USER MOD reduce.3.24.130724 H: found=0, std=0, add=858, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 862 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 50 TYR OH : rot 55:sc= 0.759 USER MOD Set 1.2: A 59 THR OG1 : rot 180:sc= 0.00304 USER MOD Set 1.3: A 62 GLN : amide:sc= 1.03 K(o=1.8,f=-1.8) USER MOD Set 2.1: A 27 ASN : amide:sc= 0.807 K(o=3.2,f=-7.5!) USER MOD Set 2.2: A 30 LYS NZ :NH3+ 179:sc= 2.4 (180deg=1.22) USER MOD Single : A 25 MET CE :methyl -158:sc= -0.175 (180deg=-0.827) USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= -0.113 (180deg=-0.603) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 35 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0663) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -173:sc= -1.88 (180deg=-2.1) USER MOD Single : A 51 LYS NZ :NH3+ -168:sc= -0.0234 (180deg=-0.193) USER MOD Single : A 54 ASN : amide:sc= -3.51! C(o=-3.5!,f=-3.4!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 66:sc= 0.556 USER MOD Single : A 65 GLN : amide:sc= -2.41! C(o=-2.4!,f=-3.9!) USER MOD Single : A 69 SER OG : rot 180:sc= -0.124 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0209 USER MOD Single : A 76 HIS : no HE2:sc= -0.183 K(o=-0.18,f=-0.96) USER MOD Single : A 79 ASN : amide:sc= 0.14 X(o=0.14,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot -97:sc= 0.152 USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 96 SER OG : rot 170:sc= 0 USER MOD Single : A 98 TYR OH : rot 113:sc= -1.53 USER MOD Single : A 99 GLN : amide:sc= -0.215 X(o=-0.22,f=-0.67) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= 1.09 K(o=1.1,f=-3.2!) USER MOD Single : A 106 HIS : no HE2:sc= 1.03 K(o=1,f=-6!) USER MOD Single : A 108 GLN : amide:sc= -0.193 X(o=-0.19,f=-0.12) USER MOD Single : A 113 SER OG : rot 52:sc= 1.28 USER MOD Single : A 123 ASN : amide:sc=-0.00671 K(o=-0.0067,f=-1.1) USER MOD Single : A 128 ASN : amide:sc= -0.603 K(o=-0.6,f=-8.5!) USER MOD Single : A 130 THR OG1 : rot -139:sc= 0.676 USER MOD Single : A 134 HIS : no HD1:sc= 1.2 K(o=1.2,f=-5.4!) USER MOD Single : A 135 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=-0.019) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=-0.0042) USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ -165:sc= -0.046 (180deg=-0.268) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 25 30.021 -4.571 -8.304 1.00 0.00 N ATOM 2 CA MET A 25 28.646 -4.158 -8.660 1.00 0.00 C ATOM 3 C MET A 25 27.649 -5.233 -8.248 1.00 0.00 C ATOM 4 O MET A 25 28.022 -6.231 -7.630 1.00 0.00 O ATOM 5 CB MET A 25 28.530 -3.880 -10.165 1.00 0.00 C ATOM 6 CG MET A 25 28.790 -5.092 -11.045 1.00 0.00 C ATOM 7 SD MET A 25 28.558 -4.741 -12.800 1.00 0.00 S ATOM 8 CE MET A 25 26.821 -4.307 -12.836 1.00 0.00 C ATOM 0 HA MET A 25 28.418 -3.238 -8.123 1.00 0.00 H new ATOM 0 HB2 MET A 25 27.531 -3.499 -10.377 1.00 0.00 H new ATOM 0 HB3 MET A 25 29.235 -3.093 -10.433 1.00 0.00 H new ATOM 0 HG2 MET A 25 29.809 -5.444 -10.881 1.00 0.00 H new ATOM 0 HG3 MET A 25 28.122 -5.901 -10.749 1.00 0.00 H new ATOM 0 HE1 MET A 25 26.433 -4.444 -13.845 1.00 0.00 H new ATOM 0 HE2 MET A 25 26.272 -4.947 -12.146 1.00 0.00 H new ATOM 0 HE3 MET A 25 26.700 -3.265 -12.539 1.00 0.00 H new ATOM 20 N GLY A 26 26.387 -5.018 -8.584 1.00 0.00 N ATOM 21 CA GLY A 26 25.349 -5.972 -8.260 1.00 0.00 C ATOM 22 C GLY A 26 24.037 -5.278 -7.981 1.00 0.00 C ATOM 23 O GLY A 26 23.127 -5.297 -8.814 1.00 0.00 O ATOM 0 H GLY A 26 26.061 -4.189 -9.081 1.00 0.00 H new ATOM 0 HA2 GLY A 26 25.224 -6.672 -9.086 1.00 0.00 H new ATOM 0 HA3 GLY A 26 25.647 -6.556 -7.389 1.00 0.00 H new ATOM 27 N ASN A 27 23.956 -4.653 -6.810 1.00 0.00 N ATOM 28 CA ASN A 27 22.788 -3.871 -6.414 1.00 0.00 C ATOM 29 C ASN A 27 21.501 -4.679 -6.498 1.00 0.00 C ATOM 30 O ASN A 27 20.577 -4.322 -7.233 1.00 0.00 O ATOM 31 CB ASN A 27 22.660 -2.600 -7.261 1.00 0.00 C ATOM 32 CG ASN A 27 23.272 -1.388 -6.588 1.00 0.00 C ATOM 33 OD1 ASN A 27 22.595 -0.662 -5.857 1.00 0.00 O ATOM 34 ND2 ASN A 27 24.552 -1.156 -6.828 1.00 0.00 N ATOM 0 H ASN A 27 24.697 -4.674 -6.109 1.00 0.00 H new ATOM 0 HA ASN A 27 22.941 -3.590 -5.372 1.00 0.00 H new ATOM 0 HB2 ASN A 27 23.144 -2.759 -8.224 1.00 0.00 H new ATOM 0 HB3 ASN A 27 21.606 -2.406 -7.462 1.00 0.00 H new ATOM 0 HD21 ASN A 27 25.013 -0.352 -6.402 1.00 0.00 H new ATOM 0 HD22 ASN A 27 25.078 -1.781 -7.439 1.00 0.00 H new ATOM 41 N LYS A 28 21.438 -5.766 -5.738 1.00 0.00 N ATOM 42 CA LYS A 28 20.204 -6.530 -5.612 1.00 0.00 C ATOM 43 C LYS A 28 19.124 -5.639 -5.015 1.00 0.00 C ATOM 44 O LYS A 28 17.943 -5.786 -5.312 1.00 0.00 O ATOM 45 CB LYS A 28 20.413 -7.766 -4.731 1.00 0.00 C ATOM 46 CG LYS A 28 20.868 -7.431 -3.321 1.00 0.00 C ATOM 47 CD LYS A 28 21.084 -8.676 -2.484 1.00 0.00 C ATOM 48 CE LYS A 28 21.719 -8.331 -1.148 1.00 0.00 C ATOM 49 NZ LYS A 28 23.038 -7.662 -1.320 1.00 0.00 N ATOM 0 H LYS A 28 22.223 -6.136 -5.202 1.00 0.00 H new ATOM 0 HA LYS A 28 19.896 -6.870 -6.601 1.00 0.00 H new ATOM 0 HB2 LYS A 28 19.481 -8.329 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 28 21.153 -8.416 -5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 28 21.795 -6.859 -3.365 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.124 -6.796 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.130 -9.177 -2.319 1.00 0.00 H new ATOM 0 HD3 LYS A 28 21.722 -9.375 -3.024 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.051 -7.679 -0.586 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.846 -9.240 -0.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 23.600 -7.774 -0.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 23.545 -8.094 -2.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.892 -6.650 -1.509 1.00 0.00 H new ATOM 63 N GLU A 29 19.568 -4.680 -4.202 1.00 0.00 N ATOM 64 CA GLU A 29 18.689 -3.706 -3.575 1.00 0.00 C ATOM 65 C GLU A 29 17.810 -3.019 -4.610 1.00 0.00 C ATOM 66 O GLU A 29 16.613 -2.837 -4.399 1.00 0.00 O ATOM 67 CB GLU A 29 19.535 -2.657 -2.851 1.00 0.00 C ATOM 68 CG GLU A 29 18.733 -1.495 -2.297 1.00 0.00 C ATOM 69 CD GLU A 29 19.612 -0.329 -1.909 1.00 0.00 C ATOM 70 OE1 GLU A 29 19.903 0.517 -2.784 1.00 0.00 O ATOM 71 OE2 GLU A 29 20.027 -0.257 -0.736 1.00 0.00 O ATOM 0 H GLU A 29 20.552 -4.561 -3.962 1.00 0.00 H new ATOM 0 HA GLU A 29 18.044 -4.225 -2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 29 20.071 -3.138 -2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 29 20.286 -2.271 -3.541 1.00 0.00 H new ATOM 0 HG2 GLU A 29 18.007 -1.169 -3.042 1.00 0.00 H new ATOM 0 HG3 GLU A 29 18.168 -1.828 -1.426 1.00 0.00 H new ATOM 78 N LYS A 30 18.407 -2.657 -5.740 1.00 0.00 N ATOM 79 CA LYS A 30 17.685 -1.951 -6.782 1.00 0.00 C ATOM 80 C LYS A 30 16.646 -2.858 -7.424 1.00 0.00 C ATOM 81 O LYS A 30 15.526 -2.434 -7.689 1.00 0.00 O ATOM 82 CB LYS A 30 18.648 -1.403 -7.837 1.00 0.00 C ATOM 83 CG LYS A 30 19.630 -0.374 -7.291 1.00 0.00 C ATOM 84 CD LYS A 30 18.912 0.779 -6.605 1.00 0.00 C ATOM 85 CE LYS A 30 19.878 1.862 -6.151 1.00 0.00 C ATOM 86 NZ LYS A 30 20.850 1.363 -5.141 1.00 0.00 N ATOM 0 H LYS A 30 19.387 -2.842 -5.954 1.00 0.00 H new ATOM 0 HA LYS A 30 17.168 -1.108 -6.324 1.00 0.00 H new ATOM 0 HB2 LYS A 30 19.207 -2.232 -8.272 1.00 0.00 H new ATOM 0 HB3 LYS A 30 18.071 -0.950 -8.643 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.305 -0.855 -6.583 1.00 0.00 H new ATOM 0 HG3 LYS A 30 20.243 0.012 -8.105 1.00 0.00 H new ATOM 0 HD2 LYS A 30 18.181 1.209 -7.289 1.00 0.00 H new ATOM 0 HD3 LYS A 30 18.360 0.402 -5.744 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.420 2.248 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 30 19.315 2.695 -5.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.498 2.131 -4.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.337 1.034 -4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 21.395 0.574 -5.544 1.00 0.00 H new ATOM 100 N ALA A 31 17.013 -4.114 -7.638 1.00 0.00 N ATOM 101 CA ALA A 31 16.102 -5.087 -8.229 1.00 0.00 C ATOM 102 C ALA A 31 14.937 -5.379 -7.287 1.00 0.00 C ATOM 103 O ALA A 31 13.779 -5.451 -7.712 1.00 0.00 O ATOM 104 CB ALA A 31 16.847 -6.370 -8.566 1.00 0.00 C ATOM 0 H ALA A 31 17.936 -4.484 -7.411 1.00 0.00 H new ATOM 0 HA ALA A 31 15.698 -4.665 -9.149 1.00 0.00 H new ATOM 0 HB1 ALA A 31 16.155 -7.088 -9.006 1.00 0.00 H new ATOM 0 HB2 ALA A 31 17.644 -6.152 -9.276 1.00 0.00 H new ATOM 0 HB3 ALA A 31 17.276 -6.791 -7.657 1.00 0.00 H new ATOM 110 N ASP A 32 15.253 -5.536 -6.006 1.00 0.00 N ATOM 111 CA ASP A 32 14.246 -5.830 -4.993 1.00 0.00 C ATOM 112 C ASP A 32 13.273 -4.672 -4.825 1.00 0.00 C ATOM 113 O ASP A 32 12.060 -4.876 -4.803 1.00 0.00 O ATOM 114 CB ASP A 32 14.901 -6.157 -3.647 1.00 0.00 C ATOM 115 CG ASP A 32 15.471 -7.561 -3.597 1.00 0.00 C ATOM 116 OD1 ASP A 32 14.697 -8.511 -3.364 1.00 0.00 O ATOM 117 OD2 ASP A 32 16.693 -7.725 -3.782 1.00 0.00 O ATOM 0 H ASP A 32 16.204 -5.464 -5.643 1.00 0.00 H new ATOM 0 HA ASP A 32 13.689 -6.702 -5.335 1.00 0.00 H new ATOM 0 HB2 ASP A 32 15.698 -5.439 -3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 32 14.165 -6.040 -2.852 1.00 0.00 H new ATOM 122 N ARG A 33 13.799 -3.453 -4.723 1.00 0.00 N ATOM 123 CA ARG A 33 12.951 -2.278 -4.528 1.00 0.00 C ATOM 124 C ARG A 33 12.034 -2.058 -5.725 1.00 0.00 C ATOM 125 O ARG A 33 10.899 -1.630 -5.556 1.00 0.00 O ATOM 126 CB ARG A 33 13.770 -1.016 -4.221 1.00 0.00 C ATOM 127 CG ARG A 33 14.743 -0.612 -5.310 1.00 0.00 C ATOM 128 CD ARG A 33 15.609 0.561 -4.874 1.00 0.00 C ATOM 129 NE ARG A 33 14.887 1.831 -4.908 1.00 0.00 N ATOM 130 CZ ARG A 33 14.802 2.679 -3.883 1.00 0.00 C ATOM 131 NH1 ARG A 33 15.254 2.334 -2.681 1.00 0.00 N ATOM 132 NH2 ARG A 33 14.236 3.867 -4.058 1.00 0.00 N ATOM 0 H ARG A 33 14.798 -3.253 -4.771 1.00 0.00 H new ATOM 0 HA ARG A 33 12.329 -2.476 -3.655 1.00 0.00 H new ATOM 0 HB2 ARG A 33 13.083 -0.189 -4.041 1.00 0.00 H new ATOM 0 HB3 ARG A 33 14.326 -1.176 -3.297 1.00 0.00 H new ATOM 0 HG2 ARG A 33 15.378 -1.460 -5.565 1.00 0.00 H new ATOM 0 HG3 ARG A 33 14.192 -0.344 -6.211 1.00 0.00 H new ATOM 0 HD2 ARG A 33 15.976 0.382 -3.863 1.00 0.00 H new ATOM 0 HD3 ARG A 33 16.482 0.625 -5.523 1.00 0.00 H new ATOM 0 HE ARG A 33 14.416 2.086 -5.776 1.00 0.00 H new ATOM 0 HH11 ARG A 33 15.670 1.414 -2.537 1.00 0.00 H new ATOM 0 HH12 ARG A 33 15.185 2.990 -1.903 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.869 4.127 -4.973 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.168 4.520 -3.277 1.00 0.00 H new ATOM 146 N GLN A 34 12.521 -2.348 -6.931 1.00 0.00 N ATOM 147 CA GLN A 34 11.684 -2.248 -8.127 1.00 0.00 C ATOM 148 C GLN A 34 10.468 -3.168 -8.001 1.00 0.00 C ATOM 149 O GLN A 34 9.353 -2.799 -8.380 1.00 0.00 O ATOM 150 CB GLN A 34 12.483 -2.602 -9.386 1.00 0.00 C ATOM 151 CG GLN A 34 13.545 -1.576 -9.751 1.00 0.00 C ATOM 152 CD GLN A 34 14.379 -2.000 -10.946 1.00 0.00 C ATOM 153 OE1 GLN A 34 15.409 -2.659 -10.801 1.00 0.00 O ATOM 154 NE2 GLN A 34 13.953 -1.614 -12.137 1.00 0.00 N ATOM 0 H GLN A 34 13.479 -2.651 -7.106 1.00 0.00 H new ATOM 0 HA GLN A 34 11.342 -1.217 -8.217 1.00 0.00 H new ATOM 0 HB2 GLN A 34 12.962 -3.570 -9.240 1.00 0.00 H new ATOM 0 HB3 GLN A 34 11.794 -2.710 -10.223 1.00 0.00 H new ATOM 0 HG2 GLN A 34 13.064 -0.622 -9.968 1.00 0.00 H new ATOM 0 HG3 GLN A 34 14.199 -1.415 -8.894 1.00 0.00 H new ATOM 0 HE21 GLN A 34 13.095 -1.069 -12.220 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.483 -1.862 -12.973 1.00 0.00 H new ATOM 163 N LYS A 35 10.691 -4.357 -7.445 1.00 0.00 N ATOM 164 CA LYS A 35 9.611 -5.305 -7.187 1.00 0.00 C ATOM 165 C LYS A 35 8.693 -4.774 -6.088 1.00 0.00 C ATOM 166 O LYS A 35 7.470 -4.910 -6.162 1.00 0.00 O ATOM 167 CB LYS A 35 10.192 -6.667 -6.785 1.00 0.00 C ATOM 168 CG LYS A 35 9.141 -7.717 -6.457 1.00 0.00 C ATOM 169 CD LYS A 35 8.315 -8.088 -7.676 1.00 0.00 C ATOM 170 CE LYS A 35 7.171 -9.020 -7.312 1.00 0.00 C ATOM 171 NZ LYS A 35 7.648 -10.300 -6.724 1.00 0.00 N ATOM 0 H LYS A 35 11.614 -4.687 -7.164 1.00 0.00 H new ATOM 0 HA LYS A 35 9.025 -5.429 -8.098 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.819 -7.037 -7.597 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.839 -6.533 -5.918 1.00 0.00 H new ATOM 0 HG2 LYS A 35 9.629 -8.609 -6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.484 -7.341 -5.673 1.00 0.00 H new ATOM 0 HD2 LYS A 35 7.916 -7.184 -8.136 1.00 0.00 H new ATOM 0 HD3 LYS A 35 8.954 -8.567 -8.418 1.00 0.00 H new ATOM 0 HE2 LYS A 35 6.511 -8.521 -6.602 1.00 0.00 H new ATOM 0 HE3 LYS A 35 6.580 -9.231 -8.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 6.841 -10.941 -6.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 8.336 -10.742 -7.