAL A 3 -4.048 -1.539 4.031 1.00 10.00 H new ATOM 0 HB VAL A 3 -5.441 -1.799 5.874 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -3.685 -2.164 7.700 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -3.138 -2.710 6.097 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -2.564 -1.158 6.753 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -5.279 -0.517 8.000 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -4.304 0.703 7.147 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -5.988 0.406 6.654 1.00 10.00 H new ATOM 38 N GLU A 4 -5.640 1.355 4.207 1.00 10.00 N ATOM 39 CA GLU A 4 -6.676 2.183 3.588 1.00 10.00 C ATOM 40 C GLU A 4 -6.502 2.202 2.076 1.00 10.00 C ATOM 41 O GLU A 4 -7.447 1.941 1.330 1.00 10.00 O ATOM 42 CB GLU A 4 -6.631 3.629 4.115 1.00 10.00 C ATOM 43 CG GLU A 4 -6.967 3.783 5.607 1.00 10.00 C ATOM 44 CD GLU A 4 -5.882 3.267 6.564 1.00 10.00 C ATOM 45 OE1 GLU A 4 -4.732 3.068 6.104 1.00 10.00 O ATOM 46 OE2 GLU A 4 -6.236 3.026 7.738 1.00 10.00 O ATOM 0 H GLU A 4 -5.049 1.877 4.853 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.640 1.746 3.846 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.635 4.034 3.938 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.329 4.234 3.536 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -7.148 4.837 5.818 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -7.897 3.253 5.813 1.00 10.00 H new ATOM 53 N LYS A 5 -5.267 2.470 1.635 1.00 10.00 N ATOM 54 CA LYS A 5 -4.877 2.503 0.233 1.00 10.00 C ATOM 55 C LYS A 5 -5.039 1.150 -0.468 1.00 10.00 C ATOM 56 O LYS A 5 -5.061 1.129 -1.691 1.00 10.00 O ATOM 57 CB LYS A 5 -3.426 2.985 0.129 1.00 10.00 C ATOM 58 CG LYS A 5 -3.136 4.351 0.778 1.00 10.00 C ATOM 59 CD LYS A 5 -3.173 5.522 -0.209 1.00 10.00 C ATOM 60 CE LYS A 5 -4.616 5.904 -0.534 1.00 10.00 C ATOM 61 NZ LYS A 5 -4.655 7.080 -1.426 1.00 10.00 N ATOM 0 H LYS A 5 -4.494 2.675 2.268 1.00 10.00 H new ATOM 0 HA LYS A 5 -5.547 3.194 -0.279 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -2.779 2.238 0.589 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -3.153 3.037 -0.925 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -3.865 4.530 1.568 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.155 4.317 1.252 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -2.651 6.379 0.215 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -2.648 5.250 -1.125 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -5.122 5.064 -1.009 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -5.156 6.122 0.387 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -5.644 7.324 -1.635 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -4.191 7.885 -0.959 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -4.158 6.860 -2.312 1.00 10.00 H new ATOM 75 N GLY A 6 -5.210 0.041 0.262 1.00 10.00 N ATOM 76 CA GLY A 6 -5.452 -1.275 -0.330 1.00 10.00 C ATOM 77 C GLY A 6 -6.906 -1.713 -0.201 1.00 10.00 C ATOM 78 O GLY A 6 -7.497 -2.137 -1.194 1.00 10.00 O ATOM 0 H GLY A 6 -5.184 0.034 1.282 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.175 -1.253 -1.384 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.810 -2.011 0.153 1.00 10.00 H new ATOM 82 N LYS A 7 -7.544 -1.563 0.969 1.00 10.00 N ATOM 83 CA LYS A 7 -8.957 -1.935 1.120 1.00 10.00 C ATOM 84 C LYS A 7 -9.872 -1.165 0.157 1.00 10.00 C ATOM 85 O LYS A 7 -10.799 -1.752 -0.391 1.00 10.00 O ATOM 86 CB LYS A 7 -9.401 -1.853 2.591 1.00 10.00 C ATOM 87 CG LYS A 7 -9.412 -0.431 3.171 1.00 10.00 C ATOM 88 CD LYS A 7 -10.813 0.185 3.311 1.00 10.00 C ATOM 89 CE LYS A 7 -11.405 0.012 4.715 1.00 10.00 C ATOM 90 NZ LYS A 7 -11.786 -1.384 5.031 1.00 10.00 N ATOM 0 H LYS A 7 -7.110 -1.192 1.814 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.057 -2.980 0.828 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.401 -2.277 2.680 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.737 -2.473 3.193 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.936 -0.448 4.151 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -8.807 0.213 2.533 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -10.762 1.247 3.072 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -11.481 -0.274 2.582 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -10.679 0.357 5.451 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -12.284 0.650 4.811 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -12.255 -1.414 5.959 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -12.437 -1.740 4.302 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -10.934 -1.980 5.055 1.00 10.00 H new ATOM 104 N LYS A 8 -9.559 0.107 -0.143 1.00 10.00 N ATOM 105 CA LYS A 8 -10.301 0.956 -1.098 1.00 10.00 C ATOM 106 C LYS A 8 -10.302 0.432 -2.536 1.00 10.00 C ATOM 107 O LYS A 8 -11.247 0.698 -3.272 1.00 10.00 O ATOM 108 CB LYS A 8 -9.764 2.405 -1.063 1.00 10.00 C ATOM 109 CG LYS A 8 -8.305 2.573 -1.543 1.00 10.00 C ATOM 110 CD LYS A 8 -8.111 3.006 -3.009 1.00 10.00 C ATOM 111 CE LYS A 8 -6.613 2.877 -3.311 1.00 10.00 C ATOM 112 NZ LYS A 8 -6.189 3.392 -4.625 1.00 10.00 N ATOM 0 H LYS A 8 -8.765 0.587 0.280 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.339 0.931 -0.767 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -10.408 3.030 -1.681 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -9.840 2.780 -0.042 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -7.817 3.308 -0.902 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -7.786 1.626 -1.395 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -8.697 2.377 -3.679 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -8.449 4.032 -3.158 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -6.056 3.404 -2.536 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -6.335 1.825 -3.244 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -5.151 3.433 -4.663 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -6.538 2.761 -5.374 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -6.579 4.346 -4.766 1.00 10.00 H new ATOM 126 N ILE A 9 -9.258 -0.302 -2.933 1.00 10.00 N ATOM 127 CA ILE A 9 -9.129 -0.895 -4.268 1.00 10.00 C ATOM 128 C ILE A 9 -9.548 -2.374 -4.248 1.00 10.00 C ATOM 129 O ILE A 9 -10.192 -2.837 -5.195 1.00 10.00 O ATOM 130 CB ILE A 9 -7.720 -0.615 -4.853 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.515 -1.209 -6.264 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.588 -1.067 -3.935 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.466 -0.639 -7.324 1.00 10.00 C ATOM 0 H ILE A 9 -8.465 -0.504 -2.325 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.823 -0.417 -4.960 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.677 0.471 -4.935 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.487 -1.028 -6.578 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -7.648 -2.290 -6.215 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.629 -0.843 -4.402 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.660 -0.541 -2.983 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.666 -2.141 -3.763 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.259 -1.106 -8.287 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.497 -0.844 -7.035 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.318 0.438 -7.404 1.00 10.00 H new ATOM 145 N PHE A 10 -9.316 -3.087 -3.133 1.00 10.00 N ATOM 146 CA PHE A 10 -9.865 -4.422 -2.917 1.00 10.00 C ATOM 147 C PHE A 10 -11.387 -4.405 -3.000 1.00 10.00 C ATOM 148 O PHE A 10 -11.978 -5.137 -3.795 1.00 10.00 O ATOM 149 CB PHE A 10 -9.383 -5.053 -1.599 1.00 10.00 C ATOM 150 CG PHE A 10 -9.761 -6.525 -1.504 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.080 -6.900 -1.177 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.823 -7.524 -1.833 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.480 -8.243 -1.283 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.212 -8.875 -1.871 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.552 -9.230 -1.653 1.00 10.00 C ATOM 0 H PHE A 10 -8.742 -2.748 -2.361 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.486 -5.055 -3.719 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.301 -4.950 -1.522 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.816 -4.512 -0.758 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.785 -6.153 -0.844 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.802 -7.251 -2.057 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.505 -8.517 -1.079 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.477 -9.641 -2.069 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.868 -10.256 -1.769 1.00 10.00 H new ATOM 165 N VAL A 11 -12.037 -3.546 -2.213 1.00 10.00 N ATOM 166 CA VAL A 11 -13.498 -3.495 -2.142 1.00 10.00 C ATOM 167 C VAL A 11 -14.137 -3.031 -3.468 1.00 10.00 C ATOM 168 O VAL A 11 -15.335 -3.210 -3.674 1.00 10.00 O ATOM 169 CB VAL A 11 -13.925 -2.637 -0.923 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.436 -2.391 -0.809 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.505 -3.335 0.382 1.00 10.00 C ATOM 0 H VAL A 11 -11.569 -2.870 -1.610 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.879 -4.505 -1.992 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.431 -1.678 -1.078 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.640 -1.783 0.072 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.788 -1.870 -1.699 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -15.954 -3.346 -0.719 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -13.808 -2.726 1.234 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -13.986 -4.311 0.444 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.423 -3.463 0.394 1.00 10.00 H new ATOM 181 N GLN A 12 -13.331 -2.516 -4.405 1.00 10.00 N ATOM 182 CA GLN A 12 -13.766 -2.083 -5.729 1.00 10.00 C ATOM 183 C GLN A 12 -13.681 -3.223 -6.742 1.00 10.00 C ATOM 184 O GLN A 12 -14.669 -3.482 -7.430 1.00 10.00 O ATOM 185 CB GLN A 12 -12.916 -0.899 -6.217 1.00 10.00 C ATOM 186 CG GLN A 12 -13.308 -0.357 -7.605 1.00 10.00 C ATOM 187 CD GLN A 12 -14.775 0.048 -7.742 1.00 10.00 C ATOM 188 OE1 GLN A 12 -15.119 1.216 -7.686 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.680 -0.891 -7.956 1.00 10.00 N ATOM 0 H GLN A 12 -12.331 -2.387 -4.254 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.807 -1.770 -5.645 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.993 -0.090 -5.491 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.870 -1.206 -6.243 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.684 0.507 -7.832 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.084 -1.117 -8.353 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.398 -1.870 -8.004 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -16.661 -0.637 -8.073 1.00 10.00 H new ATOM 198 N LYS A 13 -12.491 -3.830 -6.897 1.00 10.00 N ATOM 199 CA LYS A 13 -12.196 -4.760 -7.986 1.00 10.00 C ATOM 200 C LYS A 13 -11.672 -6.133 -7.577 1.00 10.00 C ATOM 201 O LYS A 13 -11.354 -6.939 -8.443 1.00 10.00 O ATOM 202 CB LYS A 13 -11.339 -4.049 -9.043 1.00 10.00 C ATOM 203 CG LYS A 13 -12.275 -3.617 -10.179 1.00 10.00 C ATOM 204 CD LYS A 13 -11.517 -2.867 -11.263 1.00 10.00 C ATOM 205 CE LYS A 13 -12.365 -2.838 -12.543 1.00 10.00 C ATOM 206 NZ LYS A 13 -11.557 -2.497 -13.734 1.00 10.00 N ATOM 0 H LYS A 13 -11.706 -3.684 -6.262 1.00 10.00 H new ATOM 0 HA LYS A 13 -13.154 -5.032 -8.430 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -10.836 -3.184 -8.611 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -10.562 -4.715 -9.418 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -12.757 -4.495 -10.610 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -13.066 -2.982 -9.780 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -11.298 -1.851 -10.934 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -10.560 -3.352 -11.457 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -12.834 -3.811 -12.689 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -13.169 -2.110 -12.429 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -12.167 -2.488 -14.576 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -11.130 -1.558 -13.606 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -10.806 -3.205 -13.858 1.00 10.00 H new ATOM 220 N CYS A 14 -11.673 -6.436 -6.282 1.00 10.00 N ATOM 221 CA CYS A 14 -11.487 -7.782 -5.753 1.00 10.00 C ATOM 222 C CYS A 14 -12.785 -8.302 -5.133 1.00 10.00 C ATOM 223 O CYS A 14 -13.224 -9.398 -5.478 1.00 10.00 O ATOM 224 CB CYS A 14 -10.385 -7.752 -4.705 1.00 10.00 C ATOM 225 SG CYS A 14 -8.824 -6.960 -5.178 1.00 10.00 S ATOM 0 H CYS A 14 -11.807 -5.734 -5.554 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.207 -8.452 -6.566 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.770 -7.242 -3.822 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.169 -8.779 -4.411 1.00 10.00 H new ATOM 230 N ALA A 15 -13.440 -7.509 -4.268 1.00 10.00 N ATOM 231 CA ALA A 15 -14.679 -7.909 -3.586 1.00 10.00 C ATOM 232 C ALA A 15 -15.856 -8.191 -4.542 1.00 10.00 C ATOM 233 O ALA A 15 -16.814 -8.867 -4.159 1.00 10.00 O ATOM 234 CB ALA A 15 -15.058 -6.844 -2.555 1.00 10.00 C ATOM 0 H ALA A 15 -13.123 -6.571 -4.023 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.476 -8.858 -3.090 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -15.977 -7.139 -2.048 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.256 -6.744 -1.824 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.212 -5.889 -3.058 1.00 10.00 H new ATOM 240 N GLN A 16 -15.741 -7.726 -5.794 1.00 10.00 N ATOM 241 CA GLN A 16 -16.591 -8.030 -6.946 1.00 10.00 C ATOM 242 C GLN A 16 -16.564 -9.520 -7.358 1.00 10.00 C ATOM 243 O GLN A 16 -17.476 -9.965 -8.054 1.00 10.00 O ATOM 244 CB GLN A 16 -16.161 -7.091 -8.090 1.00 10.00 C ATOM 245 CG GLN A 16 -17.156 -6.995 -9.261 1.00 10.00 C ATOM 246 CD GLN A 16 -16.690 -7.748 -10.504 1.00 10.00 C ATOM 247 