USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1123 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 144 ASN : amide:sc= 0.37 X(o=0.65,f=0.66) USER MOD Set 1.2: A 148 ASN : amide:sc= 0.277 X(o=0.65,f=0.66) USER MOD Set 2.1: A 130 HIS :FLIP no HD1:sc= -0.162 F(o=-0.76,f=-0.069) USER MOD Set 2.2: A 133 TYR OH : rot 32:sc= 0.0926 USER MOD Set 3.1: A 39 SER OG : rot -55:sc= 1.37 USER MOD Set 3.2: A 62 CYS SG : rot 180:sc= 1.08 USER MOD Set 4.1: A 35 CYS SG : rot 180:sc= -0.597 USER MOD Set 4.2: A 96 GLN : amide:sc= 0.817 K(o=0.22,f=-1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -130:sc= 2.12 (180deg=-1.88) USER MOD Single : A 3 HIS : no HD1:sc= -0.0123 X(o=-0.012,f=-0.35) USER MOD Single : A 7 TYR OH : rot 159:sc= 0.575 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.18) USER MOD Single : A 14 GLN : amide:sc= -2.6! C(o=-2.6!,f=-5.1!) USER MOD Single : A 16 ASN :FLIP amide:sc= 0.673 F(o=-0.64,f=0.67) USER MOD Single : A 17 HIS : no HD1:sc= -0.182 X(o=-0.18,f=-0.045) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -127:sc= -1.98! (180deg=-2.93) USER MOD Single : A 23 HIS : no HE2:sc= -0.0522 K(o=-0.052,f=-1.2) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HE2:sc= 0.972 K(o=0.97,f=-3.4!) USER MOD Single : A 36 THR OG1 : rot 88:sc= 0.775 USER MOD Single : A 48 HIS : no HD1:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 49 ASN : amide:sc= 0.446 K(o=0.45,f=-0.4) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.42) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 17:sc= 0.216 USER MOD Single : A 73 GLN : amide:sc= -0.55 X(o=-0.55,f=-0.49) USER MOD Single : A 74 MET CE :methyl -177:sc= -1.04 (180deg=-1.1) USER MOD Single : A 84 CYS SG : rot -153:sc= -1.11 USER MOD Single : A 86 SER OG : rot 180:sc= 0.00391 USER MOD Single : A 87 MET CE :methyl 174:sc= -0.535 (180deg=-0.58) USER MOD Single : A 88 TYR OH : rot 71:sc= 0.0223 USER MOD Single : A 89 GLN : amide:sc= 0.552 K(o=0.55,f=-4.3!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.0421 X(o=-0.042,f=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.203 F(o=-0.75,f=-0.2) USER MOD Single : A 112 CYS SG : rot 92:sc= -3.37 USER MOD Single : A 115 TYR OH : rot 9:sc= 1.19 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0275 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.193 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 45:sc= 0.499 USER MOD Single : A 132 SER OG : rot 79:sc=0.000496 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -0.42 X(o=-0.42,f=-0.14) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.052 -5.414 5.198 1.00 0.00 N ATOM 2 CA MET A 1 -16.529 -4.542 6.281 1.00 0.00 C ATOM 3 C MET A 1 -15.406 -3.699 6.911 1.00 0.00 C ATOM 4 O MET A 1 -15.655 -3.045 7.925 1.00 0.00 O ATOM 5 CB MET A 1 -17.298 -5.343 7.344 1.00 0.00 C ATOM 6 CG MET A 1 -18.565 -6.044 6.824 1.00 0.00 C ATOM 7 SD MET A 1 -20.131 -5.206 7.217 1.00 0.00 S ATOM 8 CE MET A 1 -20.596 -6.070 8.739 1.00 0.00 C ATOM 0 H1 MET A 1 -16.656 -5.290 4.361 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.071 -5.164 4.958 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.090 -6.406 5.508 1.00 0.00 H new ATOM 0 HA MET A 1 -17.221 -3.834 5.826 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.631 -6.094 7.768 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.577 -4.671 8.155 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.487 -6.144 5.741 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.598 -7.053 7.236 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.540 -5.671 9.110 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.708 -7.135 8.533 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.820 -5.925 9.491 1.00 0.00 H new ATOM 18 N ALA A 2 -14.210 -3.601 6.314 1.00 0.00 N ATOM 19 CA ALA A 2 -13.367 -2.414 6.415 1.00 0.00 C ATOM 20 C ALA A 2 -12.884 -2.072 5.005 1.00 0.00 C ATOM 21 O ALA A 2 -12.796 -2.967 4.161 1.00 0.00 O ATOM 22 CB ALA A 2 -12.186 -2.677 7.357 1.00 0.00 C ATOM 0 H ALA A 2 -13.804 -4.346 5.748 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.927 -1.576 6.830 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -11.566 -1.783 7.422 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.561 -2.932 8.348 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.590 -3.504 6.971 1.00 0.00 H new ATOM 28 N HIS A 3 -12.545 -0.808 4.758 1.00 0.00 N ATOM 29 CA HIS A 3 -12.004 -0.342 3.489 1.00 0.00 C ATOM 30 C HIS A 3 -10.522 -0.019 3.692 1.00 0.00 C ATOM 31 O HIS A 3 -10.163 0.676 4.654 1.00 0.00 O ATOM 32 CB HIS A 3 -12.810 0.859 2.965 1.00 0.00 C ATOM 33 CG HIS A 3 -14.284 0.572 2.808 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.320 1.325 3.317 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.832 -0.467 2.106 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.470 0.735 2.945 1.00 0.00 C ATOM 37 NE2 HIS A 3 -16.224 -0.374 2.230 1.00 0.00 N ATOM 0 H HIS A 3 -12.642 -0.066 5.451 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.088 -1.115 2.725 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -12.682 1.698 3.648 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.403 1.167 2.002 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -14.290 -1.222 1.556 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.456 1.103 3.188 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -16.915 -1.022 1.851 1.00 0.00 H new ATOM 45 N ILE A 4 -9.652 -0.520 2.813 1.00 0.00 N ATOM 46 CA ILE A 4 -8.210 -0.251 2.821 1.00 0.00 C ATOM 47 C ILE A 4 -7.772 0.217 1.430 1.00 0.00 C ATOM 48 O ILE A 4 -8.530 0.072 0.467 1.00 0.00 O ATOM 49 CB ILE A 4 -7.401 -1.472 3.308 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.473 -2.659 2.326 1.00 0.00 C ATOM 51 CG2 ILE A 4 -7.857 -1.882 4.719 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.327 -3.650 2.519 1.00 0.00 C ATOM 0 H ILE A 4 -9.937 -1.141 2.055 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.004 0.547 3.534 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.353 -1.176 3.350 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.423 -3.177 2.457 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.454 -2.282 1.304 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.279 -2.744 5.052 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.700 -1.052 5.408 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.916 -2.141 4.698 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.426 -4.465 1.802 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.376 -3.142 2.361 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.360 -4.051 3.532 1.00 0.00 H new ATOM 64 N PHE A 5 -6.556 0.749 1.315 1.00 0.00 N ATOM 65 CA PHE A 5 -5.990 1.261 0.071 1.00 0.00 C ATOM 66 C PHE A 5 -4.628 0.625 -0.211 1.00 0.00 C ATOM 67 O PHE A 5 -3.854 0.377 0.714 1.00 0.00 O ATOM 68 CB PHE A 5 -5.880 2.777 0.212 1.00 0.00 C ATOM 69 CG PHE A 5 -5.330 3.522 -0.977 1.00 0.00 C ATOM 70 CD1 PHE A 5 -6.218 3.965 -1.967 1.00 0.00 C ATOM 71 CD2 PHE A 5 -3.959 3.829 -1.067 1.00 0.00 C ATOM 72 CE1 PHE A 5 -5.736 4.713 -3.049 1.00 0.00 C ATOM 73 CE2 PHE A 5 -3.475 4.579 -2.151 1.00 0.00 C ATOM 74 CZ PHE A 5 -4.372 5.035 -3.129 1.00 0.00 C ATOM 0 H PHE A 5 -5.921 0.838 2.108 1.00 0.00 H new ATOM 0 HA PHE A 5 -6.630 1.009 -0.775 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -6.871 3.172 0.434 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -5.249 2.995 1.074 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -7.270 3.731 -1.896 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -3.278 3.487 -0.301 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.414 5.042 -3.822 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -2.422 4.803 -2.231 1.00 0.00 H new ATOM 0 HZ PHE A 5 -4.010 5.638 -3.949 1.00 0.00 H new ATOM 84 N VAL A 6 -4.327 0.388 -1.489 1.00 0.00 N ATOM 85 CA VAL A 6 -3.085 -0.228 -1.958 1.00 0.00 C ATOM 86 C VAL A 6 -2.136 0.825 -2.548 1.00 0.00 C ATOM 87 O VAL A 6 -2.499 1.525 -3.497 1.00 0.00 O ATOM 88 CB VAL A 6 -3.381 -1.335 -2.984 1.00 0.00 C ATOM 89 CG1 VAL A 6 -3.793 -2.617 -2.261 1.00 0.00 C ATOM 90 CG2 VAL A 6 -4.472 -0.945 -3.995 1.00 0.00 C ATOM 0 H VAL A 6 -4.962 0.627 -2.251 1.00 0.00 H new ATOM 0 HA VAL A 6 -2.589 -0.682 -1.100 1.00 0.00 H new ATOM 0 HB VAL A 6 -2.462 -1.492 -3.548 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.001 -3.397 -2.993 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -2.984 -2.941 -1.606 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -4.688 -2.429 -1.667 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -4.634 -1.768 -4.691 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -5.400 -0.731 -3.465 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -4.157 -0.060 -4.547 1.00 0.00 H new ATOM 100 N TYR A 7 -0.908 0.927 -2.034 1.00 0.00 N ATOM 101 CA TYR A 7 0.051 1.972 -2.419 1.00 0.00 C ATOM 102 C TYR A 7 0.629 1.603 -3.787 1.00 0.00 C ATOM 103 O TYR A 7 0.680 2.436 -4.695 1.00 0.00 O ATOM 104 CB TYR A 7 1.211 2.108 -1.400 1.00 0.00 C ATOM 105 CG TYR A 7 0.897 1.611 -0.001 1.00 0.00 C ATOM 106 CD1 TYR A 7 -0.291 2.001 0.647 1.00 0.00 C ATOM 107 CD2 TYR A 7 1.682 0.571 0.534 1.00 0.00 C ATOM 108 CE1 TYR A 7 -0.776 1.238 1.720 1.00 0.00 C ATOM 109 CE2 TYR A 7 1.222 -0.165 1.634 1.00 0.00 C ATOM 110 CZ TYR A 7 -0.042 0.131 2.185 1.00 0.00 C ATOM 111 OH TYR A 7 -0.611 -0.718 3.075 1.00 0.00 O ATOM 0 H TYR A 7 -0.545 0.282 -1.332 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.473 2.928 -2.447 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.074 1.560 -1.779 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.501 3.157 -1.340 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.825 2.881 0.320 1.00 0.00 H new ATOM 0 HD2 TYR A 7 2.641 0.340 0.095 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.713 1.500 2.189 1.00 0.00 H new ATOM 0 HE2 TYR A 7 1.830 -0.952 2.056 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.148 -1.581 3.046 1.00 0.00 H new ATOM 121 N GLY A 8 1.063 0.345 -3.946 1.00 0.00 N ATOM 122 CA GLY A 8 1.776 -0.072 -5.145 1.00 0.00 C ATOM 123 C GLY A 8 1.994 -1.577 -5.321 1.00 0.00 C ATOM 124 O GLY A 8 2.619 -1.951 -6.317 1.00 0.00 O ATOM 0 H GLY A 8 0.929 -0.395 -3.257 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.230 0.297 -6.013 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.750 0.417 -5.150 1.00 0.00 H new ATOM 128 N THR A 9 1.561 -2.435 -4.391 1.00 0.00 N ATOM 129 CA THR A 9 2.032 -3.823 -4.302 1.00 0.00 C ATOM 130 C THR A 9 0.946 -4.881 -4.478 1.00 0.00 C ATOM 131 O THR A 9 1.302 -6.053 -4.610 1.00 0.00 O ATOM 132 CB THR A 9 2.886 -4.008 -3.019 1.00 0.00 C ATOM 133 OG1 THR A 9 2.572 -3.038 -2.021 1.00 0.00 O ATOM 134 CG2 THR A 9 4.378 -3.897 -3.354 1.00 0.00 C ATOM 0 H THR A 9 0.874 -2.188 -3.679 1.00 0.00 H new ATOM 0 HA THR A 9 2.672 -4.000 -5.166 1.00 0.00 H new ATOM 0 HB THR A 9 2.655 -4.998 -2.626 1.00 0.00 H new ATOM 0 HG1 THR A 9 3.130 -3.190 -1.230 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.966 -4.029 -2.445 1.00 0.00 H new ATOM 0 HG22 THR A 9 4.647 -4.669 -4.075 1.00 0.00 H new ATOM 0 HG23 THR A 9 4.583 -2.915 -3.780 1.00 0.00 H new ATOM 142 N LEU A 10 -0.333 -4.502 -4.554 1.00 0.00 N ATOM 143 CA LEU A 10 -1.468 -5.395 -4.793 1.00 0.00 C ATOM 144 C LEU A 10 -2.512 -4.638 -5.629 1.00 0.00 C ATOM 145 O LEU A 10 -3.687 -4.653 -5.282 1.00 0.00 O ATOM 146 CB LEU A 10 -2.069 -5.932 -3.467 1.00 0.00 C ATOM 147 CG LEU A 10 -1.097 -6.681 -2.531 1.00 0.00 C ATOM 148 CD1 LEU A 10 -0.438 -5.737 -1.516 1.00 0.00 C ATOM 149 CD2 LEU A 10 -1.811 -7.784 -1.750 1.00 0.00 C ATOM 0 H LEU A 10 -0.616 -3.528 -4.447 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.130 -6.273 -5.343 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.493 -5.091 -2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -2.894 -6.602 -3.711 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.334 -7.114 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.238 -6.305 -0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.124 -4.968 -2.046 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.207 -5.267 -0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.097 -8.291 -1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.604 -7.346 -1.144 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.242 -8.503 -2.447 1.00 0.00 H new ATOM 161 N LYS A 11 -2.125 -3.946 -6.717 1.00 0.00 N ATOM 162 CA LYS A 11 -3.109 -3.391 -7.663 1.00 0.00 C ATOM 163 C LYS A 11 -2.683 -3.693 -9.081 1.00 0.00 C ATOM 164 O LYS A 11 -3.243 -4.629 -9.645 1.00 0.00 O ATOM 165 CB LYS A 11 -3.399 -1.898 -7.422 1.00 0.00 C ATOM 166 CG LYS A 11 -4.767 -1.404 -7.932 1.00 0.00 C ATOM 167 CD LYS A 11 -4.822 -1.025 -9.428 1.00 0.00 C ATOM 168 CE LYS A 11 -5.459 -2.083 -10.347 1.00 0.00 C ATOM 169 NZ LYS A 11 -6.919 -1.911 -10.503 1.00 0.00 N ATOM 0 H LYS A 11 -1.152 -3.760 -6.960 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.065 -3.884 -7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -3.335 -1.700 -6.352 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.617 -1.310 -7.902 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.507 -2.182 -7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.062 -0.535 -7.344 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.380 -0.094 -9.531 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.807 -0.829 -9.775 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.987 -2.035 -11.328 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.257 -3.075 -9.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.277 -2.598 -11.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.387 -2.068 -9.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.121 -0.946 -10.835 1.00 0.00 H new ATOM 183 N ARG A 12 -1.717 -2.953 -9.639 1.00 0.00 N ATOM 184 CA ARG A 12 -1.385 -2.977 -11.071 1.00 0.00 C ATOM 185 C ARG A 12 -1.176 -4.406 -11.575 1.00 0.00 C ATOM 186 O ARG A 12 -1.716 -4.755 -12.620 1.00 0.00 O ATOM 187 CB ARG A 12 -0.155 -2.094 -11.378 1.00 0.00 C ATOM 188 CG ARG A 12 -0.463 -0.843 -12.216 1.00 0.00 C ATOM 189 CD ARG A 12 0.844 -0.103 -12.546 1.00 0.00 C ATOM 190 NE ARG A 12 0.613 1.170 -13.245 1.00 0.00 N ATOM 191 CZ ARG A 12 1.558 2.042 -13.615 1.00 0.00 C ATOM 192 NH1 ARG A 12 2.844 1.791 -13.419 1.00 0.00 N ATOM 193 NH2 ARG A 12 1.237 3.191 -14.188 1.00 0.00 N ATOM 0 H ARG A 12 -1.135 -2.311 -9.101 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.237 -2.560 -11.608 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.298 -1.783 -10.436 1.00 0.00 H new ATOM 0 HB3 ARG A 12 0.586 -2.695 -11.905 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.973 -1.127 -13.136 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.137 -0.184 -11.668 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.392 0.088 -11.623 1.00 0.00 H new ATOM 0 HD3 ARG A 12 1.474 -0.743 -13.164 1.00 0.00 H new ATOM 0 HE ARG A 12 -0.353 1.409 -13.467 1.00 0.00 H new ATOM 0 HH11 ARG A 12 3.132 0.918 -12.978 1.00 0.00 H new ATOM 0 HH12 ARG A 12 3.546 2.471 -13.710 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.257 3.422 -14.353 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.969 3.845 -14.464 1.00 0.00 H new ATOM 207 N GLY A 13 -0.429 -5.223 -10.832 1.00 0.00 N ATOM 208 CA GLY A 13 -0.131 -6.598 -11.195 1.00 0.00 C ATOM 209 C GLY A 13 1.241 -6.914 -10.638 1.00 0.00 C ATOM 210 O GLY A 13 2.221 -6.949 -11.383 1.00 0.00 O ATOM 0 H GLY A 13 -0.010 -4.938 -9.947 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.879 -7.276 -10.785 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -0.146 -6.723 -12.278 1.00 0.00 H new ATOM 214 N GLN A 14 1.347 -6.994 -9.309 1.00 0.00 N ATOM 215 CA GLN A 14 2.584 -7.246 -8.598 1.00 0.00 C ATOM 216 C GLN A 14 2.640 -8.694 -8.122 1.00 0.00 C ATOM 217 O GLN A 14 1.589 -9.309 -7.908 1.00 0.00 O ATOM 218 CB GLN A 14 2.608 -6.299 -7.401 1.00 0.00 C ATOM 219 CG GLN A 14 3.028 -4.896 -7.829 1.00 0.00 C ATOM 220 CD GLN A 14 1.917 -4.170 -8.584 1.00 0.00 C ATOM 221 OE1 GLN A 14 0.745 -4.199 -8.204 1.00 0.00 O ATOM 222 NE2 GLN A 14 2.240 -3.614 -9.731 1.00 0.00 N ATOM 0 H GLN A 14 0.546 -6.881 -8.688 1.00 0.00 H new ATOM 0 HA GLN A 14 3.443 -7.080 -9.247 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.621 -6.263 -6.940 1.00 0.00 H new ATOM 0 HB3 GLN A 14 3.299 -6.676 -6.647 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.306 -4.317 -6.949 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.914 -4.960 -8.461 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.214 -3.597 -10.033 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.516 -3.200 -10.319 1.00 0.00 H new ATOM 231 N PRO A 15 3.839 -9.210 -7.802 1.00 0.00 N ATOM 232 CA PRO A 15 3.993 -10.605 -7.408 1.00 0.00 C ATOM 233 C PRO A 15 3.193 -10.908 -6.136 1.00 0.00 C ATOM 234 O PRO A 15 2.633 -11.992 -5.987 1.00 0.00 O ATOM 235 CB PRO A 15 5.500 -10.825 -7.224 1.00 0.00 C ATOM 236 CG PRO A 15 6.092 -9.426 -7.062 1.00 0.00 C ATOM 237 CD PRO A 15 5.114 -8.500 -7.776 1.00 0.00 C ATOM 0 HA PRO A 15 3.600 -11.288 -8.161 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.704 -11.443 -6.349 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.931 -11.338 -8.084 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.192 -9.159 -6.010 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.087 -9.365 -7.503 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.021 -7.549 -7.251 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.456 -8.274 -8.786 1.00 0.00 H new ATOM 245 N ASN A 16 3.074 -9.918 -5.248 1.00 0.00 N ATOM 246 CA ASN A 16 2.415 -10.040 -3.957 1.00 0.00 C ATOM 247 C ASN A 16 0.908 -10.178 -4.108 1.00 0.00 C ATOM 248 O ASN A 16 0.285 -10.696 -3.193 1.00 0.00 O ATOM 249 CB ASN A 16 2.672 -8.805 -3.076 1.00 0.00 C ATOM 250 CG ASN A 16 4.063 -8.249 -3.256 1.00 0.00 C ATOM 251 OD1 ASN A 16 4.202 -7.273 -4.139 1.00 0.00 O flip ATOM 252 ND2 ASN A 16 5.030 -8.734 -2.689 1.00 0.00 N flip ATOM 0 H ASN A 16 3.447 -8.984 -5.418 1.00 0.00 H new ATOM 0 HA ASN A 16 2.831 -10.934 -3.492 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.941 -8.033 -3.316 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.523 -9.071 -2.030 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.900 -9.486 -2.012 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.967 -8.387 -2.893 1.00 0.00 H new ATOM 259 N HIS A 17 0.311 -9.702 -5.211 1.00 0.00 N ATOM 260 CA HIS A 17 -1.137 -9.529 -5.355 1.00 0.00 C ATOM 261 C HIS A 17 -1.880 -10.827 -4.996 1.00 0.00 C ATOM 262 O HIS A 17 -2.923 -10.778 -4.347 1.00 0.00 O ATOM 263 CB HIS A 17 -1.444 -9.002 -6.776 1.00 0.00 C ATOM 264 CG HIS A 17 -2.830 -8.438 -7.016 1.00 0.00 C ATOM 265 ND1 HIS A 17 -3.144 -7.238 -7.631 1.00 0.00 N ATOM 266 CD2 HIS A 17 -4.013 -9.072 -6.756 1.00 0.00 C ATOM 267 CE1 HIS A 17 -4.486 -7.147 -7.697 1.00 0.00 C ATOM 268 NE2 HIS A 17 -5.049 -8.266 -7.225 1.00 0.00 N ATOM 0 H HIS A 17 0.833 -9.422 -6.041 1.00 0.00 H new ATOM 0 HA HIS A 17 -1.505 -8.783 -4.650 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -0.717 -8.226 -7.014 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -1.283 -9.817 -7.482 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -4.125 -10.031 -6.271 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.030 -6.294 -8.076 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -6.045 -8.486 -7.211 1.00 0.00 H new ATOM 276 N LYS A 18 -1.300 -11.993 -5.308 1.00 0.00 N ATOM 277 CA LYS A 18 -1.836 -13.308 -4.976 1.00 0.00 C ATOM 278 C LYS A 18 -2.290 -13.453 -3.523 1.00 0.00 C ATOM 279 O LYS A 18 -3.279 -14.137 -3.292 1.00 0.00 O ATOM 280 CB LYS A 18 -0.823 -14.388 -5.394 1.00 0.00 C ATOM 281 CG LYS A 18 0.514 -14.404 -4.651 1.00 0.00 C ATOM 282 CD LYS A 18 0.526 -15.361 -3.460 1.00 0.00 C ATOM 283 CE LYS A 18 1.937 -15.269 -2.886 1.00 0.00 C ATOM 284 NZ LYS A 18 2.175 -16.142 -1.716 1.00 0.00 N ATOM 0 H LYS A 18 -0.416 -12.042 -5.815 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.756 -13.440 -5.545 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -1.294 -15.363 -5.267 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.619 -14.269 -6.458 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.305 -14.687 -5.345 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.741 -13.397 -4.302 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.220 -15.076 -2.718 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.293 -16.379 -3.771 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.652 -15.525 -3.668 1.00 0.00 H new ATOM 0 HE3 LYS A 18 2.134 -14.236 -2.