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.101 -10.113 -5.807 1.00 0.00 H new ATOM 185 N VAL A 36 9.296 -4.146 -5.084 1.00 0.00 N ATOM 186 CA VAL A 36 8.552 -3.551 -3.981 1.00 0.00 C ATOM 187 C VAL A 36 7.614 -2.466 -4.495 1.00 0.00 C ATOM 188 O VAL A 36 6.431 -2.452 -4.165 1.00 0.00 O ATOM 189 CB VAL A 36 9.505 -2.946 -2.925 1.00 0.00 C ATOM 190 CG1 VAL A 36 8.734 -2.192 -1.852 1.00 0.00 C ATOM 191 CG2 VAL A 36 10.356 -4.034 -2.294 1.00 0.00 C ATOM 0 H VAL A 36 10.307 -4.036 -5.012 1.00 0.00 H new ATOM 0 HA VAL A 36 7.969 -4.344 -3.512 1.00 0.00 H new ATOM 0 HB VAL A 36 10.158 -2.236 -3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.433 -1.779 -1.125 1.00 0.00 H new ATOM 0 HG12 VAL A 36 8.168 -1.382 -2.312 1.00 0.00 H new ATOM 0 HG13 VAL A 36 8.048 -2.874 -1.349 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.021 -3.591 -1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.710 -4.767 -1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 36 10.948 -4.526 -3.066 1.00 0.00 H new ATOM 201 N VAL A 37 8.148 -1.585 -5.332 1.00 0.00 N ATOM 202 CA VAL A 37 7.366 -0.505 -5.921 1.00 0.00 C ATOM 203 C VAL A 37 6.207 -1.061 -6.746 1.00 0.00 C ATOM 204 O VAL A 37 5.119 -0.498 -6.750 1.00 0.00 O ATOM 205 CB VAL A 37 8.236 0.422 -6.803 1.00 0.00 C ATOM 206 CG1 VAL A 37 7.398 1.538 -7.413 1.00 0.00 C ATOM 207 CG2 VAL A 37 9.383 1.010 -5.995 1.00 0.00 C ATOM 0 H VAL A 37 9.126 -1.598 -5.620 1.00 0.00 H new ATOM 0 HA VAL A 37 6.969 0.086 -5.096 1.00 0.00 H new ATOM 0 HB VAL A 37 8.650 -0.179 -7.613 1.00 0.00 H new ATOM 0 HG11 VAL A 37 8.033 2.175 -8.028 1.00 0.00 H new ATOM 0 HG12 VAL A 37 6.611 1.106 -8.031 1.00 0.00 H new ATOM 0 HG13 VAL A 37 6.949 2.133 -6.617 1.00 0.00 H new ATOM 0 HG21 VAL A 37 9.983 1.659 -6.633 1.00 0.00 H new ATOM 0 HG22 VAL A 37 8.983 1.589 -5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.007 0.204 -5.609 1.00 0.00 H new ATOM 217 N SER A 38 6.446 -2.166 -7.440 1.00 0.00 N ATOM 218 CA SER A 38 5.421 -2.771 -8.280 1.00 0.00 C ATOM 219 C SER A 38 4.206 -3.199 -7.445 1.00 0.00 C ATOM 220 O SER A 38 3.061 -2.897 -7.789 1.00 0.00 O ATOM 221 CB SER A 38 6.010 -3.969 -9.032 1.00 0.00 C ATOM 222 OG SER A 38 5.123 -4.444 -10.031 1.00 0.00 O ATOM 0 H SER A 38 7.338 -2.660 -7.438 1.00 0.00 H new ATOM 0 HA SER A 38 5.080 -2.030 -9.003 1.00 0.00 H new ATOM 0 HB2 SER A 38 6.956 -3.682 -9.491 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.228 -4.771 -8.327 1.00 0.00 H new ATOM 0 HG SER A 38 5.529 -5.207 -10.493 1.00 0.00 H new ATOM 228 N ASP A 39 4.449 -3.879 -6.335 1.00 0.00 N ATOM 229 CA ASP A 39 3.363 -4.256 -5.435 1.00 0.00 C ATOM 230 C ASP A 39 2.808 -3.027 -4.718 1.00 0.00 C ATOM 231 O ASP A 39 1.613 -2.938 -4.438 1.00 0.00 O ATOM 232 CB ASP A 39 3.813 -5.319 -4.427 1.00 0.00 C ATOM 233 CG ASP A 39 3.796 -6.717 -5.019 1.00 0.00 C ATOM 234 OD1 ASP A 39 2.710 -7.339 -5.059 1.00 0.00 O ATOM 235 OD2 ASP A 39 4.864 -7.206 -5.448 1.00 0.00 O ATOM 0 H ASP A 39 5.377 -4.180 -6.035 1.00 0.00 H new ATOM 0 HA ASP A 39 2.567 -4.692 -6.038 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.820 -5.085 -4.081 1.00 0.00 H new ATOM 0 HB3 ASP A 39 3.161 -5.288 -3.554 1.00 0.00 H new ATOM 240 N LEU A 40 3.695 -2.083 -4.434 1.00 0.00 N ATOM 241 CA LEU A 40 3.339 -0.847 -3.746 1.00 0.00 C ATOM 242 C LEU A 40 2.343 -0.022 -4.568 1.00 0.00 C ATOM 243 O LEU A 40 1.367 0.498 -4.030 1.00 0.00 O ATOM 244 CB LEU A 40 4.610 -0.033 -3.483 1.00 0.00 C ATOM 245 CG LEU A 40 4.498 1.069 -2.430 1.00 0.00 C ATOM 246 CD1 LEU A 40 4.246 0.471 -1.055 1.00 0.00 C ATOM 247 CD2 LEU A 40 5.763 1.911 -2.419 1.00 0.00 C ATOM 0 H LEU A 40 4.684 -2.152 -4.674 1.00 0.00 H new ATOM 0 HA LEU A 40 2.860 -1.099 -2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.400 -0.719 -3.178 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.927 0.421 -4.422 1.00 0.00 H new ATOM 0 HG LEU A 40 3.653 1.709 -2.684 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.169 1.271 -0.319 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.317 -0.098 -1.071 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.071 -0.189 -0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.673 2.693 -1.665 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.619 1.278 -2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.906 2.366 -3.399 1.00 0.00 H new ATOM 259 N VAL A 41 2.587 0.099 -5.872 1.00 0.00 N ATOM 260 CA VAL A 41 1.667 0.816 -6.753 1.00 0.00 C ATOM 261 C VAL A 41 0.330 0.086 -6.843 1.00 0.00 C ATOM 262 O VAL A 41 -0.721 0.717 -6.961 1.00 0.00 O ATOM 263 CB VAL A 41 2.240 1.063 -8.172 1.00 0.00 C ATOM 264 CG1 VAL A 41 3.520 1.877 -8.099 1.00 0.00 C ATOM 265 CG2 VAL A 41 2.481 -0.239 -8.916 1.00 0.00 C ATOM 0 H VAL A 41 3.408 -0.287 -6.339 1.00 0.00 H new ATOM 0 HA VAL A 41 1.518 1.797 -6.302 1.00 0.00 H new ATOM 0 HB VAL A 41 1.495 1.630 -8.730 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.906 2.039 -9.105 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.313 2.839 -7.630 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.261 1.338 -7.509 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.883 -0.023 -9.906 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.193 -0.849 -8.360 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.540 -0.780 -9.016 1.00 0.00 H new ATOM 275 N ALA A 42 0.373 -1.247 -6.811 1.00 0.00 N ATOM 276 CA ALA A 42 -0.850 -2.042 -6.771 1.00 0.00 C ATOM 277 C ALA A 42 -1.656 -1.715 -5.514 1.00 0.00 C ATOM 278 O ALA A 42 -2.886 -1.658 -5.550 1.00 0.00 O ATOM 279 CB ALA A 42 -0.527 -3.529 -6.826 1.00 0.00 C ATOM 0 H ALA A 42 1.235 -1.793 -6.812 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.452 -1.791 -7.644 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.453 -4.104 -6.795 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.007 -3.751 -7.750 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.096 -3.798 -5.973 1.00 0.00 H new ATOM 285 N LEU A 43 -0.949 -1.486 -4.409 1.00 0.00 N ATOM 286 CA LEU A 43 -1.578 -1.064 -3.160 1.00 0.00 C ATOM 287 C LEU A 43 -2.270 0.281 -3.335 1.00 0.00 C ATOM 288 O LEU A 43 -3.422 0.451 -2.938 1.00 0.00 O ATOM 289 CB LEU A 43 -0.540 -0.967 -2.043 1.00 0.00 C ATOM 290 CG LEU A 43 0.020 -2.294 -1.547 1.00 0.00 C ATOM 291 CD1 LEU A 43 1.089 -2.044 -0.504 1.00 0.00 C ATOM 292 CD2 LEU A 43 -1.090 -3.154 -0.968 1.00 0.00 C ATOM 0 H LEU A 43 0.065 -1.586 -4.354 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.323 -1.812 -2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.289 -0.352 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.989 -0.444 -1.198 1.00 0.00 H new ATOM 0 HG LEU A 43 0.464 -2.826 -2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.485 -2.997 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.895 -1.455 -0.943 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.658 -1.499 0.336 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -0.674 -4.099 -0.618 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.557 -2.632 -0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.837 -3.350 -1.737 1.00 0.00 H new ATOM 304 N GLU A 44 -1.561 1.232 -3.935 1.00 0.00 N ATOM 305 CA GLU A 44 -2.133 2.538 -4.254 1.00 0.00 C ATOM 306 C GLU A 44 -3.364 2.374 -5.138 1.00 0.00 C ATOM 307 O GLU A 44 -4.339 3.112 -5.006 1.00 0.00 O ATOM 308 CB GLU A 44 -1.102 3.408 -4.971 1.00 0.00 C ATOM 309 CG GLU A 44 0.043 3.873 -4.089 1.00 0.00 C ATOM 310 CD GLU A 44 -0.340 5.035 -3.193 1.00 0.00 C ATOM 311 OE1 GLU A 44 -0.304 4.886 -1.956 1.00 0.00 O ATOM 312 OE2 GLU A 44 -0.673 6.114 -3.729 1.00 0.00 O ATOM 0 H GLU A 44 -0.585 1.123 -4.212 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.423 3.023 -3.322 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -0.693 2.848 -5.812 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.605 4.282 -5.384 1.00 0.00 H new ATOM 0 HG2 GLU A 44 0.382 3.041 -3.472 1.00 0.00 H new ATOM 0 HG3 GLU A 44 0.884 4.167 -4.718 1.00 0.00 H new ATOM 319 N GLY A 45 -3.306 1.398 -6.039 1.00 0.00 N ATOM 320 CA GLY A 45 -4.441 1.089 -6.882 1.00 0.00 C ATOM 321 C GLY A 45 -5.632 0.630 -6.070 1.00 0.00 C ATOM 322 O GLY A 45 -6.763 1.036 -6.328 1.00 0.00 O ATOM 0 H GLY A 45 -2.486 0.813 -6.199 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -4.714 1.970 -7.462 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.165 0.311 -7.594 1.00 0.00 H new ATOM 326 N ALA A 46 -5.374 -0.215 -5.077 1.00 0.00 N ATOM 327 CA ALA A 46 -6.418 -0.668 -4.168 1.00 0.00 C ATOM 328 C ALA A 46 -6.985 0.511 -3.388 1.00 0.00 C ATOM 329 O ALA A 46 -8.188 0.582 -3.142 1.00 0.00 O ATOM 330 CB ALA A 46 -5.884 -1.740 -3.226 1.00 0.00 C ATOM 0 H ALA A 46 -4.450 -0.600 -4.882 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.223 -1.110 -4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -6.680 -2.064 -2.556 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.530 -2.591 -3.807 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -5.060 -1.332 -2.640 1.00 0.00 H new ATOM 336 N LEU A 47 -6.111 1.439 -3.015 1.00 0.00 N ATOM 337 CA LEU A 47 -6.524 2.669 -2.353 1.00 0.00 C ATOM 338 C LEU A 47 -7.437 3.484 -3.264 1.00 0.00 C ATOM 339 O LEU A 47 -8.474 3.981 -2.826 1.00 0.00 O ATOM 340 CB LEU A 47 -5.291 3.494 -1.963 1.00 0.00 C ATOM 341 CG LEU A 47 -4.262 2.770 -1.092 1.00 0.00 C ATOM 342 CD1 LEU A 47 -3.196 3.738 -0.605 1.00 0.00 C ATOM 343 CD2 LEU A 47 -4.932 2.073 0.075 1.00 0.00 C ATOM 0 H LEU A 47 -5.105 1.361 -3.162 1.00 0.00 H new ATOM 0 HA LEU A 47 -7.078 2.411 -1.450 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.797 3.830 -2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.625 4.387 -1.434 1.00 0.00 H new ATOM 0 HG LEU A 47 -3.778 2.008 -1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.474 3.204 0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.685 4.178 -1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.663 4.527 -0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.178 1.566 0.678 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.452 2.809 0.688 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.648 1.342 -0.300 1.00 0.00 H new ATOM 355 N ASP A 48 -7.050 3.604 -4.533 1.00 0.00 N ATOM 356 CA ASP A 48 -7.858 4.322 -5.518 1.00 0.00 C ATOM 357 C ASP A 48 -9.220 3.661 -5.683 1.00 0.00 C ATOM 358 O ASP A 48 -10.252 4.335 -5.696 1.00 0.00 O ATOM 359 CB ASP A 48 -7.167 4.369 -6.887 1.00 0.00 C ATOM 360 CG ASP A 48 -5.979 5.308 -6.942 1.00 0.00 C ATOM 361 OD1 ASP A 48 -6.071 6.432 -6.405 1.00 0.00 O ATOM 362 OD2 ASP A 48 -4.960 4.944 -7.566 1.00 0.00 O ATOM 0 H ASP A 48 -6.183 3.214 -4.903 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.981 5.339 -5.146 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.836 3.364 -7.151 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -7.894 4.674 -7.640 1.00 0.00 H new ATOM 367 N MET A 49 -9.214 2.338 -5.793 1.00 0.00 N ATOM 368 CA MET A 49 -10.441 1.583 -6.019 1.00 0.00 C ATOM 369 C MET A 49 -11.347 1.626 -4.796 1.00 0.00 C ATOM 370 O MET A 49 -12.570 1.717 -4.924 1.00 0.00 O ATOM 371 CB MET A 49 -10.126 0.134 -6.409 1.00 0.00 C ATOM 372 CG MET A 49 -9.407 0.014 -7.744 1.00 0.00 C ATOM 373 SD MET A 49 -9.067 -1.694 -8.217 1.00 0.00 S ATOM 374 CE MET A 49 -7.984 -2.212 -6.890 1.00 0.00 C ATOM 0 H MET A 49 -8.372 1.765 -5.729 1.00 0.00 H new ATOM 0 HA MET A 49 -10.972 2.052 -6.847 1.00 0.00 H new ATOM 0 HB2 MET A 49 -9.512 -0.319 -5.631 1.00 0.00 H new ATOM 0 HB3 MET A 49 -11.055 -0.434 -6.452 1.00 0.00 H new ATOM 0 HG2 MET A 49 -10.012 0.485 -8.519 1.00 0.00 H new ATOM 0 HG3 MET A 49 -8.467 0.564 -7.694 1.00 0.00 H new ATOM 0 HE1 MET A 49 -7.590 -3.205 -7.108 1.00 0.00 H new ATOM 0 HE2 MET A 49 -7.158 -1.506 -6.798 1.00 0.00 H new ATOM 0 HE3 MET A 49 -8.543 -2.241 -5.955 1.00 0.00 H new ATOM 384 N TYR A 50 -10.754 1.570 -3.613 1.00 0.00 N ATOM 385 CA TYR A 50 -11.520 1.665 -2.380 1.00 0.00 C ATOM 386 C TYR A 50 -12.120 3.060 -2.234 1.00 0.00 C ATOM 387 O TYR A 50 -13.301 3.203 -1.917 1.00 0.00 O ATOM 388 CB TYR A 50 -10.648 1.334 -1.163 1.00 0.00 C ATOM 389 CG TYR A 50 -11.371 1.501 0.156 1.00 0.00 C ATOM 390 CD1 TYR A 50 -12.055 0.442 0.742 1.00 0.00 C ATOM 391 CD2 TYR A 50 -11.380 2.726 0.806 1.00 0.00 C ATOM 392 CE1 TYR A 50 -12.726 0.605 1.940 1.00 0.00 C ATOM 393 CE2 TYR A 50 -12.045 2.894 2.001 1.00 0.00 C ATOM 394 CZ TYR A 50 -12.715 1.836 2.564 1.00 0.00 C ATOM 395 OH TYR A 50 -13.379 2.014 3.750 1.00 0.00 O ATOM 0 H TYR A 50 -9.749 1.460 -3.481 1.00 0.00 H new ATOM 0 HA TYR A 50 -12.329 0.936 -2.428 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -10.294 0.307 -1.247 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -9.767 1.976 -1.170 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -12.062 -0.522 0.255 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -10.857 3.563 0.368 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -13.255 -0.225 2.384 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -12.039 3.855 2.493 1.00 0.00 H new ATOM 0 HH TYR A 50 -13.072 1.348 4.400 1.00 0.00 H new ATOM 405 N LYS A 51 -11.307 4.083 -2.475 1.00 0.00 N ATOM 406 CA LYS A 51 -11.762 5.464 -2.371 1.00 0.00 C ATOM 407 C LYS A 51 -12.842 5.755 -3.408 1.00 0.00 C ATOM 408 O LYS A 51 -13.749 6.547 -3.171 1.00 0.00 O ATOM 409 CB LYS A 51 -10.597 6.438 -2.545 1.00 0.00 C ATOM 410 CG LYS A 51 -11.019 7.891 -2.427 1.00 0.00 C ATOM 411 CD LYS A 51 -9.865 8.844 -2.656 1.00 0.00 C ATOM 412 CE LYS A 51 -10.312 10.287 -2.509 1.00 0.00 C ATOM 413 NZ LYS A 51 -11.329 10.663 -3.527 1.00 0.00 N ATOM 0 H LYS A 51 -10.328 3.981 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 51 -12.184 5.601 -1.375 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.836 6.224 -1.795 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.138 6.276 -3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.808 8.098 -3.150 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -11.441 8.066 -1.437 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.068 8.633 -1.944 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.452 8.687 -3.653 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.725 10.439 -1.512 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.448 10.945 -2.