OE1 GLN A 16 -16.080 -7.188 -11.400 1.00 10.00 O ATOM 248 NE2 GLN A 16 -16.954 -9.035 -10.594 1.00 10.00 N ATOM 0 H GLN A 16 -14.993 -7.078 -6.043 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.634 -7.856 -6.682 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -16.006 -6.092 -7.682 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -15.200 -7.430 -8.476 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -18.121 -7.391 -8.944 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -17.310 -5.946 -9.515 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -17.464 -9.505 -9.846 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -16.649 -9.562 -11.412 1.00 10.00 H new ATOM 257 N CYS A 17 -15.604 -10.309 -6.852 1.00 10.00 N ATOM 258 CA CYS A 17 -15.389 -11.724 -7.169 1.00 10.00 C ATOM 259 C CYS A 17 -14.982 -12.545 -5.928 1.00 10.00 C ATOM 260 O CYS A 17 -15.398 -13.699 -5.811 1.00 10.00 O ATOM 261 CB CYS A 17 -14.270 -11.832 -8.211 1.00 10.00 C ATOM 262 SG CYS A 17 -14.640 -11.257 -9.897 1.00 10.00 S ATOM 0 H CYS A 17 -14.924 -9.957 -6.178 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.329 -12.126 -7.547 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.412 -11.269 -7.844 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.964 -12.877 -8.271 1.00 10.00 H new ATOM 267 N HIS A 18 -14.234 -11.929 -5.001 1.00 10.00 N ATOM 268 CA HIS A 18 -13.747 -12.443 -3.726 1.00 10.00 C ATOM 269 C HIS A 18 -14.285 -11.576 -2.570 1.00 10.00 C ATOM 270 O HIS A 18 -13.523 -10.859 -1.917 1.00 10.00 O ATOM 271 CB HIS A 18 -12.210 -12.383 -3.728 1.00 10.00 C ATOM 272 CG HIS A 18 -11.501 -13.054 -4.850 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.055 -14.339 -4.828 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.896 -12.417 -5.892 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.198 -14.487 -5.844 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.083 -13.353 -6.544 1.00 10.00 N ATOM 0 H HIS A 18 -13.929 -10.966 -5.146 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.088 -13.470 -3.591 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -11.914 -11.334 -3.721 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -11.854 -12.820 -2.795 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.325 -15.059 -4.158 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.021 -11.380 -6.165 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.669 -15.401 -6.069 1.00 10.00 H new ATOM 284 N THR A 19 -15.596 -11.576 -2.315 1.00 10.00 N ATOM 285 CA THR A 19 -16.126 -10.780 -1.204 1.00 10.00 C ATOM 286 C THR A 19 -15.637 -11.404 0.107 1.00 10.00 C ATOM 287 O THR A 19 -15.752 -12.612 0.306 1.00 10.00 O ATOM 288 CB THR A 19 -17.653 -10.649 -1.248 1.00 10.00 C ATOM 289 OG1 THR A 19 -18.098 -10.487 -2.578 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.126 -9.411 -0.489 1.00 10.00 C ATOM 0 H THR A 19 -16.292 -12.101 -2.844 1.00 10.00 H new ATOM 0 HA THR A 19 -15.754 -9.759 -1.286 1.00 10.00 H new ATOM 0 HB THR A 19 -18.054 -11.557 -0.798 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.361 -10.153 -3.131 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.213 -9.347 -0.539 1.00 10.00 H new ATOM 0 HG22 THR A 19 -17.814 -9.482 0.553 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.689 -8.519 -0.939 1.00 10.00 H new ATOM 298 N VAL A 20 -15.028 -10.588 0.969 1.00 10.00 N ATOM 299 CA VAL A 20 -14.427 -11.015 2.244 1.00 10.00 C ATOM 300 C VAL A 20 -14.637 -9.950 3.321 1.00 10.00 C ATOM 301 O VAL A 20 -15.423 -10.186 4.235 1.00 10.00 O ATOM 302 CB VAL A 20 -12.953 -11.472 2.071 1.00 10.00 C ATOM 303 CG1 VAL A 20 -12.014 -10.459 1.401 1.00 10.00 C ATOM 304 CG2 VAL A 20 -12.331 -11.904 3.400 1.00 10.00 C ATOM 0 H VAL A 20 -14.934 -9.586 0.800 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.947 -11.906 2.595 1.00 10.00 H new ATOM 0 HB VAL A 20 -13.040 -12.316 1.387 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -11.012 -10.882 1.332 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.381 -10.229 0.401 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.982 -9.545 1.994 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -11.300 -12.216 3.235 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -12.349 -11.068 4.099 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.900 -12.736 3.815 1.00 10.00 H new ATOM 314 N GLU A 21 -14.031 -8.762 3.192 1.00 10.00 N ATOM 315 CA GLU A 21 -14.127 -7.680 4.186 1.00 10.00 C ATOM 316 C GLU A 21 -15.581 -7.250 4.458 1.00 10.00 C ATOM 317 O GLU A 21 -15.918 -6.863 5.574 1.00 10.00 O ATOM 318 CB GLU A 21 -13.283 -6.479 3.710 1.00 10.00 C ATOM 319 CG GLU A 21 -12.978 -5.501 4.854 1.00 10.00 C ATOM 320 CD GLU A 21 -12.312 -4.206 4.377 1.00 10.00 C ATOM 321 OE1 GLU A 21 -13.013 -3.356 3.776 1.00 10.00 O ATOM 322 OE2 GLU A 21 -11.139 -3.945 4.732 1.00 10.00 O ATOM 0 H GLU A 21 -13.454 -8.521 2.386 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.738 -8.058 5.132 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.348 -6.840 3.283 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -13.815 -5.954 2.916 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -13.906 -5.256 5.372 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -12.328 -5.991 5.579 1.00 10.00 H new ATOM 329 N LYS A 22 -16.455 -7.349 3.445 1.00 10.00 N ATOM 330 CA LYS A 22 -17.881 -7.006 3.538 1.00 10.00 C ATOM 331 C LYS A 22 -18.766 -8.160 4.050 1.00 10.00 C ATOM 332 O LYS A 22 -19.965 -7.968 4.272 1.00 10.00 O ATOM 333 CB LYS A 22 -18.359 -6.462 2.173 1.00 10.00 C ATOM 334 CG LYS A 22 -19.140 -5.133 2.239 1.00 10.00 C ATOM 335 CD LYS A 22 -20.542 -5.235 2.863 1.00 10.00 C ATOM 336 CE LYS A 22 -20.527 -5.073 4.391 1.00 10.00 C ATOM 337 NZ LYS A 22 -21.692 -5.750 5.005 1.00 10.00 N ATOM 0 H LYS A 22 -16.183 -7.677 2.518 1.00 10.00 H new ATOM 0 HA LYS A 22 -17.988 -6.230 4.296 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -17.490 -6.324 1.529 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -18.990 -7.214 1.700 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -18.555 -4.413 2.811 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -19.236 -4.735 1.229 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -21.185 -4.470 2.427 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -20.978 -6.201 2.609 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -19.604 -5.489 4.796 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -20.539 -4.014 4.649 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -21.796 -5.436 5.991 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -22.553 -5.511 4.473 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -21.546 -6.780 4.983 1.00 10.00 H new ATOM 351 N GLY A 23 -18.175 -9.343 4.220 1.00 10.00 N ATOM 352 CA GLY A 23 -18.839 -10.635 4.362 1.00 10.00 C ATOM 353 C GLY A 23 -18.403 -11.598 3.252 1.00 10.00 C ATOM 354 O GLY A 23 -18.494 -11.273 2.072 1.00 10.00 O ATOM 0 H GLY A 23 -17.160 -9.428 4.265 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -18.603 -11.065 5.335 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -19.920 -10.499 4.327 1.00 10.00 H new ATOM 358 N GLY A 24 -17.933 -12.789 3.633 1.00 10.00 N ATOM 359 CA GLY A 24 -17.527 -13.882 2.740 1.00 10.00 C ATOM 360 C GLY A 24 -18.513 -14.184 1.599 1.00 10.00 C ATOM 361 O GLY A 24 -19.693 -14.450 1.836 1.00 10.00 O ATOM 0 H GLY A 24 -17.819 -13.030 4.617 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -16.557 -13.637 2.307 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.392 -14.786 3.334 1.00 10.00 H new ATOM 365 N LYS A 25 -17.995 -14.209 0.363 1.00 10.00 N ATOM 366 CA LYS A 25 -18.676 -14.672 -0.855 1.00 10.00 C ATOM 367 C LYS A 25 -17.673 -14.966 -1.982 1.00 10.00 C ATOM 368 O LYS A 25 -17.242 -14.077 -2.722 1.00 10.00 O ATOM 369 CB LYS A 25 -19.749 -13.659 -1.316 1.00 10.00 C ATOM 370 CG LYS A 25 -20.973 -14.352 -1.939 1.00 10.00 C ATOM 371 CD LYS A 25 -21.915 -15.012 -0.917 1.00 10.00 C ATOM 372 CE LYS A 25 -22.439 -14.058 0.168 1.00 10.00 C ATOM 373 NZ LYS A 25 -23.161 -12.890 -0.395 1.00 10.00 N ATOM 0 H LYS A 25 -17.044 -13.892 0.176 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.182 -15.606 -0.612 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.068 -13.058 -0.465 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -19.312 -12.975 -2.043 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -21.537 -13.618 -2.515 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -20.628 -15.111 -2.641 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -22.765 -15.441 -1.448 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -21.390 -15.837 -0.436 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -23.105 -14.605 0.835 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -21.602 -13.706 0.771 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -23.492 -12.280 0.380 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -22.520 -12.350 -1.011 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -23.977 -13.220 -0.949 1.00 10.00 H new ATOM 387 N HIS A 26 -17.321 -16.244 -2.133 1.00 10.00 N ATOM 388 CA HIS A 26 -16.534 -16.792 -3.246 1.00 10.00 C ATOM 389 C HIS A 26 -17.337 -16.850 -4.566 1.00 10.00 C ATOM 390 O HIS A 26 -17.556 -17.917 -5.146 1.00 10.00 O ATOM 391 CB HIS A 26 -15.983 -18.171 -2.842 1.00 10.00 C ATOM 392 CG HIS A 26 -17.021 -19.102 -2.286 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.000 -19.743 -3.001 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.181 -19.412 -0.966 1.00 10.00 C ATOM 395 CE1 HIS A 26 -18.740 -20.447 -2.127 1.00 10.00 C ATOM 396 NE2 HIS A 26 -18.289 -20.259 -0.874 1.00 10.00 N ATOM 0 H HIS A 26 -17.587 -16.958 -1.455 1.00 10.00 H new ATOM 0 HA HIS A 26 -15.699 -16.120 -3.445 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -15.521 -18.636 -3.713 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.197 -18.034 -2.099 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.141 -19.695 -4.010 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -16.567 -19.068 -0.147 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -19.578 -21.074 -2.393 1.00 10.00 H new ATOM 404 N LYS A 27 -17.846 -15.696 -5.015 1.00 10.00 N ATOM 405 CA LYS A 27 -18.826 -15.604 -6.108 1.00 10.00 C ATOM 406 C LYS A 27 -18.222 -15.631 -7.515 1.00 10.00 C ATOM 407 O LYS A 27 -18.938 -15.891 -8.481 1.00 10.00 O ATOM 408 CB LYS A 27 -19.739 -14.388 -5.891 1.00 10.00 C ATOM 409 CG LYS A 27 -19.025 -13.029 -5.970 1.00 10.00 C ATOM 410 CD LYS A 27 -19.944 -11.945 -5.397 1.00 10.00 C ATOM 411 CE LYS A 27 -19.291 -10.566 -5.486 1.00 10.00 C ATOM 412 NZ LYS A 27 -19.891 -9.640 -4.500 1.00 10.00 N ATOM 0 H LYS A 27 -17.587 -14.789 -4.626 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.423 -16.515 -6.064 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -20.534 -14.410 -6.636 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.215 -14.477 -4.914 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -18.090 -13.063 -5.411 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -18.770 -12.798 -7.004 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -20.888 -11.939 -5.942 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -20.177 -12.174 -4.357 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -18.220 -10.653 -5.306 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -19.414 -10.164 -6.492 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -19.818 -8.664 -4.851 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -20.892 -9.884 -4.360 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -19.385 -9.721 -3.595 1.00 10.00 H new ATOM 426 N THR A 28 -16.919 -15.377 -7.671 1.00 10.00 N ATOM 427 CA THR A 28 -16.198 -15.579 -8.951 1.00 10.00 C ATOM 428 C THR A 28 -14.691 -15.834 -8.770 1.00 10.00 C ATOM 429 O THR A 28 -14.043 -16.290 -9.704 1.00 10.00 O ATOM 430 CB THR A 28 -16.446 -14.419 -9.943 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.814 -14.077 -9.994 1.00 10.00 O ATOM 432 CG2 THR A 28 -16.055 -14.727 -11.393 1.00 10.00 C ATOM 0 H THR A 28 -16.326 -15.025 -6.919 1.00 10.00 H new ATOM 0 HA THR A 28 -16.618 -16.489 -9.379 1.00 10.00 H new ATOM 0 HB THR A 28 -15.818 -13.616 -9.557 1.00 10.00 H new ATOM 0 HG1 THR A 28 -18.357 -14.869 -9.798 1.00 10.00 H new ATOM 0 HG21 THR A 28 -16.263 -13.859 -12.018 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.992 -14.962 -11.441 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.632 -15.579 -11.752 1.00 10.00 H new ATOM 440 N GLY A 29 -14.135 -15.647 -7.568 1.00 10.00 N ATOM 441 CA GLY A 29 -12.889 -16.264 -7.111 1.00 10.00 C ATOM 442 C GLY A 29 -13.058 -16.737 -5.655 1.00 10.00 C ATOM 443 O GLY A 29 -14.030 -16.340 -5.012 1.00 10.00 O ATOM 0 H GLY A 29 -14.556 -15.041 -6.864 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.631 -17.107 -7.752 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.069 -15.549 -7.180 1.00 10.00 H new ATOM 447 N PRO A 30 -12.151 -17.557 -5.089 1.00 10.00 N ATOM 448 CA PRO A 30 -12.270 -18.044 -3.715 1.00 10.00 C ATOM 449 C PRO A 30 -12.089 -16.896 -2.712 1.00 10.00 C ATOM 450 O PRO A 30 -11.109 -16.159 -2.787 1.00 10.00 O ATOM 451 CB PRO A 30 -11.183 -19.111 -3.566 1.00 10.00 C ATOM 452 CG PRO A 30 -10.119 -18.679 -4.572 1.00 10.00 C ATOM 453 CD PRO A 30 -10.956 -18.098 -5.708 1.00 10.00 C ATOM 0 HA PRO A 30 -13.256 -18.460 -3.510 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -10.787 -19.141 -2.551 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.565 -20.107 -3.789 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.438 -17.940 -4.150 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.510 -19.520 -4.905 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.406 -17.321 -6.240 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.209 -18.866 -6.439 1.00 10.00 H new ATOM 461 N ASN A 31 -13.020 -16.717 -1.770 1.00 10.00 N