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.154 -16.021 -1.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.518 -15.885 -0.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.020 -17.134 -1.986 1.00 0.00 H new ATOM 298 N VAL A 19 -1.641 -12.800 -2.552 1.00 0.00 N ATOM 299 CA VAL A 19 -1.992 -12.981 -1.146 1.00 0.00 C ATOM 300 C VAL A 19 -3.446 -12.594 -0.879 1.00 0.00 C ATOM 301 O VAL A 19 -4.102 -13.252 -0.075 1.00 0.00 O ATOM 302 CB VAL A 19 -1.024 -12.236 -0.204 1.00 0.00 C ATOM 303 CG1 VAL A 19 0.424 -12.704 -0.404 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.120 -10.715 -0.277 1.00 0.00 C ATOM 0 H VAL A 19 -0.875 -12.146 -2.716 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.889 -14.044 -0.927 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.347 -12.503 0.802 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.080 -12.159 0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.493 -13.772 -0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.729 -12.514 -1.433 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.406 -10.272 0.417 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.894 -10.384 -1.291 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.129 -10.401 -0.009 1.00 0.00 H new ATOM 314 N MET A 20 -3.978 -11.571 -1.554 1.00 0.00 N ATOM 315 CA MET A 20 -5.357 -11.160 -1.334 1.00 0.00 C ATOM 316 C MET A 20 -6.358 -11.994 -2.129 1.00 0.00 C ATOM 317 O MET A 20 -7.556 -11.908 -1.869 1.00 0.00 O ATOM 318 CB MET A 20 -5.535 -9.672 -1.623 1.00 0.00 C ATOM 319 CG MET A 20 -5.306 -9.265 -3.085 1.00 0.00 C ATOM 320 SD MET A 20 -6.275 -7.837 -3.619 1.00 0.00 S ATOM 321 CE MET A 20 -5.991 -6.748 -2.204 1.00 0.00 C ATOM 0 H MET A 20 -3.476 -11.020 -2.250 1.00 0.00 H new ATOM 0 HA MET A 20 -5.571 -11.339 -0.280 1.00 0.00 H new ATOM 0 HB2 MET A 20 -6.544 -9.379 -1.333 1.00 0.00 H new ATOM 0 HB3 MET A 20 -4.846 -9.110 -0.993 1.00 0.00 H new ATOM 0 HG2 MET A 20 -4.248 -9.045 -3.227 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.545 -10.112 -3.728 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.948 -6.405 -1.811 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.454 -7.293 -1.427 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.399 -5.889 -2.519 1.00 0.00 H new ATOM 331 N LEU A 21 -5.891 -12.792 -3.092 1.00 0.00 N ATOM 332 CA LEU A 21 -6.742 -13.679 -3.876 1.00 0.00 C ATOM 333 C LEU A 21 -7.050 -14.952 -3.084 1.00 0.00 C ATOM 334 O LEU A 21 -7.918 -15.730 -3.483 1.00 0.00 O ATOM 335 CB LEU A 21 -6.057 -14.035 -5.209 1.00 0.00 C ATOM 336 CG LEU A 21 -5.569 -12.828 -6.034 1.00 0.00 C ATOM 337 CD1 LEU A 21 -4.967 -13.323 -7.354 1.00 0.00 C ATOM 338 CD2 LEU A 21 -6.674 -11.797 -6.300 1.00 0.00 C ATOM 0 H LEU A 21 -4.905 -12.838 -3.348 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.679 -13.164 -4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.205 -14.682 -5.001 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.755 -14.612 -5.816 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.809 -12.315 -5.445 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.621 -12.470 -7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -4.126 -13.984 -7.145 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.725 -13.867 -7.918 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -6.268 -10.972 -6.885 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.486 -12.269 -6.853 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.053 -11.417 -5.351 1.00 0.00 H new ATOM 350 N ASP A 22 -6.347 -15.182 -1.973 1.00 0.00 N ATOM 351 CA ASP A 22 -6.492 -16.362 -1.145 1.00 0.00 C ATOM 352 C ASP A 22 -7.354 -16.000 0.048 1.00 0.00 C ATOM 353 O ASP A 22 -6.901 -15.404 1.020 1.00 0.00 O ATOM 354 CB ASP A 22 -5.137 -16.977 -0.777 1.00 0.00 C ATOM 355 CG ASP A 22 -4.431 -17.598 -1.990 1.00 0.00 C ATOM 356 OD1 ASP A 22 -5.119 -18.229 -2.840 1.00 0.00 O ATOM 357 OD2 ASP A 22 -3.193 -17.477 -2.094 1.00 0.00 O ATOM 0 H ASP A 22 -5.645 -14.530 -1.623 1.00 0.00 H new ATOM 0 HA ASP A 22 -6.996 -17.154 -1.698 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -4.498 -16.209 -0.341 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -5.283 -17.741 -0.013 1.00 0.00 H new ATOM 362 N HIS A 23 -8.629 -16.363 -0.049 1.00 0.00 N ATOM 363 CA HIS A 23 -9.664 -16.107 0.946 1.00 0.00 C ATOM 364 C HIS A 23 -9.354 -16.723 2.322 1.00 0.00 C ATOM 365 O HIS A 23 -9.874 -16.281 3.345 1.00 0.00 O ATOM 366 CB HIS A 23 -10.997 -16.620 0.397 1.00 0.00 C ATOM 367 CG HIS A 23 -12.140 -16.201 1.271 1.00 0.00 C ATOM 368 ND1 HIS A 23 -12.837 -17.001 2.140 1.00 0.00 N ATOM 369 CD2 HIS A 23 -12.513 -14.910 1.506 1.00 0.00 C ATOM 370 CE1 HIS A 23 -13.608 -16.206 2.895 1.00 0.00 C ATOM 371 NE2 HIS A 23 -13.476 -14.924 2.516 1.00 0.00 N ATOM 0 H HIS A 23 -8.985 -16.867 -0.861 1.00 0.00 H new ATOM 0 HA HIS A 23 -9.711 -15.032 1.120 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.149 -16.238 -0.613 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -10.970 -17.707 0.326 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -12.779 -18.018 2.201 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -12.132 -14.035 1.001 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -14.246 -16.548 3.696 1.00 0.00 H new ATOM 379 N SER A 24 -8.460 -17.706 2.368 1.00 0.00 N ATOM 380 CA SER A 24 -7.875 -18.210 3.611 1.00 0.00 C ATOM 381 C SER A 24 -7.124 -17.104 4.371 1.00 0.00 C ATOM 382 O SER A 24 -7.150 -17.066 5.603 1.00 0.00 O ATOM 383 CB SER A 24 -6.931 -19.383 3.318 1.00 0.00 C ATOM 384 OG SER A 24 -7.460 -20.607 3.791 1.00 0.00 O ATOM 0 H SER A 24 -8.116 -18.182 1.534 1.00 0.00 H new ATOM 0 HA SER A 24 -8.691 -18.557 4.244 1.00 0.00 H new ATOM 0 HB2 SER A 24 -6.757 -19.452 2.244 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.964 -19.199 3.786 1.00 0.00 H new ATOM 0 HG SER A 24 -6.835 -21.334 3.587 1.00 0.00 H new ATOM 390 N HIS A 25 -6.438 -16.205 3.662 1.00 0.00 N ATOM 391 CA HIS A 25 -5.858 -15.016 4.265 1.00 0.00 C ATOM 392 C HIS A 25 -6.969 -14.011 4.583 1.00 0.00 C ATOM 393 O HIS A 25 -6.896 -13.351 5.614 1.00 0.00 O ATOM 394 CB HIS A 25 -4.797 -14.404 3.341 1.00 0.00 C ATOM 395 CG HIS A 25 -3.719 -15.346 2.846 1.00 0.00 C ATOM 396 ND1 HIS A 25 -3.049 -15.204 1.658 1.00 0.00 N ATOM 397 CD2 HIS A 25 -3.235 -16.476 3.449 1.00 0.00 C ATOM 398 CE1 HIS A 25 -2.168 -16.212 1.549 1.00 0.00 C ATOM 399 NE2 HIS A 25 -2.226 -17.006 2.632 1.00 0.00 N ATOM 0 H HIS A 25 -6.273 -16.285 2.659 1.00 0.00 H new ATOM 0 HA HIS A 25 -5.360 -15.289 5.196 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.302 -13.976 2.475 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.316 -13.580 3.869 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -3.195 -14.461 0.975 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -3.571 -16.887 4.389 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -1.506 -16.363 0.709 1.00 0.00 H new ATOM 407 N GLY A 26 -8.009 -13.919 3.744 1.00 0.00 N ATOM 408 CA GLY A 26 -9.249 -13.200 4.023 1.00 0.00 C ATOM 409 C GLY A 26 -9.841 -12.537 2.778 1.00 0.00 C ATOM 410 O GLY A 26 -9.338 -12.694 1.661 1.00 0.00 O ATOM 0 H GLY A 26 -8.006 -14.359 2.824 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.979 -13.892 4.443 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.060 -12.439 4.780 1.00 0.00 H new ATOM 414 N LEU A 27 -10.928 -11.787 2.972 1.00 0.00 N ATOM 415 CA LEU A 27 -11.623 -11.061 1.908 1.00 0.00 C ATOM 416 C LEU A 27 -10.813 -9.894 1.350 1.00 0.00 C ATOM 417 O LEU A 27 -10.119 -9.212 2.100 1.00 0.00 O ATOM 418 CB LEU A 27 -12.935 -10.483 2.452 1.00 0.00 C ATOM 419 CG LEU A 27 -14.123 -11.453 2.449 1.00 0.00 C ATOM 420 CD1 LEU A 27 -15.344 -10.700 2.960 1.00 0.00 C ATOM 421 CD2 LEU A 27 -14.504 -11.966 1.059 1.00 0.00 C ATOM 0 H LEU A 27 -11.357 -11.665 3.889 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.791 -11.782 1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -12.768 -10.141 3.473 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.200 -9.606 1.862 1.00 0.00 H new ATOM 0 HG LEU A 27 -13.826 -12.304 3.063 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -16.206 -11.367 2.968 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -15.153 -10.341 3.971 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -15.548 -9.852 2.306 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.352 -12.646 1.142 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -14.775 -11.124 0.422 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -13.657 -12.494 0.621 1.00 0.00 H new ATOM 433 N ALA A 28 -11.012 -9.591 0.066 1.00 0.00 N ATOM 434 CA ALA A 28 -10.558 -8.397 -0.636 1.00 0.00 C ATOM 435 C ALA A 28 -11.374 -8.251 -1.926 1.00 0.00 C ATOM 436 O ALA A 28 -11.226 -9.068 -2.838 1.00 0.00 O ATOM 437 CB ALA A 28 -9.070 -8.507 -0.970 1.00 0.00 C ATOM 0 H ALA A 28 -11.530 -10.218 -0.549 1.00 0.00 H new ATOM 0 HA ALA A 28 -10.700 -7.523 -0.001 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.747 -7.607 -1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.497 -8.616 -0.049 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -8.903 -9.377 -1.606 1.00 0.00 H new ATOM 443 N ALA A 29 -12.245 -7.245 -2.007 1.00 0.00 N ATOM 444 CA ALA A 29 -13.096 -6.990 -3.171 1.00 0.00 C ATOM 445 C ALA A 29 -12.983 -5.528 -3.584 1.00 0.00 C ATOM 446 O ALA A 29 -12.805 -4.659 -2.732 1.00 0.00 O ATOM 447 CB ALA A 29 -14.547 -7.349 -2.847 1.00 0.00 C ATOM 0 H ALA A 29 -12.382 -6.572 -1.253 1.00 0.00 H new ATOM 0 HA ALA A 29 -12.765 -7.612 -4.002 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.173 -7.156 -3.718 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -14.610 -8.404 -2.581 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -14.894 -6.743 -2.010 1.00 0.00 H new ATOM 453 N PHE A 30 -13.082 -5.275 -4.886 1.00 0.00 N ATOM 454 CA PHE A 30 -12.936 -3.988 -5.555 1.00 0.00 C ATOM 455 C PHE A 30 -14.121 -3.083 -5.188 1.00 0.00 C ATOM 456 O PHE A 30 -15.122 -3.030 -5.900 1.00 0.00 O ATOM 457 CB PHE A 30 -12.837 -4.266 -7.070 1.00 0.00 C ATOM 458 CG PHE A 30 -12.252 -3.184 -7.964 1.00 0.00 C ATOM 459 CD1 PHE A 30 -12.460 -1.813 -7.722 1.00 0.00 C ATOM 460 CD2 PHE A 30 -11.468 -3.571 -9.067 1.00 0.00 C ATOM 461 CE1 PHE A 30 -11.846 -0.850 -8.537 1.00 0.00 C ATOM 462 CE2 PHE A 30 -10.884 -2.606 -9.904 1.00 0.00 C ATOM 463 CZ PHE A 30 -11.063 -1.242 -9.631 1.00 0.00 C ATOM 0 H PHE A 30 -13.282 -6.023 -5.551 1.00 0.00 H new ATOM 0 HA PHE A 30 -12.036 -3.460 -5.239 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.239 -5.168 -7.204 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.840 -4.491 -7.433 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -13.095 -1.501 -6.906 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -11.314 -4.620 -9.272 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -11.978 0.200 -8.320 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -10.298 -2.914 -10.757 1.00 0.00 H new ATOM 0 HZ PHE A 30 -10.600 -0.497 -10.261 1.00 0.00 H new ATOM 473 N ARG A 31 -14.027 -2.350 -4.082 1.00 0.00 N ATOM 474 CA ARG A 31 -15.079 -1.468 -3.588 1.00 0.00 C ATOM 475 C ARG A 31 -14.664 -0.037 -3.940 1.00 0.00 C ATOM 476 O ARG A 31 -14.399 0.787 -3.060 1.00 0.00 O ATOM 477 CB ARG A 31 -15.249 -1.738 -2.086 1.00 0.00 C ATOM 478 CG ARG A 31 -16.497 -1.162 -1.400 1.00 0.00 C ATOM 479 CD ARG A 31 -17.804 -1.886 -1.746 1.00 0.00 C ATOM 480 NE ARG A 31 -18.365 -2.573 -0.567 1.00 0.00 N ATOM 481 CZ ARG A 31 -19.346 -2.136 0.233 1.00 0.00 C ATOM 482 NH1 ARG A 31 -20.033 -1.045 -0.069 1.00 0.00 N ATOM 483 NH2 ARG A 31 -19.645 -2.808 1.334 1.00 0.00 N ATOM 0 H ARG A 31 -13.196 -2.353 -3.490 1.00 0.00 H new ATOM 0 HA ARG A 31 -16.055 -1.639 -4.042 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -15.251 -2.818 -1.936 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.371 -1.346 -1.572 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.352 -1.197 -0.320 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.595 -0.112 -1.674 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -18.529 -1.168 -2.130 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.622 -2.611 -2.539 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.961 -3.481 -0.336 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.818 -0.526 -0.920 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -20.778 -0.724 0.550 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.129 -3.655 1.570 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -20.392 -2.478 1.946 1.00 0.00 H new ATOM 497 N GLY A 32 -14.581 0.246 -5.240 1.00 0.00 N ATOM 498 CA GLY A 32 -14.177 1.544 -5.756 1.00 0.00 C ATOM 499 C GLY A 32 -12.663 1.678 -5.900 1.00 0.00 C ATOM 500 O GLY A 32 -11.894 0.750 -5.629 1.00 0.00 O ATOM 0 H GLY A 32 -14.797 -0.433 -5.970 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -14.645 1.706 -6.727 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -14.545 2.325 -5.090 1.00 0.00 H new ATOM 504 N ARG A 33 -12.211 2.851 -6.352 1.00 0.00 N ATOM 505 CA ARG A 33 -10.790 3.169 -6.528 1.00 0.00 C ATOM 506 C ARG A 33 -10.480 4.543 -5.958 1.00 0.00 C ATOM 507 O ARG A 33 -11.394 5.283 -5.610 1.00 0.00 O ATOM 508 CB ARG A 33 -10.383 3.038 -8.000 1.00 0.00 C ATOM 509 CG ARG A 33 -10.718 4.266 -8.857 1.00 0.00 C ATOM 510 CD ARG A 33 -10.669 3.857 -10.322 1.00 0.00 C ATOM 511 NE ARG A 33 -10.392 4.987 -11.223 1.00 0.00 N ATOM 512 CZ ARG A 33 -9.587 4.938 -12.288 1.00 0.00 C ATOM 513 NH1 ARG A 33 -9.073 3.784 -12.706 1.00 0.00 N ATOM 514 NH2 ARG A 33 -9.287 6.060 -12.922 1.00 0.00 N ATOM 0 H ARG A 33 -12.831 3.619 -6.610 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.192 2.448 -5.971 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -9.310 2.853 -8.054 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -10.878 2.166 -8.426 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.707 4.648 -8.603 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.007 5.069 -8.663 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.901 3.095 -10.456 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.620 3.403 -10.599 1.00 0.00 H new ATOM 0 HE ARG A 33 -10.850 5.875 -11.019 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -9.292 2.919 -12.211 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -8.460 3.764 -13.521 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -9.669 6.948 -12.596 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.674 6.037 -13.737 1.00 0.00 H new ATOM 528 N GLY A 34 -9.203 4.919 -5.894 1.00 0.00 N ATOM 529 CA GLY A 34 -8.835 6.153 -5.233 1.00 0.00 C ATOM 530 C GLY A 34 -7.459 6.669 -5.529 1.00 0.00 C ATOM 531 O GLY A 34 -6.707 6.072 -6.307 1.00 0.00 O ATOM 0 H GLY A 34 -8.424 4.391 -6.287 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.557 6.921 -5.510 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -8.923 6.006 -4.157 1.00 0.00 H new ATOM 535 N CYS A 35 -7.141 7.767 -4.848 1.00 0.00 N ATOM 536 CA CYS A 35 -5.796 8.285 -4.748 1.00 0.00 C ATOM 537 C CYS A 35 -5.512 8.927 -3.378 1.00 0.00 C ATOM 538 O CYS A 35 -6.471 9.292 -2.692 1.00 0.00 O ATOM 539 CB CYS A 35 -5.569 9.250 -5.909 1.00 0.00 C ATOM 540 SG CYS A 35 -6.316 10.881 -5.663 1.00 0.00 S ATOM 0 H CYS A 35 -7.830 8.326 -4.344 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.084 7.463 -4.820 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.497 9.372 -6.063 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -5.974 8.809 -6.820 1.00 0.00 H new ATOM 0 