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -11.457 11.695 -3.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -11.009 10.355 -4.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -12.233 10.202 -3.301 1.00 0.00 H new ATOM 427 N LEU A 52 -12.736 5.119 -4.560 1.00 0.00 N ATOM 428 CA LEU A 52 -13.753 5.244 -5.594 1.00 0.00 C ATOM 429 C LEU A 52 -15.075 4.683 -5.095 1.00 0.00 C ATOM 430 O LEU A 52 -16.136 5.275 -5.286 1.00 0.00 O ATOM 431 CB LEU A 52 -13.333 4.471 -6.840 1.00 0.00 C ATOM 432 CG LEU A 52 -13.420 5.233 -8.163 1.00 0.00 C ATOM 433 CD1 LEU A 52 -14.810 5.817 -8.372 1.00 0.00 C ATOM 434 CD2 LEU A 52 -12.360 6.323 -8.223 1.00 0.00 C ATOM 0 H LEU A 52 -11.956 4.509 -4.806 1.00 0.00 H new ATOM 0 HA LEU A 52 -13.868 6.300 -5.837 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -12.305 4.134 -6.705 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -13.954 3.578 -6.916 1.00 0.00 H new ATOM 0 HG LEU A 52 -13.232 4.526 -8.971 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -14.841 6.353 -9.321 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -15.545 5.012 -8.386 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -15.042 6.505 -7.559 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -12.438 6.854 -9.172 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -12.511 7.023 -7.402 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.371 5.873 -8.139 1.00 0.00 H new ATOM 446 N ASP A 53 -14.993 3.528 -4.462 1.00 0.00 N ATOM 447 CA ASP A 53 -16.178 2.806 -4.025 1.00 0.00 C ATOM 448 C ASP A 53 -16.814 3.434 -2.781 1.00 0.00 C ATOM 449 O ASP A 53 -18.036 3.548 -2.692 1.00 0.00 O ATOM 450 CB ASP A 53 -15.831 1.340 -3.743 1.00 0.00 C ATOM 451 CG ASP A 53 -17.059 0.493 -3.455 1.00 0.00 C ATOM 452 OD1 ASP A 53 -17.256 0.101 -2.288 1.00 0.00 O ATOM 453 OD2 ASP A 53 -17.828 0.215 -4.404 1.00 0.00 O ATOM 0 H ASP A 53 -14.112 3.065 -4.237 1.00 0.00 H new ATOM 0 HA ASP A 53 -16.906 2.864 -4.834 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -15.301 0.925 -4.600 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -15.151 1.289 -2.892 1.00 0.00 H new ATOM 458 N ASN A 54 -15.986 3.849 -1.824 1.00 0.00 N ATOM 459 CA ASN A 54 -16.492 4.311 -0.528 1.00 0.00 C ATOM 460 C ASN A 54 -16.146 5.770 -0.248 1.00 0.00 C ATOM 461 O ASN A 54 -16.214 6.210 0.898 1.00 0.00 O ATOM 462 CB ASN A 54 -15.948 3.437 0.605 1.00 0.00 C ATOM 463 CG ASN A 54 -16.414 2.003 0.507 1.00 0.00 C ATOM 464 OD1 ASN A 54 -17.480 1.646 1.008 1.00 0.00 O ATOM 465 ND2 ASN A 54 -15.614 1.168 -0.130 1.00 0.00 N ATOM 0 H ASN A 54 -14.971 3.876 -1.917 1.00 0.00 H new ATOM 0 HA ASN A 54 -17.578 4.229 -0.574 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -14.858 3.463 0.588 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -16.262 3.853 1.562 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -15.871 0.185 -0.221 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -14.739 1.506 -0.531 1.00 0.00 H new ATOM 472 N SER A 55 -15.755 6.500 -1.292 1.00 0.00 N ATOM 473 CA SER A 55 -15.490 7.947 -1.215 1.00 0.00 C ATOM 474 C SER A 55 -14.196 8.288 -0.457 1.00 0.00 C ATOM 475 O SER A 55 -13.436 9.159 -0.882 1.00 0.00 O ATOM 476 CB SER A 55 -16.671 8.677 -0.571 1.00 0.00 C ATOM 477 OG SER A 55 -17.894 8.335 -1.206 1.00 0.00 O ATOM 0 H SER A 55 -15.611 6.108 -2.222 1.00 0.00 H new ATOM 0 HA SER A 55 -15.359 8.285 -2.243 1.00 0.00 H new ATOM 0 HB2 SER A 55 -16.725 8.424 0.488 1.00 0.00 H new ATOM 0 HB3 SER A 55 -16.514 9.754 -0.634 1.00 0.00 H new ATOM 0 HG SER A 55 -18.632 8.814 -0.774 1.00 0.00 H new ATOM 483 N ARG A 56 -13.949 7.611 0.654 1.00 0.00 N ATOM 484 CA ARG A 56 -12.851 7.969 1.547 1.00 0.00 C ATOM 485 C ARG A 56 -11.717 6.948 1.507 1.00 0.00 C ATOM 486 O ARG A 56 -11.809 5.924 0.834 1.00 0.00 O ATOM 487 CB ARG A 56 -13.386 8.138 2.980 1.00 0.00 C ATOM 488 CG ARG A 56 -14.353 7.046 3.426 1.00 0.00 C ATOM 489 CD ARG A 56 -13.649 5.739 3.749 1.00 0.00 C ATOM 490 NE ARG A 56 -12.777 5.858 4.917 1.00 0.00 N ATOM 491 CZ ARG A 56 -13.207 5.900 6.179 1.00 0.00 C ATOM 492 NH1 ARG A 56 -14.509 5.882 6.451 1.00 0.00 N ATOM 493 NH2 ARG A 56 -12.329 5.972 7.172 1.00 0.00 N ATOM 0 H ARG A 56 -14.495 6.807 0.962 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.432 8.914 1.202 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -12.542 8.162 3.669 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -13.887 9.103 3.056 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -14.900 7.387 4.305 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -15.088 6.874 2.640 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -14.392 4.962 3.930 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -13.060 5.423 2.888 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.771 5.913 4.756 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -15.188 5.836 5.691 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.828 5.914 7.419 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.330 5.995 6.969 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.654 6.004 8.138 1.00 0.00 H new ATOM 507 N TYR A 57 -10.650 7.249 2.242 1.00 0.00 N ATOM 508 CA TYR A 57 -9.474 6.388 2.309 1.00 0.00 C ATOM 509 C TYR A 57 -9.605 5.352 3.420 1.00 0.00 C ATOM 510 O TYR A 57 -10.168 5.631 4.480 1.00 0.00 O ATOM 511 CB TYR A 57 -8.216 7.226 2.527 1.00 0.00 C ATOM 512 CG TYR A 57 -7.679 7.850 1.261 1.00 0.00 C ATOM 513 CD1 TYR A 57 -6.887 7.113 0.389 1.00 0.00 C ATOM 514 CD2 TYR A 57 -7.955 9.171 0.938 1.00 0.00 C ATOM 515 CE1 TYR A 57 -6.385 7.673 -0.768 1.00 0.00 C ATOM 516 CE2 TYR A 57 -7.457 9.740 -0.217 1.00 0.00 C ATOM 517 CZ TYR A 57 -6.672 8.987 -1.066 1.00 0.00 C ATOM 518 OH TYR A 57 -6.175 9.551 -2.218 1.00 0.00 O ATOM 0 H TYR A 57 -10.577 8.095 2.807 1.00 0.00 H new ATOM 0 HA TYR A 57 -9.396 5.859 1.359 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -8.435 8.015 3.246 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -7.443 6.597 2.969 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.660 6.083 0.621 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -8.569 9.763 1.600 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -5.772 7.085 -1.435 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.681 10.769 -0.455 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.471 10.483 -2.280 1.00 0.00 H new ATOM 528 N PRO A 58 -9.071 4.147 3.182 1.00 0.00 N ATOM 529 CA PRO A 58 -9.214 3.006 4.093 1.00 0.00 C ATOM 530 C PRO A 58 -8.348 3.109 5.346 1.00 0.00 C ATOM 531 O PRO A 58 -7.294 3.746 5.346 1.00 0.00 O ATOM 532 CB PRO A 58 -8.748 1.828 3.241 1.00 0.00 C ATOM 533 CG PRO A 58 -7.771 2.416 2.287 1.00 0.00 C ATOM 534 CD PRO A 58 -8.267 3.800 1.990 1.00 0.00 C ATOM 0 HA PRO A 58 -10.234 2.929 4.470 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -8.286 1.054 3.854 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -9.583 1.363 2.717 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -6.771 2.444 2.720 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -7.707 1.820 1.376 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -7.443 4.498 1.846 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -8.868 3.824 1.081 1.00 0.00 H new ATOM 542 N THR A 59 -8.815 2.468 6.409 1.00 0.00 N ATOM 543 CA THR A 59 -8.052 2.341 7.638 1.00 0.00 C ATOM 544 C THR A 59 -7.012 1.222 7.486 1.00 0.00 C ATOM 545 O THR A 59 -6.980 0.549 6.453 1.00 0.00 O ATOM 546 CB THR A 59 -8.994 2.044 8.819 1.00 0.00 C ATOM 547 OG1 THR A 59 -10.279 2.629 8.566 1.00 0.00 O ATOM 548 CG2 THR A 59 -8.442 2.604 10.121 1.00 0.00 C ATOM 0 H THR A 59 -9.732 2.023 6.441 1.00 0.00 H new ATOM 0 HA THR A 59 -7.535 3.279 7.838 1.00 0.00 H new ATOM 0 HB THR A 59 -9.082 0.962 8.917 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.879 2.438 9.317 1.00 0.00 H new ATOM 0 HG21 THR A 59 -9.130 2.378 10.935 1.00 0.00 H new ATOM 0 HG22 THR A 59 -7.472 2.152 10.329 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.327 3.684 10.033 1.00 0.00 H new ATOM 556 N THR A 60 -6.184 1.016 8.511 1.00 0.00 N ATOM 557 CA THR A 60 -5.047 0.091 8.433 1.00 0.00 C ATOM 558 C THR A 60 -5.441 -1.297 7.916 1.00 0.00 C ATOM 559 O THR A 60 -4.779 -1.846 7.031 1.00 0.00 O ATOM 560 CB THR A 60 -4.338 -0.047 9.806 1.00 0.00 C ATOM 561 OG1 THR A 60 -3.317 -1.050 9.742 1.00 0.00 O ATOM 562 CG2 THR A 60 -5.317 -0.395 10.917 1.00 0.00 C ATOM 0 H THR A 60 -6.279 1.481 9.414 1.00 0.00 H new ATOM 0 HA THR A 60 -4.357 0.529 7.712 1.00 0.00 H new ATOM 0 HB THR A 60 -3.891 0.920 10.036 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.610 -0.759 9.128 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.780 -0.482 11.861 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.069 0.390 10.999 1.00 0.00 H new ATOM 0 HG23 THR A 60 -5.805 -1.342 10.688 1.00 0.00 H new ATOM 570 N GLU A 61 -6.525 -1.847 8.440 1.00 0.00 N ATOM 571 CA GLU A 61 -6.943 -3.193 8.077 1.00 0.00 C ATOM 572 C GLU A 61 -7.521 -3.202 6.667 1.00 0.00 C ATOM 573 O GLU A 61 -7.266 -4.112 5.874 1.00 0.00 O ATOM 574 CB GLU A 61 -7.996 -3.694 9.065 1.00 0.00 C ATOM 575 CG GLU A 61 -8.149 -5.204 9.080 1.00 0.00 C ATOM 576 CD GLU A 61 -6.953 -5.888 9.701 1.00 0.00 C ATOM 577 OE1 GLU A 61 -6.845 -5.875 10.945 1.00 0.00 O ATOM 578 OE2 GLU A 61 -6.117 -6.438 8.954 1.00 0.00 O ATOM 0 H GLU A 61 -7.131 -1.383 9.117 1.00 0.00 H new ATOM 0 HA GLU A 61 -6.074 -3.850 8.110 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -7.732 -3.354 10.067 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -8.957 -3.243 8.818 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -9.048 -5.472 9.635 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -8.284 -5.565 8.060 1.00 0.00 H new ATOM 585 N GLN A 62 -8.274 -2.157 6.367 1.00 0.00 N ATOM 586 CA GLN A 62 -9.022 -2.061 5.123 1.00 0.00 C ATOM 587 C GLN A 62 -8.105 -1.827 3.927 1.00 0.00 C ATOM 588 O GLN A 62 -8.361 -2.334 2.837 1.00 0.00 O ATOM 589 CB GLN A 62 -10.038 -0.926 5.235 1.00 0.00 C ATOM 590 CG GLN A 62 -11.016 -1.108 6.383 1.00 0.00 C ATOM 591 CD GLN A 62 -11.796 0.153 6.688 1.00 0.00 C ATOM 592 OE1 GLN A 62 -12.046 0.971 5.808 1.00 0.00 O ATOM 593 NE2 GLN A 62 -12.174 0.322 7.942 1.00 0.00 N ATOM 0 H GLN A 62 -8.385 -1.349 6.980 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.536 -3.008 4.958 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.507 0.017 5.365 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.594 -0.852 4.301 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -11.711 -1.911 6.139 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -10.471 -1.418 7.274 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -11.946 -0.383 8.643 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -12.694 1.157 8.210 1.00 0.00 H new ATOM 602 N GLY A 63 -7.039 -1.065 4.139 1.00 0.00 N ATOM 603 CA GLY A 63 -6.153 -0.708 3.046 1.00 0.00 C ATOM 604 C GLY A 63 -5.475 -1.906 2.415 1.00 0.00 C ATOM 605 O GLY A 63 -5.492 -2.066 1.197 1.00 0.00 O ATOM 0 H GLY A 63 -6.772 -0.688 5.048 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.723 -0.177 2.283 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.392 -0.019 3.413 1.00 0.00 H new ATOM 609 N LEU A 64 -4.887 -2.756 3.243 1.00 0.00 N ATOM 610 CA LEU A 64 -4.207 -3.943 2.749 1.00 0.00 C ATOM 611 C LEU A 64 -5.194 -4.977 2.218 1.00 0.00 C ATOM 612 O LEU A 64 -4.906 -5.683 1.249 1.00 0.00 O ATOM 613 CB LEU A 64 -3.331 -4.548 3.834 1.00 0.00 C ATOM 614 CG LEU A 64 -1.833 -4.345 3.612 1.00 0.00 C ATOM 615 CD1 LEU A 64 -1.364 -5.069 2.358 1.00 0.00 C ATOM 616 CD2 LEU A 64 -1.494 -2.865 3.523 1.00 0.00 C ATOM 0 H LEU A 64 -4.867 -2.646 4.257 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.572 -3.637 1.918 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.607 -4.112 4.794 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.536 -5.617 3.898 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.310 -4.769 4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.294 -4.908 2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.560 -6.136 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.901 -4.682 1.492 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.422 -2.746 3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.036 -2.417 2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.781 -2.370 4.450 1.00 0.00 H new ATOM 628 N GLN A 65 -6.362 -5.053 2.844 1.00 0.00 N ATOM 629 CA GLN A 65 -7.369 -6.029 2.455 1.00 0.00 C ATOM 630 C GLN A 65 -7.992 -5.703 1.105 1.00 0.00 C ATOM 631 O GLN A 65 -8.479 -6.596 0.417 1.00 0.00 O ATOM 632 CB GLN A 65 -8.466 -6.150 3.508 1.00 0.00 C ATOM 633 CG GLN A 65 -8.153 -7.173 4.583 1.00 0.00 C ATOM 634 CD GLN A 65 -9.377 -7.573 5.376 1.00 0.00 C ATOM 635 OE1 GLN A 65 -10.283 -6.770 5.601 1.00 0.00 O ATOM 636 NE2 GLN A 65 -9.424 -8.827 5.785 1.00 0.00 N ATOM 0 H GLN A 65 -6.634 -4.451 3.621 1.00 0.00 H new ATOM 0 HA GLN A 65 -6.851 -6.984 2.371 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -8.621 -5.177 3.975 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -9.402 -6.421 3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -7.718 -8.059 4.121 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -7.402 -6.765 5.260 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -8.652 -9.460 5.578 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -10.232 -9.163 6.308 1.00 0.00 H new ATOM 645 N ALA A 66 -7.944 -4.434 0.716 1.00 0.00 N ATOM 646 CA ALA A 66 -8.619 -3.965 -0.493 1.00 0.00 C ATOM 647 C ALA A 66 -8.128 -4.684 -1.755 1.00 0.00 C ATOM 648 O ALA A 66 -8.801 -4.668 -2.785 1.00 0.00 O ATOM 649 CB ALA A 66 -8.441 -2.461 -0.634 1.00 0.00 C ATOM 0 H ALA A 66 -7.441 -3.705 1.223 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.678 -4.200 -0.388 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.946 -2.118 -1.537 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -8.870 -1.961 0.234 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -7.379 -2.225 -0.701 1.00 0.00 H new ATOM 655 N LEU A 67 -6.964 -5.317 -1.674 1.00 0.00 N ATOM 656 CA LEU A 67 -6.443 -6.085 -2.799 1.00 0.00 C ATOM 657 C LEU A 67 -6.817 -7.565 -2.706 1.00 0.00 C ATOM 658 O LEU A 67 -6.885 -8.248 -3.724 1.00 0.00 O ATOM 659 CB LEU A 67 -4.919 -5.979 -2.885 1.00 0.00 C ATOM 660 CG LEU A 67 -4.341 -4.856 -3.744 1.00 0.00 C ATOM 661 CD1 LEU A 67 -2.847 -5.070 -3.915 1.00 0.00 C ATOM 662 CD2 LEU A 67 -5.027 -4.786 -5.102 1.00 0.00 C ATOM 0 H LEU A 67 -6.366 -5.314 -0.848 1.00 0.00 H new ATOM 0 HA LEU A 67 -6.897 -5.657 -3.693 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -4.532 -5.863 -1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.536 -6.926 -3.266 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.518 -3.907 -3.239 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.433 -4.270 -4.528 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.365 -5.066 -2.938 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.670 -6.029 -4.402 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.592 -3.976 -5.688 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.889 -5.730 -5.629 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.092 -4.601 -4.962 1.00 0.00 H new ATOM 674 N VAL A 68 -7.065 -8.063 -1.501 1.00 0.00 N ATOM 675 CA VAL A 68 -7.242 -9.502 -1.305 1.00 0.00 C ATOM 676 C VAL A 68 -8.707 -9.885 -1.073 1.00 0.00 C ATOM 677 O VAL A 68 -9.215 -10.822 -1.688 1.00 0.00 O ATOM 678 CB VAL A 68 -6.354 -10.037 -0.147 1.00 0.00 C ATOM 679 CG1 VAL A 68 -6.601 -9.281 1.150 1.00 0.00 C ATOM 680 CG2 VAL A 68 -6.572 -11.528 0.061 1.00 0.00 C ATOM 0 H VAL A 68 -7.148 -7.503 -0.653 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.921 -9.976 -2.233 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.316 -9.872 -0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.961 -9.685 1.934 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.374 -8.225 1.005 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -7.646 -9.390 1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.939 -11.878 0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.618 -11.712 0.308 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -6.316 -12.064 -0.853 1.00 0.00 H new ATOM 690 N SER A 69 -9.382 -9.170 -0.190 1.00 0.00 N ATOM 691 CA SER A 69 -10.759 -9.483 0.160 1.00 0.00 C ATOM 692 C SER A 69 -11.440 -8.246 0.719 1.00 0.00 C ATOM 693 O SER A 69 -10.811 -7.462 1.424 1.00 0.00 O ATOM 694 CB SER A 69 -10.798 -10.613 1.195 1.00 0.00 C ATOM 695 OG SER A 69 -10.197 -11.796 0.689 1.00 0.00 O ATOM 0 H SER A 69 -8.997 -8.363 0.301 1.00 0.00 H new ATOM 0 HA SER A 69 -11.287 -9.810 -0.736 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.280 -10.298 2.101 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.831 -10.818 1.474 1.00 0.00 H new ATOM 0 HG SER A 69 -10.234 -12.499 1.371 1.00 0.00 H new ATOM 701 N ALA A 70 -12.720 -8.076 0.403 1.00 0.00 N ATOM 702 CA ALA A 70 -13.470 -6.927 0.883 1.00 0.00 C ATOM 703 C ALA A 70 -13.413 -6.857 2.402 1.00 0.00 C ATOM 704 O ALA A 70 -13.811 -7.804 3.088 1.00 0.00 O ATOM 705 CB ALA A 70 -14.915 -7.001 0.419 1.00 0.00 C ATOM 0 H ALA A 70 -13.255 -8.718 -0.181 1.00 0.00 H new ATOM 0 HA ALA A 70 -13.018 -6.025 0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.461 -6.133 0.788 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.947 -7.014 -0.670 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.375 -7.910 0.806 1.00 0.00 H new ATOM 711 N PRO A 71 -12.892 -5.744 2.934 1.00 0.00 N ATOM 712 CA PRO A 71 -12.778 -5.525 4.377 1.00 0.00 C ATOM 713 C PRO A 71 -14.100 -5.725 5.105 1.00 0.00 C ATOM 714 O PRO A 71 -15.145 -5.254 4.655 1.00 0.00 O ATOM 715 CB PRO A 71 -12.343 -4.062 4.470 1.00 0.00 C ATOM 716 CG PRO A 71 -11.609 -3.816 3.204 1.00 0.00 C ATOM 717 CD PRO A 71 -12.331 -4.619 2.163 1.00 0.00 C ATOM 0 HA PRO A 71 -12.088 -6.229 4.842 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -13.201 -3.397 4.568 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.707 -3.891 5.338 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.607 -2.756 2.951 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.567 -4.126 3.287 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.112 -4.036 1.675 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.655 -4.964 1.381 1.00 0.00 H new ATOM 725 N SER A 72 -14.047 -6.409 6.238 1.00 0.00 N ATOM 726 CA SER A 72 -15.224 -6.600 7.065 1.00 0.00 C ATOM 727 C SER A 72 -15.310 -5.496 8.108 1.00 0.00 C ATOM 728 O SER A 72 -15.626 -5.725 9.278 1.00 0.00 O ATOM 729 CB SER A 72 -15.197 -7.984 7.712 1.00 0.00 C ATOM 730 OG SER A 72 -13.885 -8.336 8.127 1.00 0.00 O ATOM 0 H SER A 72 -13.199 -6.841 6.604 1.00 0.00 H new ATOM 0 HA SER A 72 -16.117 -6.544 6.442 1.00 0.00 H new ATOM 0 HB2 SER A 72 -15.868 -7.999 8.571 1.00 0.00 H new ATOM 0 HB3 SER A 72 -15.568 -8.726 7.004 1.00 0.00 H new ATOM 0 HG SER A 72 -13.900 -9.225 8.539 1.00 0.00 H new ATOM 736 N ALA A 73 -15.006 -4.293 7.656 1.00 0.00 N ATOM 737 CA ALA A 73 -15.084 -3.105 8.473 1.00 0.00 C ATOM 738 C ALA A 73 -15.718 -1.997 7.657 1.00 0.00 C ATOM 739 O ALA A 73 -15.364 -1.802 6.495 1.00 0.00 O ATOM 740 CB ALA A 73 -13.702 -2.695 8.950 1.00 0.00 C ATOM 0 H ALA A 73 -14.695 -4.116 6.701 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.693 -3.304 9.355 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.780 -1.798 9.564 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.266 -3.502 9.540 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.066 -2.491 8.089 1.00 0.00 H new ATOM 746 N GLU A 74 -16.665 -1.297 8.251 1.00 0.00 N ATOM 747 CA GLU A 74 -17.399 -0.263 7.544 1.00 0.00 C ATOM 748 C GLU A 74 -16.516 0.952 7.272 1.00 0.00 C ATOM 749 O GLU A 74 -15.714 1.352 8.121 1.00 0.00 O ATOM 750 CB GLU A 74 -18.635 0.143 8.341 1.00 0.00 C ATOM 751 CG GLU A 74 -19.652 -0.978 8.482 1.00 0.00 C ATOM 752 CD GLU A 74 -20.125 -1.503 7.142 1.00 0.00 C ATOM 753 OE1 GLU A 74 -19.859 -2.682 6.828 1.00 0.00 O ATOM 754 OE2 GLU A 74 -20.767 -0.736 6.394 1.00 0.00 O ATOM 0 H GLU A 74 -16.945 -1.425 9.223 1.00 0.00 H new ATOM 0 HA GLU A 74 -17.716 -0.668 6.583 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -18.327 0.472 9.333 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -19.109 0.996 7.855 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -19.211 -1.795 9.054 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -20.509 -0.617 9.051 1.00 0.00 H new ATOM 761 N PRO A 75 -16.650 1.551 6.079 1.00 0.00 N ATOM 762 CA PRO A 75 -17.597 1.091 5.058 1.00 0.00 C ATOM 763 C PRO A 75 -17.107 -0.150 4.304 1.00 0.00 C ATOM 764 O PRO A 75 -15.960 -0.219 3.860 1.00 0.00 O ATOM 765 CB PRO A 75 -17.702 2.289 4.119 1.00 0.00 C ATOM 766 CG PRO A 75 -16.390 2.984 4.234 1.00 0.00 C ATOM 767 CD PRO A 75 -15.888 2.732 5.631 1.00 0.00 C ATOM 0 HA PRO A 75 -18.548 0.784 5.494 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -17.892 1.972 3.094 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -18.523 2.945 4.407 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -15.685 2.604 3.495 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.501 4.053 4.049 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -14.815 2.541 5.641 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -16.065 3.590 6.279 1.00 0.00 H new ATOM 775 N HIS A 76 -17.994 -1.131 4.179 1.00 0.00 N ATOM 776 CA HIS A 76 -17.680 -2.387 3.505 1.00 0.00 C ATOM 777 C HIS A 76 -17.447 -2.156 2.015 1.00 0.00 C ATOM 778 O HIS A 76 -18.280 -1.554 1.339 1.00 0.00 O ATOM 779 CB HIS A 76 -18.830 -3.375 3.703 1.00 0.00 C ATOM 780 CG HIS A 76 -18.547 -4.761 3.205 1.00 0.00 C ATOM 781 ND1 HIS A 76 -17.827 -5.683 3.927 1.00 0.00 N ATOM 782 CD2 HIS A 76 -18.901 -5.382 2.055 1.00 0.00 C ATOM 783 CE1 HIS A 76 -17.749 -6.811 3.247 1.00 0.00 C ATOM 784 NE2 HIS A 76 -18.395 -6.659 2.105 1.00 0.00 N ATOM 0 H HIS A 76 -18.947 -1.079 4.540 1.00 0.00 H new ATOM 0 HA HIS A 76 -16.767 -2.797 3.937 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -19.071 -3.425 4.765 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -19.714 -2.992 3.193 1.00 0.00 H new ATOM 0 HD1 HIS A 76 -17.416 -5.520 4.846 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -19.475 -4.953 1.247 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -17.242 -7.708 3.570 1.00 0.00 H new ATOM 793 N ALA A 77 -16.318 -2.644 1.515 1.00 0.00 N ATOM 794 CA ALA A 77 -15.977 -2.518 0.103 1.00 0.00 C ATOM 795 C ALA A 77 -16.987 -3.252 -0.773 1.00 0.00 C ATOM 796 O ALA A 77 -17.263 -4.435 -0.561 1.00 0.00 O ATOM 797 CB ALA A 77 -14.575 -3.048 -0.150 1.00 0.00 C ATOM 0 H ALA A 77 -15.618 -3.134 2.072 1.00 0.00 H new ATOM 0 HA ALA A 77 -16.007 -1.461 -0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -14.334 -2.948 -1.208 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -13.858 -2.478 0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -14.526 -4.099 0.135 1.00 0.00 H new ATOM 803 N ARG A 78 -17.540 -2.544 -1.745 1.00 0.00 N ATOM 804 CA ARG A 78 -18.525 -3.112 -2.649 1.00 0.00 C ATOM 805 C ARG A 78 -17.931 -3.294 -4.040 1.00 0.00 C ATOM 806 O ARG A 78 -16.869 -2.747 -4.349 1.00 0.00 O ATOM 807 CB ARG A 78 -19.763 -2.216 -2.729 1.00 0.00 C ATOM 808 CG ARG A 78 -20.489 -2.042 -1.404 1.00 0.00 C ATOM 809 CD ARG A 78 -20.996 -3.368 -0.861 1.00 0.00 C ATOM 810 NE ARG A 78 -21.898 -4.037 -1.797 1.00 0.00 N ATOM 811 CZ ARG A 78 -22.640 -5.101 -1.492 1.00 0.00 C ATOM 812 NH1 ARG A 78 -22.646 -5.585 -0.253 1.00 0.00 N ATOM 813 NH2 ARG A 78 -23.394 -5.668 -2.425 1.00 0.00 N ATOM 0 H ARG A 78 -17.320 -1.565 -1.928 1.00 0.00 H new ATOM 0 HA ARG A 78 -18.819 -4.086 -2.259 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -19.465 -1.235 -3.100 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -20.456 -2.636 -3.458 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -19.816 -1.585 -0.678 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -21.328 -1.358 -1.536 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -20.149 -4.019 -0.647 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -21.514 -3.198 0.083 1.00 0.00 H new ATOM 0 HE ARG A 78 -21.964 -3.665 -2.745 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -22.080 -5.141 0.471 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -23.216 -6.400 -0.027 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -23.404 -5.289 -3.372 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -23.963 -6.483 -2.195 1.00 0.00 H new ATOM 827 N ASN A 79 -18.616 -4.091 -4.861 1.00 0.00 N ATOM 828 CA ASN A 79 -18.210 -4.338 -6.247 1.00 0.00 C ATOM 829 C ASN A 79 -16.825 -4.965 -6.293 1.00 0.00 C ATOM 830 O ASN A 79 -16.022 -4.682 -7.184 1.00 0.00 O ATOM 831 CB ASN A 79 -18.227 -3.042 -7.069 1.00 0.00 C ATOM 832 CG ASN A 79 -19.588 -2.374 -7.095 1.00 0.00 C ATOM 833 OD1 ASN A 79 -20.426 -2.686 -7.940 1.00 0.00 O ATOM 834 ND2 ASN A 79 -19.809 -1.434 -6.186 1.00 0.00 N ATOM 0 H ASN A 79 -19.466 -4.583 -4.586 1.00 0.00 H new ATOM 0 HA ASN A 79 -18.928 -5.031 -6.685 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -17.495 -2.347 -6.657 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -17.917 -3.262 -8.091 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -20.701 -0.939 -6.170 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -19.087 -1.206 -5.503 1.00 0.00 H new ATOM 841 N TYR A 80 -16.551 -5.821 -5.324 1.00 0.00 N ATOM 842 CA TYR A 80 -15.251 -6.454 -5.207 1.00 0.00 C ATOM 843 C TYR A 80 -15.266 -7.817 -5.888 1.00 0.00 C ATOM 844 O TYR A 80 -16.268 -8.533 -5.843 1.00 0.00 O ATOM 845 CB TYR A 80 -14.863 -6.601 -3.728 1.00 0.00 C ATOM 846 CG TYR A 80 -15.719 -7.585 -2.956 1.00 0.00 C ATOM 847 CD1 TYR A 80 -15.270 -8.878 -2.709 1.00 0.00 C ATOM 848 CD2 TYR A 80 -16.974 -7.225 -2.476 1.00 0.00 C ATOM 849 CE1 TYR A 80 -16.042 -9.779 -2.005 1.00 0.00 C ATOM 850 CE2 TYR A 80 -17.752 -8.123 -1.770 1.00 0.00 C ATOM 851 CZ TYR A 80 -17.281 -9.399 -1.538 1.00 0.00 C ATOM 852 OH TYR A 80 -18.051 -10.298 -0.833 1.00 0.00 O ATOM 0 H TYR A 80 -17.218 -6.095 -4.602 1.00 0.00 H new ATOM 0 HA TYR A 80 -14.510 -5.826 -5.701 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -13.822 -6.917 -3.667 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -14.929 -5.625 -3.248 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -14.300 -9.182 -3.075 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -17.346 -6.228 -2.658 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -15.676 -10.778 -1.821 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -18.723 -7.828 -1.402 1.00 