ATOM 462 CA ASN A 31 -12.944 -15.636 -0.787 1.00 10.00 C ATOM 463 C ASN A 31 -11.712 -15.817 0.117 1.00 10.00 C ATOM 464 O ASN A 31 -11.512 -16.902 0.668 1.00 10.00 O ATOM 465 CB ASN A 31 -14.260 -15.480 -0.002 1.00 10.00 C ATOM 466 CG ASN A 31 -14.884 -16.736 0.594 1.00 10.00 C ATOM 467 OD1 ASN A 31 -16.098 -16.838 0.668 1.00 10.00 O ATOM 468 ND2 ASN A 31 -14.111 -17.715 1.025 1.00 10.00 N ATOM 0 H ASN A 31 -13.841 -17.313 -1.669 1.00 10.00 H new ATOM 0 HA ASN A 31 -12.812 -14.693 -1.318 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.084 -14.775 0.811 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.994 -15.024 -0.666 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -14.528 -18.558 1.420 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -13.097 -17.629 0.963 1.00 10.00 H new ATOM 475 N LEU A 32 -10.882 -14.771 0.236 1.00 10.00 N ATOM 476 CA LEU A 32 -9.569 -14.814 0.882 1.00 10.00 C ATOM 477 C LEU A 32 -9.685 -15.021 2.403 1.00 10.00 C ATOM 478 O LEU A 32 -9.555 -14.090 3.196 1.00 10.00 O ATOM 479 CB LEU A 32 -8.736 -13.558 0.536 1.00 10.00 C ATOM 480 CG LEU A 32 -8.119 -13.533 -0.879 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.133 -13.232 -1.984 1.00 10.00 C ATOM 482 CD2 LEU A 32 -7.037 -12.452 -0.944 1.00 10.00 C ATOM 0 H LEU A 32 -11.115 -13.846 -0.126 1.00 10.00 H new ATOM 0 HA LEU A 32 -9.038 -15.680 0.486 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.372 -12.680 0.651 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.931 -13.466 1.265 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.718 -14.532 -1.050 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.629 -13.231 -2.950 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -9.911 -13.996 -1.982 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -9.583 -12.255 -1.808 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.601 -12.434 -1.943 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.479 -11.481 -0.723 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.259 -12.671 -0.212 1.00 10.00 H new ATOM 494 N HIS A 33 -9.867 -16.279 2.810 1.00 10.00 N ATOM 495 CA HIS A 33 -9.673 -16.806 4.159 1.00 10.00 C ATOM 496 C HIS A 33 -8.198 -16.660 4.573 1.00 10.00 C ATOM 497 O HIS A 33 -7.438 -17.629 4.571 1.00 10.00 O ATOM 498 CB HIS A 33 -10.172 -18.266 4.201 1.00 10.00 C ATOM 499 CG HIS A 33 -9.785 -19.098 2.996 1.00 10.00 C ATOM 500 ND1 HIS A 33 -8.593 -19.038 2.310 1.00 10.00 N ATOM 501 CD2 HIS A 33 -10.608 -19.947 2.311 1.00 10.00 C ATOM 502 CE1 HIS A 33 -8.717 -19.795 1.204 1.00 10.00 C ATOM 503 NE2 HIS A 33 -9.923 -20.377 1.172 1.00 10.00 N ATOM 0 H HIS A 33 -10.174 -17.004 2.161 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.255 -16.238 4.885 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.780 -18.745 5.098 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.258 -18.263 4.290 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -7.764 -18.514 2.590 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.609 -20.234 2.599 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -7.953 -19.916 0.450 1.00 10.00 H new ATOM 511 N GLY A 34 -7.784 -15.422 4.862 1.00 10.00 N ATOM 512 CA GLY A 34 -6.439 -14.995 5.243 1.00 10.00 C ATOM 513 C GLY A 34 -5.401 -15.119 4.119 1.00 10.00 C ATOM 514 O GLY A 34 -4.830 -14.129 3.674 1.00 10.00 O ATOM 0 H GLY A 34 -8.432 -14.635 4.833 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.479 -13.957 5.574 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.109 -15.589 6.095 1.00 10.00 H new ATOM 518 N LEU A 35 -5.150 -16.348 3.664 1.00 10.00 N ATOM 519 CA LEU A 35 -4.191 -16.761 2.634 1.00 10.00 C ATOM 520 C LEU A 35 -2.705 -16.613 2.998 1.00 10.00 C ATOM 521 O LEU A 35 -1.960 -17.574 2.814 1.00 10.00 O ATOM 522 CB LEU A 35 -4.522 -16.107 1.275 1.00 10.00 C ATOM 523 CG LEU A 35 -4.700 -17.160 0.174 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.957 -18.015 0.359 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.804 -16.476 -1.186 1.00 10.00 C ATOM 0 H LEU A 35 -5.656 -17.151 4.039 1.00 10.00 H new ATOM 0 HA LEU A 35 -4.324 -17.840 2.555 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -5.434 -15.517 1.366 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.723 -15.419 0.997 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.828 -17.811 0.233 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -6.026 -18.740 -0.452 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.903 -18.540 1.313 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.838 -17.374 0.348 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.930 -17.229 -1.963 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.661 -15.803 -1.190 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.895 -15.906 -1.377 1.00 10.00 H new ATOM 537 N PHE A 36 -2.264 -15.463 3.519 1.00 10.00 N ATOM 538 CA PHE A 36 -0.842 -15.200 3.791 1.00 10.00 C ATOM 539 C PHE A 36 -0.297 -16.160 4.854 1.00 10.00 C ATOM 540 O PHE A 36 -0.745 -16.161 6.001 1.00 10.00 O ATOM 541 CB PHE A 36 -0.580 -13.741 4.196 1.00 10.00 C ATOM 542 CG PHE A 36 -0.751 -12.761 3.057 1.00 10.00 C ATOM 543 CD1 PHE A 36 -2.032 -12.424 2.588 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.386 -12.239 2.417 1.00 10.00 C ATOM 545 CE1 PHE A 36 -2.176 -11.648 1.427 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.234 -11.430 1.280 1.00 10.00 C ATOM 547 CZ PHE A 36 -1.040 -11.157 0.768 1.00 10.00 C ATOM 0 H PHE A 36 -2.880 -14.688 3.765 1.00 10.00 H new ATOM 0 HA PHE A 36 -0.309 -15.375 2.856 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.258 -13.469 5.004 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.433 -13.657 4.588 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.908 -12.763 3.122 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.372 -12.459 2.798 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -3.161 -11.429 1.042 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.106 -11.015 0.797 1.00 10.00 H new ATOM 0 HZ PHE A 36 -1.148 -10.570 -0.132 1.00 10.00 H new ATOM 557 N GLY A 37 0.624 -17.032 4.431 1.00 10.00 N ATOM 558 CA GLY A 37 1.213 -18.091 5.249 1.00 10.00 C ATOM 559 C GLY A 37 0.322 -19.330 5.399 1.00 10.00 C ATOM 560 O GLY A 37 0.715 -20.271 6.085 1.00 10.00 O ATOM 0 H GLY A 37 0.990 -17.018 3.479 1.00 10.00 H new ATOM 0 HA2 GLY A 37 2.164 -18.391 4.808 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.433 -17.692 6.239 1.00 10.00 H new ATOM 564 N ARG A 38 -0.876 -19.336 4.790 1.00 10.00 N ATOM 565 CA ARG A 38 -1.767 -20.498 4.702 1.00 10.00 C ATOM 566 C ARG A 38 -1.419 -21.362 3.477 1.00 10.00 C ATOM 567 O ARG A 38 -0.276 -21.777 3.310 1.00 10.00 O ATOM 568 CB ARG A 38 -3.243 -20.059 4.771 1.00 10.00 C ATOM 569 CG ARG A 38 -3.586 -19.290 6.058 1.00 10.00 C ATOM 570 CD ARG A 38 -5.107 -19.100 6.214 1.00 10.00 C ATOM 571 NE ARG A 38 -5.856 -20.377 6.223 1.00 10.00 N ATOM 572 CZ ARG A 38 -5.663 -21.363 7.098 1.00 10.00 C ATOM 573 NH1 ARG A 38 -5.120 -21.143 8.274 1.00 10.00 N ATOM 574 NH2 ARG A 38 -5.971 -22.604 6.815 1.00 10.00 N ATOM 0 H ARG A 38 -1.259 -18.508 4.334 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.612 -21.143 5.567 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.470 -19.431 3.909 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.881 -20.940 4.701 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.195 -19.830 6.921 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -3.096 -18.316 6.043 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.306 -18.563 7.141 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.474 -18.476 5.399 1.00 10.00 H new ATOM 0 HE ARG A 38 -6.571 -20.512 5.508 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -4.835 -20.199 8.536 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -4.984 -21.916 8.925 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -6.370 -22.836 5.905 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -5.812 -23.339 7.504 1.00 10.00 H new ATOM 588 N LYS A 39 -2.415 -21.674 2.637 1.00 10.00 N ATOM 589 CA LYS A 39 -2.333 -22.598 1.504 1.00 10.00 C ATOM 590 C LYS A 39 -3.383 -22.251 0.432 1.00 10.00 C ATOM 591 O LYS A 39 -4.210 -21.367 0.661 1.00 10.00 O ATOM 592 CB LYS A 39 -2.426 -24.041 2.037 1.00 10.00 C ATOM 593 CG LYS A 39 -3.853 -24.501 2.368 1.00 10.00 C ATOM 594 CD LYS A 39 -3.852 -25.808 3.177 1.00 10.00 C ATOM 595 CE LYS A 39 -5.172 -26.561 2.980 1.00 10.00 C ATOM 596 NZ LYS A 39 -5.151 -27.346 1.722 1.00 10.00 N ATOM 0 H LYS A 39 -3.345 -21.267 2.737 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.374 -22.502 0.995 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -2.001 -24.718 1.296 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.812 -24.125 2.934 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -4.365 -23.723 2.934 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -4.413 -24.645 1.444 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -3.018 -26.436 2.864 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -3.706 -25.588 4.235 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -5.345 -27.226 3.826 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -6.000 -25.852 2.957 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -6.003 -27.132 1.165 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -4.305 -27.096 1.171 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -5.130 -28.361 1.947 1.00 10.00 H new ATOM 610 N THR A 40 -3.347 -22.921 -0.727 1.00 10.00 N ATOM 611 CA THR A 40 -4.217 -22.618 -1.884 1.00 10.00 C ATOM 612 C THR A 40 -5.472 -23.493 -1.945 1.00 10.00 C ATOM 613 O THR A 40 -6.580 -22.976 -2.085 1.00 10.00 O ATOM 614 CB THR A 40 -3.440 -22.682 -3.215 1.00 10.00 C ATOM 615 OG1 THR A 40 -4.331 -22.602 -4.306 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.587 -23.938 -3.403 1.00 10.00 C ATOM 0 H THR A 40 -2.708 -23.698 -0.895 1.00 10.00 H new ATOM 0 HA THR A 40 -4.558 -21.594 -1.733 1.00 10.00 H new ATOM 0 HB THR A 40 -2.760 -21.831 -3.176 1.00 10.00 H new ATOM 0 HG1 THR A 40 -3.826 -22.642 -5.145 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.079 -23.892 -4.367 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.847 -23.998 -2.605 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.226 -24.820 -3.371 1.00 10.00 H new ATOM 624 N GLY A 41 -5.329 -24.813 -1.796 1.00 10.00 N ATOM 625 CA GLY A 41 -6.407 -25.797 -1.865 1.00 10.00 C ATOM 626 C GLY A 41 -7.254 -25.794 -0.593 1.00 10.00 C ATOM 627 O GLY A 41 -7.283 -26.775 0.152 1.00 10.00 O ATOM 0 H GLY A 41 -4.420 -25.240 -1.617 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.041 -25.583 -2.725 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.985 -26.790 -2.019 1.00 10.00 H new ATOM 631 N GLN A 42 -7.882 -24.649 -0.326 1.00 10.00 N ATOM 632 CA GLN A 42 -8.420 -24.245 0.970 1.00 10.00 C ATOM 633 C GLN A 42 -9.875 -23.752 0.899 1.00 10.00 C ATOM 634 O GLN A 42 -10.553 -23.739 1.930 1.00 10.00 O ATOM 635 CB GLN A 42 -7.468 -23.160 1.512 1.00 10.00 C ATOM 636 CG GLN A 42 -7.806 -22.604 2.900 1.00 10.00 C ATOM 637 CD GLN A 42 -7.847 -23.682 3.968 1.00 10.00 C ATOM 638 OE1 GLN A 42 -6.861 -23.926 4.649 1.00 10.00 O ATOM 639 NE2 GLN A 42 -8.977 -24.335 4.154 1.00 10.00 N ATOM 0 H GLN A 42 -8.036 -23.943 -1.046 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.466 -25.104 1.639 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -6.459 -23.572 1.543 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.452 -22.331 0.804 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -7.066 -21.853 3.176 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -8.772 -22.101 2.860 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -9.791 -24.120 3.578 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.037 -25.055 4.874 1.00 10.00 H new ATOM 648 N ALA A 43 -10.351 -23.375 -0.294 1.00 10.00 N ATOM 649 CA ALA A 43 -11.690 -22.849 -0.518 1.00 10.00 C ATOM 650 C ALA A 43 -12.795 -23.878 -0.186 1.00 10.00 C ATOM 651 O ALA A 43 -12.582 -25.084 -0.337 1.00 10.00 O ATOM 652 CB ALA A 43 -11.784 -22.405 -1.983 1.00 10.00 C ATOM 0 H ALA A 43 -9.796 -23.431 -1.148 1.00 10.00 H new ATOM 0 HA ALA A 43 -11.854 -22.006 0.153 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -12.779 -22.006 -2.179 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.039 -21.634 -2.178 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -11.601 -23.259 -2.635 1.00 10.00 H new ATOM 658 N PRO A 44 -13.996 -23.413 0.213 1.00 10.00 N ATOM 659 CA PRO A 44 -15.208 -24.228 0.299 1.00 10.00 C ATOM 660 C PRO A 44 -15.799 -24.486 -1.108 1.00 10.00 C ATOM 661 O PRO A 44 -15.096 -24.388 -2.113 1.00 10.00 O ATOM 662 CB PRO A 44 -16.127 -23.418 1.225 1.00 10.00 C ATOM 663 CG PRO A 44 -15.806 -21.990 0.802 1.00 10.00 C ATOM 664 CD PRO A 44 -14.299 -22.034 0.579 1.00 10.00 C ATOM 0 HA PRO A 44 -15.042 -25.229 0.697 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.178 -23.663 1.075 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -15.905 -23.593 2.278 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.341 -21.707 -0.105 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -16.080 -21.269 1.572 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -13.999 -21.344 -0.210 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.761 -21.740 1.480 1.00 10.00 H new ATOM 672 N GLY A 45 -17.088 -24.851 -1.183 1.00 10.00 N ATOM 673 CA GLY A 45 -17.843 -25.162 -2.404 1.00 10.00 C ATOM 674 C GLY A 45 -17.781 -24.093 -3.505 1.00 10.00 C ATOM 675 O GLY A 45 -18.672 -23.252 -3.613 1.00 10.00 O ATOM 0 H GLY A 45 -17.663 -24.942 -0.345 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -17.471 -26.102 -2.812 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -18.887 -25.322 -2.135 1.00 10.00 H new ATOM 679 N PHE A 46 -16.754 -24.178 -4.353 1.00 10.00 N ATOM 680 CA PHE A 46 -16.517 -23.362 -5.544 1.00 10.00 C ATOM 681 C PHE A 46 -15.874 -24.233 -6.649 1.00 10.00 C ATOM 682 O PHE A 46 -15.723 -25.447 -6.488 1.00 10.00 O ATOM 683 CB PHE A 46 -15.673 -22.136 -5.136 1.00 10.00 C ATOM 684 CG PHE A 46 -15.407 -21.104 -6.224 1.00 10.00 C ATOM 685 CD1 PHE A 46 -16.432 -20.707 -7.103 1.00 10.00 C ATOM 686 CD2 PHE A 46 -14.119 -20.565 -6.390 1.00 10.00 C ATOM 687 CE1 PHE A 46 -16.174 -19.823 -8.162 1.00 10.00 C ATOM 688 CE2 PHE A 46 -13.858 -19.683 -7.453 1.00 10.00 C ATOM 689 CZ PHE A 46 -14.879 -19.318 -8.340 1.00 10.00 C ATOM 0 H PHE A 46 -16.015 -24.867 -4.215 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.447 -22.983 -5.967 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.174 -21.637 -4.307 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.713 -22.492 -4.761 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -17.432 -21.088 -6.960 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -13.330 -20.829 -5.701 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -16.968 -19.534 -8.835 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -12.863 -19.284 -7.587 1.00 10.00 H new ATOM 0 HZ PHE A 46 -14.668 -18.648 -9.160 1.00 10.00 H new ATOM 699 N THR A 47 -15.563 -23.676 -7.824 1.00 10.00 N ATOM 700 CA THR A 47 -14.935 -24.398 -8.945 1.00 10.00 C ATOM 701 C THR A 47 -14.215 -23.407 -9.860 1.00 10.00 C ATOM 702 O THR A 47 -14.679 -22.284 -10.046 1.00 10.00 O ATOM 703 CB THR A 47 -15.995 -25.219 -9.706 1.00 10.00 C ATOM 704 OG1 THR A 47 -16.397 -26.290 -8.881 1.00 10.00 O ATOM 705 CG2 THR A 47 -15.503 -25.852 -11.010 1.00 10.00 C ATOM 0 H THR A 47 -15.742 -22.693 -8.030 1.00 10.00 H new ATOM 0 HA THR A 47 -14.192 -25.098 -8.562 1.00 10.00 H new ATOM 0 HB THR A 47 -16.790 -24.516 -9.955 1.00 10.00 H new ATOM 0 HG1 THR A 47 -15.875 -26.278 -8.052 1.00 10.00 H new ATOM 0 HG21 THR A 47 -16.317 -26.409 -11.474 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.165 -25.070 -11.689 1.00 10.00 H new ATOM 0 HG23 THR A 47 -14.676 -26.529 -10.796 1.00 10.00 H new ATOM 713 N TYR A 48 -13.060 -23.822 -10.393 1.00 10.00 N ATOM 714 CA TYR A 48 -12.069 -22.926 -10.993 1.00 10.00 C ATOM 715 C TYR A 48 -11.201 -23.624 -12.063 1.00 10.00 C ATOM 716 O TYR A 48 -11.520 -23.576 -13.248 1.00 10.00 O ATOM 717 CB TYR A 48 -11.254 -22.239 -9.866 1.00 10.00 C ATOM 718 CG TYR A 48 -11.131 -22.918 -8.492 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.866 -24.299 -8.338 1.00 10.00 C ATOM 720 CD2 TYR A 48 -11.286 -22.132 -7.330 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.728 -24.865 -7.056 1.00 10.00 C ATOM 722 CE2 TYR A 48 -11.103 -22.682 -6.048 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.803 -24.051 -5.908 1.00 10.00 C ATOM 724 OH TYR A 48 -10.581 -24.579 -4.675 1.00 10.00 O ATOM 0 H TYR A 48 -12.785 -24.804 -10.419 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.586 -22.145 -11.551 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.243 -22.083 -10.244 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.689 -21.253 -9.704 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.769 -24.925 -9.212 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.550 -21.089 -7.427 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.564 -25.927 -6.952 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -11.192 -22.056 -5.173 1.00 10.00 H new ATOM 0 HH TYR A 48 -9.931 -24.025 -4.194 1.00 10.00 H new ATOM 734 N THR A 49 -10.118 -24.284 -11.646 1.00 10.00 N ATOM 735 CA THR A 49 -9.152 -25.062 -12.441 1.00 10.00 C ATOM 736 C THR A 49 -8.677 -26.263 -11.605 1.00 10.00 C ATOM 737 O THR A 49 -9.002 -26.348 -10.420 1.00 10.00 O ATOM 738 CB THR A 49 -7.972 -24.148 -12.845 1.00 10.00 C ATOM 739 OG1 THR A 49 -6.970 -24.828 -13.568 1.00 10.00 O ATOM 740 CG2 THR A 49 -7.240 -23.548 -11.650 1.00 10.00 C ATOM 0 H THR A 49 -9.869 -24.291 -10.657 1.00 10.00 H new ATOM 0 HA THR A 49 -9.614 -25.438 -13.354 1.00 10.00 H new ATOM 0 HB THR A 49 -8.456 -23.379 -13.447 1.00 10.00 H new ATOM 0 HG1 THR A 49 -6.251 -24.203 -13.798 1.00 10.00 H new ATOM 0 HG21 THR A 49 -6.424 -22.917 -12.002 1.00 10.00 H new ATOM 0 HG22 THR A 49 -7.934 -22.948 -11.062 1.00 10.00 H new ATOM 0 HG23 THR A 49 -6.838 -24.349 -11.030 1.00 10.00 H new ATOM 748 N ASP A 50 -7.886 -27.184 -12.170 1.00 10.00 N ATOM 749 CA ASP A 50 -7.003 -28.011 -11.339 1.00 10.00 C ATOM 750 C ASP A 50 -5.761 -27.238 -10.856 1.00 10.00 C ATOM 751 O ASP A 50 -5.283 -27.452 -9.736 1.00 10.00 O ATOM 752 CB ASP A 50 -6.545 -29.287 -12.054 1.00 10.00 C ATOM 753 CG ASP A 50 -5.620 -30.051 -11.100 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.134 -30.464 -10.029 1.00 10.00 O ATOM 755 OD2 ASP A 50 -4.393 -30.049 -11.365 1.00 10.00 O ATOM 0 H ASP A 50 -7.839 -27.372 -13.171 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.607 -28.290 -10.476 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -7.403 -29.901 -12.328 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -6.022 -29.041 -12.978 1.00 10.00 H new ATOM 760 N ALA A 51 -5.227 -26.375 -11.726 1.00 10.00 N ATOM 761 CA ALA A 51 -3.868 -25.859 -11.663 1.00 10.00 C ATOM 762 C ALA A 51 -3.514 -25.289 -10.288 1.00 10.00 C ATOM 763 O ALA A 51 -2.612 -25.811 -9.630 1.00 10.00 O ATOM 764 CB ALA A 51 -3.660 -24.839 -12.785 1.00 10.00 C ATOM 0 H ALA A 51 -5.753 -26.007 -12.519 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.179 -26.691 -11.812 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.642 -24.451 -12.740 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.822 -25.321 -13.749 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.367 -24.018 -12.666 1.00 10.00 H new ATOM 770 N ASN A 52 -4.234 -24.245 -9.858 1.00 10.00 N ATOM 771 CA ASN A 52 -3.916 -23.474 -8.665 1.00 10.00 C ATOM 772 C ASN A 52 -3.720 -24.378 -7.431 1.00 10.00 C ATOM 773 O ASN A 52 -2.608 -24.455 -6.901 1.00 10.00 O ATOM 774 CB ASN A 52 -4.952 -22.346 -8.462 1.00 10.00 C ATOM 775 CG ASN A 52 -6.344 -22.807 -8.043 1.00 10.00 C ATOM 776 OD1 ASN A 52 -6.870 -23.787 -8.546 1.00 10.00 O ATOM 777 ND2 ASN A 52 -6.951 -22.181 -7.063 1.00 10.00 N ATOM 0 H ASN A 52 -5.067 -23.912 -10.343 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.952 -22.986 -8.807 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -4.572 -21.658 -7.706 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -5.038 -21.783 -9.391 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -7.855 -22.514 -6.727 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -6.519 -21.361 -6.637 1.00 10.00 H new ATOM 784 N LYS A 53 -4.772 -25.114 -7.033 1.00 10.00 N ATOM 785 CA LYS A 53 -4.784 -25.966 -5.837 1.00 10.00 C ATOM 786 C LYS A 53 -3.689 -27.030 -5.886 1.00 10.00 C ATOM 787 O LYS A 53 -2.918 -27.168 -4.945 1.00 10.00 O ATOM 788 CB LYS A 53 -6.142 -26.649 -5.540 1.00 10.00 C ATOM 789 CG LYS A 53 -7.423 -26.089 -6.173 1.00 10.00 C ATOM 790 CD LYS A 53 -7.680 -26.572 -7.610 1.00 10.00 C ATOM 791 CE LYS A 53 -8.023 -28.061 -7.807 1.00 10.00 C ATOM 792 NZ LYS A 53 -6.811 -28.897 -7.993 1.00 10.00 N ATOM 0 H LYS A 53 -5.654 -25.132 -7.545 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.594 -25.270 -5.020 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.056 -27.692 -5.844 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.282 -26.642 -4.459 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.274 -26.367 -5.551 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.369 -25.000 -6.172 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.497 -25.981 -8.023 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.794 -26.349 -8.204 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -8.581 -28.421 -6.942 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.674 -28.170 -8.674 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -7.014 -29.656 -8.675 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -6.034 -28.307 -8.353 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -6.535 -29.315 -7.082 1.00 10.00 H new ATOM 806 N ASN A 54 -3.687 -27.843 -6.952 1.00 10.00 N ATOM 807 CA ASN A 54 -2.817 -29.013 -7.049 1.00 10.00 C ATOM 808 C ASN A 54 -1.340 -28.616 -7.137 1.00 10.00 C ATOM 809 O ASN A 54 -0.521 -29.281 -6.504 1.00 10.00 O ATOM 810 CB ASN A 54 -3.272 -29.905 -8.220 1.00 10.00 C ATOM 811 CG ASN A 54 -2.511 -31.222 -8.423 1.00 10.00 C ATOM 812 OD1 ASN A 54 -2.734 -31.940 -9.382 1.00 10.00 O ATOM 813 ND2 ASN A 54 -1.530 -31.578 -7.623 1.00 10.00 N ATOM 0 H ASN A 54 -4.287 -27.705 -7.765 1.00 10.00 H new ATOM 0 HA ASN A 54 -2.906 -29.599 -6.134 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.327 -30.141 -8.078 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -3.196 -29.324 -9.139 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -0.994 -32.423 -7.819 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -1.305 -31.009 -6.807 1.00 10.00 H new ATOM 820 N LYS A 55 -0.988 -27.608 -7.951 1.00 10.00 N ATOM 821 CA LYS A 55 0.414 -27.211 -8.115 1.00 10.00 C ATOM 822 C LYS A 55 0.926 -26.419 -6.902 1.00 10.00 C ATOM 823 O LYS A 55 2.008 -26.736 -6.418 1.00 10.00 O ATOM 824 CB LYS A 55 0.632 -26.461 -9.442 1.00 10.00 C ATOM 825 CG LYS A 55 0.738 -27.359 -10.698 1.00 10.00 C ATOM 826 CD LYS A 55 -0.522 -28.106 -11.193 1.00 10.00 C ATOM 827 CE LYS A 55 -0.675 -29.532 -10.640 1.00 10.00 C ATOM 828 NZ LYS A 55 -1.756 -30.308 -11.315 1.00 10.00 N ATOM 0 H LYS A 55 -1.650 -27.059 -8.500 1.00 10.00 H new ATOM 0 HA LYS A 55 1.012 -28.121 -8.164 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.191 -25.761 -9.584 1.00 10.00 H new ATOM 0 HB3 LYS A 55 1.544 -25.869 -9.361 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.095 -26.737 -11.518 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.509 -28.105 -10.505 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -1.404 -27.527 -10.919 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -0.497 -28.153 -12.282 1.00 10.00 H new ATOM 0 HE2 LYS A 55 0.270 -30.063 -10.753 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -0.885 -29.481 -9.572 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -1.938 -31.184 -10.784 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -2.624 -29.737 -11.349 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -1.460 -30.545 -12.283 1.00 10.00 H new ATOM 842 N GLY A 56 0.156 -25.443 -6.391 1.00 10.00 N ATOM 843 CA GLY A 56 0.553 -24.571 -5.279 1.00 10.00 C ATOM 844 C GLY A 56 1.872 -23.794 -5.446 1.00 10.00 C ATOM 845 O GLY A 56 2.538 -23.859 -6.474 1.00 10.00 O ATOM 0 H GLY A 56 -0.777 -25.237 -6.748 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.247 -23.851 -5.109 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.629 -25.181 -4.379 1.00 10.00 H new ATOM 849 N ILE A 57 2.207 -23.021 -4.401 1.00 10.00 N ATOM 850 CA ILE A 57 3.349 -22.082 -4.280 1.00 10.00 C ATOM 851 C ILE A 57 3.538 -21.511 -2.850 1.00 10.00 C ATOM 852 O ILE A 57 4.540 -20.842 -2.607 1.00 10.00 O ATOM 853 CB ILE A 57 3.219 -20.863 -5.252 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.779 -20.422 -5.597 1.00 10.00 C ATOM 855 CG2 ILE A 57 4.019 -21.056 -6.551 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.952 -20.004 -4.380 1.00 10.00 C ATOM 0 H ILE A 57 1.647 -23.032 -3.549 1.00 10.00 H new ATOM 0 HA ILE A 57 4.215 -22.691 -4.539 1.00 10.00 H new ATOM 0 HB ILE A 57 3.650 -20.051 -4.666 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.823 -19.589 -6.298 1.00 10.00 H new ATOM 0 HG13 ILE A 57 1.271 -21.241 -6.106 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.894 -20.181 -7.189 1.00 10.00 H new ATOM 0 HG22 ILE A 57 5.075 -21.183 -6.313 1.00 10.00 H new ATOM 0 HG23 ILE A 57 3.656 -21.941 -7.074 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.046 -19.708 -4.703 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.876 -20.842 -3.687 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.436 -19.164 -3.882 1.00 10.00 H new ATOM 868 N THR A 58 2.629 -21.784 -1.895 1.00 10.00 N ATOM 869 CA THR A 58 2.397 -21.023 -0.647 1.00 10.00 C ATOM 870 C THR A 58 2.096 -19.537 -0.896 1.00 10.00 C ATOM 871 O THR A 58 2.921 -18.775 -1.400 1.00 10.00 O ATOM 872 CB THR A 58 3.541 -21.212 0.365 1.00 10.00 C ATOM 873 OG1 THR A 58 3.637 -22.583 0.681 1.00 10.00 O ATOM 874 CG2 THR A 58 3.294 -20.475 1.685 1.00 10.00 C ATOM 0 H THR A 58 2.001 -22.584 -1.975 1.00 10.00 H new ATOM 0 HA THR A 58 1.496 -21.445 -0.202 1.00 10.00 H new ATOM 0 HB THR A 58 4.444 -20.814 -0.097 1.00 10.00 H new ATOM 0 HG1 THR A 58 4.363 -22.720 1.324 1.00 10.00 H new ATOM 0 HG21 THR A 58 4.134 -20.645 2.359 1.00 10.00 H new ATOM 0 HG22 THR A 58 3.194 -19.407 1.492 1.00 10.00 H new ATOM 0 HG23 THR A 58 2.379 -20.848 2.144 1.00 10.00 H new ATOM 882 N TRP A 59 0.883 -19.107 -0.536 1.00 10.00 N ATOM 883 CA TRP A 59 0.475 -17.705 -0.611 1.00 10.00 C ATOM 884 C TRP A 59 1.139 -16.863 0.485 1.00 10.00 C ATOM 885 O TRP A 59 1.075 -17.207 1.666 1.00 10.00 O ATOM 886 CB TRP A 59 -1.050 -17.614 -0.579 1.00 10.00 C ATOM 887 CG TRP A 59 -1.720 -18.118 -1.825 1.00 10.00 C ATOM 888 CD1 TRP A 59 -2.706 -19.041 -1.874 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.459 -17.741 -3.216 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.111 -19.211 -3.180 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.340 -18.486 -4.058 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.551 -16.869 -3.857 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.313 -18.393 -5.461 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.483 -16.800 -5.259 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.358 -17.556 -6.059 1.00 10.00 C ATOM 0 H TRP A 59 0.154 -19.727 -0.183 1.00 10.00 H new ATOM 0 HA TRP A 59 0.818 -17.284 -1.556 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.419 -18.182 0.275 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.338 -16.575 -0.419 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.113 -19.564 -1.022 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -3.891 -19.805 -3.462 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.100 -16.247 -3.261 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.012 -18.953 -6.065 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.249 -16.159 -5.727 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.295 -17.493 -7.135 1.00 10.00 H new ATOM 906 N LYS A 60 1.801 -15.777 0.071 1.00 10.00 N ATOM 907 CA LYS A 60 2.619 -14.871 0.885 1.00 10.00 C ATOM 908 C LYS A 60 2.896 -13.571 0.115 1.00 10.00 C ATOM 909 O LYS A 60 2.523 -13.453 -1.054 1.00 10.00 O ATOM 910 CB LYS A 60 3.927 -15.569 1.324 1.00 10.00 C ATOM 911 CG LYS A 60 4.829 -16.085 0.194 1.00 10.00 C ATOM 912 CD LYS A 60 6.193 -16.513 0.753 1.00 10.00 C ATOM 913 CE LYS A 60 7.076 -17.029 -0.386 1.00 10.00 C ATOM 914 NZ LYS A 60 8.509 -16.989 -0.022 1.00 10.00 N ATOM 0 H LYS A 60 1.778 -15.488 -0.907 1.00 10.00 H new ATOM 0 HA LYS A 60 2.070 -14.610 1.790 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.503 -14.869 1.930 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.668 -16.410 1.967 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.352 -16.929 -0.304 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.964 -15.306 -0.557 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.676 -15.670 1.247 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.061 -17.291 1.505 1.00 10.00 H new ATOM 0 HE2 LYS A 60 6.791 -18.051 -0.634 1.00 10.00 H new ATOM 0 HE3 LYS A 60 6.909 -16.426 -1.279 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 9.086 -16.944 -0.886 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 8.695 -16.149 0.563 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 8.755 -17.846 0.514 1.00 10.00 H new ATOM 928 N GLU A 61 3.564 -12.612 0.764 1.00 10.00 N ATOM 929 CA GLU A 61 3.868 -11.274 0.226 1.00 10.00 C ATOM 930 C GLU A 61 4.656 -11.286 -1.084 1.00 10.00 C ATOM 931 O GLU A 61 4.448 -10.400 -1.901 1.00 10.00 O ATOM 932 CB GLU A 61 4.578 -10.421 1.292 1.00 10.00 C ATOM 933 CG GLU A 61 3.715 -10.264 2.555 1.00 10.00 C ATOM 934 CD GLU A 61 4.243 -9.198 3.515 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.336 -8.024 3.096 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.479 -9.561 4.691 1.00 10.00 O ATOM 0 H GLU A 61 3.922 -12.746 1.710 1.00 10.00 H new ATOM 0 HA GLU A 61 2.908 -10.824 -0.024 1.00 10.00 H new ATOM 0 HB2 GLU A 61 5.529 -10.884 1.555 1.00 10.00 H new ATOM 0 HB3 GLU A 61 4.805 -9.437 0.881 1.00 10.00 H new ATOM 0 HG2 GLU A 61 2.697 -10.008 2.262 1.00 10.00 H new ATOM 0 HG3 GLU A 61 3.666 -11.221 3.075 1.00 10.00 H new ATOM 943 N GLU A 62 5.495 -12.293 -1.321 1.00 10.00 N ATOM 944 CA GLU A 62 6.118 -12.546 -2.620 1.00 10.00 C ATOM 945 C GLU A 62 5.082 -13.084 -3.627 1.00 10.00 C ATOM 946 O GLU A 62 4.677 -12.383 -4.555 1.00 10.00 O ATOM 947 CB GLU A 62 7.266 -13.556 -2.435 1.00 10.00 C ATOM 948 CG GLU A 62 8.446 -13.057 -1.584 1.00 10.00 C ATOM 949 CD GLU A 62 9.130 -14.256 -0.918 1.00 10.00 C ATOM 950 OE1 GLU A 62 9.624 -15.166 -1.625 1.00 10.00 O ATOM 951 OE2 GLU A 62 8.982 -14.406 0.318 1.00 10.00 O ATOM 0 H GLU A 62 5.766 -12.967 -0.605 1.00 10.00 H new ATOM 0 HA GLU A 62 6.514 -11.612 -3.019 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.864 -14.459 -1.976 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.642 -13.839 -3.418 1.00 10.00 H new ATOM 0 HG2 GLU A 62 9.158 -12.518 -2.209 1.00 10.00 H new ATOM 0 HG3 GLU A 62 8.093 -12.357 -0.826 1.00 10.00 H new ATOM 958 N THR A 63 4.644 -14.336 -3.441 1.00 10.00 N ATOM 959 CA THR A 63 3.909 -15.144 -4.420 1.00 10.00 C ATOM 960 C THR A 63 2.603 -14.507 -4.846 1.00 10.00 C ATOM 961 O THR A 63 2.284 -14.567 -6.026 1.00 10.00 O ATOM 962 CB THR A 63 3.663 -16.568 -3.885 1.00 10.00 C ATOM 963 OG1 THR A 63 2.967 -16.528 -2.658 1.00 10.00 O ATOM 964 CG2 THR A 63 4.972 -17.318 -3.633 1.00 10.00 C ATOM 0 H THR A 63 4.800 -14.834 -2.565 1.00 10.00 H new ATOM 0 HA THR A 63 4.539 -15.201 -5.307 1.00 10.00 H new ATOM 0 HB THR A 63 3.081 -17.083 -4.650 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.726 -17.439 -2.389 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.752 -18.317 -3.257 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.532 -17.396 -4.565 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.566 -16.776 -2.897 1.00 10.00 H new ATOM 972 N LEU A 64 1.865 -13.862 -3.940 1.00 10.00 N ATOM 973 CA LEU A 64 0.617 -13.194 -4.251 1.00 10.00 C ATOM 974 C LEU A 64 0.812 -11.871 -4.983 1.00 10.00 C ATOM 975 O LEU A 64 -0.042 -11.499 -5.780 1.00 10.00 O ATOM 976 CB LEU A 64 -0.130 -12.985 -2.928 1.00 10.00 C ATOM 977 CG LEU A 64 -1.656 -13.014 -3.063 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.267 -13.641 -1.807 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.260 -11.611 -3.227 1.00 10.00 C ATOM 0 H LEU A 64 2.129 -13.793 -2.957 1.00 10.00 H new ATOM 0 HA LEU A 64 0.041 -13.817 -4.936 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.177 -13.758 -2.223 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.169 -12.028 -2.501 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.883 -13.596 -3.956 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.353 -13.662 -1.902 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.893 -14.658 -1.689 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.991 -13.050 -0.934 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.343 -11.690 -3.318 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -2.012 -11.004 -2.356 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.853 -11.142 -4.123 1.00 10.00 H new ATOM 991 N MET A 65 1.930 -11.180 -4.750 1.00 10.00 N ATOM 992 CA MET A 65 2.314 -10.001 -5.520 1.00 10.00 C ATOM 993 C MET A 65 2.699 -10.425 -6.937 1.00 10.00 C ATOM 994 O MET A 65 2.167 -9.890 -7.905 1.00 10.00 O ATOM 995 CB MET A 65 3.467 -9.289 -4.795 1.00 10.00 C ATOM 996 CG MET A 65 3.571 -7.811 -5.153 1.00 10.00 C ATOM 997 SD MET A 65 5.133 -6.982 -4.735 1.00 10.00 S ATOM 998 CE MET A 65 5.430 -7.573 -3.045 1.00 10.00 C ATOM 0 H MET A 65 2.596 -11.426 -4.018 1.00 10.00 H new ATOM 0 HA MET A 65 1.482 -9.301 -5.601 1.00 10.00 H new ATOM 0 HB2 MET A 65 3.328 -9.388 -3.718 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.406 -9.784 -5.042 1.00 10.00 H new ATOM 0 HG2 MET A 65 3.407 -7.708 -6.226 1.00 10.00 H new ATOM 0 HG3 MET A 65 2.760 -7.281 -4.654 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.024 -6.838 -2.502 1.00 10.00 H new ATOM 0 HE2 MET A 65 4.476 -7.716 -2.537 1.00 10.00 H new ATOM 0 HE3 MET A 65 5.968 -8.520 -3.080 1.00 10.00 H new ATOM 1008 N GLU A 66 3.552 -11.448 -7.038 1.00 10.00 N ATOM 1009 CA GLU A 66 4.003 -12.052 -8.293 1.00 10.00 C ATOM 1010 C GLU A 66 2.806 -12.548 -9.112 1.00 10.00 C ATOM 1011 O GLU A 66 2.690 -12.267 -10.304 1.00 10.00 O ATOM 1012 CB GLU A 66 4.968 -13.201 -7.939 1.00 10.00 C ATOM 1013 CG GLU A 66 6.178 -13.298 -8.876 1.00 10.00 C ATOM 1014 CD GLU A 66 7.278 -14.227 -8.327 1.00 10.00 C ATOM 1015 OE1 GLU A 66 6.970 -15.093 -7.465 1.00 10.00 O ATOM 1016 OE2 GLU A 66 8.423 -14.093 -8.805 1.00 10.00 O ATOM 0 H GLU A 66 3.962 -11.894 -6.217 1.00 10.00 H new ATOM 0 HA GLU A 66 4.521 -11.318 -8.911 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.321 -13.066 -6.917 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.422 -14.144 -7.966 1.00 10.00 H new ATOM 0 HG2 GLU A 66 5.851 -13.664 -9.849 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.593 -12.302 -9.032 1.00 10.00 H new ATOM 1023 N TYR A 67 1.876 -13.222 -8.429 1.00 10.00 N ATOM 1024 CA TYR A 67 0.592 -13.650 -8.948 1.00 10.00 C ATOM 1025 C TYR A 67 -0.293 -12.481 -9.390 1.00 10.00 C ATOM 1026 O TYR A 67 -0.643 -12.437 -10.562 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.074 -14.528 -7.902 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.483 -14.937 -8.233 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.709 -15.861 -9.264 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.561 -14.383 -7.524 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.020 -16.234 -9.590 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -3.878 -14.719 -7.877 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.110 -15.657 -8.904 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.380 -15.982 -9.253 1.00 10.00 O ATOM 0 H TYR A 67 2.013 -13.492 -7.455 1.00 10.00 H new ATOM 0 HA TYR A 67 0.749 -14.228 -9.859 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.528 -15.426 -7.764 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.078 -13.997 -6.950 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -0.875 -16.284 -9.805 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.377 -13.699 -6.708 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.196 -16.963 -10.367 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.710 -14.261 -7.364 1.00 10.00 H new ATOM 0 HH TYR A 67 -5.847 -15.182 -9.572 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.666 -11.533 -8.516 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.519 -10.404 -8.935 1.00 10.00 C ATOM 1046 C LEU A 68 -0.943 -9.581 -10.101 1.00 10.00 C ATOM 1047 O LEU A 68 -1.733 -9.084 -10.904 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.842 -9.492 -7.739 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.242 -9.697 -7.128 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.310 -9.083 -8.033 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.584 -11.152 -6.818 1.00 10.00 C ATOM 0 H LEU A 68 -0.398 -11.522 -7.532 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.438 -10.853 -9.311 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.095 -9.657 -6.963 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.748 -8.453 -8.057 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.224 -9.184 -6.166 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.294 -9.235 -7.589 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -4.123 -8.015 -8.144 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.276 -9.561 -9.012 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.585 -11.207 -6.391 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.548 -11.738 -7.736 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -2.863 -11.551 -6.105 1.00 10.00 H new ATOM 1063 N GLU A 69 0.385 -9.448 -10.223 1.00 10.00 N ATOM 1064 CA GLU A 69 1.005 -8.774 -11.363 1.00 10.00 C ATOM 1065 C GLU A 69 0.907 -9.538 -12.703 1.00 10.00 C ATOM 1066 O GLU A 69 0.925 -8.887 -13.746 1.00 10.00 O ATOM 1067 CB GLU A 69 2.467 -8.476 -11.019 1.00 10.00 C ATOM 1068 CG GLU A 69 2.678 -7.358 -9.978 1.00 10.00 C ATOM 1069 CD GLU A 69 1.957 -6.033 -10.275 1.00 10.00 C ATOM 1070 OE1 GLU A 69 0.779 -5.911 -9.857 1.00 10.00 O ATOM 1071 OE2 GLU A 69 2.600 -5.129 -10.849 1.00 10.00 O ATOM 0 H GLU A 69 1.052 -9.803 -9.538 1.00 10.00 H new ATOM 0 HA GLU A 69 0.441 -7.856 -11.529 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.930 -9.390 -10.647 1.00 10.00 H new ATOM 0 HB3 GLU A 69 2.991 -8.203 -11.935 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.345 -7.723 -9.006 1.00 10.00 H new ATOM 0 HG3 GLU A 69 3.747 -7.159 -9.895 1.00 10.00 H new ATOM 1078 N ASN A 70 0.758 -10.874 -12.700 1.00 10.00 N ATOM 1079 CA ASN A 70 0.281 -11.657 -13.857 1.00 10.00 C ATOM 1080 C ASN A 70 -0.183 -13.084 -13.461 1.00 10.00 C ATOM 1081 O ASN A 70 0.611 -14.033 -13.482 1.00 10.00 O ATOM 1082 CB ASN A 70 1.332 -11.740 -14.983 1.00 10.00 C ATOM 1083 CG ASN A 70 0.701 -12.231 -16.285 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.112 -13.151 -16.327 1.00 10.00 O ATOM 1085 ND2 ASN A 70 1.054 -11.625 -17.399 1.00 10.00 N ATOM 0 H ASN A 70 0.968 -11.449 -11.884 1.00 10.00 H new ATOM 0 HA ASN A 70 -0.585 -11.114 -14.236 1.00 10.00 H new ATOM 0 HB2 ASN A 70 1.781 -10.759 -15.139 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.135 -12.415 -14.687 1.00 10.00 H new ATOM 0 HD21 ASN A 70 0.653 -11.920 -18.289 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.728 -10.860 -17.372 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.478 -13.284 -13.152 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.956 -14.525 -12.549 1.00 10.00 C ATOM 1094 C PRO A 71 -2.000 -15.684 -13.548 1.00 10.00 C ATOM 1095 O PRO A 71 -1.626 -16.807 -13.206 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.329 -14.168 -11.976 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.826 -13.025 -12.855 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.532 -12.286 -13.184 1.00 10.00 C ATOM 0 HA PRO A 71 -1.284 -14.891 -11.773 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -4.008 -15.020 -12.012 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.256 -13.863 -10.932 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -4.326 -13.389 -13.752 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.537 -12.387 -12.330 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.592 -11.814 -14.165 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -2.341 -11.494 -12.460 1.00 10.00 H new ATOM 1106 N LYS A 72 -2.387 -15.384 -14.797 1.00 10.00 N ATOM 1107 CA LYS A 72 -2.424 -16.311 -15.930 1.00 10.00 C ATOM 1108 C LYS A 72 -1.053 -16.915 -16.235 1.00 10.00 C ATOM 1109 O LYS A 72 -0.968 -18.113 -16.495 1.00 10.00 O ATOM 1110 CB LYS A 72 -3.005 -15.607 -17.172 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.481 -15.967 -17.403 1.00 10.00 C ATOM 1112 CD LYS A 72 -5.032 -15.384 -18.714 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.537 -13.943 -18.563 1.00 10.00 C ATOM 1114 NZ LYS A 72 -6.897 -13.904 -17.976 1.00 10.00 N ATOM 0 H LYS A 72 -2.696 -14.446 -15.052 1.00 10.00 H new ATOM 0 HA LYS A 72 -3.075 -17.141 -15.653 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.910 -14.528 -17.054 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.423 -15.884 -18.051 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.589 -17.052 -17.418 