HG CYS A 35 -6.070 11.631 -6.696 1.00 0.00 H new ATOM 546 N THR A 36 -4.245 9.084 -2.957 1.00 0.00 N ATOM 547 CA THR A 36 -3.946 9.838 -1.742 1.00 0.00 C ATOM 548 C THR A 36 -4.036 11.339 -2.083 1.00 0.00 C ATOM 549 O THR A 36 -3.133 11.866 -2.726 1.00 0.00 O ATOM 550 CB THR A 36 -2.593 9.404 -1.117 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.448 9.930 -1.751 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.335 7.898 -1.111 1.00 0.00 C ATOM 0 H THR A 36 -3.429 8.703 -3.435 1.00 0.00 H new ATOM 0 HA THR A 36 -4.676 9.625 -0.962 1.00 0.00 H new ATOM 0 HB THR A 36 -2.722 9.800 -0.110 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.229 10.802 -1.360 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.366 7.697 -0.655 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.116 7.397 -0.539 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.339 7.524 -2.135 1.00 0.00 H new ATOM 560 N VAL A 37 -5.117 12.039 -1.731 1.00 0.00 N ATOM 561 CA VAL A 37 -5.209 13.478 -2.029 1.00 0.00 C ATOM 562 C VAL A 37 -4.263 14.302 -1.157 1.00 0.00 C ATOM 563 O VAL A 37 -3.726 15.320 -1.603 1.00 0.00 O ATOM 564 CB VAL A 37 -6.653 13.992 -1.920 1.00 0.00 C ATOM 565 CG1 VAL A 37 -7.293 13.815 -3.291 1.00 0.00 C ATOM 566 CG2 VAL A 37 -7.501 13.302 -0.832 1.00 0.00 C ATOM 0 H VAL A 37 -5.927 11.648 -1.250 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.892 13.605 -3.064 1.00 0.00 H new ATOM 0 HB VAL A 37 -6.618 15.037 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -8.324 14.169 -3.260 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.735 14.389 -4.030 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.279 12.760 -3.565 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.504 13.728 -0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.562 12.234 -1.041 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.037 13.456 0.142 1.00 0.00 H new ATOM 576 N GLU A 38 -4.005 13.841 0.063 1.00 0.00 N ATOM 577 CA GLU A 38 -2.766 14.156 0.734 1.00 0.00 C ATOM 578 C GLU A 38 -1.692 13.393 -0.020 1.00 0.00 C ATOM 579 O GLU A 38 -1.734 12.164 -0.085 1.00 0.00 O ATOM 580 CB GLU A 38 -2.838 13.724 2.204 1.00 0.00 C ATOM 581 CG GLU A 38 -3.050 14.937 3.110 1.00 0.00 C ATOM 582 CD GLU A 38 -3.911 14.605 4.318 1.00 0.00 C ATOM 583 OE1 GLU A 38 -3.498 13.799 5.180 1.00 0.00 O ATOM 584 OE2 GLU A 38 -5.048 15.113 4.404 1.00 0.00 O ATOM 0 H GLU A 38 -4.641 13.250 0.599 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.555 15.225 0.737 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.654 13.014 2.341 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.918 13.211 2.484 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.083 15.311 3.446 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.520 15.738 2.539 1.00 0.00 H new ATOM 591 N SER A 39 -0.742 14.111 -0.610 1.00 0.00 N ATOM 592 CA SER A 39 0.461 13.487 -1.123 1.00 0.00 C ATOM 593 C SER A 39 1.157 12.752 0.034 1.00 0.00 C ATOM 594 O SER A 39 1.108 13.247 1.163 1.00 0.00 O ATOM 595 CB SER A 39 1.358 14.577 -1.715 1.00 0.00 C ATOM 596 OG SER A 39 0.617 15.474 -2.531 1.00 0.00 O ATOM 0 H SER A 39 -0.786 15.121 -0.742 1.00 0.00 H new ATOM 0 HA SER A 39 0.234 12.764 -1.906 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.840 15.130 -0.909 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.151 14.117 -2.305 1.00 0.00 H new ATOM 0 HG SER A 39 0.144 14.970 -3.226 1.00 0.00 H new ATOM 602 N PHE A 40 1.829 11.626 -0.224 1.00 0.00 N ATOM 603 CA PHE A 40 2.704 11.010 0.778 1.00 0.00 C ATOM 604 C PHE A 40 4.003 10.605 0.074 1.00 0.00 C ATOM 605 O PHE A 40 3.956 10.260 -1.107 1.00 0.00 O ATOM 606 CB PHE A 40 2.021 9.735 1.274 1.00 0.00 C ATOM 607 CG PHE A 40 0.984 9.966 2.343 1.00 0.00 C ATOM 608 CD1 PHE A 40 1.326 10.052 3.701 1.00 0.00 C ATOM 609 CD2 PHE A 40 -0.353 10.114 1.944 1.00 0.00 C ATOM 610 CE1 PHE A 40 0.323 10.275 4.666 1.00 0.00 C ATOM 611 CE2 PHE A 40 -1.347 10.318 2.904 1.00 0.00 C ATOM 612 CZ PHE A 40 -1.022 10.367 4.264 1.00 0.00 C ATOM 0 H PHE A 40 1.785 11.125 -1.112 1.00 0.00 H new ATOM 0 HA PHE A 40 2.901 11.694 1.604 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.549 9.236 0.428 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.781 9.056 1.661 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.357 9.947 4.007 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.613 10.070 0.897 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.586 10.375 5.709 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -2.374 10.439 2.594 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.802 10.475 5.003 1.00 0.00 H new ATOM 622 N PRO A 41 5.139 10.532 0.783 1.00 0.00 N ATOM 623 CA PRO A 41 6.446 10.107 0.268 1.00 0.00 C ATOM 624 C PRO A 41 6.561 8.587 0.104 1.00 0.00 C ATOM 625 O PRO A 41 6.447 7.837 1.075 1.00 0.00 O ATOM 626 CB PRO A 41 7.476 10.629 1.273 1.00 0.00 C ATOM 627 CG PRO A 41 6.656 10.768 2.551 1.00 0.00 C ATOM 628 CD PRO A 41 5.277 11.143 2.087 1.00 0.00 C ATOM 0 HA PRO A 41 6.605 10.508 -0.733 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.307 9.935 1.399 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.901 11.582 0.959 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.643 9.836 3.115 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.073 11.532 3.207 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.516 10.777 2.776 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.161 12.225 2.030 1.00 0.00 H new ATOM 636 N LEU A 42 6.842 8.147 -1.125 1.00 0.00 N ATOM 637 CA LEU A 42 6.928 6.755 -1.559 1.00 0.00 C ATOM 638 C LEU A 42 8.361 6.465 -2.009 1.00 0.00 C ATOM 639 O LEU A 42 8.761 6.995 -3.047 1.00 0.00 O ATOM 640 CB LEU A 42 5.941 6.568 -2.737 1.00 0.00 C ATOM 641 CG LEU A 42 5.801 5.127 -3.259 1.00 0.00 C ATOM 642 CD1 LEU A 42 5.101 4.186 -2.272 1.00 0.00 C ATOM 643 CD2 LEU A 42 5.085 5.038 -4.624 1.00 0.00 C ATOM 0 H LEU A 42 7.027 8.796 -1.890 1.00 0.00 H new ATOM 0 HA LEU A 42 6.672 6.070 -0.751 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.958 6.920 -2.424 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.261 7.205 -3.561 1.00 0.00 H new ATOM 0 HG LEU A 42 6.833 4.798 -3.382 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.036 3.188 -2.705 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.671 4.143 -1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.097 4.557 -2.065 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.020 3.995 -4.933 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.081 5.454 -4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.648 5.603 -5.367 1.00 0.00 H new ATOM 655 N VAL A 43 9.137 5.633 -1.299 1.00 0.00 N ATOM 656 CA VAL A 43 10.537 5.361 -1.667 1.00 0.00 C ATOM 657 C VAL A 43 10.827 3.860 -1.743 1.00 0.00 C ATOM 658 O VAL A 43 10.267 3.074 -0.980 1.00 0.00 O ATOM 659 CB VAL A 43 11.531 6.063 -0.711 1.00 0.00 C ATOM 660 CG1 VAL A 43 11.330 7.574 -0.697 1.00 0.00 C ATOM 661 CG2 VAL A 43 11.471 5.570 0.738 1.00 0.00 C ATOM 0 H VAL A 43 8.820 5.136 -0.466 1.00 0.00 H new ATOM 0 HA VAL A 43 10.682 5.778 -2.664 1.00 0.00 H new ATOM 0 HB VAL A 43 12.509 5.804 -1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 43 12.047 8.030 -0.014 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.482 7.971 -1.701 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.317 7.803 -0.366 1.00 0.00 H new ATOM 0 HG21 VAL A 43 12.200 6.115 1.338 1.00 0.00 H new ATOM 0 HG22 VAL A 43 10.472 5.739 1.139 1.00 0.00 H new ATOM 0 HG23 VAL A 43 11.699 4.505 0.770 1.00 0.00 H new ATOM 671 N ILE A 44 11.740 3.468 -2.634 1.00 0.00 N ATOM 672 CA ILE A 44 12.309 2.115 -2.689 1.00 0.00 C ATOM 673 C ILE A 44 13.500 2.100 -1.734 1.00 0.00 C ATOM 674 O ILE A 44 14.374 2.958 -1.860 1.00 0.00 O ATOM 675 CB ILE A 44 12.740 1.736 -4.130 1.00 0.00 C ATOM 676 CG1 ILE A 44 11.541 1.954 -5.076 1.00 0.00 C ATOM 677 CG2 ILE A 44 13.268 0.282 -4.210 1.00 0.00 C ATOM 678 CD1 ILE A 44 11.781 1.604 -6.537 1.00 0.00 C ATOM 0 H ILE A 44 12.113 4.091 -3.351 1.00 0.00 H new ATOM 0 HA ILE A 44 11.565 1.375 -2.394 1.00 0.00 H new ATOM 0 HB ILE A 44 13.567 2.377 -4.436 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.702 1.360 -4.712 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.241 3.000 -5.017 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.559 0.057 -5.236 1.00 0.00 H new ATOM 0 HG22 ILE A 44 14.132 0.172 -3.555 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.485 -0.407 -3.895 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.874 1.795 -7.111 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.594 2.215 -6.929 1.00 0.00 H new ATOM 0 HD13 ILE A 44 12.047 0.550 -6.620 1.00 0.00 H new ATOM 690 N ALA A 45 13.556 1.133 -0.812 1.00 0.00 N ATOM 691 CA ALA A 45 14.708 0.960 0.065 1.00 0.00 C ATOM 692 C ALA A 45 15.034 -0.520 0.307 1.00 0.00 C ATOM 693 O ALA A 45 14.271 -1.421 -0.067 1.00 0.00 O ATOM 694 CB ALA A 45 14.442 1.693 1.385 1.00 0.00 C ATOM 0 H ALA A 45 12.809 0.456 -0.657 1.00 0.00 H new ATOM 0 HA ALA A 45 15.584 1.389 -0.422 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.298 1.570 2.048 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.286 2.753 1.187 1.00 0.00 H new ATOM 0 HB3 ALA A 45 13.553 1.278 1.859 1.00 0.00 H new ATOM 700 N GLY A 46 16.155 -0.753 0.988 1.00 0.00 N ATOM 701 CA GLY A 46 16.603 -2.034 1.503 1.00 0.00 C ATOM 702 C GLY A 46 17.238 -2.928 0.432 1.00 0.00 C ATOM 703 O GLY A 46 17.435 -2.529 -0.722 1.00 0.00 O ATOM 0 H GLY A 46 16.811 -0.002 1.205 1.00 0.00 H new ATOM 0 HA2 GLY A 46 17.326 -1.865 2.301 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.755 -2.556 1.947 1.00 0.00 H new ATOM 707 N GLU A 47 17.571 -4.161 0.818 1.00 0.00 N ATOM 708 CA GLU A 47 18.355 -5.081 -0.001 1.00 0.00 C ATOM 709 C GLU A 47 17.504 -5.988 -0.904 1.00 0.00 C ATOM 710 O GLU A 47 18.056 -6.720 -1.728 1.00 0.00 O ATOM 711 CB GLU A 47 19.312 -5.891 0.893 1.00 0.00 C ATOM 712 CG GLU A 47 20.637 -6.079 0.143 1.00 0.00 C ATOM 713 CD GLU A 47 21.645 -6.987 0.841 1.00 0.00 C ATOM 714 OE1 GLU A 47 21.675 -7.073 2.088 1.00 0.00 O ATOM 715 OE2 GLU A 47 22.459 -7.592 0.104 1.00 0.00 O ATOM 0 H GLU A 47 17.299 -4.552 1.720 1.00 0.00 H new ATOM 0 HA GLU A 47 18.940 -4.475 -0.692 1.00 0.00 H new ATOM 0 HB2 GLU A 47 19.481 -5.371 1.836 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.874 -6.859 1.137 1.00 0.00 H new ATOM 0 HG2 GLU A 47 20.424 -6.488 -0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 47 21.094 -5.101 -0.009 1.00 0.00 H new ATOM 722 N HIS A 48 16.174 -5.922 -0.824 1.00 0.00 N ATOM 723 CA HIS A 48 15.257 -6.673 -1.679 1.00 0.00 C ATOM 724 C HIS A 48 14.359 -5.742 -2.508 1.00 0.00 C ATOM 725 O HIS A 48 13.417 -6.216 -3.144 1.00 0.00 O ATOM 726 CB HIS A 48 14.482 -7.687 -0.822 1.00 0.00 C ATOM 727 CG HIS A 48 15.255 -8.946 -0.540 1.00 0.00 C ATOM 728 ND1 HIS A 48 15.170 -10.177 -1.163 1.00 0.00 N ATOM 729 CD2 HIS A 48 16.164 -9.048 0.460 1.00 0.00 C ATOM 730 CE1 HIS A 48 16.045 -10.999 -0.551 1.00 0.00 C ATOM 731 NE2 HIS A 48 16.662 -10.356 0.461 1.00 0.00 N ATOM 0 H HIS A 48 15.694 -5.330 -0.146 1.00 0.00 H new ATOM 0 HA HIS A 48 15.823 -7.238 -2.419 1.00 0.00 H new ATOM 0 HB2 HIS A 48 14.208 -7.218 0.123 1.00 0.00 H new ATOM 0 HB3 HIS A 48 13.553 -7.946 -1.330 1.00 0.00 H new ATOM 0 HD2 HIS A 48 16.453 -8.258 1.137 1.00 0.00 H new ATOM 0 HE1 HIS A 48 16.226 -12.026 -0.831 1.00 0.00 H new ATOM 0 HE2 HIS A 48 17.354 -10.746 1.101 1.00 0.00 H new ATOM 739 N ASN A 49 14.680 -4.442 -2.557 1.00 0.00 N ATOM 740 CA ASN A 49 13.952 -3.380 -3.254 1.00 0.00 C ATOM 741 C ASN A 49 12.479 -3.370 -2.828 1.00 0.00 C ATOM 742 O ASN A 49 11.587 -3.685 -3.620 1.00 0.00 O ATOM 743 CB ASN A 49 14.117 -3.484 -4.782 1.00 0.00 C ATOM 744 CG ASN A 49 15.553 -3.363 -5.268 1.00 0.00 C ATOM 745 OD1 ASN A 49 16.255 -2.422 -4.907 1.00 0.00 O ATOM 746 ND2 ASN A 49 15.979 -4.262 -6.141 1.00 0.00 N ATOM 0 H ASN A 49 15.508 -4.084 -2.080 1.00 0.00 H new ATOM 0 HA ASN A 49 14.386 -2.423 -2.964 1.00 0.00 H new ATOM 0 HB2 ASN A 49 13.713 -4.440 -5.115 1.00 0.00 H new ATOM 0 HB3 ASN A 49 13.520 -2.704 -5.254 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.916 -4.185 -6.536 1.00 0.00 H new ATOM 0 HD22 ASN A 49 15.370 -5.031 -6.419 1.00 0.00 H new ATOM 753 N ILE A 50 12.250 -2.940 -1.590 1.00 0.00 N ATOM 754 CA ILE A 50 11.041 -2.965 -0.769 1.00 0.00 C ATOM 755 C ILE A 50 10.444 -1.553 -0.745 1.00 0.00 C ATOM 756 O ILE A 50 11.035 -0.682 -0.108 1.00 0.00 O ATOM 757 CB ILE A 50 11.239 -3.614 0.625 1.00 0.00 C ATOM 758 CG1 ILE A 50 11.553 -5.118 0.437 1.00 0.00 C ATOM 759 CG2 ILE A 50 9.967 -3.476 1.475 1.00 0.00 C ATOM 760 CD1 ILE A 50 11.916 -5.889 1.714 1.00 0.00 C ATOM 0 H ILE A 50 13.012 -2.507 -1.069 1.00 0.00 H new ATOM 0 HA ILE A 50 10.312 -3.635 -1.224 1.00 0.00 H new ATOM 0 HB ILE A 50 12.060 -3.109 1.134 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.687 -5.596 -0.020 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.378 -5.212 -0.269 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.128 -3.938 2.449 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.732 -2.420 1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.137 -3.972 0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.116 -6.931 1.465 1.00 0.00 H new ATOM 0 HD12 ILE A 50 12.804 -5.447 2.166 1.00 0.00 H new ATOM 0 HD13 ILE A 50 11.086 -5.837 2.419 1.00 0.00 H new ATOM 772 N PRO A 51 9.539 -1.200 -1.675 1.00 0.00 N ATOM 773 CA PRO A 51 8.873 0.098 -1.664 1.00 0.00 C ATOM 774 C PRO A 51 8.046 0.329 -0.383 1.00 0.00 C ATOM 775 O PRO A 51 7.129 -0.449 -0.105 1.00 0.00 O ATOM 776 CB PRO A 51 7.997 0.073 -2.914 1.00 0.00 C ATOM 777 CG PRO A 51 7.632 -1.391 -3.115 1.00 0.00 C ATOM 778 CD PRO A 51 8.875 -2.108 -2.609 1.00 0.00 C ATOM 0 HA PRO A 51 9.586 0.923 -1.669 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.106 0.687 -2.783 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.532 0.468 -3.778 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.743 -1.670 -2.549 1.00 0.00 H new ATOM 0 HG3 PRO A 51 7.428 -1.619 -4.161 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.608 -3.042 -2.115 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.537 -2.363 -3.436 1.00 0.00 H new ATOM 786 N TRP A 52 8.298 1.430 0.339 1.00 0.00 N ATOM 787 CA TRP A 52 7.568 1.859 1.539 1.00 0.00 C ATOM 788 C TRP A 52 6.873 3.202 1.275 1.00 0.00 C ATOM 789 O TRP A 52 7.362 3.994 0.461 1.00 0.00 O ATOM 790 CB TRP A 52 8.528 2.096 2.722 1.00 0.00 C ATOM 791 CG TRP A 52 9.543 1.047 3.070 1.00 0.00 C ATOM 792 CD1 TRP A 52 10.647 0.748 2.354 1.00 0.00 C ATOM 793 CD2 TRP A 52 9.602 0.180 4.240 1.00 0.00 C ATOM 794 NE1 TRP A 52 11.309 -0.320 2.927 1.00 0.00 N ATOM 795 CE2 TRP A 52 10.698 -0.721 4.092 1.00 0.00 C ATOM 796 CE3 TRP A 52 8.829 0.056 5.410 1.00 0.00 C ATOM 797 CZ2 TRP A 52 10.966 -1.740 5.019 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.092 -0.950 6.351 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.151 -1.855 6.158 1.00 0.00 C ATOM 0 H TRP A 52 9.049 2.074 0.091 1.00 0.00 H new ATOM 0 HA TRP A 52 6.854 1.070 1.776 1.00 0.00 H new ATOM 0 HB2 TRP A 52 9.069 3.021 2.524 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.918 2.267 3.609 1.00 0.00 H new ATOM 0 HD1 TRP A 52 10.966 1.268 1.463 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.144 -0.756 2.536 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.019 0.748 5.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.786 -2.425 4.