0.00 H new ATOM 0 HH TYR A 80 -18.895 -9.873 -0.574 1.00 0.00 H new ATOM 862 N PRO A 81 -14.165 -8.181 -6.556 1.00 0.00 N ATOM 863 CA PRO A 81 -14.026 -9.500 -7.169 1.00 0.00 C ATOM 864 C PRO A 81 -13.813 -10.587 -6.121 1.00 0.00 C ATOM 865 O PRO A 81 -13.074 -10.392 -5.154 1.00 0.00 O ATOM 866 CB PRO A 81 -12.779 -9.353 -8.047 1.00 0.00 C ATOM 867 CG PRO A 81 -11.989 -8.259 -7.418 1.00 0.00 C ATOM 868 CD PRO A 81 -12.984 -7.329 -6.781 1.00 0.00 C ATOM 0 HA PRO A 81 -14.917 -9.797 -7.723 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -12.209 -10.282 -8.081 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -13.047 -9.106 -9.074 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -11.298 -8.657 -6.675 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -11.389 -7.735 -8.163 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -12.604 -6.916 -5.846 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -13.217 -6.486 -7.431 1.00 0.00 H new ATOM 876 N GLU A 82 -14.471 -11.725 -6.305 1.00 0.00 N ATOM 877 CA GLU A 82 -14.296 -12.855 -5.404 1.00 0.00 C ATOM 878 C GLU A 82 -12.882 -13.402 -5.519 1.00 0.00 C ATOM 879 O GLU A 82 -12.426 -13.743 -6.609 1.00 0.00 O ATOM 880 CB GLU A 82 -15.323 -13.947 -5.692 1.00 0.00 C ATOM 881 CG GLU A 82 -16.756 -13.503 -5.449 1.00 0.00 C ATOM 882 CD GLU A 82 -17.726 -14.661 -5.473 1.00 0.00 C ATOM 883 OE1 GLU A 82 -17.830 -15.372 -4.453 1.00 0.00 O ATOM 884 OE2 GLU A 82 -18.382 -14.875 -6.511 1.00 0.00 O ATOM 0 H GLU A 82 -15.128 -11.889 -7.068 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.454 -12.509 -4.382 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -15.220 -14.269 -6.728 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -15.107 -14.813 -5.067 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -16.819 -12.999 -4.485 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -17.043 -12.776 -6.209 1.00 0.00 H new ATOM 891 N GLY A 83 -12.190 -13.477 -4.395 1.00 0.00 N ATOM 892 CA GLY A 83 -10.794 -13.858 -4.411 1.00 0.00 C ATOM 893 C GLY A 83 -9.894 -12.642 -4.468 1.00 0.00 C ATOM 894 O GLY A 83 -8.675 -12.747 -4.316 1.00 0.00 O ATOM 0 H GLY A 83 -12.570 -13.281 -3.469 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -10.564 -14.442 -3.520 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.599 -14.498 -5.271 1.00 0.00 H new ATOM 898 N GLY A 84 -10.507 -11.486 -4.704 1.00 0.00 N ATOM 899 CA GLY A 84 -9.781 -10.235 -4.724 1.00 0.00 C ATOM 900 C GLY A 84 -8.978 -10.040 -5.991 1.00 0.00 C ATOM 901 O GLY A 84 -9.187 -10.730 -6.991 1.00 0.00 O ATOM 0 H GLY A 84 -11.507 -11.397 -4.884 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.485 -9.410 -4.616 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.111 -10.196 -3.865 1.00 0.00 H new ATOM 905 N TYR A 85 -8.065 -9.088 -5.944 1.00 0.00 N ATOM 906 CA TYR A 85 -7.163 -8.821 -7.050 1.00 0.00 C ATOM 907 C TYR A 85 -5.898 -9.640 -6.877 1.00 0.00 C ATOM 908 O TYR A 85 -5.187 -9.933 -7.839 1.00 0.00 O ATOM 909 CB TYR A 85 -6.840 -7.328 -7.114 1.00 0.00 C ATOM 910 CG TYR A 85 -8.025 -6.485 -7.534 1.00 0.00 C ATOM 911 CD1 TYR A 85 -8.317 -6.297 -8.879 1.00 0.00 C ATOM 912 CD2 TYR A 85 -8.860 -5.894 -6.592 1.00 0.00 C ATOM 913 CE1 TYR A 85 -9.405 -5.545 -9.275 1.00 0.00 C ATOM 914 CE2 TYR A 85 -9.950 -5.139 -6.982 1.00 0.00 C ATOM 915 CZ TYR A 85 -10.218 -4.970 -8.324 1.00 0.00 C ATOM 916 OH TYR A 85 -11.307 -4.228 -8.718 1.00 0.00 O ATOM 0 H TYR A 85 -7.927 -8.478 -5.138 1.00 0.00 H new ATOM 0 HA TYR A 85 -7.640 -9.105 -7.988 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -6.492 -6.995 -6.136 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -6.021 -7.169 -7.815 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -7.682 -6.747 -9.628 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -8.654 -6.027 -5.540 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.617 -5.408 -10.325 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -10.589 -4.684 -6.239 1.00 0.00 H new ATOM 0 HH TYR A 85 -11.072 -3.277 -8.717 1.00 0.00 H new ATOM 926 N ILE A 86 -5.636 -10.010 -5.637 1.00 0.00 N ATOM 927 CA ILE A 86 -4.539 -10.892 -5.300 1.00 0.00 C ATOM 928 C ILE A 86 -4.992 -11.815 -4.171 1.00 0.00 C ATOM 929 O ILE A 86 -5.692 -11.390 -3.254 1.00 0.00 O ATOM 930 CB ILE A 86 -3.275 -10.091 -4.902 1.00 0.00 C ATOM 931 CG1 ILE A 86 -2.130 -11.040 -4.545 1.00 0.00 C ATOM 932 CG2 ILE A 86 -3.573 -9.134 -3.754 1.00 0.00 C ATOM 933 CD1 ILE A 86 -0.837 -10.334 -4.203 1.00 0.00 C ATOM 0 H ILE A 86 -6.183 -9.704 -4.832 1.00 0.00 H new ATOM 0 HA ILE A 86 -4.267 -11.488 -6.171 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.966 -9.492 -5.759 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.432 -11.656 -3.698 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.954 -11.714 -5.383 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -2.668 -8.584 -3.495 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.350 -8.432 -4.058 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.914 -9.700 -2.888 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.072 -11.072 -3.961 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.510 -9.740 -5.056 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.995 -9.681 -3.345 1.00 0.00 H new ATOM 945 N ARG A 87 -4.623 -13.086 -4.272 1.00 0.00 N ATOM 946 CA ARG A 87 -5.155 -14.121 -3.389 1.00 0.00 C ATOM 947 C ARG A 87 -4.668 -13.971 -1.955 1.00 0.00 C ATOM 948 O ARG A 87 -5.343 -14.405 -1.022 1.00 0.00 O ATOM 949 CB ARG A 87 -4.784 -15.505 -3.915 1.00 0.00 C ATOM 950 CG ARG A 87 -5.468 -15.859 -5.222 1.00 0.00 C ATOM 951 CD ARG A 87 -4.991 -17.202 -5.743 1.00 0.00 C ATOM 952 NE ARG A 87 -5.229 -18.276 -4.783 1.00 0.00 N ATOM 953 CZ ARG A 87 -4.686 -19.487 -4.871 1.00 0.00 C ATOM 954 NH1 ARG A 87 -3.879 -19.785 -5.883 1.00 0.00 N ATOM 955 NH2 ARG A 87 -4.947 -20.396 -3.940 1.00 0.00 N ATOM 0 H ARG A 87 -3.953 -13.428 -4.961 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.239 -14.005 -3.381 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.704 -15.555 -4.054 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -5.043 -16.252 -3.164 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.548 -15.885 -5.075 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -5.266 -15.086 -5.963 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.503 -17.431 -6.678 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.926 -17.146 -5.968 1.00 0.00 H new ATOM 0 HE ARG A 87 -5.850 -18.086 -3.996 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -3.674 -19.084 -6.595 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -3.464 -20.715 -5.948 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -5.562 -20.165 -3.160 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -4.532 -21.326 -4.004 1.00 0.00 H new ATOM 969 N ARG A 88 -3.504 -13.369 -1.778 1.00 0.00 N ATOM 970 CA ARG A 88 -2.945 -13.172 -0.448 1.00 0.00 C ATOM 971 C ARG A 88 -2.507 -11.730 -0.265 1.00 0.00 C ATOM 972 O ARG A 88 -2.425 -10.972 -1.230 1.00 0.00 O ATOM 973 CB ARG A 88 -1.747 -14.097 -0.221 1.00 0.00 C ATOM 974 CG ARG A 88 -2.104 -15.570 -0.127 1.00 0.00 C ATOM 975 CD ARG A 88 -0.861 -16.433 0.013 1.00 0.00 C ATOM 976 NE ARG A 88 -0.061 -16.069 1.185 1.00 0.00 N ATOM 977 CZ ARG A 88 1.247 -16.309 1.298 1.00 0.00 C ATOM 978 NH1 ARG A 88 1.901 -16.912 0.312 1.00 0.00 N ATOM 979 NH2 ARG A 88 1.900 -15.946 2.398 1.00 0.00 N ATOM 0 H ARG A 88 -2.927 -13.008 -2.537 1.00 0.00 H new ATOM 0 HA ARG A 88 -3.721 -13.409 0.280 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -1.036 -13.959 -1.036 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -1.241 -13.798 0.697 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.760 -15.733 0.728 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.658 -15.869 -1.016 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.155 -17.480 0.087 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.251 -16.336 -0.885 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.532 -15.604 1.961 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.404 -17.192 -0.533 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.901 -17.095 0.400 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.401 -15.483 3.158 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.900 -16.131 2.482 1.00 0.00 H new ATOM 993 N LEU A 89 -2.242 -11.355 0.978 1.00 0.00 N ATOM 994 CA LEU A 89 -1.704 -10.039 1.280 1.00 0.00 C ATOM 995 C LEU A 89 -0.337 -9.878 0.623 1.00 0.00 C ATOM 996 O LEU A 89 0.536 -10.736 0.778 1.00 0.00 O ATOM 997 CB LEU A 89 -1.585 -9.831 2.799 1.00 0.00 C ATOM 998 CG LEU A 89 -2.889 -9.504 3.547 1.00 0.00 C ATOM 999 CD1 LEU A 89 -3.510 -8.225 3.016 1.00 0.00 C ATOM 1000 CD2 LEU A 89 -3.885 -10.650 3.457 1.00 0.00 C ATOM 0 H LEU A 89 -2.392 -11.947 1.795 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.387 -9.287 0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.158 -10.734 3.235 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.876 -9.023 2.979 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.635 -9.359 4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.431 -8.014 3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.812 -7.399 3.150 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.734 -8.342 1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -4.794 -10.385 3.996 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.126 -10.841 2.411 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -3.449 -11.546 3.899 1.00 0.00 H new ATOM 1012 N PRO A 90 -0.146 -8.795 -0.143 1.00 0.00 N ATOM 1013 CA PRO A 90 1.117 -8.531 -0.832 1.00 0.00 C ATOM 1014 C PRO A 90 2.281 -8.390 0.141 1.00 0.00 C ATOM 1015 O PRO A 90 2.168 -7.737 1.184 1.00 0.00 O ATOM 1016 CB PRO A 90 0.868 -7.216 -1.577 1.00 0.00 C ATOM 1017 CG PRO A 90 -0.311 -6.604 -0.904 1.00 0.00 C ATOM 1018 CD PRO A 90 -1.144 -7.748 -0.402 1.00 0.00 C ATOM 0 HA PRO A 90 1.396 -9.350 -1.495 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.737 -6.561 -1.521 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.670 -7.394 -2.634 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.001 -5.959 -0.083 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -0.878 -5.984 -1.599 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -1.693 -7.482 0.501 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.880 -8.066 -1.140 1.00 0.00 H new ATOM 1026 N GLN A 91 3.394 -9.014 -0.202 1.00 0.00 N ATOM 1027 CA GLN A 91 4.571 -9.011 0.646 1.00 0.00 C ATOM 1028 C GLN A 91 5.792 -8.575 -0.149 1.00 0.00 C ATOM 1029 O GLN A 91 5.885 -8.835 -1.349 1.00 0.00 O ATOM 1030 CB GLN A 91 4.802 -10.410 1.224 1.00 0.00 C ATOM 1031 CG GLN A 91 3.675 -10.895 2.123 1.00 0.00 C ATOM 1032 CD GLN A 91 3.846 -12.340 2.544 1.00 0.00 C ATOM 1033 OE1 GLN A 91 4.414 -13.152 1.810 1.00 0.00 O ATOM 1034 NE2 GLN A 91 3.350 -12.676 3.723 1.00 0.00 N ATOM 0 H GLN A 91 3.507 -9.534 -1.072 1.00 0.00 H new ATOM 0 HA GLN A 91 4.412 -8.307 1.463 1.00 0.00 H new ATOM 0 HB2 GLN A 91 4.929 -11.116 0.403 1.00 0.00 H new ATOM 0 HB3 GLN A 91 5.733 -10.410 1.791 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.627 -10.265 3.011 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.725 -10.783 1.601 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.887 -11.974 4.300 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.430 -13.637 4.055 1.00 0.00 H new ATOM 1043 N ASP A 92 6.710 -7.893 0.517 1.00 0.00 N ATOM 1044 CA ASP A 92 7.973 -7.514 -0.100 1.00 0.00 C ATOM 1045 C ASP A 92 8.858 -8.747 -0.236 1.00 0.00 C ATOM 1046 O ASP A 92 8.696 -9.717 0.506 1.00 0.00 O ATOM 1047 CB ASP A 92 8.689 -6.410 0.700 1.00 0.00 C ATOM 1048 CG ASP A 92 8.947 -6.760 2.155 1.00 0.00 C ATOM 1049 OD1 ASP A 92 8.480 -6.001 3.030 1.00 0.00 O ATOM 1050 OD2 ASP A 92 9.622 -7.781 2.429 1.00 0.00 O ATOM 0 H ASP A 92 6.605 -7.590 1.485 1.00 0.00 H new ATOM 0 HA ASP A 92 7.767 -7.106 -1.089 1.00 0.00 H new ATOM 0 HB2 ASP A 92 9.641 -6.187 0.218 1.00 0.00 H new ATOM 0 HB3 ASP A 92 8.090 -5.500 0.658 1.00 0.00 H new ATOM 1055 N PRO A 93 9.773 -8.738 -1.225 1.00 0.00 N ATOM 1056 CA PRO A 93 10.638 -9.886 -1.545 1.00 0.00 C ATOM 1057 C PRO A 93 11.454 -10.401 -0.359 1.00 0.00 C ATOM 1058 O PRO A 93 11.974 -11.516 -0.402 1.00 0.00 O ATOM 1059 CB PRO A 93 11.577 -9.337 -2.622 1.00 0.00 C ATOM 1060 CG PRO A 93 10.834 -8.208 -3.236 1.00 0.00 C ATOM 1061 CD PRO A 93 10.028 -7.599 -2.129 1.00 0.00 C ATOM 0 HA PRO A 93 10.040 -10.743 -1.854 1.00 0.00 H new ATOM 0 HB2 PRO A 93 12.520 -9.001 -2.190 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.819 -10.100 -3.362 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.519 -7.478 -3.668 1.00 0.00 H new ATOM 0 HG3 PRO A 93 10.189 -8.557 -4.043 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.575 -6.801 -1.626 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.100 -7.165 -2.500 1.00 0.00 H new ATOM 1069 N TRP A 94 11.574 -9.594 0.688 1.00 0.00 N ATOM 1070 CA TRP A 94 12.313 -9.997 1.873 1.00 0.00 C ATOM 1071 C TRP A 94 11.452 -10.889 2.758 1.00 0.00 C ATOM 1072 O TRP A 94 11.967 -11.707 3.520 1.00 0.00 O ATOM 1073 CB TRP A 94 12.795 -8.774 2.650 1.00 0.00 C ATOM 1074 CG TRP A 94 13.742 -7.925 1.861 1.00 0.00 C ATOM 1075 CD1 TRP A 94 15.047 -8.202 1.581 1.00 0.00 C ATOM 1076 CD2 TRP A 94 13.458 -6.662 1.251 1.00 0.00 C ATOM 1077 NE1 TRP A 94 15.590 -7.196 0.822 1.00 0.00 N ATOM 1078 CE2 TRP A 94 14.637 -6.235 0.611 1.00 0.00 C ATOM 1079 CE3 TRP A 94 12.324 -5.852 1.183 1.00 0.00 C ATOM 1080 CZ2 TRP A 94 14.711 -5.033 -0.090 1.00 0.00 C ATOM 1081 CZ3 TRP A 94 12.399 -4.660 0.491 1.00 0.00 C ATOM 1082 CH2 TRP A 94 13.584 -4.259 -0.138 1.00 0.00 C ATOM 0 H TRP A 94 11.169 -8.659 0.739 1.00 0.00 H new ATOM 0 HA TRP A 94 13.188 -10.565 1.556 1.00 0.00 H new ATOM 0 HB2 TRP A 94 11.934 -8.174 2.945 1.00 0.00 H new ATOM 0 HB3 TRP A 94 13.285 -9.101 3.567 1.00 0.00 H new ATOM 0 HD1 TRP A 94 15.576 -9.084 1.909 1.00 0.00 H new ATOM 0 HE1 TRP A 94 16.548 -7.168 0.472 1.00 0.00 H new ATOM 0 HE3 TRP A 94 11.404 -6.152 1.