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -5.076 -15.599 -16.567 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.251 -15.412 -19.474 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.847 -16.013 -19.071 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -4.850 -13.380 -17.931 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -5.546 -13.455 -19.538 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -7.089 -12.951 -17.607 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -7.598 -14.140 -18.707 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.960 -14.594 -17.201 1.00 10.00 H new ATOM 1128 N LYS A 73 0.010 -16.097 -16.213 1.00 10.00 N ATOM 1129 CA LYS A 73 1.385 -16.577 -16.389 1.00 10.00 C ATOM 1130 C LYS A 73 1.896 -17.287 -15.130 1.00 10.00 C ATOM 1131 O LYS A 73 2.583 -18.297 -15.254 1.00 10.00 O ATOM 1132 CB LYS A 73 2.297 -15.404 -16.804 1.00 10.00 C ATOM 1133 CG LYS A 73 3.430 -15.765 -17.776 1.00 10.00 C ATOM 1134 CD LYS A 73 4.431 -16.795 -17.238 1.00 10.00 C ATOM 1135 CE LYS A 73 5.686 -16.808 -18.111 1.00 10.00 C ATOM 1136 NZ LYS A 73 6.642 -17.847 -17.660 1.00 10.00 N ATOM 0 H LYS A 73 -0.061 -15.089 -16.073 1.00 10.00 H new ATOM 0 HA LYS A 73 1.400 -17.319 -17.188 1.00 10.00 H new ATOM 0 HB2 LYS A 73 1.680 -14.631 -17.262 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.736 -14.971 -15.905 1.00 10.00 H new ATOM 0 HG2 LYS A 73 2.992 -16.151 -18.697 1.00 10.00 H new ATOM 0 HG3 LYS A 73 3.970 -14.855 -18.037 1.00 10.00 H new ATOM 0 HD2 LYS A 73 4.696 -16.554 -16.209 1.00 10.00 H new ATOM 0 HD3 LYS A 73 3.976 -17.785 -17.226 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.408 -16.992 -19.149 1.00 10.00 H new ATOM 0 HE3 LYS A 73 6.166 -15.830 -18.078 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 7.484 -17.833 -18.271 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 6.924 -17.656 -16.677 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 6.190 -18.782 -17.715 1.00 10.00 H new ATOM 1150 N TYR A 74 1.603 -16.763 -13.931 1.00 10.00 N ATOM 1151 CA TYR A 74 2.231 -17.253 -12.704 1.00 10.00 C ATOM 1152 C TYR A 74 1.808 -18.670 -12.284 1.00 10.00 C ATOM 1153 O TYR A 74 2.660 -19.424 -11.817 1.00 10.00 O ATOM 1154 CB TYR A 74 2.007 -16.254 -11.568 1.00 10.00 C ATOM 1155 CG TYR A 74 2.919 -16.504 -10.385 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.304 -16.320 -10.544 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.404 -16.927 -9.144 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.170 -16.537 -9.462 1.00 10.00 C ATOM 1159 CE2 TYR A 74 3.265 -17.109 -8.045 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.650 -16.894 -8.201 1.00 10.00 C ATOM 1161 OH TYR A 74 5.480 -16.944 -7.127 1.00 10.00 O ATOM 0 H TYR A 74 0.937 -16.003 -13.789 1.00 10.00 H new ATOM 0 HA TYR A 74 3.295 -17.336 -12.926 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.170 -15.243 -11.941 1.00 10.00 H new ATOM 0 HB3 TYR A 74 0.969 -16.309 -11.240 1.00 10.00 H new ATOM 0 HD1 TYR A 74 4.701 -16.011 -11.500 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.346 -17.112 -9.035 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.236 -16.430 -9.595 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.867 -17.412 -7.088 1.00 10.00 H new ATOM 0 HH TYR A 74 6.354 -16.574 -7.371 1.00 10.00 H new ATOM 1171 N ILE A 75 0.538 -19.058 -12.478 1.00 10.00 N ATOM 1172 CA ILE A 75 0.075 -20.440 -12.253 1.00 10.00 C ATOM 1173 C ILE A 75 -0.744 -20.953 -13.457 1.00 10.00 C ATOM 1174 O ILE A 75 -1.652 -20.266 -13.931 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.622 -20.638 -10.883 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.442 -19.419 -10.410 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.438 -21.011 -9.826 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.323 -19.729 -9.192 1.00 10.00 C ATOM 0 H ILE A 75 -0.197 -18.426 -12.795 1.00 10.00 H new ATOM 0 HA ILE A 75 0.960 -21.073 -12.189 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.344 -21.444 -11.011 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.762 -18.604 -10.162 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.072 -19.071 -11.229 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -0.046 -21.152 -8.859 1.00 10.00 H new ATOM 0 HG22 ILE A 75 0.936 -21.935 -10.120 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.174 -20.210 -9.750 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.876 -18.834 -8.905 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -3.025 -20.524 -9.444 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.695 -20.049 -8.361 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.388 -22.135 -14.010 1.00 10.00 N ATOM 1191 CA PRO A 76 -0.642 -22.493 -15.408 1.00 10.00 C ATOM 1192 C PRO A 76 -2.121 -22.778 -15.703 1.00 10.00 C ATOM 1193 O PRO A 76 -2.597 -23.899 -15.543 1.00 10.00 O ATOM 1194 CB PRO A 76 0.265 -23.699 -15.696 1.00 10.00 C ATOM 1195 CG PRO A 76 0.411 -24.362 -14.329 1.00 10.00 C ATOM 1196 CD PRO A 76 0.456 -23.155 -13.395 1.00 10.00 C ATOM 0 HA PRO A 76 -0.412 -21.657 -16.069 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.183 -24.374 -16.425 1.00 10.00 H new ATOM 0 HB3 PRO A 76 1.230 -23.390 -16.098 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.427 -25.021 -14.104 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.317 -24.964 -14.262 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.090 -23.417 -12.402 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.477 -22.794 -13.273 1.00 10.00 H new ATOM 1204 N GLY A 77 -2.842 -21.749 -16.157 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.249 -21.831 -16.553 1.00 10.00 C ATOM 1206 C GLY A 77 -5.211 -21.094 -15.617 1.00 10.00 C ATOM 1207 O GLY A 77 -6.412 -21.089 -15.881 1.00 10.00 O ATOM 0 H GLY A 77 -2.452 -20.812 -16.262 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -4.356 -21.424 -17.558 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.540 -22.880 -16.601 1.00 10.00 H new ATOM 1211 N THR A 78 -4.709 -20.457 -14.551 1.00 10.00 N ATOM 1212 CA THR A 78 -5.508 -19.592 -13.675 1.00 10.00 C ATOM 1213 C THR A 78 -6.108 -18.422 -14.452 1.00 10.00 C ATOM 1214 O THR A 78 -5.393 -17.495 -14.825 1.00 10.00 O ATOM 1215 CB THR A 78 -4.663 -19.102 -12.491 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.477 -20.186 -11.614 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.353 -17.996 -11.692 1.00 10.00 C ATOM 0 H THR A 78 -3.731 -20.528 -14.271 1.00 10.00 H new ATOM 0 HA THR A 78 -6.338 -20.178 -13.280 1.00 10.00 H new ATOM 0 HB THR A 78 -3.729 -18.709 -12.893 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.253 -20.264 -11.021 1.00 10.00 H new ATOM 0 HG21 THR A 78 -4.710 -17.688 -10.867 1.00 10.00 H new ATOM 0 HG22 THR A 78 -5.543 -17.142 -12.342 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.298 -18.368 -11.296 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.424 -18.473 -14.702 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.128 -17.530 -15.574 1.00 10.00 C ATOM 1227 C LYS A 79 -8.098 -16.103 -15.024 1.00 10.00 C ATOM 1228 O LYS A 79 -7.639 -15.215 -15.738 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.565 -18.012 -15.839 1.00 10.00 C ATOM 1230 CG LYS A 79 -9.566 -19.264 -16.735 1.00 10.00 C ATOM 1231 CD LYS A 79 -10.977 -19.736 -17.122 1.00 10.00 C ATOM 1232 CE LYS A 79 -11.794 -18.732 -17.953 1.00 10.00 C ATOM 1233 NZ LYS A 79 -11.136 -18.386 -19.235 1.00 10.00 N ATOM 0 H LYS A 79 -8.036 -19.182 -14.297 1.00 10.00 H new ATOM 0 HA LYS A 79 -7.600 -17.501 -16.527 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -10.058 -18.236 -14.893 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.138 -17.217 -16.317 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -9.000 -19.053 -17.642 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -9.049 -20.073 -16.218 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -10.891 -20.665 -17.685 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -11.530 -19.965 -16.211 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -12.780 -19.151 -18.156 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -11.947 -17.824 -17.371 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -11.743 -17.733 -19.771 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -10.221 -17.930 -19.044 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -10.982 -19.251 -19.791 1.00 10.00 H new ATOM 1247 N MET A 80 -8.585 -15.900 -13.791 1.00 10.00 N ATOM 1248 CA MET A 80 -8.670 -14.628 -13.051 1.00 10.00 C ATOM 1249 C MET A 80 -8.725 -13.373 -13.955 1.00 10.00 C ATOM 1250 O MET A 80 -7.715 -12.727 -14.259 1.00 10.00 O ATOM 1251 CB MET A 80 -7.565 -14.587 -11.980 1.00 10.00 C ATOM 1252 CG MET A 80 -7.501 -13.216 -11.296 1.00 10.00 C ATOM 1253 SD MET A 80 -6.678 -13.186 -9.695 1.00 10.00 S ATOM 1254 CE MET A 80 -6.291 -11.427 -9.623 1.00 10.00 C ATOM 0 H MET A 80 -8.957 -16.676 -13.243 1.00 10.00 H new ATOM 0 HA MET A 80 -9.634 -14.595 -12.543 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.750 -15.360 -11.234 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.602 -14.812 -12.439 1.00 10.00 H new ATOM 0 HG2 MET A 80 -6.989 -12.521 -11.961 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.518 -12.845 -11.169 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.106 -11.137 -8.589 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.402 -11.225 -10.221 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.130 -10.853 -10.016 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.939 -13.043 -14.413 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.208 -11.987 -15.397 1.00 10.00 C ATOM 1266 C ILE A 81 -10.046 -10.590 -14.761 1.00 10.00 C ATOM 1267 O ILE A 81 -11.019 -9.907 -14.450 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.580 -12.193 -16.095 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.744 -13.649 -16.607 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.711 -11.208 -17.276 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -13.098 -13.949 -17.262 1.00 10.00 C ATOM 0 H ILE A 81 -10.786 -13.517 -14.100 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.463 -12.054 -16.189 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.365 -12.003 -15.363 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -10.953 -13.858 -17.327 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -11.601 -14.332 -15.770 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.674 -11.353 -17.766 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.642 -10.185 -16.906 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.909 -11.389 -17.992 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -13.122 -14.989 -17.589 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -13.897 -13.777 -16.541 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.239 -13.295 -18.123 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.786 -10.176 -14.597 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.362 -8.827 -14.200 1.00 10.00 C ATOM 1285 C PHE A 82 -6.875 -8.589 -14.503 1.00 10.00 C ATOM 1286 O PHE A 82 -6.528 -7.573 -15.095 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.630 -8.604 -12.703 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.373 -7.196 -12.193 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -8.776 -6.068 -12.940 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.754 -7.017 -10.943 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.549 -4.772 -12.446 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.581 -5.717 -10.429 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.977 -4.596 -11.177 1.00 10.00 C ATOM 0 H PHE A 82 -7.994 -10.802 -14.744 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.944 -8.114 -14.784 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.668 -8.862 -12.496 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -8.009 -9.296 -12.134 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -9.261 -6.202 -13.896 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.413 -7.873 -10.379 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -8.815 -3.912 -13.043 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -7.141 -5.581 -9.452 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.842 -3.602 -10.777 1.00 10.00 H new ATOM 1303 N ALA A 83 -6.024 -9.562 -14.160 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.590 -9.699 -14.450 1.00 10.00 C ATOM 1305 C ALA A 83 -3.620 -8.503 -14.243 1.00 10.00 C ATOM 1306 O ALA A 83 -2.426 -8.686 -14.462 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.459 -10.322 -15.849 1.00 10.00 C ATOM 0 H ALA A 83 -6.357 -10.357 -13.615 1.00 10.00 H new ATOM 0 HA ALA A 83 -4.220 -10.334 -13.645 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.404 -10.439 -16.098 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.944 -11.298 -15.860 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.935 -9.672 -16.583 1.00 10.00 H new ATOM 1313 N GLY A 84 -4.075 -7.333 -13.778 1.00 10.00 N ATOM 1314 CA GLY A 84 -3.241 -6.212 -13.327 1.00 10.00 C ATOM 1315 C GLY A 84 -4.069 -5.186 -12.541 1.00 10.00 C ATOM 1316 O GLY A 84 -5.292 -5.282 -12.523 1.00 10.00 O ATOM 0 H GLY A 84 -5.072 -7.134 -13.703 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -2.431 -6.587 -12.701 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.780 -5.728 -14.188 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.430 -4.196 -11.896 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.082 -3.375 -10.854 1.00 10.00 C ATOM 1322 C ILE A 85 -3.638 -1.893 -10.891 1.00 10.00 C ATOM 1323 O ILE A 85 -3.078 -1.363 -9.939 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.917 -4.076 -9.476 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.871 -3.452 -8.430 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.453 -4.177 -8.992 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -4.807 -4.128 -7.058 1.00 10.00 C ATOM 0 H ILE A 85 -2.459 -3.942 -12.077 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.151 -3.313 -11.056 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.213 -5.116 -9.612 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.630 -2.395 -8.316 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.893 -3.507 -8.805 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.423 -4.678 -8.024 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -1.870 -4.748 -9.714 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.032 -3.176 -8.895 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.503 -3.637 -6.378 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.078 -5.179 -7.157 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -3.795 -4.050 -6.661 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.936 -1.193 -12.000 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.697 0.248 -12.269 1.00 10.00 C ATOM 1341 C LYS A 86 -2.229 0.700 -12.274 1.00 10.00 C ATOM 1342 O LYS A 86 -1.783 1.307 -13.243 1.00 10.00 O ATOM 1343 CB LYS A 86 -4.491 1.154 -11.303 1.00 10.00 C ATOM 1344 CG LYS A 86 -6.007 0.924 -11.251 1.00 10.00 C ATOM 1345 CD LYS A 86 -6.629 1.897 -10.233 1.00 10.00 C ATOM 1346 CE LYS A 86 -8.145 1.740 -10.072 1.00 10.00 C ATOM 1347 NZ LYS A 86 -8.880 2.084 -11.311 1.00 10.00 N ATOM 0 H LYS A 86 -4.384 -1.648 -12.795 1.00 10.00 H new ATOM 0 HA LYS A 86 -4.054 0.362 -13.292 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.089 1.019 -10.299 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -4.311 2.192 -11.581 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -6.445 1.080 -12.237 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -6.222 -0.106 -10.966 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -6.153 1.747 -9.264 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -6.410 2.919 -10.541 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -8.374 0.712 -9.790 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -8.490 2.378 -9.258 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -9.901 1.963 -11.154 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -8.684 3.073 -11.568 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -8.572 1.458 -12.083 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.503 0.469 -11.178 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.172 0.992 -10.861 1.00 10.00 C ATOM 1363 C LYS A 87 0.438 0.158 -9.726 1.00 10.00 C ATOM 1364 O LYS A 87 -0.285 -0.405 -8.902 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.284 2.477 -10.441 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.209 2.664 -9.229 1.00 10.00 C ATOM 1367 CD LYS A 87 -1.278 4.097 -8.717 1.00 10.00 C ATOM 1368 CE LYS A 87 -2.231 4.085 -7.519 1.00 10.00 C ATOM 1369 NZ LYS A 87 -2.152 5.337 -6.749 1.00 10.00 N ATOM 0 H LYS A 87 -1.856 -0.133 -10.434 1.00 10.00 H new ATOM 0 HA LYS A 87 0.472 0.927 -11.738 1.00 10.00 H new ATOM 0 HB2 LYS A 87 0.708 2.862 -10.203 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -0.661 3.063 -11.279 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -2.213 2.336 -9.498 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.868 2.017 -8.421 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -0.290 4.452 -8.423 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -1.640 4.770 -9.494 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -3.253 3.936 -7.868 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -1.990 3.243 -6.870 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -2.811 5.293 -5.946 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -1.183 5.466 -6.395 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -2.406 6.138 -7.362 1.00 10.00 H new ATOM 1383 N LYS A 88 1.772 0.143 -9.623 1.00 10.00 N ATOM 1384 CA LYS A 88 2.491 -0.671 -8.630 1.00 10.00 C ATOM 1385 C LYS A 88 2.242 -0.288 -7.162 1.00 10.00 C ATOM 1386 O LYS A 88 2.737 -0.997 -6.289 1.00 10.00 O ATOM 1387 CB LYS A 88 3.995 -0.717 -8.952 1.00 10.00 C ATOM 1388 CG LYS A 88 4.741 0.618 -8.748 1.00 10.00 C ATOM 1389 CD LYS A 88 6.102 0.461 -8.044 1.00 10.00 C ATOM 1390 CE LYS A 88 6.036 0.522 -6.508 1.00 10.00 C ATOM 1391 NZ LYS A 88 5.461 -0.688 -5.873 1.00 10.00 N ATOM 0 H LYS A 88 2.385 0.694 -10.224 1.00 10.00 H new ATOM 0 HA LYS A 88 2.068 -1.671 -8.722 1.00 10.00 H new ATOM 0 HB2 LYS A 88 4.463 -1.478 -8.327 1.00 10.00 H new ATOM 0 HB3 LYS A 88 4.121 -1.033 -9.988 1.00 10.00 H new ATOM 0 HG2 LYS A 88 4.895 1.091 -9.718 1.00 10.00 H new ATOM 0 HG3 LYS A 88 4.113 1.290 -8.162 1.00 10.00 H new ATOM 0 HD2 LYS A 88 6.542 -0.492 -8.339 1.00 10.00 H new ATOM 0 HD3 LYS A 88 6.772 1.244 -8.398 1.00 10.00 H new ATOM 0 HE2 LYS A 88 7.042 0.679 -6.119 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.442 1.388 -6.216 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 5.620 -0.650 -4.846 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 4.439 -0.728 -6.063 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 5.919 -1.536 -6.263 1.00 10.00 H new ATOM 1405 N THR A 89 1.543 0.818 -6.877 1.00 10.00 N ATOM 1406 CA THR A 89 1.137 1.248 -5.528 1.00 10.00 C ATOM 1407 C THR A 89 -0.004 0.378 -5.003 1.00 10.00 C ATOM 1408 O THR A 89 0.156 -0.255 -3.964 1.00 10.00 O ATOM 1409 CB THR A 89 0.699 2.727 -5.490 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.291 3.480 -6.528 1.00 10.00 O ATOM 1411 CG2 THR A 89 1.099 3.392 -4.174 1.00 10.00 C ATOM 0 H THR A 89 1.232 1.463 -7.604 1.00 10.00 H new ATOM 0 HA THR A 89 2.015 1.135 -4.891 1.00 10.00 H new ATOM 0 HB THR A 89 -0.385 2.716 -5.604 1.00 10.00 H new ATOM 0 HG1 THR A 89 0.988 4.410 -6.471 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.776 4.433 -4.179 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.625 2.869 -3.343 1.00 10.00 H new ATOM 0 HG23 THR A 89 2.182 3.349 -4.059 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.107 0.258 -5.765 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.290 -0.528 -5.391 1.00 10.00 C ATOM 1421 C GLU A 90 -1.903 -1.973 -5.049 1.00 10.00 C ATOM 1422 O GLU A 90 -2.480 -2.588 -4.156 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.291 -0.607 -6.557 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.697 0.683 -7.275 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.539 1.641 -6.442 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -3.944 2.413 -5.661 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -5.780 1.692 -6.621 1.00 10.00 O ATOM 0 H GLU A 90 -1.199 0.714 -6.673 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.734 -0.029 -4.530 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.873 -1.282 -7.304 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.201 -1.073 -6.179 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -2.794 1.202 -7.598 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.253 0.421 -8.175 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.901 -2.495 -5.771 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.291 -3.808 -5.590 1.00 10.00 C ATOM 1436 C ARG A 91 0.256 -3.999 -4.172 1.00 10.00 C ATOM 1437 O ARG A 91 -0.230 -4.863 -3.444 1.00 10.00 O ATOM 1438 CB ARG A 91 0.758 -4.014 -6.701 1.00 10.00 C ATOM 1439 CG ARG A 91 1.548 -5.329 -6.641 1.00 10.00 C ATOM 1440 CD ARG A 91 0.679 -6.584 -6.788 1.00 10.00 C ATOM 1441 NE ARG A 91 0.075 -7.003 -5.510 1.00 10.00 N ATOM 1442 CZ ARG A 91 -1.206 -7.205 -5.245 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -2.154 -6.813 -6.063 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -1.556 -7.811 -4.139 1.00 10.00 N ATOM 0 H ARG A 91 -0.474 -1.977 -6.540 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.045 -4.589 -5.689 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.253 -3.960 -7.665 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.465 -3.186 -6.664 1.00 10.00 H new ATOM 0 HG2 ARG A 91 2.300 -5.326 -7.430 1.00 10.00 H new ATOM 0 HG3 ARG A 91 2.082 -5.378 -5.692 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -0.111 -6.393 -7.514 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.286 -7.398 -7.184 1.00 10.00 H new ATOM 0 HE ARG A 91 0.722 -7.156 -4.737 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -1.913 -6.337 -6.933 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -3.132 -6.984 -5.829 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -0.842 -8.127 -3.483 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -2.543 -7.967 -3.933 1.00 10.00 H new ATOM 1458 N GLU A 92 1.272 -3.228 -3.780 1.00 10.00 N ATOM 1459 CA GLU A 92 1.841 -3.297 -2.426 1.00 10.00 C ATOM 1460 C GLU A 92 0.859 -2.832 -1.337 1.00 10.00 C ATOM 1461 O GLU A 92 0.884 -3.381 -0.236 1.00 10.00 O ATOM 1462 CB GLU A 92 3.164 -2.518 -2.349 1.00 10.00 C ATOM 1463 CG GLU A 92 3.011 -1.053 -2.770 1.00 10.00 C ATOM 1464 CD GLU A 92 4.252 -0.235 -2.442 1.00 10.00 C ATOM 1465 OE1 GLU A 92 5.183 -0.250 -3.282 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.225 0.407 -1.368 1.00 10.00 O ATOM 0 H GLU A 92 1.723 -2.542 -4.385 1.00 10.00 H new ATOM 0 HA GLU A 92 2.043 -4.349 -2.226 1.00 10.00 H new ATOM 0 HB2 GLU A 92 3.548 -2.561 -1.330 1.00 10.00 H new ATOM 0 HB3 GLU A 92 3.903 -3.001 -2.988 1.00 10.00 H new ATOM 0 HG2 GLU A 92 2.815 -1.002 -3.841 1.00 10.00 H new ATOM 0 HG3 GLU A 92 2.147 -0.619 -2.267 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.035 -1.882 -1.643 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.136 -1.494 -0.767 1.00 10.00 C ATOM 1475 C ASP A 93 -2.023 -2.707 -0.443 1.00 10.00 C ATOM 1476 O ASP A 93 -2.296 -2.964 0.726 1.00 10.00 O ATOM 1477 CB ASP A 93 -1.944 -0.361 -1.417 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.223 0.988 -1.475 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.393 1.240 -0.573 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -1.540 1.786 -2.390 1.00 10.00 O ATOM 0 H ASP A 93 -0.009 -1.358 -2.518 1.00 10.00 H new ATOM 0 HA ASP A 93 -0.731 -1.126 0.176 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.210 -0.659 -2.431 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -2.876 -0.236 -0.866 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.416 -3.504 -1.447 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.179 -4.740 -1.246 1.00 10.00 C ATOM 1487 C LEU A 94 -2.484 -5.747 -0.341 1.00 10.00 C ATOM 1488 O LEU A 94 -3.135 -6.318 0.534 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.466 -5.432 -2.588 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.955 -5.622 -2.857 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.635 -4.276 -3.017 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.108 -6.395 -4.161 1.00 10.00 C ATOM 0 H LEU A 94 -2.211 -3.306 -2.426 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.103 -4.426 -0.760 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.030 -4.843 -3.394 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -2.974 -6.404 -2.601 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.409 -6.158 -2.024 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.698 -4.426 -3.209 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.509 -3.694 -2.104 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.188 -3.739 -3.854 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.167 -6.543 -4.374 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.649 -5.832 -4.974 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.617 -7.364 -4.069 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.187 -5.980 -0.579 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.372 -6.861 0.252 1.00 10.00 C ATOM 1506 C ILE A 95 -0.440 -6.361 1.697 1.00 10.00 C ATOM 1507 O ILE A 95 -0.817 -7.123 2.584 1.00 10.00 O ATOM 1508 CB ILE A 95 1.077 -6.953 -0.288 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.177 -7.551 -1.712 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.966 -7.755 0.670 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.639 -8.977 -1.893 1.00 10.00 C ATOM 0 H ILE A 95 -0.677 -5.560 -1.356 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.761 -7.879 0.221 1.00 10.00 H new ATOM 0 HB ILE A 95 1.429 -5.924 -0.353 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.641 -6.894 -2.397 1.00 10.00 H new ATOM 0 HG13 ILE A 95 2.224 -7.540 -2.014 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.979 -7.806 0.270 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.985 -7.266 1.644 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.567 -8.764 0.778 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.764 -9.284 -2.931 1.00 10.00 H new ATOM 0 HD12 ILE A 95 1.189 -9.658 -1.244 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.419 -9.002 -1.632 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.154 -5.074 1.928 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.069 -4.507 3.269 1.00 10.00 C ATOM 1525 C ALA A 96 -1.431 -4.337 3.953 1.00 10.00 C ATOM 1526 O ALA A 96 -1.453 -4.313 5.182 1.00 10.00 O ATOM 1527 CB ALA A 96 0.670 -3.167 3.180 1.00 10.00 C ATOM 0 H ALA A 96 0.025 -4.399 1.185 1.00 10.00 H new ATOM 0 HA ALA A 96 0.479 -5.210 3.896 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.744 -2.726 4.174 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.671 -3.329 2.779 1.00 10.00 H new ATOM 0 HB3 ALA A 96 0.121 -2.492 2.523 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.538 -4.252 3.201 1.00 10.00 N ATOM 1534 CA TYR A 97 -3.918 -4.447 3.659 1.00 10.00 C ATOM 1535 C TYR A 97 -4.144 -5.900 4.109 1.00 10.00 C ATOM 1536 O TYR A 97 -4.370 -6.141 5.297 1.00 10.00 O ATOM 1537 CB TYR A 97 -4.893 -3.984 2.553 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.231 -4.693 2.466 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.152 -4.676 3.534 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.532 -5.412 1.297 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.367 -5.388 