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.475 -1.031 7.233 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.337 -2.635 6.882 1.00 0.00 H new ATOM 810 N LEU A 53 5.816 3.513 2.036 1.00 0.00 N ATOM 811 CA LEU A 53 5.187 4.831 2.108 1.00 0.00 C ATOM 812 C LEU A 53 5.367 5.376 3.525 1.00 0.00 C ATOM 813 O LEU A 53 4.867 4.794 4.497 1.00 0.00 O ATOM 814 CB LEU A 53 3.700 4.736 1.715 1.00 0.00 C ATOM 815 CG LEU A 53 3.072 6.120 1.451 1.00 0.00 C ATOM 816 CD1 LEU A 53 3.416 6.582 0.032 1.00 0.00 C ATOM 817 CD2 LEU A 53 1.543 6.081 1.577 1.00 0.00 C ATOM 0 H LEU A 53 5.362 2.827 2.639 1.00 0.00 H new ATOM 0 HA LEU A 53 5.659 5.517 1.404 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.602 4.119 0.822 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.148 4.235 2.510 1.00 0.00 H new ATOM 0 HG LEU A 53 3.475 6.807 2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.970 7.560 -0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.498 6.651 -0.076 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.024 5.865 -0.689 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.137 7.074 1.384 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.136 5.375 0.853 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.269 5.766 2.584 1.00 0.00 H new ATOM 829 N LEU A 54 6.124 6.466 3.660 1.00 0.00 N ATOM 830 CA LEU A 54 6.328 7.120 4.949 1.00 0.00 C ATOM 831 C LEU A 54 5.128 8.028 5.214 1.00 0.00 C ATOM 832 O LEU A 54 4.588 8.637 4.288 1.00 0.00 O ATOM 833 CB LEU A 54 7.651 7.911 5.004 1.00 0.00 C ATOM 834 CG LEU A 54 8.898 7.173 4.491 1.00 0.00 C ATOM 835 CD1 LEU A 54 10.140 8.061 4.592 1.00 0.00 C ATOM 836 CD2 LEU A 54 9.113 5.883 5.275 1.00 0.00 C ATOM 0 H LEU A 54 6.609 6.916 2.884 1.00 0.00 H new ATOM 0 HA LEU A 54 6.406 6.360 5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.529 8.825 4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.830 8.211 6.037 1.00 0.00 H new ATOM 0 HG LEU A 54 8.736 6.927 3.442 1.00 0.00 H new ATOM 0 HD11 LEU A 54 11.008 7.515 4.223 1.00 0.00 H new ATOM 0 HD12 LEU A 54 9.994 8.960 3.993 1.00 0.00 H new ATOM 0 HD13 LEU A 54 10.303 8.341 5.633 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.000 5.372 4.899 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.249 6.117 6.331 1.00 0.00 H new ATOM 0 HD23 LEU A 54 8.244 5.236 5.156 1.00 0.00 H new ATOM 848 N TYR A 55 4.696 8.141 6.470 1.00 0.00 N ATOM 849 CA TYR A 55 3.545 8.966 6.813 1.00 0.00 C ATOM 850 C TYR A 55 3.973 10.431 6.880 1.00 0.00 C ATOM 851 O TYR A 55 4.395 10.912 7.936 1.00 0.00 O ATOM 852 CB TYR A 55 2.906 8.497 8.123 1.00 0.00 C ATOM 853 CG TYR A 55 1.565 9.152 8.410 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.430 8.745 7.687 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.441 10.158 9.386 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.843 9.264 7.996 1.00 0.00 C ATOM 857 CE2 TYR A 55 0.178 10.706 9.682 1.00 0.00 C ATOM 858 CZ TYR A 55 -0.974 10.242 9.009 1.00 0.00 C ATOM 859 OH TYR A 55 -2.196 10.713 9.388 1.00 0.00 O ATOM 0 H TYR A 55 5.128 7.670 7.265 1.00 0.00 H new ATOM 0 HA TYR A 55 2.784 8.865 6.039 1.00 0.00 H new ATOM 0 HB2 TYR A 55 2.773 7.416 8.087 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.588 8.707 8.947 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.535 8.027 6.887 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.317 10.511 9.910 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.715 8.916 7.462 1.00 0.00 H new ATOM 0 HE2 TYR A 55 0.090 11.484 10.426 1.00 0.00 H new ATOM 0 HH TYR A 55 -2.084 11.379 10.098 1.00 0.00 H new ATOM 869 N LEU A 56 3.910 11.138 5.752 1.00 0.00 N ATOM 870 CA LEU A 56 4.134 12.577 5.690 1.00 0.00 C ATOM 871 C LEU A 56 3.097 13.229 4.777 1.00 0.00 C ATOM 872 O LEU A 56 3.348 13.355 3.577 1.00 0.00 O ATOM 873 CB LEU A 56 5.581 12.942 5.327 1.00 0.00 C ATOM 874 CG LEU A 56 6.058 14.153 6.164 1.00 0.00 C ATOM 875 CD1 LEU A 56 7.462 13.875 6.679 1.00 0.00 C ATOM 876 CD2 LEU A 56 6.028 15.477 5.400 1.00 0.00 C ATOM 0 H LEU A 56 3.699 10.720 4.846 1.00 0.00 H new ATOM 0 HA LEU A 56 3.995 12.985 6.691 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.234 12.088 5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.648 13.177 4.265 1.00 0.00 H new ATOM 0 HG LEU A 56 5.357 14.270 6.991 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.807 14.723 7.270 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.451 12.980 7.301 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.135 13.723 5.836 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.375 16.280 6.050 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.678 15.409 4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.009 15.687 5.077 1.00 0.00 H new ATOM 888 N PRO A 57 1.915 13.569 5.312 1.00 0.00 N ATOM 889 CA PRO A 57 0.836 14.150 4.536 1.00 0.00 C ATOM 890 C PRO A 57 1.301 15.471 3.919 1.00 0.00 C ATOM 891 O PRO A 57 1.855 16.334 4.603 1.00 0.00 O ATOM 892 CB PRO A 57 -0.323 14.322 5.520 1.00 0.00 C ATOM 893 CG PRO A 57 0.343 14.422 6.887 1.00 0.00 C ATOM 894 CD PRO A 57 1.583 13.548 6.729 1.00 0.00 C ATOM 0 HA PRO A 57 0.522 13.528 3.698 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.904 15.217 5.296 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.010 13.477 5.475 1.00 0.00 H new ATOM 0 HG2 PRO A 57 0.603 15.451 7.135 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.309 14.058 7.681 1.00 0.00 H new ATOM 0 HD2 PRO A 57 2.409 13.931 7.328 1.00 0.00 H new ATOM 0 HD3 PRO A 57 1.388 12.531 7.068 1.00 0.00 H new ATOM 902 N GLY A 58 1.103 15.613 2.613 1.00 0.00 N ATOM 903 CA GLY A 58 1.450 16.798 1.851 1.00 0.00 C ATOM 904 C GLY A 58 2.885 16.802 1.323 1.00 0.00 C ATOM 905 O GLY A 58 3.309 17.834 0.807 1.00 0.00 O ATOM 0 H GLY A 58 0.683 14.880 2.041 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.764 16.889 1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.303 17.677 2.479 1.00 0.00 H new ATOM 909 N LYS A 59 3.645 15.706 1.422 1.00 0.00 N ATOM 910 CA LYS A 59 4.973 15.558 0.816 1.00 0.00 C ATOM 911 C LYS A 59 4.910 14.356 -0.122 1.00 0.00 C ATOM 912 O LYS A 59 3.996 13.552 -0.008 1.00 0.00 O ATOM 913 CB LYS A 59 5.964 15.394 1.980 1.00 0.00 C ATOM 914 CG LYS A 59 7.425 15.043 1.665 1.00 0.00 C ATOM 915 CD LYS A 59 8.154 16.112 0.839 1.00 0.00 C ATOM 916 CE LYS A 59 9.560 16.403 1.394 1.00 0.00 C ATOM 917 NZ LYS A 59 10.370 17.209 0.455 1.00 0.00 N ATOM 0 H LYS A 59 3.347 14.878 1.938 1.00 0.00 H new ATOM 0 HA LYS A 59 5.297 16.411 0.219 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.963 16.325 2.547 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.573 14.619 2.639 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.962 14.891 2.601 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.453 14.097 1.124 1.00 0.00 H new ATOM 0 HD2 LYS A 59 8.233 15.780 -0.196 1.00 0.00 H new ATOM 0 HD3 LYS A 59 7.568 17.031 0.835 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.473 16.931 2.343 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.071 15.462 1.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.309 17.382 0.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.475 16.694 -0.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.896 18.118 0.279 1.00 0.00 H new ATOM 931 N GLY A 60 5.860 14.176 -1.034 1.00 0.00 N ATOM 932 CA GLY A 60 5.799 13.083 -1.995 1.00 0.00 C ATOM 933 C GLY A 60 4.760 13.387 -3.060 1.00 0.00 C ATOM 934 O GLY A 60 4.805 14.474 -3.637 1.00 0.00 O ATOM 0 H GLY A 60 6.681 14.774 -1.127 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.775 12.940 -2.458 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.548 12.153 -1.485 1.00 0.00 H new ATOM 938 N HIS A 61 3.871 12.436 -3.349 1.00 0.00 N ATOM 939 CA HIS A 61 2.949 12.493 -4.480 1.00 0.00 C ATOM 940 C HIS A 61 1.604 11.850 -4.126 1.00 0.00 C ATOM 941 O HIS A 61 1.497 11.148 -3.117 1.00 0.00 O ATOM 942 CB HIS A 61 3.567 11.739 -5.658 1.00 0.00 C ATOM 943 CG HIS A 61 4.886 12.281 -6.150 1.00 0.00 C ATOM 944 ND1 HIS A 61 5.049 13.273 -7.090 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.131 11.909 -5.734 1.00 0.00 C ATOM 946 CE1 HIS A 61 6.363 13.509 -7.217 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.067 12.714 -6.393 1.00 0.00 N ATOM 0 H HIS A 61 3.771 11.588 -2.791 1.00 0.00 H new ATOM 0 HA HIS A 61 2.776 13.538 -4.738 1.00 0.00 H new ATOM 0 HB2 HIS A 61 3.706 10.697 -5.368 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.858 11.748 -6.486 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.355 11.130 -5.021 1.00 0.00 H new ATOM 0 HE1 HIS A 61 6.795 14.237 -7.888 1.00 0.00 H new ATOM 0 HE2 HIS A 61 8.080 12.700 -6.272 1.00 0.00 H new ATOM 955 N CYS A 62 0.593 12.065 -4.968 1.00 0.00 N ATOM 956 CA CYS A 62 -0.794 11.666 -4.782 1.00 0.00 C ATOM 957 C CYS A 62 -1.093 10.306 -5.390 1.00 0.00 C ATOM 958 O CYS A 62 -1.596 10.200 -6.508 1.00 0.00 O ATOM 959 CB CYS A 62 -1.722 12.735 -5.372 1.00 0.00 C ATOM 960 SG CYS A 62 -1.290 14.398 -4.783 1.00 0.00 S ATOM 0 H CYS A 62 0.734 12.553 -5.852 1.00 0.00 H new ATOM 0 HA CYS A 62 -0.972 11.577 -3.710 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -1.663 12.708 -6.460 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.754 12.510 -5.103 1.00 0.00 H new ATOM 0 HG CYS A 62 -2.099 15.269 -5.309 1.00 0.00 H new ATOM 966 N VAL A 63 -0.735 9.259 -4.659 1.00 0.00 N ATOM 967 CA VAL A 63 -0.655 7.921 -5.214 1.00 0.00 C ATOM 968 C VAL A 63 -1.993 7.339 -5.544 1.00 0.00 C ATOM 969 O VAL A 63 -2.897 7.483 -4.738 1.00 0.00 O ATOM 970 CB VAL A 63 0.245 7.057 -4.339 1.00 0.00 C ATOM 971 CG1 VAL A 63 0.230 7.008 -2.830 1.00 0.00 C ATOM 972 CG2 VAL A 63 0.503 5.648 -4.872 1.00 0.00 C ATOM 0 H VAL A 63 -0.494 9.316 -3.670 1.00 0.00 H new ATOM 0 HA VAL A 63 -0.178 7.966 -6.193 1.00 0.00 H new ATOM 0 HB VAL A 63 1.049 7.779 -4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 63 0.983 6.301 -2.481 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.450 7.998 -2.432 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -0.754 6.689 -2.486 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.153 5.111 -4.181 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -0.444 5.116 -4.967 1.00 0.00 H new ATOM 0 HG23 VAL A 63 0.984 5.711 -5.848 1.00 0.00 H new ATOM 982 N THR A 64 -2.137 6.696 -6.705 1.00 0.00 N ATOM 983 CA THR A 64 -3.414 6.102 -7.071 1.00 0.00 C ATOM 984 C THR A 64 -3.423 4.656 -6.573 1.00 0.00 C ATOM 985 O THR A 64 -2.363 4.030 -6.456 1.00 0.00 O ATOM 986 CB THR A 64 -3.731 6.288 -8.567 1.00 0.00 C ATOM 987 OG1 THR A 64 -3.146 5.294 -9.387 1.00 0.00 O ATOM 988 CG2 THR A 64 -3.325 7.668 -9.102 1.00 0.00 C ATOM 0 H THR A 64 -1.395 6.577 -7.395 1.00 0.00 H new ATOM 0 HA THR A 64 -4.240 6.619 -6.582 1.00 0.00 H new ATOM 0 HB THR A 64 -4.816 6.195 -8.620 1.00 0.00 H new ATOM 0 HG1 THR A 64 -3.382 5.462 -10.323 1.00 0.00 H new ATOM 0 HG21 THR A 64 -3.575 7.736 -10.161 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.860 8.443 -8.553 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.252 7.807 -8.973 1.00 0.00 H new ATOM 996 N GLY A 65 -4.605 4.122 -6.289 1.00 0.00 N ATOM 997 CA GLY A 65 -4.781 2.759 -5.829 1.00 0.00 C ATOM 998 C GLY A 65 -6.227 2.335 -6.026 1.00 0.00 C ATOM 999 O GLY A 65 -7.046 3.076 -6.581 1.00 0.00 O ATOM 0 H GLY A 65 -5.481 4.638 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.118 2.091 -6.379 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.510 2.682 -4.776 1.00 0.00 H new ATOM 1003 N GLU A 66 -6.537 1.136 -5.557 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.873 0.567 -5.498 1.00 0.00 C ATOM 1005 C GLU A 66 -8.303 0.600 -4.028 1.00 0.00 C ATOM 1006 O GLU A 66 -7.442 0.699 -3.143 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.782 -0.841 -6.108 1.00 0.00 C ATOM 1008 CG GLU A 66 -9.089 -1.625 -6.333 1.00 0.00 C ATOM 1009 CD GLU A 66 -8.843 -2.848 -7.243 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -8.092 -2.721 -8.227 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -9.297 -3.981 -6.915 1.00 0.00 O ATOM 0 H GLU A 66 -5.827 0.502 -5.189 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.629 1.112 -6.064 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.276 -0.755 -7.070 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.141 -1.442 -5.463 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.491 -1.954 -5.375 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -9.836 -0.973 -6.786 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.608 0.557 -3.758 1.00 0.00 N ATOM 1019 CA ILE A 67 -10.150 0.607 -2.408 1.00 0.00 C ATOM 1020 C ILE A 67 -10.782 -0.761 -2.192 1.00 0.00 C ATOM 1021 O ILE A 67 -11.762 -1.118 -2.845 1.00 0.00 O ATOM 1022 CB ILE A 67 -11.118 1.796 -2.217 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -10.411 3.137 -2.518 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -11.658 1.811 -0.773 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -11.371 4.327 -2.528 1.00 0.00 C ATOM 0 H ILE A 67 -10.323 0.486 -4.482 1.00 0.00 H new ATOM 0 HA ILE A 67 -9.386 0.793 -1.653 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.946 1.674 -2.915 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -9.636 3.309 -1.771 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.913 3.070 -3.485 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.339 2.653 -0.648 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.190 0.881 -0.574 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -10.827 1.910 -0.075 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.816 5.240 -2.745 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -12.132 4.174 -3.293 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.850 4.416 -1.553 1.00 0.00 H new ATOM 1037 N TYR A 68 -10.173 -1.569 -1.328 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.634 -2.924 -1.095 1.00 0.00 C ATOM 1039 C TYR A 68 -11.590 -2.942 0.078 1.00 0.00 C ATOM 1040 O TYR A 68 -11.183 -2.555 1.175 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.461 -3.872 -0.853 1.00 0.00 C ATOM 1042 CG TYR A 68 -8.680 -4.106 -2.117 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -9.245 -4.983 -3.058 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -7.481 -3.416 -2.404 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -8.635 -5.171 -4.299 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -6.868 -3.628 -3.653 1.00 0.00 C ATOM 1047 CZ TYR A 68 -7.439 -4.493 -4.607 1.00 0.00 C ATOM 1048 OH TYR A 68 -6.890 -4.600 -5.845 1.00 0.00 O ATOM 0 H TYR A 68 -9.356 -1.302 -0.778 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.157 -3.272 -1.986 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.805 -3.455 -0.089 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.832 -4.823 -0.470 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.155 -5.514 -2.820 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -7.045 -2.742 -1.682 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.080 -5.837 -5.024 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -5.944 -3.119 -3.884 1.00 0.00 H new ATOM 0 HH TYR A 68 -7.560 -4.945 -6.471 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.813 -3.442 -0.122 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.551 -4.029 0.984 1.00 0.00 C ATOM 1060 C GLU A 69 -12.818 -5.312 1.360 1.00 0.00 C ATOM 1061 O GLU A 69 -12.859 -6.312 0.635 1.00 0.00 O ATOM 1062 CB GLU A 69 -15.038 -4.302 0.691 1.00 0.00 C ATOM 1063 CG GLU A 69 -15.672 -4.853 1.987 1.00 0.00 C ATOM 1064 CD GLU A 69 -17.162 -5.194 1.933 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -17.879 -4.883 0.962 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -17.662 -5.741 2.946 1.00 0.00 O ATOM 0 H GLU A 69 -13.298 -3.450 -1.019 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.578 -3.313 1.805 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.541 -3.388 0.377 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.143 -5.020 -0.123 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.128 -5.752 2.276 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -15.520 -4.119 2.779 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.151 -5.271 2.502 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.632 -6.437 3.189 1.00 0.00 C ATOM 1075 C VAL A 70 -12.560 -6.725 4.375 1.00 0.00 C ATOM 1076 O VAL A 70 -13.395 -5.888 4.741 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.166 -6.179 3.602 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.271 -5.956 2.373 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -9.989 -4.989 4.557 1.00 0.00 C ATOM 0 H VAL A 70 -11.951 -4.398 2.989 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.616 -7.320 2.550 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.865 -7.081 4.135 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.246 -5.777 2.697 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.301 -6.840 1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.630 -5.093 1.813 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -8.933 -4.872 4.801 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.354 -4.080 4.078 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.555 -5.169 5.471 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.394 -7.874 5.021 1.00 0.00 N ATOM 1090 CA ASP A 71 -12.919 -8.103 6.368 1.00 0.00 C ATOM 1091 C ASP A 71 -11.764 -8.401 7.312 1.00 0.00 C ATOM 1092 O ASP A 71 -10.593 -8.425 6.911 1.00 0.00 O ATOM 1093 CB ASP A 71 -14.033 -9.173 6.397 1.00 0.00 C ATOM 1094 CG ASP A 71 -15.456 -8.598 6.290 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -15.880 -8.102 5.226 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -16.201 -8.644 7.295 1.00 0.00 O ATOM 0 H ASP A 71 -11.894 -8.672 4.630 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.411 -7.195 6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.872 -9.872 5.577 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.951 -9.743 7.322 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.109 -8.582 8.587 1.00 0.00 N ATOM 1102 CA GLU A 72 -11.233 -8.696 9.745 1.00 0.00 C ATOM 1103 C GLU A 72 -10.065 -9.622 9.450 1.00 0.00 C ATOM 1104 O GLU A 72 -8.919 -9.266 9.725 1.00 0.00 O ATOM 1105 CB GLU A 72 -12.026 -9.207 10.969 1.00 0.00 C ATOM 1106 CG GLU A 72 -11.833 -8.241 12.140 1.00 0.00 C ATOM 1107 CD GLU A 72 -12.178 -8.824 13.516 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -12.900 -9.838 13.618 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -11.608 -8.330 14.525 1.00 0.00 O ATOM 0 H GLU A 72 -13.090 -8.658 8.854 1.00 0.00 H new ATOM 0 HA GLU A 72 -10.836 -7.706 9.971 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -13.084 -9.289 10.722 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.685 -10.204 11.246 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -10.795 -7.908 12.151 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.449 -7.358 11.970 1.00 0.00 H new ATOM 1116 N GLN A 73 -10.369 -10.776 8.858 1.00 0.00 N ATOM 1117 CA GLN A 73 -9.409 -11.822 8.577 1.00 0.00 C ATOM 1118 C GLN A 73 -8.263 -11.307 7.702 1.00 0.00 C ATOM 1119 O GLN A 73 -7.099 -11.554 8.023 1.00 0.00 O ATOM 1120 CB GLN A 73 -10.154 -13.016 7.955 1.00 0.00 C ATOM 1121 CG GLN A 73 -9.373 -14.339 7.960 1.00 0.00 C ATOM 1122 CD GLN A 73 -8.775 -14.607 9.334 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -9.480 -14.971 10.274 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -7.505 -14.287 9.503 1.00 0.00 N ATOM 0 H GLN A 73 -11.315 -11.007 8.556 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.937 -12.157 9.501 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.091 -13.162 8.493 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.413 -12.768 6.926 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.035 -15.159 7.680 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.579 -14.301 7.214 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.944 -13.988 8.705 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.085 -14.339 10.431 1.00 0.00 H new ATOM 1133 N MET A 74 -8.582 -10.557 6.640 1.00 0.00 N ATOM 1134 CA MET A 74 -7.554 -10.090 5.712 1.00 0.00 C ATOM 1135 C MET A 74 -6.739 -9.000 6.377 1.00 0.00 C ATOM 1136 O MET A 74 -5.512 -9.005 6.312 1.00 0.00 O ATOM 1137 CB MET A 74 -8.210 -9.574 4.429 1.00 0.00 C ATOM 1138 CG MET A 74 -7.289 -8.766 3.500 1.00 0.00 C ATOM 1139 SD MET A 74 -5.801 -9.598 2.884 1.00 0.00 S ATOM 1140 CE MET A 74 -6.531 -11.115 2.241 1.00 0.00 C ATOM 0 H MET A 74 -9.531 -10.266 6.407 1.00 0.00 H new ATOM 0 HA MET A 74 -6.890 -10.914 5.449 