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 15.624 -4.724 -0.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 11.527 -4.025 0.434 1.00 0.00 H new ATOM 0 HH2 TRP A 94 13.609 -3.320 -0.671 1.00 0.00 H new ATOM 1093 N GLY A 95 10.140 -10.729 2.648 1.00 0.00 N ATOM 1094 CA GLY A 95 9.224 -11.591 3.365 1.00 0.00 C ATOM 1095 C GLY A 95 8.346 -10.840 4.342 1.00 0.00 C ATOM 1096 O GLY A 95 7.702 -11.448 5.199 1.00 0.00 O ATOM 0 H GLY A 95 9.693 -10.015 2.073 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.593 -12.117 2.649 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.793 -12.348 3.905 1.00 0.00 H new ATOM 1100 N SER A 96 8.309 -9.525 4.224 1.00 0.00 N ATOM 1101 CA SER A 96 7.507 -8.716 5.122 1.00 0.00 C ATOM 1102 C SER A 96 6.205 -8.299 4.445 1.00 0.00 C ATOM 1103 O SER A 96 6.171 -8.051 3.239 1.00 0.00 O ATOM 1104 CB SER A 96 8.299 -7.488 5.561 1.00 0.00 C ATOM 1105 OG SER A 96 9.605 -7.852 5.988 1.00 0.00 O ATOM 0 H SER A 96 8.823 -8.997 3.518 1.00 0.00 H new ATOM 0 HA SER A 96 7.259 -9.308 6.003 1.00 0.00 H new ATOM 0 HB2 SER A 96 8.366 -6.780 4.735 1.00 0.00 H new ATOM 0 HB3 SER A 96 7.774 -6.983 6.372 1.00 0.00 H new ATOM 0 HG SER A 96 10.146 -7.044 6.110 1.00 0.00 H new ATOM 1111 N ASP A 97 5.133 -8.246 5.217 1.00 0.00 N ATOM 1112 CA ASP A 97 3.830 -7.872 4.689 1.00 0.00 C ATOM 1113 C ASP A 97 3.654 -6.363 4.737 1.00 0.00 C ATOM 1114 O ASP A 97 3.949 -5.728 5.749 1.00 0.00 O ATOM 1115 CB ASP A 97 2.708 -8.578 5.464 1.00 0.00 C ATOM 1116 CG ASP A 97 2.599 -8.171 6.922 1.00 0.00 C ATOM 1117 OD1 ASP A 97 3.610 -8.254 7.658 1.00 0.00 O ATOM 1118 OD2 ASP A 97 1.481 -7.810 7.353 1.00 0.00 O ATOM 0 H ASP A 97 5.139 -8.458 6.215 1.00 0.00 H new ATOM 0 HA ASP A 97 3.773 -8.191 3.648 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.758 -8.373 4.971 1.00 0.00 H new ATOM 0 HB3 ASP A 97 2.869 -9.655 5.411 1.00 0.00 H new ATOM 1123 N TYR A 98 3.193 -5.797 3.625 1.00 0.00 N ATOM 1124 CA TYR A 98 3.015 -4.355 3.513 1.00 0.00 C ATOM 1125 C TYR A 98 2.030 -3.849 4.550 1.00 0.00 C ATOM 1126 O TYR A 98 1.048 -4.520 4.871 1.00 0.00 O ATOM 1127 CB TYR A 98 2.534 -3.973 2.112 1.00 0.00 C ATOM 1128 CG TYR A 98 3.589 -4.122 1.043 1.00 0.00 C ATOM 1129 CD1 TYR A 98 3.601 -5.226 0.204 1.00 0.00 C ATOM 1130 CD2 TYR A 98 4.574 -3.157 0.871 1.00 0.00 C ATOM 1131 CE1 TYR A 98 4.562 -5.369 -0.774 1.00 0.00 C ATOM 1132 CE2 TYR A 98 5.540 -3.294 -0.107 1.00 0.00 C ATOM 1133 CZ TYR A 98 5.528 -4.402 -0.927 1.00 0.00 C ATOM 1134 OH TYR A 98 6.486 -4.544 -1.898 1.00 0.00 O ATOM 0 H TYR A 98 2.936 -6.318 2.787 1.00 0.00 H new ATOM 0 HA TYR A 98 3.983 -3.888 3.692 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.676 -4.593 1.851 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.188 -2.939 2.126 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.844 -5.988 0.319 1.00 0.00 H new ATOM 0 HD2 TYR A 98 4.584 -2.287 1.511 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.556 -6.237 -1.417 1.00 0.00 H new ATOM 0 HE2 TYR A 98 6.301 -2.537 -0.229 1.00 0.00 H new ATOM 0 HH TYR A 98 6.362 -3.855 -2.583 1.00 0.00 H new ATOM 1144 N GLN A 99 2.299 -2.666 5.069 1.00 0.00 N ATOM 1145 CA GLN A 99 1.477 -2.096 6.118 1.00 0.00 C ATOM 1146 C GLN A 99 0.843 -0.791 5.662 1.00 0.00 C ATOM 1147 O GLN A 99 1.490 0.026 5.007 1.00 0.00 O ATOM 1148 CB GLN A 99 2.326 -1.858 7.364 1.00 0.00 C ATOM 1149 CG GLN A 99 2.993 -3.118 7.894 1.00 0.00 C ATOM 1150 CD GLN A 99 2.005 -4.121 8.437 1.00 0.00 C ATOM 1151 OE1 GLN A 99 0.939 -3.766 8.944 1.00 0.00 O ATOM 1152 NE2 GLN A 99 2.355 -5.384 8.329 1.00 0.00 N ATOM 0 H GLN A 99 3.082 -2.080 4.780 1.00 0.00 H new ATOM 0 HA GLN A 99 0.677 -2.799 6.353 1.00 0.00 H new ATOM 0 HB2 GLN A 99 3.094 -1.119 7.135 1.00 0.00 H new ATOM 0 HB3 GLN A 99 1.697 -1.433 8.146 1.00 0.00 H new ATOM 0 HG2 GLN A 99 3.571 -3.581 7.094 1.00 0.00 H new ATOM 0 HG3 GLN A 99 3.697 -2.847 8.680 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.248 -5.631 7.902 1.00 0.00 H new ATOM 0 HE22 GLN A 99 1.734 -6.117 8.672 1.00 0.00 H new ATOM 1161 N LEU A 100 -0.426 -0.614 5.997 1.00 0.00 N ATOM 1162 CA LEU A 100 -1.140 0.618 5.708 1.00 0.00 C ATOM 1163 C LEU A 100 -1.470 1.305 7.021 1.00 0.00 C ATOM 1164 O LEU A 100 -2.094 0.709 7.896 1.00 0.00 O ATOM 1165 CB LEU A 100 -2.419 0.313 4.902 1.00 0.00 C ATOM 1166 CG LEU A 100 -3.243 1.518 4.405 1.00 0.00 C ATOM 1167 CD1 LEU A 100 -4.165 2.047 5.492 1.00 0.00 C ATOM 1168 CD2 LEU A 100 -2.334 2.629 3.912 1.00 0.00 C ATOM 0 H LEU A 100 -0.987 -1.319 6.475 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.520 1.280 5.104 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -2.137 -0.284 4.035 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.068 -0.308 5.520 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.857 1.170 3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.731 2.896 5.108 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -4.854 1.260 5.799 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.572 2.365 6.350 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.939 3.468 3.567 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.688 2.958 4.726 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.722 2.260 3.089 1.00 0.00 H new ATOM 1180 N LEU A 101 -1.031 2.541 7.176 1.00 0.00 N ATOM 1181 CA LEU A 101 -1.283 3.268 8.405 1.00 0.00 C ATOM 1182 C LEU A 101 -2.112 4.516 8.122 1.00 0.00 C ATOM 1183 O LEU A 101 -1.668 5.429 7.423 1.00 0.00 O ATOM 1184 CB LEU A 101 0.051 3.630 9.081 1.00 0.00 C ATOM 1185 CG LEU A 101 -0.016 4.000 10.574 1.00 0.00 C ATOM 1186 CD1 LEU A 101 -0.611 5.384 10.780 1.00 0.00 C ATOM 1187 CD2 LEU A 101 -0.815 2.960 11.348 1.00 0.00 C ATOM 0 H LEU A 101 -0.503 3.058 6.473 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.853 2.635 9.085 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.731 2.786 8.969 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.491 4.468 8.541 1.00 0.00 H new ATOM 0 HG LEU A 101 1.005 4.015 10.955 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -0.643 5.611 11.846 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.005 6.124 10.269 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.622 5.410 10.373 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.851 3.239 12.401 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.829 2.910 10.951 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.338 1.985 11.247 1.00 0.00 H new ATOM 1199 N SER A 102 -3.336 4.519 8.633 1.00 0.00 N ATOM 1200 CA SER A 102 -4.204 5.683 8.568 1.00 0.00 C ATOM 1201 C SER A 102 -4.291 6.341 9.948 1.00 0.00 C ATOM 1202 O SER A 102 -4.515 5.653 10.947 1.00 0.00 O ATOM 1203 CB SER A 102 -5.598 5.267 8.080 1.00 0.00 C ATOM 1204 OG SER A 102 -6.478 6.377 7.990 1.00 0.00 O ATOM 0 H SER A 102 -3.753 3.715 9.103 1.00 0.00 H new ATOM 0 HA SER A 102 -3.791 6.404 7.863 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.514 4.790 7.104 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.016 4.526 8.762 1.00 0.00 H new ATOM 0 HG SER A 102 -7.355 6.074 7.675 1.00 0.00 H new ATOM 1210 N PRO A 103 -4.098 7.667 10.042 1.00 0.00 N ATOM 1211 CA PRO A 103 -3.727 8.528 8.916 1.00 0.00 C ATOM 1212 C PRO A 103 -2.246 8.399 8.575 1.00 0.00 C ATOM 1213 O PRO A 103 -1.427 8.077 9.437 1.00 0.00 O ATOM 1214 CB PRO A 103 -4.033 9.947 9.427 1.00 0.00 C ATOM 1215 CG PRO A 103 -4.726 9.766 10.737 1.00 0.00 C ATOM 1216 CD PRO A 103 -4.253 8.449 11.268 1.00 0.00 C ATOM 0 HA PRO A 103 -4.266 8.268 8.005 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -3.117 10.526 9.546 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -4.664 10.489 8.722 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -4.481 10.576 11.424 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -5.809 9.771 10.611 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -3.314 8.542 11.814 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -4.975 8.000 11.950 1.00 0.00 H new ATOM 1224 N GLY A 104 -1.915 8.660 7.320 1.00 0.00 N ATOM 1225 CA GLY A 104 -0.555 8.496 6.851 1.00 0.00 C ATOM 1226 C GLY A 104 0.433 9.407 7.551 1.00 0.00 C ATOM 1227 O GLY A 104 0.111 10.547 7.901 1.00 0.00 O ATOM 0 H GLY A 104 -2.572 8.986 6.611 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.250 7.460 6.997 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -0.522 8.690 5.779 1.00 0.00 H new ATOM 1231 N GLN A 105 1.641 8.905 7.744 1.00 0.00 N ATOM 1232 CA GLN A 105 2.695 9.657 8.405 1.00 0.00 C ATOM 1233 C GLN A 105 3.308 10.669 7.440 1.00 0.00 C ATOM 1234 O GLN A 105 3.871 11.683 7.854 1.00 0.00 O ATOM 1235 CB GLN A 105 3.774 8.701 8.922 1.00 0.00 C ATOM 1236 CG GLN A 105 4.847 9.375 9.761 1.00 0.00 C ATOM 1237 CD GLN A 105 5.908 8.404 10.241 1.00 0.00 C ATOM 1238 OE1 GLN A 105 6.218 7.418 9.568 1.00 0.00 O ATOM 1239 NE2 GLN A 105 6.470 8.674 11.405 1.00 0.00 N ATOM 0 H GLN A 105 1.918 7.969 7.449 1.00 0.00 H new ATOM 0 HA GLN A 105 2.266 10.196 9.249 1.00 0.00 H new ATOM 0 HB2 GLN A 105 3.299 7.921 9.517 1.00 0.00 H new ATOM 0 HB3 GLN A 105 4.247 8.210 8.072 1.00 0.00 H new ATOM 0 HG2 GLN A 105 5.320 10.163 9.175 1.00 0.00 H new ATOM 0 HG3 GLN A 105 4.382 9.854 10.623 1.00 0.00 H new ATOM 0 HE21 GLN A 105 6.184 9.501 11.930 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.190 8.056 11.779 1.00 0.00 H new ATOM 1248 N HIS A 106 3.191 10.389 6.151 1.00 0.00 N ATOM 1249 CA HIS A 106 3.746 11.264 5.125 1.00 0.00 C ATOM 1250 C HIS A 106 2.641 11.790 4.213 1.00 0.00 C ATOM 1251 O HIS A 106 2.837 12.750 3.466 1.00 0.00 O ATOM 1252 CB HIS A 106 4.784 10.515 4.286 1.00 0.00 C ATOM 1253 CG HIS A 106 5.874 9.861 5.080 1.00 0.00 C ATOM 1254 ND1 HIS A 106 5.911 8.505 5.322 1.00 0.00 N ATOM 1255 CD2 HIS A 106 6.976 10.374 5.672 1.00 0.00 C ATOM 1256 CE1 HIS A 106 6.986 8.213 6.027 1.00 0.00 C ATOM 1257 NE2 HIS A 106 7.649 9.330 6.255 1.00 0.00 N ATOM 0 H HIS A 106 2.716 9.562 5.788 1.00 0.00 H new ATOM 0 HA HIS A 106 4.227 12.105 5.624 1.00 0.00 H new ATOM 0 HB2 HIS A 106 4.274 9.753 3.697 1.00 0.00 H new ATOM 0 HB3 HIS A 106 5.235 11.214 3.581 1.00 0.00 H new ATOM 0 HD1 HIS A 106 5.214 7.831 5.005 1.00 0.00 H new ATOM 0 HD2 HIS A 106 7.272 11.413 5.684 1.00 0.00 H new ATOM 0 HE1 HIS A 106 7.275 7.227 6.361 1.00 0.00 H new ATOM 1266 N GLY A 107 1.483 11.146 4.265 1.00 0.00 N ATOM 1267 CA GLY A 107 0.367 11.558 3.438 1.00 0.00 C ATOM 1268 C GLY A 107 -0.971 11.256 4.080 1.00 0.00 C ATOM 1269 O GLY A 107 -1.096 11.282 5.304 1.00 0.00 O ATOM 0 H GLY A 107 1.297 10.344 4.867 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.439 12.628 3.242 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.427 11.052 2.474 1.00 0.00 H new ATOM 1273 N GLN A 108 -1.974 10.982 3.256 1.00 0.00 N ATOM 1274 CA GLN A 108 -3.306 10.662 3.753 1.00 0.00 C ATOM 1275 C GLN A 108 -3.317 9.258 4.344 1.00 0.00 C ATOM 1276 O GLN A 108 -3.848 9.033 5.433 1.00 0.00 O ATOM 1277 CB GLN A 108 -4.337 10.774 2.627 1.00 0.00 C ATOM 1278 CG GLN A 108 -5.772 10.580 3.092 1.00 0.00 C ATOM 1279 CD GLN A 108 -6.213 11.638 4.082 1.00 0.00 C ATOM 1280 OE1 GLN A 108 -6.725 12.688 3.697 1.00 0.00 O ATOM 1281 NE2 GLN A 108 -6.029 11.366 5.362 1.00 0.00 N ATOM 0 H GLN A 108 -1.890 10.975 2.239 1.00 0.00 H new ATOM 0 HA GLN A 108 -3.571 11.375 4.534 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -4.245 11.754 2.158 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -4.109 10.032 1.862 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -6.435 10.598 2.227 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -5.872 9.596 3.550 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -5.600 10.483 5.639 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -6.316 12.039 6.073 1.00 0.00 H new ATOM 1290 N VAL A 109 -2.720 8.324 3.617 1.00 0.00 N ATOM 1291 CA VAL A 109 -2.546 6.954 4.084 1.00 0.00 C ATOM 1292 C VAL A 109 -1.196 6.419 3.618 1.00 0.00 C ATOM 1293 O VAL A 109 -0.860 6.489 2.430 1.00 0.00 O ATOM 1294 CB VAL A 109 -3.673 6.006 3.600 1.00 0.00 C ATOM 1295 CG1 VAL A 109 -4.954 6.223 4.389 1.00 0.00 C ATOM 1296 CG2 VAL A 109 -3.929 6.180 2.111 1.00 0.00 C ATOM 0 H VAL A 109 -2.342 8.494 2.685 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.591 6.980 5.173 1.00 0.00 H new ATOM 0 HB VAL A 109 -3.339 4.983 3.774 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -5.725 5.543 4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -4.768 6.029 5.445 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -5.289 7.252 4.263 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.724 5.504 1.797 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -4.228 7.209 1.911 