3.424 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -7.722 -6.146 1.207 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.653 -6.130 2.261 1.00 10.00 C ATOM 1544 OH TYR A 97 -9.809 -6.841 2.154 1.00 10.00 O ATOM 0 H TYR A 97 -2.490 -4.034 2.206 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.113 -3.834 4.539 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.083 -2.920 2.694 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.390 -4.093 1.592 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -6.929 -4.120 4.433 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -5.844 -5.399 0.465 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.080 -5.363 4.235 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -7.926 -6.729 0.321 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.117 -6.826 1.224 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.055 -6.876 3.194 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.372 -8.281 3.481 1.00 10.00 C ATOM 1556 C LEU A 98 -3.488 -8.873 4.585 1.00 10.00 C ATOM 1557 O LEU A 98 -3.969 -9.694 5.363 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.279 -9.123 2.199 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.389 -8.829 1.175 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.029 -9.378 -0.206 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.736 -9.424 1.601 1.00 10.00 C ATOM 0 H LEU A 98 -3.760 -6.712 2.231 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.396 -8.308 3.853 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.311 -8.947 1.730 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.316 -10.179 2.467 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.479 -7.744 1.128 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.833 -9.154 -0.907 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.106 -8.914 -0.553 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.892 -10.458 -0.144 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.490 -9.192 0.849 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.641 -10.505 1.699 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -7.035 -8.998 2.559 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.239 -8.405 4.732 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.360 -8.799 5.841 1.00 10.00 C ATOM 1575 C LYS A 99 -1.929 -8.470 7.235 1.00 10.00 C ATOM 1576 O LYS A 99 -1.554 -9.122 8.208 1.00 10.00 O ATOM 1577 CB LYS A 99 0.060 -8.228 5.621 1.00 10.00 C ATOM 1578 CG LYS A 99 1.158 -9.308 5.640 1.00 10.00 C ATOM 1579 CD LYS A 99 1.281 -10.151 6.923 1.00 10.00 C ATOM 1580 CE LYS A 99 2.026 -11.466 6.668 1.00 10.00 C ATOM 1581 NZ LYS A 99 3.473 -11.289 6.413 1.00 10.00 N ATOM 0 H LYS A 99 -1.811 -7.743 4.085 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.297 -9.887 5.832 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.090 -7.705 4.665 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.272 -7.490 6.395 1.00 10.00 H new ATOM 0 HG2 LYS A 99 0.983 -9.985 4.804 1.00 10.00 H new ATOM 0 HG3 LYS A 99 2.117 -8.821 5.460 1.00 10.00 H new ATOM 0 HD2 LYS A 99 1.806 -9.577 7.686 1.00 10.00 H new ATOM 0 HD3 LYS A 99 0.286 -10.366 7.314 1.00 10.00 H new ATOM 0 HE2 LYS A 99 1.895 -12.121 7.530 1.00 10.00 H new ATOM 0 HE3 LYS A 99 1.574 -11.970 5.813 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 3.934 -12.220 6.367 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 3.608 -10.791 5.510 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 3.895 -10.731 7.183 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.867 -7.516 7.353 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.640 -7.301 8.592 1.00 10.00 C ATOM 1597 C LYS A 100 -4.763 -8.320 8.712 1.00 10.00 C ATOM 1598 O LYS A 100 -4.853 -8.944 9.756 1.00 10.00 O ATOM 1599 CB LYS A 100 -4.179 -5.868 8.745 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.119 -4.891 9.283 1.00 10.00 C ATOM 1601 CD LYS A 100 -1.949 -4.743 8.317 1.00 10.00 C ATOM 1602 CE LYS A 100 -1.134 -3.477 8.568 1.00 10.00 C ATOM 1603 NZ LYS A 100 -0.182 -3.277 7.453 1.00 10.00 N ATOM 0 H LYS A 100 -3.111 -6.875 6.599 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.938 -7.445 9.413 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.537 -5.513 7.779 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -5.036 -5.876 9.419 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -3.576 -3.916 9.454 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -2.753 -5.245 10.247 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -1.298 -5.613 8.405 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -2.327 -4.730 7.295 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -1.797 -2.616 8.654 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -0.594 -3.560 9.511 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 0.007 -2.261 7.336 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 0.708 -3.772 7.663 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -0.591 -3.657 6.575 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.519 -8.577 7.638 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.597 -9.579 7.577 1.00 10.00 C ATOM 1619 C ALA A 101 -6.155 -11.044 7.827 1.00 10.00 C ATOM 1620 O ALA A 101 -6.975 -11.960 7.769 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.310 -9.432 6.225 1.00 10.00 C ATOM 0 H ALA A 101 -5.395 -8.078 6.757 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.273 -9.372 8.407 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.114 -10.165 6.156 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.726 -8.428 6.140 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.597 -9.599 5.418 1.00 10.00 H new ATOM 1627 N THR A 102 -4.865 -11.280 8.099 1.00 10.00 N ATOM 1628 CA THR A 102 -4.307 -12.547 8.599 1.00 10.00 C ATOM 1629 C THR A 102 -3.808 -12.490 10.049 1.00 10.00 C ATOM 1630 O THR A 102 -3.100 -13.408 10.463 1.00 10.00 O ATOM 1631 CB THR A 102 -3.195 -13.092 7.685 1.00 10.00 C ATOM 1632 OG1 THR A 102 -1.971 -12.414 7.874 1.00 10.00 O ATOM 1633 CG2 THR A 102 -3.571 -13.032 6.211 1.00 10.00 C ATOM 0 H THR A 102 -4.150 -10.564 7.972 1.00 10.00 H new ATOM 0 HA THR A 102 -5.153 -13.235 8.585 1.00 10.00 H new ATOM 0 HB THR A 102 -3.072 -14.136 7.972 1.00 10.00 H new ATOM 0 HG1 THR A 102 -1.292 -12.792 7.276 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.752 -13.428 5.610 1.00 10.00 H new ATOM 0 HG22 THR A 102 -4.468 -13.627 6.040 1.00 10.00 H new ATOM 0 HG23 THR A 102 -3.762 -11.997 5.926 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.117 -11.433 10.813 1.00 10.00 N ATOM 1642 CA ASN A 103 -3.764 -11.335 12.235 1.00 10.00 C ATOM 1643 C ASN A 103 -4.708 -10.427 13.050 1.00 10.00 C ATOM 1644 O ASN A 103 -4.995 -10.754 14.201 1.00 10.00 O ATOM 1645 CB ASN A 103 -2.278 -10.943 12.390 1.00 10.00 C ATOM 1646 CG ASN A 103 -1.955 -9.470 12.188 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -1.866 -8.706 13.132 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -1.691 -9.007 10.984 1.00 10.00 N ATOM 0 H ASN A 103 -4.621 -10.619 10.460 1.00 10.00 H new ATOM 0 HA ASN A 103 -3.904 -12.325 12.669 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -1.948 -11.234 13.387 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -1.693 -11.524 11.678 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.420 -8.031 10.861 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.757 -9.624 10.174 1.00 10.00 H new ATOM 1655 N GLU A 104 -5.224 -9.346 12.456 1.00 10.00 N ATOM 1656 CA GLU A 104 -6.531 -8.751 12.769 1.00 10.00 C ATOM 1657 C GLU A 104 -7.673 -9.585 12.163 1.00 10.00 C ATOM 1658 O GLU A 104 -7.514 -10.029 10.996 1.00 10.00 O ATOM 1659 CB GLU A 104 -6.596 -7.297 12.263 1.00 10.00 C ATOM 1660 CG GLU A 104 -5.595 -6.365 12.969 1.00 10.00 C ATOM 1661 CD GLU A 104 -5.690 -4.919 12.455 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -6.739 -4.276 12.693 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -4.709 -4.456 11.830 1.00 10.00 O ATOM 1664 OXT GLU A 104 -8.684 -9.756 12.870 1.00 10.00 O ATOM 0 H GLU A 104 -4.728 -8.843 11.720 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.652 -8.747 13.852 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -6.402 -7.283 11.191 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -7.606 -6.913 12.409 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -5.781 -6.381 14.043 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -4.582 -6.738 12.815 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.708 -13.316 -7.972 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -7.843 -16.599 -7.461 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.838 -12.433 -5.297 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.514 -10.082 -8.522 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.140 -14.317 -10.115 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.501 -14.296 -6.724 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.225 -15.647 -6.669 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.220 -15.931 -5.657 1.00 10.00 C HETATM 1680 C3A HEC A 105 -5.962 -14.753 -5.036 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.809 -13.761 -5.667 1.00 10.00 C HETATM 1682 CMA HEC A 105 -4.939 -14.453 -3.966 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.550 -17.268 -5.439 1.00 10.00 C HETATM 1684 CBA HEC A 105 -6.412 -18.337 -4.739 1.00 10.00 C HETATM 1685 CGA HEC A 105 -5.790 -19.726 -4.805 1.00 10.00 C HETATM 1686 O1A HEC A 105 -5.493 -20.167 -5.931 1.00 10.00 O HETATM 1687 O2A HEC A 105 -5.594 -20.345 -3.739 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.267 -11.604 -7.093 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.507 -11.427 -5.966 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.423 -10.026 -5.604 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.130 -9.331 -6.542 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.665 -10.336 -7.459 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.618 -9.513 -4.427 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.313 -7.821 -6.676 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.059 -7.141 -7.228 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.076 -12.407 -9.024 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.232 -11.049 -9.199 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.390 -10.758 -10.027 1.00 10.00 C HETATM 1699 C3C HEC A 105 -11.992 -11.952 -10.259 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.069 -12.973 -9.788 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.915 -9.372 -10.348 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.381 -12.197 -10.814 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.467 -12.021 -12.337 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.339 -15.088 -8.664 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.295 -15.301 -9.631 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.363 -16.710 -10.006 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.553 -17.376 -9.144 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.844 -16.350 -8.384 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.270 -17.314 -11.059 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.496 -18.881 -8.917 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.201 -19.644 -9.255 1.00 10.00 C HETATM 1712 CGD HEC A 105 -7.928 -19.978 -10.717 1.00 10.00 C HETATM 1713 O1D HEC A 105 -8.703 -19.601 -11.624 1.00 10.00 O HETATM 1714 O2D HEC A 105 -6.879 -20.628 -10.896 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.311 -17.128 -10.793 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -11.056 -16.860 -12.027 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -11.096 -18.389 -11.116 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.187 -8.863 -9.423 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.143 -8.801 -10.863 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.793 -9.455 -10.989 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.991 -9.964 -3.507 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.569 -9.777 -4.561 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.715 -8.429 -4.365 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.137 -15.071 -3.090 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -3.941 -14.671 -4.346 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -5.000 -13.401 -3.689 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.361 -19.057 -8.884 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -8.208 -20.579 -8.695 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.183 -11.003 -12.602 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.791 -12.724 -12.823 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.488 -12.211 -12.668 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.220 -7.325 -6.557 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.830 -7.545 -8.214 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.232 -6.068 -7.307 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -6.556 -18.056 -3.696 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.399 -18.362 -5.201 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.719 -19.063 -7.866 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.302 -19.331 -9.496 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.234 -17.658 -6.406 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -4.648 -17.110 -4.848 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.923 -14.624 -10.808 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.624 -9.048 -8.848 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.286 -12.153 -4.400 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.514 -17.632 -7.348 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.824 -21.349 -10.234 1.00 10.00 H new HETATM 0 H2A HEC A 105 -5.478 -21.299 -3.931 1.00 10.00 H new