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.603 -10.426 3.873 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.062 -8.951 4.701 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.876 -8.442 2.640 1.00 0.00 H new ATOM 0 HG3 MET A 74 -6.978 -7.866 4.031 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.742 -11.770 1.870 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.078 -11.621 3.036 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.215 -10.873 1.427 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.418 -8.053 7.021 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.708 -6.963 7.664 1.00 0.00 C ATOM 1152 C LEU A 75 -5.796 -7.519 8.778 1.00 0.00 C ATOM 1153 O LEU A 75 -4.729 -6.966 9.010 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.708 -5.914 8.181 1.00 0.00 C ATOM 1155 CG LEU A 75 -7.366 -4.426 7.955 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -8.224 -3.571 8.898 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -5.903 -4.034 8.154 1.00 0.00 C ATOM 0 H LEU A 75 -8.434 -8.021 7.108 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.065 -6.459 6.943 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.673 -6.111 7.714 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -7.835 -6.070 9.252 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.576 -4.248 6.900 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.991 -2.517 8.747 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.279 -3.743 8.686 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.012 -3.845 9.932 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.784 -2.967 7.968 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.602 -4.260 9.177 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.278 -4.595 7.459 1.00 0.00 H new ATOM 1169 N ARG A 76 -6.173 -8.607 9.471 1.00 0.00 N ATOM 1170 CA ARG A 76 -5.328 -9.252 10.490 1.00 0.00 C ATOM 1171 C ARG A 76 -4.120 -9.931 9.864 1.00 0.00 C ATOM 1172 O ARG A 76 -3.059 -9.949 10.481 1.00 0.00 O ATOM 1173 CB ARG A 76 -6.099 -10.319 11.286 1.00 0.00 C ATOM 1174 CG ARG A 76 -6.990 -9.731 12.381 1.00 0.00 C ATOM 1175 CD ARG A 76 -7.686 -10.859 13.138 1.00 0.00 C ATOM 1176 NE ARG A 76 -8.737 -10.354 14.033 1.00 0.00 N ATOM 1177 CZ ARG A 76 -9.278 -11.032 15.052 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -8.794 -12.209 15.442 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -10.342 -10.530 15.660 1.00 0.00 N ATOM 0 H ARG A 76 -7.075 -9.065 9.340 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.008 -8.452 11.158 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.715 -10.900 10.599 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.387 -11.010 11.738 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.391 -9.134 13.069 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.731 -9.064 11.941 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.122 -11.559 12.425 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.950 -11.414 13.720 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.082 -9.409 13.863 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.992 -12.615 14.961 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.226 -12.705 16.222 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.735 -9.641 15.350 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.769 -11.032 16.439 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.288 -10.543 8.693 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.181 -11.119 7.947 1.00 0.00 C ATOM 1195 C PHE A 77 -2.164 -10.033 7.599 1.00 0.00 C ATOM 1196 O PHE A 77 -0.976 -10.227 7.842 1.00 0.00 O ATOM 1197 CB PHE A 77 -3.703 -11.851 6.705 1.00 0.00 C ATOM 1198 CG PHE A 77 -2.638 -12.080 5.654 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -1.535 -12.915 5.912 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -2.712 -11.382 4.438 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -0.554 -13.106 4.923 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -1.719 -11.547 3.463 1.00 0.00 C ATOM 1203 CZ PHE A 77 -0.648 -12.424 3.697 1.00 0.00 C ATOM 0 H PHE A 77 -5.195 -10.651 8.239 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.669 -11.858 8.563 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.119 -12.812 7.006 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.518 -11.274 6.267 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.442 -13.408 6.868 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.540 -10.713 4.253 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.272 -13.777 5.105 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.778 -11.001 2.533 1.00 0.00 H new ATOM 0 HZ PHE A 77 0.103 -12.575 2.936 1.00 0.00 H new ATOM 1213 N LEU A 78 -2.614 -8.894 7.065 1.00 0.00 N ATOM 1214 CA LEU A 78 -1.731 -7.769 6.766 1.00 0.00 C ATOM 1215 C LEU A 78 -1.005 -7.324 8.037 1.00 0.00 C ATOM 1216 O LEU A 78 0.199 -7.092 7.995 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.526 -6.594 6.171 1.00 0.00 C ATOM 1218 CG LEU A 78 -2.721 -6.586 4.643 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -2.954 -7.967 4.031 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -3.928 -5.709 4.294 1.00 0.00 C ATOM 0 H LEU A 78 -3.593 -8.729 6.830 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.996 -8.093 6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.511 -6.580 6.639 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.025 -5.668 6.454 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.790 -6.201 4.227 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.081 -7.870 2.953 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.096 -8.607 4.239 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.851 -8.410 4.464 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.071 -5.700 3.213 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -4.820 -6.110 4.774 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.753 -4.692 4.646 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.711 -7.279 9.170 1.00 0.00 N ATOM 1233 CA ASP A 79 -1.210 -6.858 10.484 1.00 0.00 C ATOM 1234 C ASP A 79 -0.138 -7.782 11.092 1.00 0.00 C ATOM 1235 O ASP A 79 0.273 -7.602 12.241 1.00 0.00 O ATOM 1236 CB ASP A 79 -2.395 -6.758 11.446 1.00 0.00 C ATOM 1237 CG ASP A 79 -2.164 -5.715 12.532 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -2.133 -4.501 12.201 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -2.205 -6.071 13.732 1.00 0.00 O ATOM 0 H ASP A 79 -2.695 -7.548 9.199 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.718 -5.897 10.334 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.295 -6.505 10.886 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.569 -7.730 11.908 1.00 0.00 H new ATOM 1244 N ASP A 80 0.286 -8.792 10.338 1.00 0.00 N ATOM 1245 CA ASP A 80 1.291 -9.793 10.683 1.00 0.00 C ATOM 1246 C ASP A 80 2.326 -9.902 9.556 1.00 0.00 C ATOM 1247 O ASP A 80 3.534 -9.847 9.799 1.00 0.00 O ATOM 1248 CB ASP A 80 0.573 -11.130 10.909 1.00 0.00 C ATOM 1249 CG ASP A 80 1.511 -12.235 11.381 1.00 0.00 C ATOM 1250 OD1 ASP A 80 2.459 -12.607 10.660 1.00 0.00 O ATOM 1251 OD2 ASP A 80 1.261 -12.811 12.465 1.00 0.00 O ATOM 0 H ASP A 80 -0.091 -8.943 9.402 1.00 0.00 H new ATOM 0 HA ASP A 80 1.822 -9.510 11.592 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.218 -10.992 11.647 1.00 0.00 H new ATOM 0 HB3 ASP A 80 0.093 -11.440 9.981 1.00 0.00 H new ATOM 1256 N PHE A 81 1.845 -10.009 8.312 1.00 0.00 N ATOM 1257 CA PHE A 81 2.641 -10.116 7.097 1.00 0.00 C ATOM 1258 C PHE A 81 3.488 -8.865 6.870 1.00 0.00 C ATOM 1259 O PHE A 81 4.667 -8.988 6.539 1.00 0.00 O ATOM 1260 CB PHE A 81 1.698 -10.363 5.909 1.00 0.00 C ATOM 1261 CG PHE A 81 2.346 -10.443 4.534 1.00 0.00 C ATOM 1262 CD1 PHE A 81 3.534 -11.172 4.331 1.00 0.00 C ATOM 1263 CD2 PHE A 81 1.748 -9.785 3.441 1.00 0.00 C ATOM 1264 CE1 PHE A 81 4.116 -11.240 3.053 1.00 0.00 C ATOM 1265 CE2 PHE A 81 2.336 -9.847 2.164 1.00 0.00 C ATOM 1266 CZ PHE A 81 3.522 -10.574 1.968 1.00 0.00 C ATOM 0 H PHE A 81 0.843 -10.023 8.123 1.00 0.00 H new ATOM 0 HA PHE A 81 3.333 -10.952 7.197 1.00 0.00 H new ATOM 0 HB2 PHE A 81 1.160 -11.294 6.088 1.00 0.00 H new ATOM 0 HB3 PHE A 81 0.956 -9.565 5.891 1.00 0.00 H new ATOM 0 HD1 PHE A 81 4.000 -11.681 5.161 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.833 -9.230 3.584 1.00 0.00 H new ATOM 0 HE1 PHE A 81 5.023 -11.807 2.905 1.00 0.00 H new ATOM 0 HE2 PHE A 81 1.874 -9.335 1.333 1.00 0.00 H new ATOM 0 HZ PHE A 81 3.975 -10.621 0.989 1.00 0.00 H new ATOM 1276 N GLU A 82 2.921 -7.675 7.082 1.00 0.00 N ATOM 1277 CA GLU A 82 3.635 -6.401 6.979 1.00 0.00 C ATOM 1278 C GLU A 82 4.492 -6.152 8.232 1.00 0.00 C ATOM 1279 O GLU A 82 4.980 -5.042 8.436 1.00 0.00 O ATOM 1280 CB GLU A 82 2.646 -5.244 6.729 1.00 0.00 C ATOM 1281 CG GLU A 82 1.698 -5.440 5.530 1.00 0.00 C ATOM 1282 CD GLU A 82 2.365 -5.321 4.152 1.00 0.00 C ATOM 1283 OE1 GLU A 82 3.529 -5.734 3.935 1.00 0.00 O ATOM 1284 OE2 GLU A 82 1.700 -4.824 3.212 1.00 0.00 O ATOM 0 H GLU A 82 1.938 -7.568 7.334 1.00 0.00 H new ATOM 0 HA GLU A 82 4.311 -6.450 6.125 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.045 -5.100 7.627 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.215 -4.327 6.576 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.234 -6.423 5.609 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.897 -4.704 5.595 1.00 0.00 H new ATOM 1291 N ASP A 83 4.658 -7.170 9.086 1.00 0.00 N ATOM 1292 CA ASP A 83 5.554 -7.257 10.239 1.00 0.00 C ATOM 1293 C ASP A 83 5.399 -6.121 11.255 1.00 0.00 C ATOM 1294 O ASP A 83 6.276 -5.865 12.088 1.00 0.00 O ATOM 1295 CB ASP A 83 7.003 -7.408 9.770 1.00 0.00 C ATOM 1296 CG ASP A 83 7.876 -8.014 10.861 1.00 0.00 C ATOM 1297 OD1 ASP A 83 7.425 -9.009 11.495 1.00 0.00 O ATOM 1298 OD2 ASP A 83 8.964 -7.474 11.131 1.00 0.00 O ATOM 0 H ASP A 83 4.119 -8.029 8.975 1.00 0.00 H new ATOM 0 HA ASP A 83 5.257 -8.151 10.788 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.036 -8.039 8.882 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.399 -6.433 9.484 1.00 0.00 H new ATOM 1303 N CYS A 84 4.285 -5.399 11.183 1.00 0.00 N ATOM 1304 CA CYS A 84 4.008 -4.278 12.051 1.00 0.00 C ATOM 1305 C CYS A 84 3.928 -4.749 13.508 1.00 0.00 C ATOM 1306 O CYS A 84 3.572 -5.909 13.744 1.00 0.00 O ATOM 1307 CB CYS A 84 2.706 -3.605 11.610 1.00 0.00 C ATOM 1308 SG CYS A 84 1.376 -4.795 11.373 1.00 0.00 S ATOM 0 H CYS A 84 3.544 -5.585 10.508 1.00 0.00 H new ATOM 0 HA CYS A 84 4.815 -3.548 11.982 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.406 -2.871 12.358 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.876 -3.062 10.680 1.00 0.00 H new ATOM 0 HG CYS A 84 0.533 -4.335 10.497 1.00 0.00 H new ATOM 1314 N PRO A 85 4.166 -3.881 14.506 1.00 0.00 N ATOM 1315 CA PRO A 85 4.557 -2.473 14.400 1.00 0.00 C ATOM 1316 C PRO A 85 6.017 -2.227 13.967 1.00 0.00 C ATOM 1317 O PRO A 85 6.413 -1.064 13.848 1.00 0.00 O ATOM 1318 CB PRO A 85 4.282 -1.890 15.789 1.00 0.00 C ATOM 1319 CG PRO A 85 4.439 -3.079 16.735 1.00 0.00 C ATOM 1320 CD PRO A 85 3.967 -4.260 15.898 1.00 0.00 C ATOM 0 HA PRO A 85 3.987 -1.994 13.604 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.985 -1.093 16.032 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.281 -1.463 15.850 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.473 -3.202 17.057 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.837 -2.958 17.635 1.00 0.00 H new ATOM 0 HD2 PRO A 85 4.533 -5.159 16.141 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.918 -4.481 16.094 1.00 0.00 H new ATOM 1328 N SER A 86 6.830 -3.275 13.807 1.00 0.00 N ATOM 1329 CA SER A 86 8.260 -3.192 13.525 1.00 0.00 C ATOM 1330 C SER A 86 8.549 -2.543 12.180 1.00 0.00 C ATOM 1331 O SER A 86 9.201 -1.498 12.129 1.00 0.00 O ATOM 1332 CB SER A 86 8.873 -4.588 13.590 1.00 0.00 C ATOM 1333 OG SER A 86 8.421 -5.193 14.795 1.00 0.00 O ATOM 0 H SER A 86 6.496 -4.236 13.873 1.00 0.00 H new ATOM 0 HA SER A 86 8.714 -2.554 14.284 1.00 0.00 H new ATOM 0 HB2 SER A 86 8.572 -5.180 12.726 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.961 -4.531 13.573 1.00 0.00 H new ATOM 0 HG SER A 86 8.796 -6.095 14.869 1.00 0.00 H new ATOM 1339 N MET A 87 8.110 -3.180 11.092 1.00 0.00 N ATOM 1340 CA MET A 87 8.339 -2.654 9.762 1.00 0.00 C ATOM 1341 C MET A 87 7.392 -1.463 9.556 1.00 0.00 C ATOM 1342 O MET A 87 7.827 -0.312 9.617 1.00 0.00 O ATOM 1343 CB MET A 87 8.153 -3.744 8.703 1.00 0.00 C ATOM 1344 CG MET A 87 9.253 -4.799 8.581 1.00 0.00 C ATOM 1345 SD MET A 87 8.990 -6.044 7.268 1.00 0.00 S ATOM 1346 CE MET A 87 8.248 -5.104 5.904 1.00 0.00 C ATOM 0 H MET A 87 7.595 -4.060 11.115 1.00 0.00 H new ATOM 0 HA MET A 87 9.368 -2.310 9.656 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.214 -4.258 8.909 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.044 -3.257 7.734 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.201 -4.294 8.397 1.00 0.00 H new ATOM 0 HG3 MET A 87 9.348 -5.315 9.536 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.151 -5.747 5.029 1.00 0.00 H new ATOM 0 HE2 MET A 87 7.262 -4.747 6.202 1.00 0.00 H new ATOM 0 HE3 MET A 87 8.884 -4.253 5.660 1.00 0.00 H new ATOM 1356 N TYR A 88 6.110 -1.740 9.305 1.00 0.00 N ATOM 1357 CA TYR A 88 5.052 -0.749 9.114 1.00 0.00 C ATOM 1358 C TYR A 88 4.251 -0.609 10.407 1.00 0.00 C ATOM 1359 O TYR A 88 4.569 -1.257 11.404 1.00 0.00 O ATOM 1360 CB TYR A 88 4.150 -1.204 7.960 1.00 0.00 C ATOM 1361 CG TYR A 88 4.857 -1.284 6.625 1.00 0.00 C ATOM 1362 CD1 TYR A 88 5.070 -0.114 5.876 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.293 -2.524 6.125 1.00 0.00 C ATOM 1364 CE1 TYR A 88 5.699 -0.186 4.623 1.00 0.00 C ATOM 1365 CE2 TYR A 88 5.920 -2.603 4.869 1.00 0.00 C ATOM 1366 CZ TYR A 88 6.126 -1.429 4.110 1.00 0.00 C ATOM 1367 OH TYR A 88 6.731 -1.474 2.893 1.00 0.00 O ATOM 0 H TYR A 88 5.769 -2.698 9.227 1.00 0.00 H new ATOM 0 HA TYR A 88 5.480 0.222 8.867 1.00 0.00 H new ATOM 0 HB2 TYR A 88 3.736 -2.183 8.200 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.310 -0.515 7.875 1.00 0.00 H new ATOM 0 HD1 TYR A 88 4.750 0.841 6.265 1.00 0.00 H new ATOM 0 HD2 TYR A 88 5.145 -3.420 6.709 1.00 0.00 H new ATOM 0 HE1 TYR A 88 5.857 0.715 4.049 1.00 0.00 H new ATOM 0 HE2 TYR A 88 6.244 -3.559 4.485 1.00 0.00 H new ATOM 0 HH TYR A 88 7.623 -1.074 2.956 1.00 0.00 H new ATOM 1377 N GLN A 89 3.188 0.199 10.428 1.00 0.00 N ATOM 1378 CA GLN A 89 2.125 0.049 11.415 1.00 0.00 C ATOM 1379 C GLN A 89 0.804 0.587 10.843 1.00 0.00 C ATOM 1380 O GLN A 89 0.815 1.445 9.961 1.00 0.00 O ATOM 1381 CB GLN A 89 2.534 0.619 12.789 1.00 0.00 C ATOM 1382 CG GLN A 89 3.077 2.047 12.826 1.00 0.00 C ATOM 1383 CD GLN A 89 4.508 2.322 12.324 1.00 0.00 C ATOM 1384 OE1 GLN A 89 4.795 3.428 11.869 1.00 0.00 O ATOM 1385 NE2 GLN A 89 5.484 1.436 12.466 1.00 0.00 N ATOM 0 H GLN A 89 3.044 0.964 9.769 1.00 0.00 H new ATOM 0 HA GLN A 89 1.952 -1.008 11.619 1.00 0.00 H new ATOM 0 HB2 GLN A 89 1.665 0.572 13.445 1.00 0.00 H new ATOM 0 HB3 GLN A 89 3.291 -0.040 13.215 1.00 0.00 H new ATOM 0 HG2 GLN A 89 2.400 2.671 12.243 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.020 2.393 13.858 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.281 0.509 12.840 1.00 0.00 H new ATOM 0 HE22 GLN A 89 6.438 1.681 12.201 1.00 0.00 H new ATOM 1394 N ARG A 90 -0.341 0.051 11.291 1.00 0.00 N ATOM 1395 CA ARG A 90 -1.660 0.463 10.794 1.00 0.00 C ATOM 1396 C ARG A 90 -1.916 1.925 11.147 1.00 0.00 C ATOM 1397 O ARG A 90 -1.888 2.257 12.334 1.00 0.00 O ATOM 1398 CB ARG A 90 -2.758 -0.472 11.359 1.00 0.00 C ATOM 1399 CG ARG A 90 -4.183 -0.200 10.841 1.00 0.00 C ATOM 1400 CD ARG A 90 -5.085 0.700 11.696 1.00 0.00 C ATOM 1401 NE ARG A 90 -5.300 0.262 13.095 1.00 0.00 N ATOM 1402 CZ ARG A 90 -6.305 0.692 13.876 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -7.307 1.380 13.338 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -6.319 0.445 15.179 1.00 0.00 N ATOM 0 H ARG A 90 -0.378 -0.677 12.005 1.00 0.00 H new ATOM 0 HA ARG A 90 -1.685 0.377 9.708 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.493 -1.502 11.121 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.761 -0.387 12.446 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -4.102 0.248 9.851 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.685 -1.159 10.717 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.655 1.702 11.712 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.056 0.777 11.207 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.642 -0.410 13.491 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -7.310 1.579 12.338 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -8.073 1.709 13.926 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.557 -0.081 15.607 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.092 0.781 15.753 1.00 0.00 H new ATOM 1418 N THR A 91 -2.242 2.758 10.162 1.00 0.00 N ATOM 1419 CA THR A 91 -2.766 4.116 10.321 1.00 0.00 C ATOM 1420 C THR A 91 -3.978 4.239 9.391 1.00 0.00 C ATOM 1421 O THR A 91 -4.290 3.310 8.636 1.00 0.00 O ATOM 1422 CB THR A 91 -1.641 5.130 10.009 1.00 0.00 C ATOM 1423 OG1 THR A 91 -0.521 4.833 10.827 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.916 6.622 10.222 1.00 0.00 C ATOM 0 H THR A 91 -2.144 2.493 9.182 1.00 0.00 H new ATOM 0 HA THR A 91 -3.093 4.328 11.339 1.00 0.00 H new ATOM 0 HB THR A 91 -1.504 5.003 8.935 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.200 5.469 10.637 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.028 7.197 9.958 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.750 6.932 9.592 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.166 6.800 11.268 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.675 5.371 9.459 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.756 5.752 8.575 1.00 0.00 C ATOM 1434 C ALA A 92 -5.459 7.110 7.962 1.00 0.00 C ATOM 1435 O ALA A 92 -5.125 8.057 8.683 1.00 0.00 O ATOM 1436 CB ALA A 92 -7.057 5.805 9.373 1.00 0.00 C ATOM 0 H ALA A 92 -4.486 6.077 10.170 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.855 5.021 7.773 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.877 6.091 8.714 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.262 4.824 9.801 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.963 6.538 10.174 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.636 7.201 6.645 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.400 8.395 5.831 1.00 0.00 C ATOM 1444 C LEU A 93 -6.677 8.763 5.058 1.00 0.00 C ATOM 1445 O LEU A 93 -7.680 8.049 5.156 1.00 0.00 O ATOM 1446 CB LEU A 93 -4.120 8.197 4.975 1.00 0.00 C ATOM 1447 CG LEU A 93 -4.157 7.397 3.645 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -5.239 6.322 3.591 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -4.445 8.253 2.420 1.00 0.00 C ATOM 0 H LEU A 93 -5.962 6.410 6.090 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.192 9.268 6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.739 9.190 4.738 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.380 7.716 5.615 1.00 0.00 H new ATOM 0 HG LEU A 93 -3.155 6.969 3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -5.196 5.811 2.629 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.076 5.602 4.393 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -6.218 6.785 3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.455 7.623 1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.416 8.736 2.533 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.671 9.014 2.318 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.634 9.866 4.312 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.717 10.439 3.519 1.00 0.00 C ATOM 1463 C GLN A 94 -7.460 10.179 2.029 1.00 0.00 C ATOM 1464 O GLN A 94 -6.483 10.677 1.460 1.00 0.00 O ATOM 1465 CB GLN A 94 -7.818 11.946 3.813 1.00 0.00 C ATOM 1466 CG GLN A 94 -9.097 12.589 3.252 1.00 0.00 C ATOM 1467 CD GLN A 94 -10.299 12.284 4.138 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -10.452 12.862 5.206 1.00 0.00 O ATOM 1469 NE2 GLN A 94 -11.134 11.328 3.779 1.00 0.00 N ATOM 0 H GLN A 94 -5.781 10.421 4.242 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.665 9.970 3.785 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -7.784 12.102 4.891 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -6.950 12.451 3.390 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -8.962 13.668 3.176 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.282 12.219 2.243 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.006 10.847 2.889 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.908 11.070 4.392 1.00 0.00 H new ATOM 1478 N VAL A 95 -8.319 9.376 1.403 1.00 0.00 N ATOM 1479 CA VAL A 95 -8.232 8.960 0.005 1.00 0.00 C ATOM 1480 C VAL A 95 -9.363 9.665 -0.762 1.00 0.00 C ATOM 1481 O VAL A 95 -10.462 9.794 -0.227 1.00 0.00 O ATOM 1482 CB VAL A 95 -8.301 7.413 -0.020 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -8.464 6.782 -1.404 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -7.043 6.804 0.616 1.00 0.00 C ATOM 0 H VAL A 95 -9.130 8.980 1.878 1.00 0.00 H new ATOM 0 HA VAL A 95 -7.301 9.244 -0.485 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.205 7.187 0.546 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.501 5.697 -1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.388 7.137 -1.859 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.619 7.061 -2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.111 5.716 0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.162 7.126 0.061 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.961 7.136 1.651 1.00 0.00 H new ATOM 1494 N GLN A 96 -9.131 10.124 -1.998 1.00 0.00 N ATOM 1495 CA GLN A 96 -10.172 10.530 -2.927 1.00 0.00 C ATOM 1496 C GLN A 96 -10.759 9.243 -3.445 1.00 0.00 C ATOM 1497 O GLN A 96 -10.005 8.342 -3.805 1.00 0.00 O ATOM 1498 CB GLN A 96 -9.643 11.346 -4.124 1.00 0.00 C ATOM 1499 CG GLN A 96 -10.762 11.633 -5.148 1.00 0.00 C ATOM 1500 CD GLN A 96 -10.404 12.622 -6.260 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -9.379 12.538 -6.931 1.00 0.00 O ATOM 1502 NE2 GLN A 96 -11.299 13.551 -6.537 1.00 0.00 N ATOM 0 H GLN A 96 -8.191 10.222 -2.381 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.886 11.175 -2.414 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.223 12.287 -3.768 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.834 10.800 -4.610 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -11.060 10.690 -5.607 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -11.631 12.015 -4.612 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -12.151 13.621 -5.980 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -11.139 14.199 -7.308 1.00 0.00 H new ATOM 1511 N VAL A 97 -12.073 9.168 -3.553 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.743 7.989 -4.058 1.00 0.00 C ATOM 1513 C VAL A 97 -13.055 8.236 -5.528 1.00 0.00 C ATOM 1514 O VAL A 97 -14.122 8.724 -5.885 1.00 0.00 O ATOM 1515 CB VAL A 97 -13.874 7.635 -3.097 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -14.862 8.679 -2.727 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -14.562 6.308 -3.395 1.00 0.00 C ATOM 0 H VAL A 97 -12.704 9.925 -3.292 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.150 7.075 -4.075 1.00 0.00 H new ATOM 0 HB VAL A 97 -13.281 7.533 -2.188 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -15.595 8.259 -2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -14.349 9.512 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -15.369 9.034 -3.624 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -15.352 6.136 -2.664 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.993 6.338 -4.395 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.833 5.500 -3.339 1.00 0.00 H new ATOM 1527 N LEU A 98 -12.054 7.973 -6.374 1.00 0.00 N ATOM 1528 CA LEU A 98 -12.077 8.212 -7.815 1.00 0.00 C ATOM 1529 C LEU A 98 -13.165 7.402 -8.509 1.00 0.00 C ATOM 1530 O LEU A 98 -13.559 7.725 -9.627 1.00 0.00 O ATOM 1531 CB LEU A 98 -10.717 7.853 -8.456 1.00 0.00 C ATOM 1532 CG LEU A 98 -9.771 9.031 -8.753 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -10.445 10.292 -9.309 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -8.982 9.343 -7.492 1.00 0.00 C ATOM 0 H LEU A 98 -11.171 7.572 -6.058 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.285 9.274 -7.948 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.200 7.157 -7.795 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.908 7.324 -9.389 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.116 8.710 -9.562 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.692 11.060 -9.483 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.944 10.054 -10.248 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -11.178 10.659 -8.591 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.305 10.176 -7.683 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.669 9.610 -6.690 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.405 8.467 -7.198 1.00 0.00 H new ATOM 1546 N GLU A 99 -13.615 6.308 -7.905 1.00 0.00 N ATOM 1547 CA GLU A 99 -14.766 5.557 -8.353 1.00 0.00 C ATOM 1548 C GLU A 99 -15.312 4.841 -7.122 1.00 0.00 C ATOM 1549 O GLU A 99 -14.544 4.532 -6.207 1.00 0.00 O ATOM 1550 CB GLU A 99 -14.334 4.558 -9.437 1.00 0.00 C ATOM 1551 CG GLU A 99 -15.484 4.097 -10.340 1.00 0.00 C ATOM 1552 CD GLU A 99 -15.244 4.550 -11.784 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -14.493 3.856 -12.517 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -15.722 5.650 -12.143 1.00 0.00 O ATOM 0 H GLU A 99 -13.175 5.916 -7.073 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.532 6.196 -8.791 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.560 5.016 -10.053 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.887 3.687 -8.959 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.571 3.011 -10.303 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -16.427 4.505 -9.976 1.00 0.00 H new ATOM 1561 N TRP A 100 -16.601 4.523 -7.126 1.00 0.00 N ATOM 1562 CA TRP A 100 -17.281 3.767 -6.089 1.00 0.00 C ATOM 1563 C TRP A 100 -18.113 2.696 -6.778 1.00 0.00 C ATOM 1564 O TRP A 100 -18.904 3.017 -7.670 1.00 0.00 O ATOM 1565 CB TRP A 100 -18.139 4.697 -5.223 1.00 0.00 C ATOM 1566 CG TRP A 100 -18.749 4.013 -4.042 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -20.012 3.551 -3.926 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -18.077 3.633 -2.817 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -20.164 2.939 -2.694 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -18.989 2.952 -1.966 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -16.745 3.727 -2.394 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -18.584 2.409 -0.733 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -16.331 3.239 -1.150 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -17.240 2.557 -0.325 1.00 0.00 C ATOM 0 H TRP A 100 -17.224 4.798 -7.885 1.00 0.00 H new ATOM 0 HA TRP A 100 -16.567 3.294 -5.415 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -17.524 5.527 -4.875 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.933 5.123 -5.837 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -20.783 3.644 -4.677 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -21.037 2.528 -2.363 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -16.018 4.189 -3.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -19.291 1.886 -0.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -15.312 3.387 -0.824 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -16.912 2.147 0.619 1.00 0.00 H new ATOM 1585 N GLU A 101 -17.914 1.434 -6.406 1.00 0.00 N ATOM 1586 CA GLU A 101 -18.662 0.310 -6.935 1.00 0.00 C ATOM 1587 C GLU A 101 -19.878 0.055 -6.047 1.00 0.00 C ATOM 1588 O GLU A 101 -19.729 -0.318 -4.880 1.00 0.00 O ATOM 1589 CB GLU A 101 -17.763 -0.938 -6.985 1.00 0.00 C ATOM 1590 CG GLU A 101 -16.603 -0.849 -7.988 1.00 0.00 C ATOM 1591 CD GLU A 101 -17.043 -0.733 -9.446 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -18.045 -1.362 -9.850 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -16.382 0.009 -10.211 1.00 0.00 O ATOM 0 H GLU A 101 -17.214 1.165 -5.715 1.00 0.00 H new ATOM 0 HA GLU A 101 -18.998 0.535 -7.947 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -17.354 -1.115 -5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -18.377 -1.803 -7.235 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -15.986 0.014 -7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -15.975 -1.733 -7.879 1.00 0.00 H new ATOM 1600 N GLY A 102 -21.080 0.229 -6.590 1.00 0.00 N ATOM 1601 CA GLY A 102 -22.322 -0.192 -5.943 1.00 0.00 C ATOM 1602 C GLY A 102 -22.934 0.918 -5.099 1.00 0.00 C ATOM 1603 O GLY A 102 -22.541 2.081 -5.192 1.00 0.00 O ATOM 0 H GLY A 102 -21.222 0.670 -7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -23.038 -0.505 -6.703 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.126 -1.060 -5.313 1.00 0.00 H new ATOM 1607 N ASP A 103 -23.937 0.569 -4.300 1.00 0.00 N ATOM 1608 CA ASP A 103 -24.674 1.477 -3.422 1.00 0.00 C ATOM 1609 C ASP A 103 -23.788 1.974 -2.263 1.00 0.00 C ATOM 1610 O ASP A 103 -22.679 1.475 -2.045 1.00 0.00 O ATOM 1611 CB ASP A 103 -25.924 0.736 -2.932 1.00 0.00 C ATOM 1612 CG ASP A 103 -26.927 1.601 -2.171 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -26.924 2.844 -2.315 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -27.734 0.998 -1.423 1.00 0.00 O ATOM 0 H ASP A 103 -24.274 -0.392 -4.243 1.00 0.00 H new ATOM 0 HA ASP A 103 -24.977 2.374 -3.963 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -26.427 0.293 -3.792 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -25.612 -0.086 -2.287 1.00 0.00 H new ATOM 1619 N GLY A 104 -24.264 2.932 -1.472 1.00 0.00 N ATOM 1620 CA GLY A 104 -23.640 3.364 -0.236 1.00 0.00 C ATOM 1621 C GLY A 104 -22.386 4.188 -0.467 1.00 0.00 C ATOM 1622 O GLY A 104 -21.330 3.804 0.023 1.00 0.00 O ATOM 0 H GLY A 104 -25.122 3.442 -1.685 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -24.354 3.952 0.340 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -23.389 2.489 0.364 1.00 0.00 H new ATOM 1626 N ASP A 105 -22.546 5.388 -1.023 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.541 6.246 -1.660 1.00 0.00 C ATOM 1628 C ASP A 105 -21.115 7.367 -0.698 1.00 0.00 C ATOM 1629 O ASP A 105 -21.868 8.333 -0.517 1.00 0.00 O ATOM 1630 CB ASP A 105 -22.045 6.856 -2.973 1.00 0.00 C ATOM 1631 CG ASP A 105 -21.171 8.028 -3.446 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -19.957 8.067 -3.145 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -21.734 8.936 -4.097 1.00 0.00 O ATOM 0 H ASP A 105 -23.466 5.827 -1.042 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.684 5.615 -1.897 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.065 6.086 -3.744 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.070 7.201 -2.841 1.00 0.00 H new ATOM 1638 N PRO A 106 -20.079 7.131 0.128 1.00 0.00 N ATOM 1639 CA PRO A 106 -19.660 8.026 1.206 1.00 0.00 C ATOM 1640 C PRO A 106 -19.369 9.465 0.758 1.00 0.00 C ATOM 1641 O PRO A 106 -19.473 10.359 1.601 1.00 0.00 O ATOM 1642 CB PRO A 106 -18.400 7.382 1.800 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.815 6.631 0.611 1.00 0.00 C ATOM 1644 CD PRO A 106 -19.049 6.127 -0.109 1.00 0.00 C ATOM 0 HA PRO A 106 -20.472 8.132 1.926 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.707 8.129 2.187 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -18.639 6.711 2.625 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -17.215 7.283 -0.023 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -17.169 5.812 0.928 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -18.858 6.005 -1.175 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -19.355 5.153 0.273 1.00 0.00 H new ATOM 1652 N GLY A 107 -19.066 9.699 -0.519 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.600 10.980 -1.031 1.00 0.00 C ATOM 1654 C GLY A 107 -17.093 10.940 -1.266 1.00 0.00 C ATOM 1655 O GLY A 107 -16.391 10.126 -0.679 1.00 0.00 O ATOM 0 H GLY A 107 -19.141 8.982 -1.241 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -19.114 11.216 -1.963 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.844 11.772 -0.323 1.00 0.00 H new ATOM 1659 N ASP A 108 -16.633 11.836 -2.150 1.00 0.00 N ATOM 1660 CA ASP A 108 -15.344 11.878 -2.858 1.00 0.00 C ATOM 1661 C ASP A 108 -14.109 12.044 -2.008 1.00 0.00 C ATOM 1662 O ASP A 108 -13.008 12.070 -2.567 1.00 0.00 O ATOM 1663 CB ASP A 108 -15.410 13.070 -3.816 1.00 0.00 C ATOM 1664 CG ASP A 108 -14.313 13.139 -4.881 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -14.253 12.273 -5.781 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -13.544 14.128 -4.895 1.00 0.00 O ATOM 0 H ASP A 108 -17.214 12.632 -2.415 1.00 0.00 H new ATOM 0 HA ASP A 108 -15.230 10.903 -3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -16.377 13.052 -4.320 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -15.374 13.986 -3.227 1.00 0.00 H new ATOM 1671 N SER A 109 -14.214 12.042 -0.687 1.00 0.00 N ATOM 1672 CA SER A 109 -13.121 11.465 0.043 1.00 0.00 C ATOM 1673 C SER A 109 -13.575 10.524 1.147 1.00 0.00 C ATOM 1674 O SER A 109 -14.652 10.658 1.721 1.00 0.00 O ATOM 1675 CB SER A 109 -12.175 12.553 0.507 1.00 0.00 C ATOM 1676 OG SER A 109 -12.789 13.622 1.208 1.00 0.00 O ATOM 0 H SER A 109 -14.992 12.409 -0.138 1.00 0.00 H new ATOM 0 HA SER A 109 -12.560 10.819 -0.632 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.417 12.105 1.149 1.00 0.00 H new ATOM 0 HB3 SER A 109 -11.657 12.958 -0.362 1.00 0.00 H new ATOM 0 HG SER A 109 -12.107 14.275 1.471 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.714 9.557 1.457 1.00 0.00 N ATOM 1683 CA VAL A 110 -12.991 8.470 2.376 1.00 0.00 C ATOM 1684 C VAL A 110 -11.781 8.250 3.278 1.00 0.00 C ATOM 1685 O VAL A 110 -10.641 8.514 2.882 1.00 0.00 O ATOM 1686 CB VAL A 110 -13.361 7.196 1.587 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -14.608 7.375 0.745 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -12.230 6.653 0.697 1.00 0.00 C ATOM 0 H VAL A 110 -11.776 9.513 1.059 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.842 8.722 3.009 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.551 6.458 2.366 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.823 6.449 0.211 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -15.450 7.625 1.390 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -14.450 8.179 0.027 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.573 5.758 0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.947 7.410 -0.034 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -11.367 6.406 1.315 1.00 0.00 H new ATOM 1698 N GLN A 111 -12.029 7.746 4.484 1.00 0.00 N ATOM 1699 CA GLN A 111 -11.008 7.253 5.394 1.00 0.00 C ATOM 1700 C GLN A 111 -10.821 5.772 5.064 1.00 0.00 C ATOM 1701 O GLN A 111 -11.812 5.042 4.970 1.00 0.00 O ATOM 1702 CB GLN A 111 -11.461 7.510 6.849 1.00 0.00 C ATOM 1703 CG GLN A 111 -10.392 7.209 7.916 1.00 0.00 C ATOM 1704 CD GLN A 111 -10.592 5.842 8.569 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -9.958 4.793 8.069 1.00 0.00 O flip ATOM 1706 NE2 GLN A 111 -11.316 5.709 9.554 1.00 0.00 N flip ATOM 0 H GLN A 111 -12.973 7.669 4.862 1.00 0.00 H new ATOM 0 HA GLN A 111 -10.050 7.761 5.285 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.765 8.553 6.942 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.342 6.902 7.054 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -9.404 7.249 7.458 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.420 7.983 8.683 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.805 6.516 9.940 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.427 4.791 9.985 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.586 5.306 4.870 1.00 0.00 N ATOM 1716 CA CYS A 112 -9.267 3.876 4.761 1.00 0.00 C ATOM 1717 C CYS A 112 -8.111 3.546 5.716 