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.019 5.952 1.556 1.00 0.00 H new ATOM 1306 N ASP A 110 -0.415 5.900 4.552 1.00 0.00 N ATOM 1307 CA ASP A 110 0.941 5.463 4.248 1.00 0.00 C ATOM 1308 C ASP A 110 1.040 3.952 4.129 1.00 0.00 C ATOM 1309 O ASP A 110 0.698 3.221 5.060 1.00 0.00 O ATOM 1310 CB ASP A 110 1.922 5.956 5.313 1.00 0.00 C ATOM 1311 CG ASP A 110 2.649 7.218 4.895 1.00 0.00 C ATOM 1312 OD1 ASP A 110 3.853 7.137 4.583 1.00 0.00 O ATOM 1313 OD2 ASP A 110 2.023 8.299 4.880 1.00 0.00 O ATOM 0 H ASP A 110 -0.694 5.771 5.524 1.00 0.00 H new ATOM 0 HA ASP A 110 1.203 5.898 3.283 1.00 0.00 H new ATOM 0 HB2 ASP A 110 1.382 6.143 6.241 1.00 0.00 H new ATOM 0 HB3 ASP A 110 2.651 5.173 5.521 1.00 0.00 H new ATOM 1318 N ILE A 111 1.497 3.500 2.970 1.00 0.00 N ATOM 1319 CA ILE A 111 1.828 2.099 2.755 1.00 0.00 C ATOM 1320 C ILE A 111 3.342 1.953 2.712 1.00 0.00 C ATOM 1321 O ILE A 111 4.011 2.657 1.957 1.00 0.00 O ATOM 1322 CB ILE A 111 1.233 1.547 1.436 1.00 0.00 C ATOM 1323 CG1 ILE A 111 1.499 2.515 0.279 1.00 0.00 C ATOM 1324 CG2 ILE A 111 -0.255 1.280 1.578 1.00 0.00 C ATOM 1325 CD1 ILE A 111 0.965 2.045 -1.053 1.00 0.00 C ATOM 0 H ILE A 111 1.648 4.093 2.154 1.00 0.00 H new ATOM 0 HA ILE A 111 1.398 1.526 3.577 1.00 0.00 H new ATOM 0 HB ILE A 111 1.725 0.600 1.215 1.00 0.00 H new ATOM 0 HG12 ILE A 111 1.053 3.480 0.517 1.00 0.00 H new ATOM 0 HG13 ILE A 111 2.574 2.674 0.192 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -0.647 0.893 0.637 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.419 0.547 2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -0.769 2.208 1.831 1.00 0.00 H new ATOM 0 HD11 ILE A 111 1.194 2.786 -1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 111 1.430 1.095 -1.317 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.115 1.914 -0.986 1.00 0.00 H new ATOM 1337 N PHE A 112 3.884 1.063 3.528 1.00 0.00 N ATOM 1338 CA PHE A 112 5.329 0.912 3.620 1.00 0.00 C ATOM 1339 C PHE A 112 5.742 -0.545 3.782 1.00 0.00 C ATOM 1340 O PHE A 112 4.972 -1.379 4.266 1.00 0.00 O ATOM 1341 CB PHE A 112 5.884 1.758 4.777 1.00 0.00 C ATOM 1342 CG PHE A 112 5.178 1.556 6.091 1.00 0.00 C ATOM 1343 CD1 PHE A 112 4.117 2.372 6.451 1.00 0.00 C ATOM 1344 CD2 PHE A 112 5.581 0.561 6.968 1.00 0.00 C ATOM 1345 CE1 PHE A 112 3.470 2.198 7.659 1.00 0.00 C ATOM 1346 CE2 PHE A 112 4.935 0.382 8.176 1.00 0.00 C ATOM 1347 CZ PHE A 112 3.879 1.201 8.522 1.00 0.00 C ATOM 0 H PHE A 112 3.351 0.438 4.132 1.00 0.00 H new ATOM 0 HA PHE A 112 5.754 1.269 2.682 1.00 0.00 H new ATOM 0 HB2 PHE A 112 6.941 1.525 4.907 1.00 0.00 H new ATOM 0 HB3 PHE A 112 5.821 2.811 4.503 1.00 0.00 H new ATOM 0 HD1 PHE A 112 3.792 3.153 5.779 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.409 -0.081 6.704 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.645 2.841 7.928 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.256 -0.399 8.850 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.374 1.062 9.466 1.00 0.00 H new ATOM 1357 N SER A 113 6.958 -0.832 3.336 1.00 0.00 N ATOM 1358 CA SER A 113 7.564 -2.146 3.471 1.00 0.00 C ATOM 1359 C SER A 113 8.532 -2.162 4.649 1.00 0.00 C ATOM 1360 O SER A 113 9.304 -1.218 4.850 1.00 0.00 O ATOM 1361 CB SER A 113 8.305 -2.508 2.180 1.00 0.00 C ATOM 1362 OG SER A 113 9.210 -3.580 2.381 1.00 0.00 O ATOM 0 H SER A 113 7.555 -0.151 2.866 1.00 0.00 H new ATOM 0 HA SER A 113 6.780 -2.881 3.653 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.583 -2.780 1.410 1.00 0.00 H new ATOM 0 HB3 SER A 113 8.848 -1.636 1.815 1.00 0.00 H new ATOM 0 HG SER A 113 8.743 -4.325 2.814 1.00 0.00 H new ATOM 1368 N LEU A 114 8.497 -3.248 5.415 1.00 0.00 N ATOM 1369 CA LEU A 114 9.354 -3.386 6.585 1.00 0.00 C ATOM 1370 C LEU A 114 10.787 -3.653 6.160 1.00 0.00 C ATOM 1371 O LEU A 114 11.714 -3.477 6.947 1.00 0.00 O ATOM 1372 CB LEU A 114 8.886 -4.524 7.505 1.00 0.00 C ATOM 1373 CG LEU A 114 7.522 -4.347 8.196 1.00 0.00 C ATOM 1374 CD1 LEU A 114 7.418 -2.992 8.872 1.00 0.00 C ATOM 1375 CD2 LEU A 114 6.376 -4.543 7.219 1.00 0.00 C ATOM 0 H LEU A 114 7.884 -4.045 5.245 1.00 0.00 H new ATOM 0 HA LEU A 114 9.296 -2.448 7.138 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.852 -5.442 6.918 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.641 -4.667 8.278 1.00 0.00 H new ATOM 0 HG LEU A 114 7.447 -5.117 8.964 1.00 0.00 H new ATOM 0 HD11 LEU A 114 6.443 -2.898 9.351 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.202 -2.899 9.624 1.00 0.00 H new ATOM 0 HD13 LEU A 114 7.534 -2.204 8.128 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.427 -4.411 7.740 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.454 -3.811 6.415 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.423 -5.548 6.800 1.00 0.00 H new ATOM 1387 N GLY A 115 10.943 -4.122 4.922 1.00 0.00 N ATOM 1388 CA GLY A 115 12.256 -4.346 4.359 1.00 0.00 C ATOM 1389 C GLY A 115 13.038 -5.427 5.078 1.00 0.00 C ATOM 1390 O GLY A 115 12.473 -6.214 5.840 1.00 0.00 O ATOM 0 H GLY A 115 10.170 -4.351 4.297 1.00 0.00 H new ATOM 0 HA2 GLY A 115 12.152 -4.619 3.309 1.00 0.00 H new ATOM 0 HA3 GLY A 115 12.822 -3.415 4.391 1.00 0.00 H new ATOM 1394 N PRO A 116 14.356 -5.477 4.854 1.00 0.00 N ATOM 1395 CA PRO A 116 15.240 -6.466 5.472 1.00 0.00 C ATOM 1396 C PRO A 116 15.398 -6.229 6.967 1.00 0.00 C ATOM 1397 O PRO A 116 15.663 -7.156 7.731 1.00 0.00 O ATOM 1398 CB PRO A 116 16.586 -6.263 4.760 1.00 0.00 C ATOM 1399 CG PRO A 116 16.301 -5.365 3.601 1.00 0.00 C ATOM 1400 CD PRO A 116 15.094 -4.562 3.981 1.00 0.00 C ATOM 0 HA PRO A 116 14.846 -7.477 5.371 1.00 0.00 H new ATOM 0 HB2 PRO A 116 17.320 -5.815 5.431 1.00 0.00 H new ATOM 0 HB3 PRO A 116 16.999 -7.215 4.425 1.00 0.00 H new ATOM 0 HG2 PRO A 116 17.151 -4.715 3.394 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.114 -5.944 2.697 1.00 0.00 H new ATOM 0 HD2 PRO A 116 15.367 -3.642 4.498 1.00 0.00 H new ATOM 0 HD3 PRO A 116 14.508 -4.275 3.108 1.00 0.00 H new ATOM 1408 N ASP A 117 15.214 -4.979 7.377 1.00 0.00 N ATOM 1409 CA ASP A 117 15.450 -4.589 8.761 1.00 0.00 C ATOM 1410 C ASP A 117 14.265 -4.951 9.644 1.00 0.00 C ATOM 1411 O ASP A 117 14.374 -4.954 10.869 1.00 0.00 O ATOM 1412 CB ASP A 117 15.699 -3.078 8.842 1.00 0.00 C ATOM 1413 CG ASP A 117 14.465 -2.263 8.491 1.00 0.00 C ATOM 1414 OD1 ASP A 117 14.104 -2.206 7.305 1.00 0.00 O ATOM 1415 OD2 ASP A 117 13.848 -1.684 9.406 1.00 0.00 O ATOM 0 H ASP A 117 14.903 -4.220 6.771 1.00 0.00 H new ATOM 0 HA ASP A 117 16.327 -5.129 9.118 1.00 0.00 H new ATOM 0 HB2 ASP A 117 16.025 -2.821 9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 117 16.511 -2.810 8.166 1.00 0.00 H new ATOM 1420 N GLY A 118 13.136 -5.259 9.015 1.00 0.00 N ATOM 1421 CA GLY A 118 11.957 -5.688 9.747 1.00 0.00 C ATOM 1422 C GLY A 118 11.289 -4.566 10.526 1.00 0.00 C ATOM 1423 O GLY A 118 10.220 -4.758 11.100 1.00 0.00 O ATOM 0 H GLY A 118 13.016 -5.219 8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 118 11.238 -6.112 9.046 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.237 -6.484 10.438 1.00 0.00 H new ATOM 1427 N VAL A 119 11.906 -3.394 10.530 1.00 0.00 N ATOM 1428 CA VAL A 119 11.433 -2.284 11.337 1.00 0.00 C ATOM 1429 C VAL A 119 10.838 -1.183 10.464 1.00 0.00 C ATOM 1430 O VAL A 119 11.446 -0.774 9.454 1.00 0.00 O ATOM 1431 CB VAL A 119 12.576 -1.692 12.197 1.00 0.00 C ATOM 1432 CG1 VAL A 119 12.062 -0.601 13.122 1.00 0.00 C ATOM 1433 CG2 VAL A 119 13.268 -2.785 12.997 1.00 0.00 C ATOM 0 H VAL A 119 12.740 -3.188 9.980 1.00 0.00 H new ATOM 0 HA VAL A 119 10.657 -2.674 11.996 1.00 0.00 H new ATOM 0 HB VAL A 119 13.303 -1.244 11.520 1.00 0.00 H new ATOM 0 HG11 VAL A 119 12.888 -0.205 13.712 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.623 0.201 12.529 1.00 0.00 H new ATOM 0 HG13 VAL A 119 11.306 -1.016 13.789 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.068 -2.348 13.594 1.00 0.00 H new ATOM 0 HG22 VAL A 119 12.545 -3.267 13.655 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.687 -3.525 12.315 1.00 0.00 H new ATOM 1443 N PRO A 120 9.626 -0.715 10.837 1.00 0.00 N ATOM 1444 CA PRO A 120 8.974 0.416 10.181 1.00 0.00 C ATOM 1445 C PRO A 120 9.592 1.749 10.597 1.00 0.00 C ATOM 1446 O PRO A 120 10.084 1.889 11.720 1.00 0.00 O ATOM 1447 CB PRO A 120 7.526 0.318 10.660 1.00 0.00 C ATOM 1448 CG PRO A 120 7.610 -0.348 11.989 1.00 0.00 C ATOM 1449 CD PRO A 120 8.802 -1.267 11.931 1.00 0.00 C ATOM 0 HA PRO A 120 9.075 0.380 9.096 1.00 0.00 H new ATOM 0 HB2 PRO A 120 7.068 1.304 10.740 1.00 0.00 H new ATOM 0 HB3 PRO A 120 6.918 -0.261 9.965 1.00 0.00 H new ATOM 0 HG2 PRO A 120 7.725 0.388 12.785 1.00 0.00 H new ATOM 0 HG3 PRO A 120 6.699 -0.907 12.201 1.00 0.00 H new ATOM 0 HD2 PRO A 120 9.346 -1.275 12.875 1.00 0.00 H new ATOM 0 HD3 PRO A 120 8.504 -2.295 11.726 1.00 0.00 H new ATOM 1457 N GLU A 121 9.557 2.715 9.679 1.00 0.00 N ATOM 1458 CA GLU A 121 10.163 4.038 9.875 1.00 0.00 C ATOM 1459 C GLU A 121 11.684 3.945 9.853 1.00 0.00 C ATOM 1460 O GLU A 121 12.385 4.872 10.261 1.00 0.00 O ATOM 1461 CB GLU A 121 9.704 4.686 11.183 1.00 0.00 C ATOM 1462 CG GLU A 121 8.222 5.002 11.228 1.00 0.00 C ATOM 1463 CD GLU A 121 7.805 5.578 12.560 1.00 0.00 C ATOM 1464 OE1 GLU A 121 7.939 6.802 12.751 1.00 0.00 O ATOM 1465 OE2 GLU A 121 7.347 4.806 13.427 1.00 0.00 O ATOM 0 H GLU A 121 9.105 2.604 8.771 1.00 0.00 H new ATOM 0 HA GLU A 121 9.830 4.667 9.049 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.948 4.021 12.011 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.266 5.607 11.337 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.978 5.709 10.435 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.652 4.094 11.032 1.00 0.00 H new ATOM 1472 N SER A 122 12.186 2.829 9.361 1.00 0.00 N ATOM 1473 CA SER A 122 13.612 2.608 9.251 1.00 0.00 C ATOM 1474 C SER A 122 14.138 3.156 7.928 1.00 0.00 C ATOM 1475 O SER A 122 13.361 3.668 7.119 1.00 0.00 O ATOM 1476 CB SER A 122 13.889 1.110 9.371 1.00 0.00 C ATOM 1477 OG SER A 122 12.683 0.367 9.242 1.00 0.00 O ATOM 0 H SER A 122 11.616 2.052 9.027 1.00 0.00 H new ATOM 0 HA SER A 122 14.129 3.135 10.053 1.00 0.00 H new ATOM 0 HB2 SER A 122 14.596 0.802 8.601 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.353 0.896 10.334 1.00 0.00 H new ATOM 1483 N ASN A 123 15.445 3.078 7.708 1.00 0.00 N ATOM 1484 CA ASN A 123 16.014 3.494 6.426 1.00 0.00 C ATOM 1485 C ASN A 123 15.482 2.602 5.318 1.00 0.00 C ATOM 1486 O ASN A 123 15.122 3.066 4.235 1.00 0.00 O ATOM 1487 CB ASN A 123 17.542 3.440 6.448 1.00 0.00 C ATOM 1488 CG ASN A 123 18.156 4.522 7.309 1.00 0.00 C ATOM 1489 OD1 ASN A 123 17.593 5.607 7.467 1.00 0.00 O ATOM 1490 ND2 ASN A 123 19.321 4.239 7.866 1.00 0.00 N ATOM 0 H ASN A 123 16.125 2.736 8.388 1.00 0.00 H new ATOM 0 HA ASN A 123 15.718 4.527 6.243 1.00 0.00 H new ATOM 0 HB2 ASN A 123 17.861 2.465 6.816 1.00 0.00 H new ATOM 0 HB3 ASN A 123 17.919 3.535 5.430 1.00 0.00 H new ATOM 0 HD21 ASN A 123 19.788 4.931 8.452 1.00 0.00 H new ATOM 0 HD22 ASN A 123 19.753 3.328 7.710 1.00 0.00 H new ATOM 1497 N ASP A 124 15.408 1.316 5.616 1.00 0.00 N ATOM 1498 CA ASP A 124 14.843 0.344 4.705 1.00 0.00 C ATOM 1499 C ASP A 124 13.354 0.251 4.965 1.00 0.00 C ATOM 1500 O ASP A 124 12.844 -0.741 5.505 1.00 0.00 O ATOM 1501 CB ASP A 124 15.503 -1.026 4.873 1.00 0.00 C ATOM 1502 CG ASP A 124 16.975 -1.018 4.519 1.00 0.00 C ATOM 1503 OD1 ASP A 124 17.307 -1.250 3.338 1.00 0.00 O ATOM 1504 OD2 ASP A 124 17.806 -0.790 5.424 1.00 0.00 O ATOM 0 H ASP A 124 15.738 0.920 6.496 1.00 0.00 H new ATOM 0 HA ASP A 124 15.025 0.665 3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.384 -1.357 5.905 1.00 0.00 H new ATOM 0 HB3 ASP A 124 14.987 -1.752 4.244 1.00 0.00 H new ATOM 1509 N ASP A 125 12.688 1.340 4.686 1.00 0.00 N ATOM 1510 CA ASP A 125 11.239 1.409 4.748 1.00 0.00 C ATOM 1511 C ASP A 125 10.705 2.020 3.470 1.00 0.00 C ATOM 1512 O ASP A 125 10.602 3.240 3.348 1.00 0.00 O ATOM 1513 CB ASP A 125 10.786 2.230 5.951 1.00 0.00 C ATOM 1514 CG ASP A 125 10.319 1.369 7.105 1.00 0.00 C ATOM 1515 OD1 ASP A 125 9.089 1.307 7.329 1.00 0.00 O ATOM 1516 OD2 ASP A 125 11.175 0.788 7.821 1.00 0.00 O ATOM 0 H ASP A 125 13.132 2.215 4.406 1.00 0.00 H new ATOM 0 HA ASP A 125 10.846 0.399 4.859 1.00 0.00 H new ATOM 0 HB2 ASP A 125 11.609 2.862 6.285 1.00 0.00 H new ATOM 0 HB3 ASP A 125 9.977 2.894 5.648 1.00 0.00 H new ATOM 1521 N ILE A 126 10.395 1.168 2.512 1.00 0.00 N ATOM 1522 CA ILE A 126 9.942 1.623 1.211 1.00 0.00 C ATOM 1523 C ILE A 126 8.444 1.886 1.225 1.00 0.00 C ATOM 1524 O ILE A 126 7.638 0.956 1.233 1.00 0.00 O ATOM 1525 CB ILE A 126 10.273 0.600 0.109 1.00 0.00 C ATOM 1526 CG1 ILE A 126 11.779 0.321 0.083 1.00 0.00 C ATOM 1527 CG2 ILE A 126 9.795 1.111 -1.245 1.00 0.00 C ATOM 1528 CD1 ILE A 126 12.188 -0.746 -0.909 1.00 0.00 C ATOM 0 H ILE A 126 10.449 0.154 2.610 1.00 0.00 H new ATOM 0 HA ILE A 126 10.470 2.551 0.992 1.00 0.00 H new ATOM 0 HB ILE A 126 9.754 -0.334 0.326 1.00 0.00 H new ATOM 0 HG12 ILE A 126 12.306 1.245 -0.155 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.100 0.019 1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 126 10.035 0.379 -2.016 1.00 0.00 H new ATOM 0 HG22 ILE A 126 8.717 1.266 -1.215 1.00 0.00 H new ATOM 0 HG23 ILE A 126 10.291 2.054 -1.474 1.00 0.00 H new ATOM 0 HD11 ILE A 126 13.268 -0.886 -0.868 