1.00 0.00 C ATOM 1718 O CYS A 112 -7.608 4.462 6.368 1.00 0.00 O ATOM 1719 CB CYS A 112 -8.942 3.510 3.304 1.00 0.00 C ATOM 1720 SG CYS A 112 -7.282 4.024 2.879 1.00 0.00 S ATOM 0 H CYS A 112 -8.771 5.913 4.783 1.00 0.00 H new ATOM 0 HA CYS A 112 -10.129 3.276 5.051 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -9.042 2.434 3.163 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -9.658 3.987 2.635 1.00 0.00 H new ATOM 0 HG CYS A 112 -6.453 3.050 3.113 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.652 2.289 5.780 1.00 0.00 N ATOM 1727 CA PHE A 113 -6.367 1.937 6.395 1.00 0.00 C ATOM 1728 C PHE A 113 -5.298 1.700 5.335 1.00 0.00 C ATOM 1729 O PHE A 113 -5.614 1.494 4.157 1.00 0.00 O ATOM 1730 CB PHE A 113 -6.489 0.727 7.319 1.00 0.00 C ATOM 1731 CG PHE A 113 -7.527 0.868 8.406 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -7.430 1.914 9.341 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -8.579 -0.056 8.497 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -8.361 2.016 10.384 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -9.490 0.024 9.560 1.00 0.00 C ATOM 1736 CZ PHE A 113 -9.378 1.053 10.512 1.00 0.00 C ATOM 0 H PHE A 113 -8.162 1.488 5.407 1.00 0.00 H new ATOM 0 HA PHE A 113 -6.062 2.786 7.006 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.729 -0.150 6.718 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.520 0.541 7.782 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.636 2.641 9.255 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.687 -0.828 7.749 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -8.297 2.833 11.088 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.280 -0.707 9.648 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.071 1.104 11.339 1.00 0.00 H new ATOM 1746 N VAL A 114 -4.049 1.798 5.787 1.00 0.00 N ATOM 1747 CA VAL A 114 -2.826 2.049 5.043 1.00 0.00 C ATOM 1748 C VAL A 114 -1.711 1.622 6.006 1.00 0.00 C ATOM 1749 O VAL A 114 -1.651 2.088 7.149 1.00 0.00 O ATOM 1750 CB VAL A 114 -2.796 3.560 4.643 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -3.500 3.713 3.296 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -3.352 4.472 5.746 1.00 0.00 C ATOM 0 H VAL A 114 -3.854 1.692 6.783 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.725 1.502 4.105 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.765 3.894 4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -3.491 4.761 2.998 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -2.982 3.117 2.545 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -4.531 3.370 3.383 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.308 5.510 5.416 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.387 4.201 5.955 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.756 4.353 6.651 1.00 0.00 H new ATOM 1762 N TYR A 115 -0.911 0.620 5.638 1.00 0.00 N ATOM 1763 CA TYR A 115 0.280 0.233 6.389 1.00 0.00 C ATOM 1764 C TYR A 115 1.394 1.163 5.944 1.00 0.00 C ATOM 1765 O TYR A 115 2.124 0.889 4.991 1.00 0.00 O ATOM 1766 CB TYR A 115 0.618 -1.259 6.228 1.00 0.00 C ATOM 1767 CG TYR A 115 -0.257 -2.116 7.117 1.00 0.00 C ATOM 1768 CD1 TYR A 115 0.060 -2.256 8.481 1.00 0.00 C ATOM 1769 CD2 TYR A 115 -1.442 -2.683 6.615 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -0.813 -2.932 9.349 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -2.323 -3.349 7.483 1.00 0.00 C ATOM 1772 CZ TYR A 115 -2.017 -3.473 8.855 1.00 0.00 C ATOM 1773 OH TYR A 115 -2.915 -4.046 9.697 1.00 0.00 O ATOM 0 H TYR A 115 -1.074 0.053 4.806 1.00 0.00 H new ATOM 0 HA TYR A 115 0.118 0.341 7.461 1.00 0.00 H new ATOM 0 HB2 TYR A 115 0.485 -1.555 5.187 1.00 0.00 H new ATOM 0 HB3 TYR A 115 1.666 -1.426 6.475 1.00 0.00 H new ATOM 0 HD1 TYR A 115 0.981 -1.841 8.863 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.674 -2.606 5.563 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -0.562 -3.037 10.394 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -3.240 -3.769 7.098 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.645 -3.882 10.625 1.00 0.00 H new ATOM 1783 N THR A 116 1.461 2.316 6.596 1.00 0.00 N ATOM 1784 CA THR A 116 2.533 3.277 6.435 1.00 0.00 C ATOM 1785 C THR A 116 3.580 3.026 7.516 1.00 0.00 C ATOM 1786 O THR A 116 3.449 2.110 8.331 1.00 0.00 O ATOM 1787 CB THR A 116 1.946 4.698 6.459 1.00 0.00 C ATOM 1788 OG1 THR A 116 0.920 4.862 7.420 1.00 0.00 O ATOM 1789 CG2 THR A 116 1.318 4.995 5.106 1.00 0.00 C ATOM 0 H THR A 116 0.752 2.612 7.267 1.00 0.00 H new ATOM 0 HA THR A 116 3.034 3.166 5.473 1.00 0.00 H new ATOM 0 HB THR A 116 2.771 5.367 6.706 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.588 5.783 7.390 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.899 6.001 5.113 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.079 4.924 4.328 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.526 4.273 4.906 1.00 0.00 H new ATOM 1797 N THR A 117 4.641 3.821 7.524 1.00 0.00 N ATOM 1798 CA THR A 117 5.653 3.786 8.561 1.00 0.00 C ATOM 1799 C THR A 117 5.934 5.227 8.988 1.00 0.00 C ATOM 1800 O THR A 117 5.982 6.145 8.164 1.00 0.00 O ATOM 1801 CB THR A 117 6.897 3.011 8.077 1.00 0.00 C ATOM 1802 OG1 THR A 117 7.985 3.263 8.941 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.288 3.352 6.633 1.00 0.00 C ATOM 0 H THR A 117 4.822 4.516 6.800 1.00 0.00 H new ATOM 0 HA THR A 117 5.311 3.241 9.441 1.00 0.00 H new ATOM 0 HB THR A 117 6.640 1.952 8.095 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.771 2.767 8.630 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.169 2.777 6.349 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.463 3.106 5.965 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.510 4.416 6.558 1.00 0.00 H new ATOM 1811 N ALA A 118 6.124 5.410 10.292 1.00 0.00 N ATOM 1812 CA ALA A 118 6.676 6.615 10.893 1.00 0.00 C ATOM 1813 C ALA A 118 8.134 6.407 11.315 1.00 0.00 C ATOM 1814 O ALA A 118 8.801 7.366 11.695 1.00 0.00 O ATOM 1815 CB ALA A 118 5.838 6.971 12.124 1.00 0.00 C ATOM 0 H ALA A 118 5.889 4.696 10.981 1.00 0.00 H new ATOM 0 HA ALA A 118 6.648 7.420 10.159 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.238 7.873 12.588 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.805 7.145 11.823 1.00 0.00 H new ATOM 0 HB3 ALA A 118 5.874 6.149 12.839 1.00 0.00 H new ATOM 1821 N THR A 119 8.644 5.174 11.284 1.00 0.00 N ATOM 1822 CA THR A 119 9.847 4.775 12.013 1.00 0.00 C ATOM 1823 C THR A 119 11.060 4.663 11.063 1.00 0.00 C ATOM 1824 O THR A 119 11.937 3.819 11.215 1.00 0.00 O ATOM 1825 CB THR A 119 9.459 3.558 12.880 1.00 0.00 C ATOM 1826 OG1 THR A 119 10.354 3.365 13.946 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.216 2.250 12.120 1.00 0.00 C ATOM 0 H THR A 119 8.227 4.416 10.744 1.00 0.00 H new ATOM 0 HA THR A 119 10.215 5.523 12.715 1.00 0.00 H new ATOM 0 HB THR A 119 8.482 3.829 13.280 1.00 0.00 H new ATOM 0 HG1 THR A 119 10.074 2.587 14.472 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.950 1.463 12.826 1.00 0.00 H new ATOM 0 HG22 THR A 119 8.403 2.389 11.408 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.122 1.966 11.585 1.00 0.00 H new ATOM 1835 N TYR A 120 11.100 5.542 10.058 1.00 0.00 N ATOM 1836 CA TYR A 120 12.080 5.564 8.977 1.00 0.00 C ATOM 1837 C TYR A 120 13.510 5.874 9.461 1.00 0.00 C ATOM 1838 O TYR A 120 13.731 6.403 10.559 1.00 0.00 O ATOM 1839 CB TYR A 120 11.592 6.574 7.921 1.00 0.00 C ATOM 1840 CG TYR A 120 11.354 7.980 8.451 1.00 0.00 C ATOM 1841 CD1 TYR A 120 12.432 8.871 8.580 1.00 0.00 C ATOM 1842 CD2 TYR A 120 10.068 8.381 8.864 1.00 0.00 C ATOM 1843 CE1 TYR A 120 12.258 10.122 9.203 1.00 0.00 C ATOM 1844 CE2 TYR A 120 9.882 9.636 9.474 1.00 0.00 C ATOM 1845 CZ TYR A 120 10.979 10.507 9.663 1.00 0.00 C ATOM 1846 OH TYR A 120 10.783 11.724 10.249 1.00 0.00 O ATOM 0 H TYR A 120 10.415 6.293 9.975 1.00 0.00 H new ATOM 0 HA TYR A 120 12.152 4.568 8.540 1.00 0.00 H new ATOM 0 HB2 TYR A 120 12.327 6.623 7.117 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.665 6.203 7.484 1.00 0.00 H new ATOM 0 HD1 TYR A 120 13.403 8.594 8.198 1.00 0.00 H new ATOM 0 HD2 TYR A 120 9.224 7.725 8.712 1.00 0.00 H new ATOM 0 HE1 TYR A 120 13.101 10.786 9.329 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.896 9.935 9.799 1.00 0.00 H new ATOM 0 HH TYR A 120 9.841 11.817 10.502 1.00 0.00 H new ATOM 1856 N ALA A 121 14.490 5.592 8.598 1.00 0.00 N ATOM 1857 CA ALA A 121 15.879 6.031 8.722 1.00 0.00 C ATOM 1858 C ALA A 121 16.042 7.374 7.988 1.00 0.00 C ATOM 1859 O ALA A 121 15.338 7.588 6.998 1.00 0.00 O ATOM 1860 CB ALA A 121 16.781 4.957 8.108 1.00 0.00 C ATOM 0 H ALA A 121 14.329 5.030 7.762 1.00 0.00 H new ATOM 0 HA ALA A 121 16.156 6.171 9.767 1.00 0.00 H new ATOM 0 HB1 ALA A 121 17.823 5.266 8.191 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.639 4.015 8.638 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.524 4.824 7.057 1.00 0.00 H new ATOM 1866 N PRO A 122 16.946 8.281 8.407 1.00 0.00 N ATOM 1867 CA PRO A 122 17.001 9.634 7.860 1.00 0.00 C ATOM 1868 C PRO A 122 17.344 9.665 6.373 1.00 0.00 C ATOM 1869 O PRO A 122 16.872 10.562 5.669 1.00 0.00 O ATOM 1870 CB PRO A 122 18.050 10.386 8.688 1.00 0.00 C ATOM 1871 CG PRO A 122 18.929 9.276 9.260 1.00 0.00 C ATOM 1872 CD PRO A 122 17.947 8.121 9.450 1.00 0.00 C ATOM 0 HA PRO A 122 16.019 10.103 7.927 1.00 0.00 H new ATOM 0 HB2 PRO A 122 18.627 11.075 8.071 1.00 0.00 H new ATOM 0 HB3 PRO A 122 17.587 10.977 9.478 1.00 0.00 H new ATOM 0 HG2 PRO A 122 19.737 9.010 8.579 1.00 0.00 H new ATOM 0 HG3 PRO A 122 19.391 9.572 10.202 1.00 0.00 H new ATOM 0 HD2 PRO A 122 18.452 7.159 9.364 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.491 8.154 10.439 1.00 0.00 H new ATOM 1880 N GLU A 123 18.116 8.689 5.896 1.00 0.00 N ATOM 1881 CA GLU A 123 18.483 8.544 4.496 1.00 0.00 C ATOM 1882 C GLU A 123 17.280 8.418 3.575 1.00 0.00 C ATOM 1883 O GLU A 123 17.337 8.850 2.425 1.00 0.00 O ATOM 1884 CB GLU A 123 19.432 7.357 4.278 1.00 0.00 C ATOM 1885 CG GLU A 123 18.958 6.044 4.930 1.00 0.00 C ATOM 1886 CD GLU A 123 19.696 5.780 6.235 1.00 0.00 C ATOM 1887 OE1 GLU A 123 19.618 6.658 7.119 1.00 0.00 O ATOM 1888 OE2 GLU A 123 20.397 4.744 6.339 1.00 0.00 O ATOM 0 H GLU A 123 18.511 7.961 6.491 1.00 0.00 H new ATOM 0 HA GLU A 123 19.002 9.466 4.234 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.554 7.195 3.207 1.00 0.00 H new ATOM 0 HB3 GLU A 123 20.414 7.613 4.675 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.886 6.095 5.119 1.00 0.00 H new ATOM 0 HG3 GLU A 123 19.121 5.214 4.243 1.00 0.00 H new ATOM 1895 N TRP A 124 16.177 7.859 4.066 1.00 0.00 N ATOM 1896 CA TRP A 124 15.028 7.562 3.235 1.00 0.00 C ATOM 1897 C TRP A 124 14.295 8.843 2.821 1.00 0.00 C ATOM 1898 O TRP A 124 13.434 8.802 1.947 1.00 0.00 O ATOM 1899 CB TRP A 124 14.167 6.534 3.981 1.00 0.00 C ATOM 1900 CG TRP A 124 14.777 5.158 4.119 1.00 0.00 C ATOM 1901 CD1 TRP A 124 16.002 4.755 3.697 1.00 0.00 C ATOM 1902 CD2 TRP A 124 14.161 3.954 4.661 1.00 0.00 C ATOM 1903 NE1 TRP A 124 16.198 3.422 3.994 1.00 0.00 N ATOM 1904 CE2 TRP A 124 15.063 2.859 4.532 1.00 0.00 C ATOM 1905 CE3 TRP A 124 12.891 3.674 5.189 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 14.706 1.546 4.881 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 12.500 2.357 5.492 1.00 0.00 C ATOM 1908 CH2 TRP A 124 13.406 1.292 5.348 1.00 0.00 C ATOM 0 H TRP A 124 16.061 7.603 5.046 1.00 0.00 H new ATOM 0 HA TRP A 124 15.324 7.116 2.285 1.00 0.00 H new ATOM 0 HB2 TRP A 124 13.952 6.920 4.978 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.213 6.440 3.463 1.00 0.00 H new ATOM 0 HD1 TRP A 124 16.722 5.388 3.199 1.00 0.00 H new ATOM 0 HE1 TRP A 124 17.071 2.919 3.835 1.00 0.00 H new ATOM 0 HE3 TRP A 124 12.201 4.485 5.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 15.422 0.742 4.791 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.496 2.163 5.838 1.00 0.00 H new ATOM 0 HH2 TRP A 124 13.104 0.285 5.595 1.00 0.00 H new ATOM 1919 N LEU A 125 14.670 9.996 3.385 1.00 0.00 N ATOM 1920 CA LEU A 125 14.177 11.299 2.962 1.00 0.00 C ATOM 1921 C LEU A 125 15.050 11.915 1.870 1.00 0.00 C ATOM 1922 O LEU A 125 14.569 12.825 1.189 1.00 0.00 O ATOM 1923 CB LEU A 125 14.118 12.260 4.163 1.00 0.00 C ATOM 1924 CG LEU A 125 12.931 12.077 5.118 1.00 0.00 C ATOM 1925 CD1 LEU A 125 11.590 12.240 4.398 1.00 0.00 C ATOM 1926 CD2 LEU A 125 12.951 10.749 5.863 1.00 0.00 C ATOM 0 H LEU A 125 15.334 10.045 4.158 1.00 0.00 H new ATOM 0 HA LEU A 125 13.178 11.147 2.554 1.00 0.00 H new ATOM 0 HB2 LEU A 125 15.039 12.150 4.736 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.099 13.282 3.784 1.00 0.00 H new ATOM 0 HG LEU A 125 13.041 12.870 5.858 1.00 0.00 H new ATOM 0 HD11 LEU A 125 10.776 12.103 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.529 13.238 3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 125 11.509 11.495 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 125 12.083 10.687 6.520 1.00 0.00 H new ATOM 0 HD22 LEU A 125 12.922 9.929 5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 125 13.862 10.679 6.458 1.00 0.00 H new ATOM 1938 N PHE A 126 16.308 11.491 1.696 1.00 0.00 N ATOM 1939 CA PHE A 126 17.150 11.970 0.595 1.00 0.00 C ATOM 1940 C PHE A 126 16.622 11.444 -0.739 1.00 0.00 C ATOM 1941 O PHE A 126 16.677 12.147 -1.751 1.00 0.00 O ATOM 1942 CB PHE A 126 18.619 11.542 0.768 1.00 0.00 C ATOM 1943 CG PHE A 126 19.295 11.908 2.078 1.00 0.00 C ATOM 1944 CD1 PHE A 126 19.113 13.175 2.665 1.00 0.00 C ATOM 1945 CD2 PHE A 126 20.119 10.965 2.719 1.00 0.00 C ATOM 1946 CE1 PHE A 126 19.707 13.474 3.902 1.00 0.00 C ATOM 1947 CE2 PHE A 126 20.676 11.247 3.980 1.00 0.00 C ATOM 1948 CZ PHE A 126 20.476 12.505 4.569 1.00 0.00 C ATOM 0 H PHE A 126 16.766 10.814 2.307 1.00 0.00 H new ATOM 0 HA PHE A 126 17.111 13.059 0.606 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.672 10.460 0.650 1.00 0.00 H new ATOM 0 HB3 PHE A 126 19.197 11.980 -0.045 1.00 0.00 H new ATOM 0 HD1 PHE A 126 18.514 13.920 2.162 1.00 0.00 H new ATOM 0 HD2 PHE A 126 20.325 10.019 2.240 1.00 0.00 H new ATOM 0 HE1 PHE A 126 19.572 14.451 4.342 1.00 0.00 H new ATOM 0 HE2 PHE A 126 21.257 10.496 4.494 1.00 0.00 H new ATOM 0 HZ PHE A 126 20.912 12.728 5.532 1.00 0.00 H new ATOM 1958 N LEU A 127 16.110 10.211 -0.727 1.00 0.00 N ATOM 1959 CA LEU A 127 15.630 9.491 -1.899 1.00 0.00 C ATOM 1960 C LEU A 127 14.514 10.285 -2.597 1.00 0.00 C ATOM 1961 O LEU A 127 13.771 11.003 -1.923 1.00 0.00 O ATOM 1962 CB LEU A 127 15.122 8.096 -1.477 1.00 0.00 C ATOM 1963 CG LEU A 127 16.120 7.251 -0.656 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.512 5.888 -0.312 1.00 0.00 C ATOM 1965 CD2 LEU A 127 17.452 7.045 -1.384 1.00 0.00 C ATOM 0 H LEU A 127 16.017 9.671 0.133 1.00 0.00 H new ATOM 0 HA LEU A 127 16.451 9.370 -2.605 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.210 8.221 -0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 127 14.852 7.539 -2.374 1.00 0.00 H new ATOM 0 HG LEU A 127 16.323 7.809 0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 127 16.229 5.305 0.267 1.00 0.00 H new ATOM 0 HD12 LEU A 127 14.604 6.032 0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.270 5.355 -1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 127 18.117 6.445 -0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 127 17.275 6.531 -2.328 1.00 0.00 H new ATOM 0 HD23 LEU A 127 17.913 8.013 -1.579 1.00 0.00 H new ATOM 1977 N PRO A 128 14.362 10.161 -3.929 1.00 0.00 N ATOM 1978 CA PRO A 128 13.250 10.771 -4.650 1.00 0.00 C ATOM 1979 C PRO A 128 11.956 9.999 -4.379 1.00 0.00 C ATOM 1980 O PRO A 128 11.998 8.858 -3.906 1.00 0.00 O ATOM 1981 CB PRO A 128 13.648 10.690 -6.124 1.00 0.00 C ATOM 1982 CG PRO A 128 14.447 9.389 -6.177 1.00 0.00 C ATOM 1983 CD PRO A 128 15.195 9.391 -4.843 1.00 0.00 C ATOM 0 HA PRO A 128 13.063 11.799 -4.341 1.00 0.00 H new ATOM 0 HB2 PRO A 128 12.777 10.659 -6.779 1.00 0.00 H new ATOM 0 HB3 PRO A 128 14.247 11.547 -6.431 1.00 0.00 H new ATOM 0 HG2 PRO A 128 13.797 8.520 -6.274 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.133 9.370 -7.024 1.00 0.00 H new ATOM 0 HD2 PRO A 128 15.345 8.376 -4.476 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.182 9.841 -4.948 1.00 0.00 H new ATOM 1991 N TYR A 129 10.813 10.582 -4.738 1.00 0.00 N ATOM 1992 CA TYR A 129 9.495 10.026 -4.459 1.00 0.00 C ATOM 1993 C TYR A 129 8.750 9.746 -5.757 1.00 0.00 C ATOM 1994 O TYR A 129 9.076 10.305 -6.809 1.00 0.00 O ATOM 1995 CB TYR A 129 8.711 11.018 -3.597 1.00 0.00 C ATOM 1996 CG TYR A 129 9.421 11.560 -2.375 1.00 0.00 C ATOM 1997 CD1 TYR A 129 10.194 10.708 -1.573 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.354 12.932 -2.077 1.00 0.00 C ATOM 1999 CE1 TYR A 129 10.965 11.227 -0.515 1.00 0.00 C ATOM 2000 CE2 TYR A 129 10.066 13.446 -0.987 1.00 0.00 C ATOM 2001 CZ TYR A 129 10.919 12.612 -0.234 1.00 0.00 C ATOM 2002 OH TYR A 129 11.726 13.184 0.703 1.00 0.00 O ATOM 0 H TYR A 129 10.779 11.470 -5.240 1.00 0.00 H new ATOM 0 HA TYR A 129 9.603 9.083 -3.923 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.421 11.861 -4.225 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.791 10.533 -3.270 1.00 0.00 H new ATOM 0 HD1 TYR A 129 10.198 9.646 -1.768 1.00 0.00 H new ATOM 0 HD2 TYR A 129 8.754 13.589 -2.689 1.00 0.00 H new ATOM 0 HE1 TYR A 129 11.587 10.572 0.077 1.00 0.00 H new ATOM 0 HE2 TYR A 129 9.962 14.487 -0.721 1.00 0.00 H new ATOM 0 HH TYR A 129 12.640 12.846 0.598 1.00 0.00 H new ATOM 2012 N HIS A 130 7.737 8.880 -5.675 1.00 0.00 N ATOM 2013 CA HIS A 130 6.977 8.423 -6.835 1.00 0.00 C ATOM 2014 C HIS A 130 5.474 8.328 -6.505 1.00 0.00 C ATOM 2015 O HIS A 130 5.103 8.401 -5.340 1.00 0.00 O ATOM 2016 CB HIS A 130 7.591 7.089 -7.311 1.00 0.00 C ATOM 2017 CG HIS A 130 9.106 7.122 -7.430 1.00 0.00 C ATOM 2018 ND1 HIS A 130 10.011 6.794 -6.448 1.00 0.00 N flip ATOM 2019 CD2 HIS A 130 9.827 7.645 -8.482 1.00 0.00 C flip ATOM 2020 CE1 HIS A 130 11.295 7.068 -6.938 1.00 0.00 C flip ATOM 2021 NE2 HIS