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.691 -1.684 -0.660 1.00 0.00 H new ATOM 0 HD13 ILE A 126 11.900 -0.438 -1.914 1.00 0.00 H new ATOM 1540 N GLY A 127 8.087 3.156 1.255 1.00 0.00 N ATOM 1541 CA GLY A 127 6.697 3.543 1.212 1.00 0.00 C ATOM 1542 C GLY A 127 6.380 4.356 -0.023 1.00 0.00 C ATOM 1543 O GLY A 127 7.285 4.705 -0.788 1.00 0.00 O ATOM 0 H GLY A 127 8.744 3.935 1.309 1.00 0.00 H new ATOM 0 HA2 GLY A 127 6.070 2.651 1.231 1.00 0.00 H new ATOM 0 HA3 GLY A 127 6.453 4.123 2.102 1.00 0.00 H new ATOM 1547 N ASN A 128 5.104 4.667 -0.216 1.00 0.00 N ATOM 1548 CA ASN A 128 4.666 5.431 -1.383 1.00 0.00 C ATOM 1549 C ASN A 128 5.347 6.798 -1.446 1.00 0.00 C ATOM 1550 O ASN A 128 5.662 7.298 -2.527 1.00 0.00 O ATOM 1551 CB ASN A 128 3.133 5.591 -1.410 1.00 0.00 C ATOM 1552 CG ASN A 128 2.525 6.069 -0.095 1.00 0.00 C ATOM 1553 OD1 ASN A 128 3.180 6.709 0.726 1.00 0.00 O ATOM 1554 ND2 ASN A 128 1.248 5.780 0.101 1.00 0.00 N ATOM 0 H ASN A 128 4.352 4.403 0.420 1.00 0.00 H new ATOM 0 HA ASN A 128 4.963 4.864 -2.265 1.00 0.00 H new ATOM 0 HB2 ASN A 128 2.868 6.297 -2.197 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.685 4.634 -1.677 1.00 0.00 H new ATOM 0 HD21 ASN A 128 0.780 6.090 0.952 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.732 5.247 -0.599 1.00 0.00 H new ATOM 1561 N TRP A 129 5.576 7.389 -0.284 1.00 0.00 N ATOM 1562 CA TRP A 129 6.243 8.679 -0.192 1.00 0.00 C ATOM 1563 C TRP A 129 7.753 8.525 -0.344 1.00 0.00 C ATOM 1564 O TRP A 129 8.424 9.411 -0.871 1.00 0.00 O ATOM 1565 CB TRP A 129 5.911 9.332 1.153 1.00 0.00 C ATOM 1566 CG TRP A 129 6.543 10.677 1.352 1.00 0.00 C ATOM 1567 CD1 TRP A 129 6.033 11.883 0.972 1.00 0.00 C ATOM 1568 CD2 TRP A 129 7.798 10.955 1.988 1.00 0.00 C ATOM 1569 NE1 TRP A 129 6.893 12.891 1.327 1.00 0.00 N ATOM 1570 CE2 TRP A 129 7.984 12.347 1.951 1.00 0.00 C ATOM 1571 CE3 TRP A 129 8.783 10.159 2.584 1.00 0.00 C ATOM 1572 CZ2 TRP A 129 9.112 12.964 2.487 1.00 0.00 C ATOM 1573 CZ3 TRP A 129 9.903 10.772 3.114 1.00 0.00 C ATOM 1574 CH2 TRP A 129 10.058 12.163 3.063 1.00 0.00 C ATOM 0 H TRP A 129 5.307 6.992 0.616 1.00 0.00 H new ATOM 0 HA TRP A 129 5.886 9.315 -1.002 1.00 0.00 H new ATOM 0 HB2 TRP A 129 4.829 9.434 1.238 1.00 0.00 H new ATOM 0 HB3 TRP A 129 6.232 8.669 1.956 1.00 0.00 H new ATOM 0 HD1 TRP A 129 5.090 12.024 0.465 1.00 0.00 H new ATOM 0 HE1 TRP A 129 6.744 13.885 1.154 1.00 0.00 H new ATOM 0 HE3 TRP A 129 8.670 9.086 2.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 9.235 14.036 2.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.671 10.168 3.575 1.00 0.00 H new ATOM 0 HH2 TRP A 129 10.944 12.612 3.488 1.00 0.00 H new ATOM 1585 N THR A 130 8.276 7.390 0.100 1.00 0.00 N ATOM 1586 CA THR A 130 9.711 7.143 0.077 1.00 0.00 C ATOM 1587 C THR A 130 10.231 7.108 -1.357 1.00 0.00 C ATOM 1588 O THR A 130 11.260 7.707 -1.673 1.00 0.00 O ATOM 1589 CB THR A 130 10.042 5.813 0.771 1.00 0.00 C ATOM 1590 OG1 THR A 130 9.213 5.664 1.931 1.00 0.00 O ATOM 1591 CG2 THR A 130 11.508 5.759 1.177 1.00 0.00 C ATOM 0 H THR A 130 7.724 6.622 0.482 1.00 0.00 H new ATOM 0 HA THR A 130 10.198 7.958 0.612 1.00 0.00 H new ATOM 0 HB THR A 130 9.852 4.999 0.071 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.744 5.294 2.667 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.715 4.807 1.666 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.135 5.856 0.291 1.00 0.00 H new ATOM 0 HG23 THR A 130 11.725 6.576 1.866 1.00 0.00 H new ATOM 1599 N ILE A 131 9.507 6.405 -2.220 1.00 0.00 N ATOM 1600 CA ILE A 131 9.848 6.361 -3.632 1.00 0.00 C ATOM 1601 C ILE A 131 9.286 7.597 -4.338 1.00 0.00 C ATOM 1602 O ILE A 131 9.815 8.065 -5.348 1.00 0.00 O ATOM 1603 CB ILE A 131 9.332 5.061 -4.303 1.00 0.00 C ATOM 1604 CG1 ILE A 131 9.714 5.014 -5.785 1.00 0.00 C ATOM 1605 CG2 ILE A 131 7.827 4.923 -4.134 1.00 0.00 C ATOM 1606 CD1 ILE A 131 11.208 4.960 -6.023 1.00 0.00 C ATOM 0 H ILE A 131 8.683 5.860 -1.965 1.00 0.00 H new ATOM 0 HA ILE A 131 10.934 6.361 -3.722 1.00 0.00 H new ATOM 0 HB ILE A 131 9.811 4.219 -3.804 1.00 0.00 H new ATOM 0 HG12 ILE A 131 9.249 4.141 -6.244 1.00 0.00 H new ATOM 0 HG13 ILE A 131 9.306 5.892 -6.285 1.00 0.00 H new ATOM 0 HG21 ILE A 131 7.490 4.004 -4.613 1.00 0.00 H new ATOM 0 HG22 ILE A 131 7.582 4.890 -3.073 1.00 0.00 H new ATOM 0 HG23 ILE A 131 7.329 5.776 -4.595 1.00 0.00 H new ATOM 0 HD11 ILE A 131 11.405 4.929 -7.095 1.00 0.00 H new ATOM 0 HD12 ILE A 131 11.677 5.845 -5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 131 11.619 4.067 -5.552 1.00 0.00 H new ATOM 1618 N GLY A 132 8.209 8.127 -3.762 1.00 0.00 N ATOM 1619 CA GLY A 132 7.677 9.411 -4.168 1.00 0.00 C ATOM 1620 C GLY A 132 7.076 9.419 -5.555 1.00 0.00 C ATOM 1621 O GLY A 132 7.204 10.405 -6.278 1.00 0.00 O ATOM 0 H GLY A 132 7.690 7.677 -3.008 1.00 0.00 H new ATOM 0 HA2 GLY A 132 6.915 9.720 -3.452 1.00 0.00 H new ATOM 0 HA3 GLY A 132 8.474 10.153 -4.125 1.00 0.00 H new ATOM 1625 N PHE A 133 6.382 8.351 -5.928 1.00 0.00 N ATOM 1626 CA PHE A 133 5.804 8.265 -7.266 1.00 0.00 C ATOM 1627 C PHE A 133 4.527 9.100 -7.391 1.00 0.00 C ATOM 1628 O PHE A 133 3.844 9.047 -8.412 1.00 0.00 O ATOM 1629 CB PHE A 133 5.539 6.807 -7.676 1.00 0.00 C ATOM 1630 CG PHE A 133 4.777 5.983 -6.670 1.00 0.00 C ATOM 1631 CD1 PHE A 133 3.579 6.426 -6.133 1.00 0.00 C ATOM 1632 CD2 PHE A 133 5.262 4.748 -6.276 1.00 0.00 C ATOM 1633 CE1 PHE A 133 2.884 5.656 -5.223 1.00 0.00 C ATOM 1634 CE2 PHE A 133 4.572 3.974 -5.365 1.00 0.00 C ATOM 1635 CZ PHE A 133 3.383 4.428 -4.838 1.00 0.00 C ATOM 0 H PHE A 133 6.206 7.541 -5.333 1.00 0.00 H new ATOM 0 HA PHE A 133 6.542 8.681 -7.952 1.00 0.00 H new ATOM 0 HB2 PHE A 133 4.986 6.806 -8.615 1.00 0.00 H new ATOM 0 HB3 PHE A 133 6.496 6.322 -7.869 1.00 0.00 H new ATOM 0 HD1 PHE A 133 3.184 7.386 -6.430 1.00 0.00 H new ATOM 0 HD2 PHE A 133 6.193 4.385 -6.687 1.00 0.00 H new ATOM 0 HE1 PHE A 133 1.951 6.014 -4.813 1.00 0.00 H new ATOM 0 HE2 PHE A 133 4.964 3.013 -5.066 1.00 0.00 H new ATOM 0 HZ PHE A 133 2.842 3.824 -4.125 1.00 0.00 H new ATOM 1645 N HIS A 134 4.205 9.866 -6.352 1.00 0.00 N ATOM 1646 CA HIS A 134 3.048 10.754 -6.401 1.00 0.00 C ATOM 1647 C HIS A 134 3.388 12.003 -7.198 1.00 0.00 C ATOM 1648 O HIS A 134 2.527 12.600 -7.840 1.00 0.00 O ATOM 1649 CB HIS A 134 2.571 11.139 -4.996 1.00 0.00 C ATOM 1650 CG HIS A 134 1.973 10.004 -4.220 1.00 0.00 C ATOM 1651 ND1 HIS A 134 2.112 9.872 -2.856 1.00 0.00 N ATOM 1652 CD2 HIS A 134 1.217 8.955 -4.621 1.00 0.00 C ATOM 1653 CE1 HIS A 134 1.469 8.792 -2.451 1.00 0.00 C ATOM 1654 NE2 HIS A 134 0.918 8.217 -3.502 1.00 0.00 N ATOM 0 H HIS A 134 4.724 9.890 -5.474 1.00 0.00 H new ATOM 0 HA HIS A 134 2.235 10.219 -6.892 1.00 0.00 H new ATOM 0 HB2 HIS A 134 3.414 11.544 -4.436 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.832 11.936 -5.080 1.00 0.00 H new ATOM 0 HD2 HIS A 134 0.907 8.739 -5.633 1.00 0.00 H new ATOM 0 HE1 HIS A 134 1.405 8.440 -1.432 1.00 0.00 H new ATOM 0 HE2 HIS A 134 0.360 7.363 -3.486 1.00 0.00 H new ATOM 1663 N HIS A 135 4.654 12.393 -7.159 1.00 0.00 N ATOM 1664 CA HIS A 135 5.129 13.500 -7.973 1.00 0.00 C ATOM 1665 C HIS A 135 5.888 12.958 -9.174 1.00 0.00 C ATOM 1666 O HIS A 135 6.682 12.023 -9.051 1.00 0.00 O ATOM 1667 CB HIS A 135 6.006 14.469 -7.161 1.00 0.00 C ATOM 1668 CG HIS A 135 7.194 13.837 -6.494 1.00 0.00 C ATOM 1669 ND1 HIS A 135 7.192 13.436 -5.177 1.00 0.00 N ATOM 1670 CD2 HIS A 135 8.433 13.557 -6.967 1.00 0.00 C ATOM 1671 CE1 HIS A 135 8.377 12.939 -4.870 1.00 0.00 C ATOM 1672 NE2 HIS A 135 9.148 12.998 -5.939 1.00 0.00 N ATOM 0 H HIS A 135 5.368 11.960 -6.574 1.00 0.00 H new ATOM 0 HA HIS A 135 4.265 14.068 -8.319 1.00 0.00 H new ATOM 0 HB2 HIS A 135 6.357 15.260 -7.823 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.388 14.943 -6.398 1.00 0.00 H new ATOM 0 HD2 HIS A 135 8.791 13.740 -7.969 1.00 0.00 H new ATOM 0 HE1 HIS A 135 8.666 12.549 -3.905 1.00 0.00 H new ATOM 0 HE2 HIS A 135 10.116 12.680 -5.992 1.00 0.00 H new ATOM 1681 N HIS A 136 5.627 13.524 -10.336 1.00 0.00 N ATOM 1682 CA HIS A 136 6.253 13.052 -11.561 1.00 0.00 C ATOM 1683 C HIS A 136 7.190 14.105 -12.126 1.00 0.00 C ATOM 1684 O HIS A 136 7.057 15.293 -11.833 1.00 0.00 O ATOM 1685 CB HIS A 136 5.198 12.676 -12.605 1.00 0.00 C ATOM 1686 CG HIS A 136 4.339 11.514 -12.209 1.00 0.00 C ATOM 1687 ND1 HIS A 136 4.545 10.230 -12.668 1.00 0.00 N ATOM 1688 CD2 HIS A 136 3.259 11.449 -11.396 1.00 0.00 C ATOM 1689 CE1 HIS A 136 3.629 9.431 -12.155 1.00 0.00 C ATOM 1690 NE2 HIS A 136 2.836 10.144 -11.379 1.00 0.00 N ATOM 0 H HIS A 136 4.988 14.309 -10.460 1.00 0.00 H new ATOM 0 HA HIS A 136 6.832 12.161 -11.317 1.00 0.00 H new ATOM 0 HB2 HIS A 136 4.560 13.540 -12.790 1.00 0.00 H new ATOM 0 HB3 HIS A 136 5.698 12.442 -13.545 1.00 0.00 H new ATOM 0 HD2 HIS A 136 2.812 12.273 -10.859 1.00 0.00 H new ATOM 0 HE1 HIS A 136 3.543 8.370 -12.340 1.00 0.00 H new ATOM 0 HE2 HIS A 136 2.040 9.784 -10.853 1.00 0.00 H new ATOM 1699 N HIS A 137 8.150 13.660 -12.916 1.00 0.00 N ATOM 1700 CA HIS A 137 9.094 14.556 -13.560 1.00 0.00 C ATOM 1701 C HIS A 137 9.102 14.295 -15.059 1.00 0.00 C ATOM 1702 O HIS A 137 8.456 13.350 -15.522 1.00 0.00 O ATOM 1703 CB HIS A 137 10.503 14.366 -12.984 1.00 0.00 C ATOM 1704 CG HIS A 137 10.614 14.697 -11.525 1.00 0.00 C ATOM 1705 ND1 HIS A 137 11.125 13.822 -10.591 1.00 0.00 N ATOM 1706 CD2 HIS A 137 10.284 15.820 -10.844 1.00 0.00 C ATOM 1707 CE1 HIS A 137 11.104 14.393 -9.401 1.00 0.00 C ATOM 1708 NE2 HIS A 137 10.598 15.606 -9.524 1.00 0.00 N ATOM 0 H HIS A 137 8.297 12.673 -13.129 1.00 0.00 H new ATOM 0 HA HIS A 137 8.785 15.585 -13.373 1.00 0.00 H new ATOM 0 HB2 HIS A 137 10.810 13.331 -13.136 1.00 0.00 H new ATOM 0 HB3 HIS A 137 11.200 14.991 -13.542 1.00 0.00 H new ATOM 0 HD2 HIS A 137 9.853 16.718 -11.262 1.00 0.00 H new ATOM 0 HE1 HIS A 137 11.444 13.943 -8.480 1.00 0.00 H new ATOM 0 HE2 HIS A 137 10.463 16.274 -8.765 1.00 0.00 H new ATOM 1717 N HIS A 138 9.830 15.126 -15.803 1.00 0.00 N ATOM 1718 CA HIS A 138 9.935 14.997 -17.258 1.00 0.00 C ATOM 1719 C HIS A 138 8.576 15.193 -17.920 1.00 0.00 C ATOM 1720 O HIS A 138 7.896 14.229 -18.273 1.00 0.00 O ATOM 1721 CB HIS A 138 10.517 13.633 -17.654 1.00 0.00 C ATOM 1722 CG HIS A 138 11.857 13.346 -17.054 1.00 0.00 C ATOM 1723 ND1 HIS A 138 12.103 12.244 -16.262 1.00 0.00 N ATOM 1724 CD2 HIS A 138 13.029 14.016 -17.138 1.00 0.00 C ATOM 1725 CE1 HIS A 138 13.367 12.251 -15.885 1.00 0.00 C ATOM 1726 NE2 HIS A 138 13.949 13.314 -16.401 1.00 0.00 N ATOM 0 H HIS A 138 10.363 15.906 -15.417 1.00 0.00 H new ATOM 0 HA HIS A 138 10.612 15.776 -17.607 1.00 0.00 H new ATOM 0 HB2 HIS A 138 9.820 12.851 -17.353 1.00 0.00 H new ATOM 0 HB3 HIS A 138 10.599 13.586 -18.740 1.00 0.00 H new ATOM 0 HD2 HIS A 138 13.207 14.931 -17.683 1.00 0.00 H new ATOM 0 HE1 HIS A 138 13.844 11.511 -15.259 1.00 0.00 H new ATOM 0 HE2 HIS A 138 14.927 13.574 -16.273 1.00 0.00 H new ATOM 1735 N HIS A 139 8.183 16.447 -18.077 1.00 0.00 N ATOM 1736 CA HIS A 139 6.912 16.780 -18.699 1.00 0.00 C ATOM 1737 C HIS A 139 6.998 16.592 -20.212 1.00 0.00 C ATOM 1738 O HIS A 139 7.424 17.491 -20.936 1.00 0.00 O ATOM 1739 CB HIS A 139 6.518 18.224 -18.361 1.00 0.00 C ATOM 1740 CG HIS A 139 5.148 18.609 -18.835 1.00 0.00 C ATOM 1741 ND1 HIS A 139 4.013 18.419 -18.081 1.00 0.00 N ATOM 1742 CD2 HIS A 139 4.735 19.183 -19.989 1.00 0.00 C ATOM 1743 CE1 HIS A 139 2.962 18.856 -18.748 1.00 0.00 C ATOM 1744 NE2 HIS A 139 3.373 19.325 -19.908 1.00 0.00 N ATOM 0 H HIS A 139 8.730 17.255 -17.780 1.00 0.00 H new ATOM 0 HA HIS A 139 6.145 16.110 -18.309 1.00 0.00 H new ATOM 0 HB2 HIS A 139 6.569 18.360 -17.281 1.00 0.00 H new ATOM 0 HB3 HIS A 139 7.248 18.902 -18.803 1.00 0.00 H new ATOM 0 HD2 HIS A 139 5.361 19.475 -20.819 1.00 0.00 H new ATOM 0 HE1 HIS A 139 1.939 18.833 -18.402 1.00 0.00 H new ATOM 0 HE2 HIS A 139 2.775 19.728 -20.629 1.00 0.00 H new ATOM 1753 N LYS A 140 6.603 15.419 -20.679 1.00 0.00 N ATOM 1754 CA LYS A 140 6.637 15.111 -22.100 1.00 0.00 C ATOM 1755 C LYS A 140 5.251 15.266 -22.707 1.00 0.00 C ATOM 1756 O LYS A 140 4.918 16.383 -23.153 1.00 0.00 O ATOM 1757 CB LYS A 140 7.153 13.691 -22.338 1.00 0.00 C ATOM 1758 CG LYS A 140 8.616 13.497 -21.977 1.00 0.00 C ATOM 1759 CD LYS A 140 9.072 12.077 -22.270 1.00 0.00 C ATOM 1760 CE LYS A 140 10.570 11.914 -22.073 1.00 0.00 C ATOM 1761 NZ LYS A 140 11.354 12.719 -23.048 1.00 0.00 N ATOM 1762 OXT LYS A 140 4.493 14.276 -22.723 1.00 0.00 O ATOM 0 H LYS A 140 6.254 14.661 -20.092 1.00 0.00 H new ATOM 0 HA LYS A 140 7.318 15.812 -22.582 1.00 0.00 H new ATOM 0 HB2 LYS A 140 6.550 12.994 -21.756 1.00 0.00 H new ATOM 0 HB3 LYS A 140 7.011 13.435 -23.388 1.00 0.00 H new ATOM 0 HG2 LYS A 140 9.228 14.202 -22.540 1.00 0.00 H new ATOM 0 HG3 LYS A 140 8.765 13.719 -20.920 1.00 0.00 H new ATOM 0 HD2 LYS A 140 8.542 11.383 -21.618 1.00 0.00 H new ATOM 0 HD3 LYS A 140 8.809 11.815 -23.295 1.00 0.00 H new ATOM 0 HE2 LYS A 140 10.836 12.213 -21.059 1.00 0.00 H new ATOM 0 HE3 LYS A 140 10.836 10.862 -22.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 12.342 12.393 -23.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 10.948 12.605 -23.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 11.322 13.722 -22.776 1.00 0.00 H new TER 1776 LYS A 140 HETATM 1777 CA CA A 201 12.642 -1.173 7.273 1.00 0.00 CA