A 130 11.126 7.631 -8.148 1.00 0.00 N flip ATOM 0 H HIS A 130 7.421 8.475 -4.794 1.00 0.00 H new ATOM 0 HA HIS A 130 7.043 9.140 -7.654 1.00 0.00 H new ATOM 0 HB2 HIS A 130 7.307 6.300 -6.615 1.00 0.00 H new ATOM 0 HB3 HIS A 130 7.165 6.828 -8.280 1.00 0.00 H new ATOM 0 HD2 HIS A 130 9.417 8.004 -9.414 1.00 0.00 H new ATOM 0 HE1 HIS A 130 12.233 6.867 -6.443 1.00 0.00 H new ATOM 0 HE2 HIS A 130 11.880 7.996 -8.730 1.00 0.00 H new ATOM 2029 N GLU A 131 4.595 8.190 -7.502 1.00 0.00 N ATOM 2030 CA GLU A 131 3.124 8.289 -7.363 1.00 0.00 C ATOM 2031 C GLU A 131 2.406 7.075 -7.946 1.00 0.00 C ATOM 2032 O GLU A 131 1.186 6.939 -7.881 1.00 0.00 O ATOM 2033 CB GLU A 131 2.669 9.503 -8.170 1.00 0.00 C ATOM 2034 CG GLU A 131 1.327 10.086 -7.692 1.00 0.00 C ATOM 2035 CD GLU A 131 0.985 11.386 -8.417 1.00 0.00 C ATOM 2036 OE1 GLU A 131 1.065 11.412 -9.667 1.00 0.00 O ATOM 2037 OE2 GLU A 131 0.677 12.406 -7.758 1.00 0.00 O ATOM 0 H GLU A 131 4.888 8.000 -8.460 1.00 0.00 H new ATOM 0 HA GLU A 131 2.886 8.360 -6.302 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.434 10.277 -8.111 1.00 0.00 H new ATOM 0 HB3 GLU A 131 2.581 9.221 -9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 131 0.534 9.357 -7.858 1.00 0.00 H new ATOM 0 HG3 GLU A 131 1.372 10.269 -6.618 1.00 0.00 H new ATOM 2044 N SER A 132 3.161 6.187 -8.563 1.00 0.00 N ATOM 2045 CA SER A 132 2.821 4.789 -8.691 1.00 0.00 C ATOM 2046 C SER A 132 4.111 4.026 -8.453 1.00 0.00 C ATOM 2047 O SER A 132 5.173 4.637 -8.272 1.00 0.00 O ATOM 2048 CB SER A 132 2.176 4.524 -10.065 1.00 0.00 C ATOM 2049 OG SER A 132 3.086 4.196 -11.105 1.00 0.00 O ATOM 0 H SER A 132 4.051 6.427 -9.000 1.00 0.00 H new ATOM 0 HA SER A 132 2.075 4.461 -7.968 1.00 0.00 H new ATOM 0 HB2 SER A 132 1.458 3.710 -9.961 1.00 0.00 H new ATOM 0 HB3 SER A 132 1.613 5.409 -10.362 1.00 0.00 H new ATOM 0 HG SER A 132 3.353 3.257 -11.022 1.00 0.00 H new ATOM 2055 N TYR A 133 4.036 2.705 -8.548 1.00 0.00 N ATOM 2056 CA TYR A 133 5.216 1.925 -8.819 1.00 0.00 C ATOM 2057 C TYR A 133 4.982 1.029 -10.011 1.00 0.00 C ATOM 2058 O TYR A 133 3.894 0.965 -10.589 1.00 0.00 O ATOM 2059 CB TYR A 133 5.647 1.159 -7.562 1.00 0.00 C ATOM 2060 CG TYR A 133 6.709 1.862 -6.750 1.00 0.00 C ATOM 2061 CD1 TYR A 133 7.796 2.499 -7.379 1.00 0.00 C ATOM 2062 CD2 TYR A 133 6.589 1.902 -5.355 1.00 0.00 C ATOM 2063 CE1 TYR A 133 8.650 3.327 -6.634 1.00 0.00 C ATOM 2064 CE2 TYR A 133 7.480 2.678 -4.600 1.00 0.00 C ATOM 2065 CZ TYR A 133 8.471 3.445 -5.242 1.00 0.00 C ATOM 2066 OH TYR A 133 9.249 4.295 -4.524 1.00 0.00 O ATOM 0 H TYR A 133 3.177 2.165 -8.442 1.00 0.00 H new ATOM 0 HA TYR A 133 6.044 2.584 -9.079 1.00 0.00 H new ATOM 0 HB2 TYR A 133 4.773 0.993 -6.932 1.00 0.00 H new ATOM 0 HB3 TYR A 133 6.019 0.178 -7.856 1.00 0.00 H new ATOM 0 HD1 TYR A 133 7.972 2.350 -8.434 1.00 0.00 H new ATOM 0 HD2 TYR A 133 5.812 1.336 -4.862 1.00 0.00 H new ATOM 0 HE1 TYR A 133 9.442 3.872 -7.127 1.00 0.00 H new ATOM 0 HE2 TYR A 133 7.406 2.687 -3.523 1.00 0.00 H new ATOM 0 HH TYR A 133 9.483 5.070 -5.077 1.00 0.00 H new ATOM 2076 N ASP A 134 6.063 0.364 -10.381 1.00 0.00 N ATOM 2077 CA ASP A 134 6.098 -0.591 -11.474 1.00 0.00 C ATOM 2078 C ASP A 134 7.112 -1.670 -11.116 1.00 0.00 C ATOM 2079 O ASP A 134 8.297 -1.528 -11.408 1.00 0.00 O ATOM 2080 CB ASP A 134 6.423 0.113 -12.818 1.00 0.00 C ATOM 2081 CG ASP A 134 5.320 0.041 -13.873 1.00 0.00 C ATOM 2082 OD1 ASP A 134 4.290 -0.646 -13.656 1.00 0.00 O ATOM 2083 OD2 ASP A 134 5.436 0.681 -14.939 1.00 0.00 O ATOM 0 H ASP A 134 6.964 0.477 -9.917 1.00 0.00 H new ATOM 0 HA ASP A 134 5.121 -1.054 -11.614 1.00 0.00 H new ATOM 0 HB2 ASP A 134 6.643 1.161 -12.617 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.329 -0.329 -13.232 1.00 0.00 H new ATOM 2088 N SER A 135 6.694 -2.739 -10.426 1.00 0.00 N ATOM 2089 CA SER A 135 7.579 -3.912 -10.311 1.00 0.00 C ATOM 2090 C SER A 135 7.859 -4.506 -11.704 1.00 0.00 C ATOM 2091 O SER A 135 8.918 -5.097 -11.899 1.00 0.00 O ATOM 2092 CB SER A 135 7.095 -4.972 -9.303 1.00 0.00 C ATOM 2093 OG SER A 135 8.155 -5.319 -8.415 1.00 0.00 O ATOM 0 H SER A 135 5.792 -2.821 -9.957 1.00 0.00 H new ATOM 0 HA SER A 135 8.519 -3.556 -9.890 1.00 0.00 H new ATOM 0 HB2 SER A 135 6.247 -4.587 -8.737 1.00 0.00 H new ATOM 0 HB3 SER A 135 6.749 -5.859 -9.833 1.00 0.00 H new ATOM 0 HG SER A 135 7.840 -5.992 -7.776 1.00 0.00 H new ATOM 2099 N GLU A 136 6.991 -4.255 -12.693 1.00 0.00 N ATOM 2100 CA GLU A 136 7.228 -4.576 -14.091 1.00 0.00 C ATOM 2101 C GLU A 136 7.538 -3.238 -14.757 1.00 0.00 C ATOM 2102 O GLU A 136 6.688 -2.625 -15.404 1.00 0.00 O ATOM 2103 CB GLU A 136 6.052 -5.333 -14.750 1.00 0.00 C ATOM 2104 CG GLU A 136 5.373 -6.445 -13.933 1.00 0.00 C ATOM 2105 CD GLU A 136 6.272 -7.172 -12.932 1.00 0.00 C ATOM 2106 OE1 GLU A 136 7.266 -7.812 -13.333 1.00 0.00 O ATOM 2107 OE2 GLU A 136 5.988 -7.080 -11.716 1.00 0.00 O ATOM 0 H GLU A 136 6.086 -3.813 -12.531 1.00 0.00 H new ATOM 0 HA GLU A 136 8.057 -5.275 -14.205 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.290 -4.601 -15.019 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.414 -5.773 -15.679 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.532 -6.011 -13.391 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.961 -7.180 -14.625 1.00 0.00 H new ATOM 2114 N GLY A 137 8.729 -2.723 -14.475 1.00 0.00 N ATOM 2115 CA GLY A 137 9.245 -1.487 -15.040 1.00 0.00 C ATOM 2116 C GLY A 137 10.743 -1.614 -15.272 1.00 0.00 C ATOM 2117 O GLY A 137 11.408 -2.368 -14.554 1.00 0.00 O ATOM 0 H GLY A 137 9.379 -3.169 -13.828 1.00 0.00 H new ATOM 0 HA2 GLY A 137 8.739 -1.267 -15.980 1.00 0.00 H new ATOM 0 HA3 GLY A 137 9.041 -0.655 -14.366 1.00 0.00 H new ATOM 2121 N PRO A 138 11.308 -0.842 -16.212 1.00 0.00 N ATOM 2122 CA PRO A 138 12.663 -1.049 -16.698 1.00 0.00 C ATOM 2123 C PRO A 138 13.735 -0.618 -15.697 1.00 0.00 C ATOM 2124 O PRO A 138 14.912 -0.855 -15.948 1.00 0.00 O ATOM 2125 CB PRO A 138 12.742 -0.224 -17.983 1.00 0.00 C ATOM 2126 CG PRO A 138 11.771 0.927 -17.733 1.00 0.00 C ATOM 2127 CD PRO A 138 10.672 0.265 -16.912 1.00 0.00 C ATOM 0 HA PRO A 138 12.860 -2.109 -16.861 1.00 0.00 H new ATOM 0 HB2 PRO A 138 13.754 0.138 -18.165 1.00 0.00 H new ATOM 0 HB3 PRO A 138 12.452 -0.811 -18.854 1.00 0.00 H new ATOM 0 HG2 PRO A 138 12.244 1.746 -17.191 1.00 0.00 H new ATOM 0 HG3 PRO A 138 11.386 1.342 -18.665 1.00 0.00 H new ATOM 0 HD2 PRO A 138 10.232 0.971 -16.208 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.866 -0.090 -17.553 1.00 0.00 H new ATOM 2135 N HIS A 139 13.363 0.008 -14.576 1.00 0.00 N ATOM 2136 CA HIS A 139 14.282 0.645 -13.639 1.00 0.00 C ATOM 2137 C HIS A 139 15.422 -0.280 -13.193 1.00 0.00 C ATOM 2138 O HIS A 139 16.531 0.199 -12.968 1.00 0.00 O ATOM 2139 CB HIS A 139 13.509 1.148 -12.422 1.00 0.00 C ATOM 2140 CG HIS A 139 12.257 1.935 -12.731 1.00 0.00 C ATOM 2141 ND1 HIS A 139 12.176 3.287 -12.988 1.00 0.00 N ATOM 2142 CD2 HIS A 139 10.979 1.441 -12.740 1.00 0.00 C ATOM 2143 CE1 HIS A 139 10.876 3.600 -13.123 1.00 0.00 C ATOM 2144 NE2 HIS A 139 10.112 2.514 -12.938 1.00 0.00 N ATOM 0 H HIS A 139 12.387 0.085 -14.291 1.00 0.00 H new ATOM 0 HA HIS A 139 14.745 1.481 -14.163 1.00 0.00 H new ATOM 0 HB2 HIS A 139 13.237 0.291 -11.806 1.00 0.00 H new ATOM 0 HB3 HIS A 139 14.172 1.773 -11.824 1.00 0.00 H new ATOM 0 HD2 HIS A 139 10.695 0.406 -12.616 1.00 0.00 H new ATOM 0 HE1 HIS A 139 10.500 4.587 -13.349 1.00 0.00 H new ATOM 0 HE2 HIS A 139 9.093 2.480 -12.941 1.00 0.00 H new ATOM 2152 N GLY A 140 15.163 -1.586 -13.070 1.00 0.00 N ATOM 2153 CA GLY A 140 16.179 -2.624 -12.895 1.00 0.00 C ATOM 2154 C GLY A 140 16.368 -3.054 -11.440 1.00 0.00 C ATOM 2155 O GLY A 140 16.850 -4.150 -11.176 1.00 0.00 O ATOM 0 H GLY A 140 14.214 -1.958 -13.090 1.00 0.00 H new ATOM 0 HA2 GLY A 140 15.903 -3.495 -13.490 1.00 0.00 H new ATOM 0 HA3 GLY A 140 17.130 -2.260 -13.284 1.00 0.00 H new ATOM 2159 N LEU A 141 15.930 -2.226 -10.493 1.00 0.00 N ATOM 2160 CA LEU A 141 15.864 -2.493 -9.053 1.00 0.00 C ATOM 2161 C LEU A 141 14.436 -2.900 -8.681 1.00 0.00 C ATOM 2162 O LEU A 141 13.746 -2.184 -7.943 1.00 0.00 O ATOM 2163 CB LEU A 141 16.274 -1.250 -8.233 1.00 0.00 C ATOM 2164 CG LEU A 141 15.699 0.066 -8.781 1.00 0.00 C ATOM 2165 CD1 LEU A 141 15.143 0.907 -7.648 1.00 0.00 C ATOM 2166 CD2 LEU A 141 16.708 0.856 -9.607 1.00 0.00 C ATOM 0 H LEU A 141 15.590 -1.292 -10.723 1.00 0.00 H new ATOM 0 HA LEU A 141 16.560 -3.299 -8.820 1.00 0.00 H new ATOM 0 HB2 LEU A 141 15.944 -1.380 -7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 141 17.362 -1.181 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 141 14.889 -0.196 -9.461 1.00 0.00 H new ATOM 0 HD11 LEU A 141 14.739 1.836 -8.049 1.00 0.00 H new ATOM 0 HD12 LEU A 141 14.351 0.356 -7.141 1.00 0.00 H new ATOM 0 HD13 LEU A 141 15.939 1.134 -6.939 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.244 1.775 -9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 141 17.571 1.103 -8.988 1.00 0.00 H new ATOM 0 HD23 LEU A 141 17.031 0.256 -10.457 1.00 0.00 H new ATOM 2178 N ARG A 142 13.900 -3.957 -9.286 1.00 0.00 N ATOM 2179 CA ARG A 142 12.543 -4.386 -8.963 1.00 0.00 C ATOM 2180 C ARG A 142 12.561 -5.286 -7.729 1.00 0.00 C ATOM 2181 O ARG A 142 13.637 -5.642 -7.234 1.00 0.00 O ATOM 2182 CB ARG A 142 11.890 -5.024 -10.191 1.00 0.00 C ATOM 2183 CG ARG A 142 11.939 -4.065 -11.392 1.00 0.00 C ATOM 2184 CD ARG A 142 11.223 -2.733 -11.111 1.00 0.00 C ATOM 2185 NE ARG A 142 11.995 -1.718 -10.368 1.00 0.00 N ATOM 2186 CZ ARG A 142 11.532 -0.540 -9.927 1.00 0.00 C ATOM 2187 NH1 ARG A 142 10.280 -0.169 -10.124 1.00 0.00 N ATOM 2188 NH2 ARG A 142 12.339 0.313 -9.318 1.00 0.00 N ATOM 0 H ARG A 142 14.374 -4.523 -9.990 1.00 0.00 H new ATOM 0 HA ARG A 142 11.923 -3.528 -8.703 1.00 0.00 H new ATOM 0 HB2 ARG A 142 12.402 -5.953 -10.440 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.855 -5.281 -9.966 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.979 -3.867 -11.653 1.00 0.00 H new ATOM 0 HG3 ARG A 142 11.480 -4.546 -12.256 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.919 -2.301 -12.064 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.312 -2.946 -10.552 1.00 0.00 H new ATOM 0 HE ARG A 142 12.973 -1.933 -10.172 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.638 -0.785 -10.623 1.00 0.00 H new ATOM 0 HH12 ARG A 142 9.955 0.733 -9.777 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.322 0.076 -9.181 1.00 0.00 H new ATOM 0 HH22 ARG A 142 11.979 1.207 -8.985 1.00 0.00 H new ATOM 2202 N TYR A 143 11.379 -5.582 -7.186 1.00 0.00 N ATOM 2203 CA TYR A 143 11.256 -6.319 -5.934 1.00 0.00 C ATOM 2204 C TYR A 143 11.875 -7.701 -6.131 1.00 0.00 C ATOM 2205 O TYR A 143 11.830 -8.258 -7.232 1.00 0.00 O ATOM 2206 CB TYR A 143 9.780 -6.397 -5.501 1.00 0.00 C ATOM 2207 CG TYR A 143 9.498 -7.168 -4.218 1.00 0.00 C ATOM 2208 CD1 TYR A 143 10.208 -6.898 -3.031 1.00 0.00 C ATOM 2209 CD2 TYR A 143 8.491 -8.149 -4.205 1.00 0.00 C ATOM 2210 CE1 TYR A 143 9.958 -7.644 -1.865 1.00 0.00 C ATOM 2211 CE2 TYR A 143 8.182 -8.840 -3.021 1.00 0.00 C ATOM 2212 CZ TYR A 143 8.925 -8.604 -1.848 1.00 0.00 C ATOM 2213 OH TYR A 143 8.641 -9.311 -0.721 1.00 0.00 O ATOM 0 H TYR A 143 10.486 -5.318 -7.602 1.00 0.00 H new ATOM 0 HA TYR A 143 11.788 -5.808 -5.132 1.00 0.00 H new ATOM 0 HB2 TYR A 143 9.404 -5.381 -5.381 1.00 0.00 H new ATOM 0 HB3 TYR A 143 9.209 -6.855 -6.309 1.00 0.00 H new ATOM 0 HD1 TYR A 143 10.949 -6.113 -3.016 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.950 -8.373 -5.113 1.00 0.00 H new ATOM 0 HE1 TYR A 143 10.558 -7.481 -0.982 1.00 0.00 H new ATOM 0 HE2 TYR A 143 7.372 -9.554 -3.010 1.00 0.00 H new ATOM 0 HH TYR A 143 7.898 -9.925 -0.899 1.00 0.00 H new ATOM 2223 N ASN A 144 12.401 -8.279 -5.055 1.00 0.00 N ATOM 2224 CA ASN A 144 12.984 -9.612 -5.023 1.00 0.00 C ATOM 2225 C ASN A 144 12.061 -10.429 -4.110 1.00 0.00 C ATOM 2226 O ASN A 144 12.388 -10.612 -2.934 1.00 0.00 O ATOM 2227 CB ASN A 144 14.443 -9.573 -4.506 1.00 0.00 C ATOM 2228 CG ASN A 144 15.528 -9.499 -5.578 1.00 0.00 C ATOM 2229 OD1 ASN A 144 16.498 -10.249 -5.501 1.00 0.00 O ATOM 2230 ND2 ASN A 144 15.428 -8.623 -6.564 1.00 0.00 N ATOM 0 H ASN A 144 12.433 -7.812 -4.149 1.00 0.00 H new ATOM 0 HA ASN A 144 13.050 -10.059 -6.015 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.552 -8.712 -3.846 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.617 -10.462 -3.900 1.00 0.00 H new ATOM 0 HD21 ASN A 144 16.161 -8.565 -7.271 1.00 0.00 H new ATOM 0 HD22 ASN A 144 14.618 -8.006 -6.617 1.00 0.00 H new ATOM 2237 N PRO A 145 10.901 -10.900 -4.619 1.00 0.00 N ATOM 2238 CA PRO A 145 9.946 -11.670 -3.828 1.00 0.00 C ATOM 2239 C PRO A 145 10.522 -13.022 -3.414 1.00 0.00 C ATOM 2240 O PRO A 145 10.283 -13.465 -2.289 1.00 0.00 O ATOM 2241 CB PRO A 145 8.701 -11.837 -4.714 1.00 0.00 C ATOM 2242 CG PRO A 145 9.238 -11.683 -6.131 1.00 0.00 C ATOM 2243 CD PRO A 145 10.345 -10.654 -5.947 1.00 0.00 C ATOM 0 HA PRO A 145 9.703 -11.157 -2.897 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.234 -12.811 -4.567 1.00 0.00 H new ATOM 0 HB3 PRO A 145 7.946 -11.084 -4.489 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.619 -12.625 -6.526 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.470 -11.335 -6.822 1.00 0.00 H new ATOM 0 HD2 PRO A 145 11.109 -10.760 -6.717 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.953 -9.640 -6.025 1.00 0.00 H new ATOM 2251 N ARG A 146 11.233 -13.697 -4.322 1.00 0.00 N ATOM 2252 CA ARG A 146 11.872 -14.989 -4.092 1.00 0.00 C ATOM 2253 C ARG A 146 13.116 -15.179 -4.956 1.00 0.00 C ATOM 2254 O ARG A 146 13.733 -16.241 -4.930 1.00 0.00 O ATOM 2255 CB ARG A 146 10.789 -16.059 -4.321 1.00 0.00 C ATOM 2256 CG ARG A 146 11.225 -17.527 -4.210 1.00 0.00 C ATOM 2257 CD ARG A 146 9.959 -18.370 -3.984 1.00 0.00 C ATOM 2258 NE ARG A 146 10.101 -19.778 -4.394 1.00 0.00 N ATOM 2259 CZ ARG A 146 10.062 -20.231 -5.655 1.00 0.00 C ATOM 2260 NH1 ARG A 146 9.852 -19.405 -6.674 1.00 0.00 N ATOM 2261 NH2 ARG A 146 10.250 -21.519 -5.903 1.00 0.00 N ATOM 0 H ARG A 146 11.382 -13.345 -5.267 1.00 0.00 H new ATOM 0 HA ARG A 146 12.253 -15.066 -3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 146 9.987 -15.889 -3.603 1.00 0.00 H new ATOM 0 HB3 ARG A 146 10.366 -15.905 -5.314 1.00 0.00 H new ATOM 0 HG2 ARG A 146 11.739 -17.844 -5.117 1.00 0.00 H new ATOM 0 HG3 ARG A 146 11.925 -17.658 -3.385 1.00 0.00 H new ATOM 0 HD2 ARG A 146 9.694 -18.334 -2.927 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.132 -17.922 -4.536 1.00 0.00 H new ATOM 0 HE ARG A 146 10.241 -20.467 -3.655 1.00 0.00 H new ATOM 0 HH11 ARG A 146 9.717 -18.408 -6.503 1.00 0.00 H new ATOM 0 HH12 ARG A 146 9.826 -19.767 -7.627 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.424 -22.166 -5.134 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.220 -21.863 -6.863 1.00 0.00 H new ATOM 2275 N GLU A 147 13.508 -14.141 -5.688 1.00 0.00 N ATOM 2276 CA GLU A 147 14.443 -14.195 -6.800 1.00 0.00 C ATOM 2277 C GLU A 147 15.787 -14.769 -6.384 1.00 0.00 C ATOM 2278 O GLU A 147 16.344 -15.612 -7.088 1.00 0.00 O ATOM 2279 CB GLU A 147 14.627 -12.784 -7.375 1.00 0.00 C ATOM 2280 CG GLU A 147 13.353 -12.143 -7.938 1.00 0.00 C ATOM 2281 CD GLU A 147 12.828 -12.865 -9.178 1.00 0.00 C ATOM 2282 OE1 GLU A 147 12.402 -14.027 -9.055 1.00 0.00 O ATOM 2283 OE2 GLU A 147 12.787 -12.266 -10.282 1.00 0.00 O ATOM 0 H GLU A 147 13.165 -13.197 -5.512 1.00 0.00 H new ATOM 0 HA GLU A 147 14.029 -14.858 -7.560 1.00 0.00 H new ATOM 0 HB2 GLU A 147 15.026 -12.138 -6.593 1.00 0.00 H new ATOM 0 HB3 GLU A 147 15.375 -12.825 -8.166 1.00 0.00 H new ATOM 0 HG2 GLU A 147 12.581 -12.143 -7.169 1.00 0.00 H new ATOM 0 HG3 GLU A 147 13.555 -11.101 -8.187 1.00 0.00 H new ATOM 2290 N ASN A 148 16.273 -14.357 -5.217 1.00 0.00 N ATOM 2291 CA ASN A 148 17.483 -14.879 -4.595 1.00 0.00 C ATOM 2292 C ASN A 148 17.147 -15.445 -3.208 1.00 0.00 C ATOM 2293 O ASN A 148 17.989 -15.460 -2.313 1.00 0.00 O ATOM 2294 CB ASN A 148 18.617 -13.831 -4.654 1.00 0.00 C ATOM 2295 CG ASN A 148 18.683 -12.857 -3.479 1.00 0.00 C ATOM 2296 OD1 ASN A 148 19.511 -13.010 -2.586 1.00 0.00 O ATOM 2297 ND2 ASN A 148 17.865 -11.817 -3.469 1.00 0.00 N ATOM 0 H ASN A 148 15.822 -13.629 -4.663 1.00 0.00 H new ATOM 0 HA ASN A 148 17.883 -15.727 -5.151 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.569 -14.357 -4.720 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.507 -13.255 -5.573 1.00 0.00 H new ATOM 0 HD21 ASN A 148 17.919 -11.133 -2.714 1.00 0.00 H new ATOM 0 HD22 ASN A 148 17.181 -11.699 -4.216 1.00 0.00 H new ATOM 2304 N ARG A 149 15.915 -15.952 -3.051 1.00 0.00 N ATOM 2305 CA ARG A 149 15.221 -16.104 -1.788 1.00 0.00 C ATOM 2306 C ARG A 149 15.161 -14.749 -1.106 1.00 0.00 C ATOM 2307 O ARG A 149 14.576 -13.843 -1.743 1.00 0.00 O ATOM 2308 CB ARG A 149 15.801 -17.270 -0.958 1.00 0.00 C ATOM 2309 CG ARG A 149 14.871 -17.699 0.186 1.00 0.00 C ATOM 2310 CD ARG A 149 13.663 -18.440 -0.370 1.00 0.00 C ATOM 2311 NE ARG A 149 12.453 -18.202 0.417 1.00 0.00 N ATOM 2312 CZ ARG A 149 11.241 -18.669 0.119 1.00 0.00 C ATOM 2313 NH1 ARG A 149 11.081 -19.528 -0.889 1.00 0.00 N ATOM 2314 NH2 ARG A 149 10.193 -18.267 0.828 1.00 0.00 N ATOM 0 H ARG A 149 15.361 -16.278 -3.843 1.00 0.00 H new ATOM 0 HA ARG A 149 14.186 -16.412 -1.934 1.00 0.00 H new ATOM 0 HB2 ARG A 149 15.983 -18.122 -1.613 1.00 0.00 H new ATOM 0 HB3 ARG A 149 16.765 -16.973 -0.546 1.00 0.00 H new ATOM 0 HG2 ARG A 149 15.411 -18.340 0.883 1.00 0.00 H new ATOM 0 HG3 ARG A 149 14.544 -16.823 0.746 1.00 0.00 H new ATOM 0 HD2 ARG A 149 13.491 -18.128 -1.400 1.00 0.00 H new ATOM 0 HD3 ARG A 149 13.874 -19.509 -0.392 1.00 0.00 H new ATOM 0 HE ARG A 149 12.544 -17.634 1.260 1.00 0.00 H new ATOM 0 HH11 ARG A 149 11.888 -19.830 -1.435 1.00 0.00 H new ATOM 0 HH12 ARG A 149 10.152 -19.883 -1.114 1.00 0.00 H new ATOM 0 HH21 ARG A 149 10.319 -17.606 1.594 1.00 0.00 H new ATOM 0 HH22 ARG A 149 9.262 -18.620 0.606 1.00 0.00 H new TER 2328 ARG A 149