USER MOD reduce.3.24.130724 H: found=0, std=0, add=1077, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1073 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 102 TYR OH : rot -53:sc= -2.1 USER MOD Set 1.2: A 110 CYS SG : rot 80:sc= -4.21! USER MOD Set 2.1: A 65 SER OG : rot 90:sc= 0.523 USER MOD Set 2.2: A 74 HIS : no HE2:sc= -3.82! C(o=-3.3!,f=-24!) USER MOD Set 3.1: A 26 HIS : no HE2:sc= -8.05! C(o=-8.5!,f=-8.6!) USER MOD Set 3.2: A 96 THR OG1 : rot 180:sc= -0.479 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 67:sc= 0.465 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 26:sc= 1.27 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -0.302 K(o=-0.3,f=-1.8!) USER MOD Single : A 14 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.9!) USER MOD Single : A 21 GLN : amide:sc=-0.00714 K(o=-0.0071,f=-0.9) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc=-0.00147 USER MOD Single : A 33 MET CE :methyl -170:sc= -0.53 (180deg=-0.991) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.328 X(o=-0.33,f=-0.00073) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 84:sc= 0.928 USER MOD Single : A 54 GLN :FLIP amide:sc= -2.01! C(o=-3.6!,f=-2!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -155:sc= -0.75 (180deg=-0.995) USER MOD Single : A 68 TYR OH : rot -111:sc= 1.24 USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0.41) USER MOD Single : A 73 LYS NZ :NH3+ -176:sc= 0.0321 (180deg=0.0164) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= -0.193 (180deg=-0.193) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.0155 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN :FLIP amide:sc= -2.51 F(o=-3.1!,f=-2.5) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 ASN : amide:sc= -0.929! X(o=-0.93!,f=-0.75) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 166:sc= -0.0159 (180deg=-0.23) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 84:sc= -0.168! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -2.67! C(o=-2.7!,f=-4.7!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -162:sc= -0.528 (180deg=-0.872) USER MOD Single : A 129 THR OG1 : rot 51:sc= 0.721 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 20:sc= 0.32 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.093 -9.646 26.919 1.00 0.00 N ATOM 2 CA GLY A 1 3.887 -10.850 26.759 1.00 0.00 C ATOM 3 C GLY A 1 4.949 -10.706 25.687 1.00 0.00 C ATOM 4 O GLY A 1 4.633 -10.490 24.517 1.00 0.00 O ATOM 0 H1 GLY A 1 2.382 -9.796 27.663 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.713 -8.855 27.186 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.615 -9.424 26.023 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.364 -11.096 27.708 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.231 -11.683 26.507 1.00 0.00 H new ATOM 8 N SER A 2 6.211 -10.825 26.086 1.00 0.00 N ATOM 9 CA SER A 2 7.323 -10.702 25.151 1.00 0.00 C ATOM 10 C SER A 2 7.717 -12.065 24.592 1.00 0.00 C ATOM 11 O SER A 2 8.901 -12.379 24.466 1.00 0.00 O ATOM 12 CB SER A 2 8.526 -10.053 25.839 1.00 0.00 C ATOM 13 OG SER A 2 9.157 -10.962 26.725 1.00 0.00 O ATOM 0 H SER A 2 6.489 -11.006 27.050 1.00 0.00 H new ATOM 0 HA SER A 2 7.001 -10.069 24.324 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.241 -9.716 25.088 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.202 -9.170 26.389 1.00 0.00 H new ATOM 0 HG SER A 2 9.563 -11.691 26.211 1.00 0.00 H new ATOM 19 N SER A 3 6.715 -12.872 24.257 1.00 0.00 N ATOM 20 CA SER A 3 6.955 -14.205 23.714 1.00 0.00 C ATOM 21 C SER A 3 6.610 -14.257 22.229 1.00 0.00 C ATOM 22 O SER A 3 7.411 -14.704 21.410 1.00 0.00 O ATOM 23 CB SER A 3 6.133 -15.245 24.477 1.00 0.00 C ATOM 24 OG SER A 3 6.589 -16.558 24.202 1.00 0.00 O ATOM 0 H SER A 3 5.730 -12.626 24.352 1.00 0.00 H new ATOM 0 HA SER A 3 8.015 -14.433 23.831 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.199 -15.051 25.548 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.082 -15.156 24.201 1.00 0.00 H new ATOM 0 HG SER A 3 6.048 -17.204 24.703 1.00 0.00 H new ATOM 30 N GLY A 4 5.410 -13.795 21.890 1.00 0.00 N ATOM 31 CA GLY A 4 4.979 -13.798 20.505 1.00 0.00 C ATOM 32 C GLY A 4 4.628 -15.187 20.009 1.00 0.00 C ATOM 33 O GLY A 4 5.417 -15.820 19.306 1.00 0.00 O ATOM 0 H GLY A 4 4.729 -13.419 22.550 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.112 -13.147 20.396 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.770 -13.382 19.881 1.00 0.00 H new ATOM 37 N SER A 5 3.443 -15.663 20.377 1.00 0.00 N ATOM 38 CA SER A 5 2.993 -16.989 19.969 1.00 0.00 C ATOM 39 C SER A 5 2.785 -17.052 18.459 1.00 0.00 C ATOM 40 O SER A 5 1.744 -16.639 17.947 1.00 0.00 O ATOM 41 CB SER A 5 1.693 -17.353 20.690 1.00 0.00 C ATOM 42 OG SER A 5 1.854 -17.284 22.097 1.00 0.00 O ATOM 0 H SER A 5 2.778 -15.151 20.956 1.00 0.00 H new ATOM 0 HA SER A 5 3.766 -17.708 20.242 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.898 -16.675 20.378 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.385 -18.359 20.405 1.00 0.00 H new ATOM 0 HG SER A 5 1.009 -17.519 22.535 1.00 0.00 H new ATOM 48 N SER A 6 3.783 -17.572 17.752 1.00 0.00 N ATOM 49 CA SER A 6 3.712 -17.686 16.300 1.00 0.00 C ATOM 50 C SER A 6 4.866 -18.528 15.765 1.00 0.00 C ATOM 51 O SER A 6 5.767 -18.912 16.509 1.00 0.00 O ATOM 52 CB SER A 6 3.738 -16.298 15.656 1.00 0.00 C ATOM 53 OG SER A 6 2.436 -15.741 15.593 1.00 0.00 O ATOM 0 H SER A 6 4.650 -17.921 18.161 1.00 0.00 H new ATOM 0 HA SER A 6 2.775 -18.180 16.044 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.391 -15.640 16.229 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.156 -16.367 14.652 1.00 0.00 H new ATOM 0 HG SER A 6 1.882 -16.123 16.306 1.00 0.00 H new ATOM 59 N GLY A 7 4.830 -18.813 14.466 1.00 0.00 N ATOM 60 CA GLY A 7 5.878 -19.608 13.852 1.00 0.00 C ATOM 61 C GLY A 7 5.354 -20.907 13.272 1.00 0.00 C ATOM 62 O GLY A 7 5.642 -21.987 13.787 1.00 0.00 O ATOM 0 H GLY A 7 4.094 -18.508 13.829 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.355 -19.027 13.063 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.645 -19.828 14.594 1.00 0.00 H new ATOM 66 N LYS A 8 4.581 -20.803 12.196 1.00 0.00 N ATOM 67 CA LYS A 8 4.015 -21.979 11.544 1.00 0.00 C ATOM 68 C LYS A 8 4.555 -22.127 10.125 1.00 0.00 C ATOM 69 O LYS A 8 3.940 -21.662 9.166 1.00 0.00 O ATOM 70 CB LYS A 8 2.488 -21.884 11.513 1.00 0.00 C ATOM 71 CG LYS A 8 1.806 -23.182 11.118 1.00 0.00 C ATOM 72 CD LYS A 8 0.293 -23.049 11.149 1.00 0.00 C ATOM 73 CE LYS A 8 -0.270 -23.399 12.518 1.00 0.00 C ATOM 74 NZ LYS A 8 -1.710 -23.037 12.635 1.00 0.00 N ATOM 0 H LYS A 8 4.332 -19.917 11.757 1.00 0.00 H new ATOM 0 HA LYS A 8 4.307 -22.858 12.118 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.131 -21.581 12.497 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.195 -21.102 10.813 1.00 0.00 H new ATOM 0 HG2 LYS A 8 2.126 -23.472 10.117 1.00 0.00 H new ATOM 0 HG3 LYS A 8 2.116 -23.978 11.795 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.011 -22.029 10.889 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.146 -23.703 10.396 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -0.148 -24.467 12.698 1.00 0.00 H new ATOM 0 HE3 LYS A 8 0.299 -22.879 13.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.056 -23.291 13.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.824 -22.014 12.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.257 -23.553 11.917 1.00 0.00 H new ATOM 88 N ALA A 9 5.707 -22.778 10.000 1.00 0.00 N ATOM 89 CA ALA A 9 6.327 -22.990 8.699 1.00 0.00 C ATOM 90 C ALA A 9 5.675 -24.156 7.964 1.00 0.00 C ATOM 91 O ALA A 9 5.420 -25.207 8.551 1.00 0.00 O ATOM 92 CB ALA A 9 7.821 -23.233 8.859 1.00 0.00 C ATOM 0 H ALA A 9 6.229 -23.168 10.785 1.00 0.00 H new ATOM 0 HA ALA A 9 6.179 -22.090 8.102 1.00 0.00 H new ATOM 0 HB1 ALA A 9 8.271 -23.390 7.879 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.281 -22.368 9.335 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.982 -24.116 9.478 1.00 0.00 H new ATOM 98 N GLU A 10 5.408 -23.963 6.676 1.00 0.00 N ATOM 99 CA GLU A 10 4.784 -25.000 5.862 1.00 0.00 C ATOM 100 C GLU A 10 4.738 -24.586 4.394 1.00 0.00 C ATOM 101 O GLU A 10 4.602 -23.405 4.076 1.00 0.00 O ATOM 102 CB GLU A 10 3.369 -25.292 6.365 1.00 0.00 C ATOM 103 CG GLU A 10 2.807 -26.614 5.869 1.00 0.00 C ATOM 104 CD GLU A 10 1.522 -27.003 6.573 1.00 0.00 C ATOM 105 OE1 GLU A 10 1.506 -27.001 7.822 1.00 0.00 O ATOM 106 OE2 GLU A 10 0.532 -27.308 5.876 1.00 0.00 O ATOM 0 H GLU A 10 5.614 -23.099 6.174 1.00 0.00 H new ATOM 0 HA GLU A 10 5.386 -25.904 5.948 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.373 -25.295 7.455 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.707 -24.485 6.051 1.00 0.00 H new ATOM 0 HG2 GLU A 10 2.623 -26.547 4.797 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.549 -27.398 6.017 1.00 0.00 H new ATOM 113 N ALA A 11 4.853 -25.566 3.504 1.00 0.00 N ATOM 114 CA ALA A 11 4.823 -25.304 2.071 1.00 0.00 C ATOM 115 C ALA A 11 3.982 -26.345 1.340 1.00 0.00 C ATOM 116 O ALA A 11 4.173 -27.547 1.520 1.00 0.00 O ATOM 117 CB ALA A 11 6.237 -25.277 1.510 1.00 0.00 C ATOM 0 H ALA A 11 4.968 -26.549 3.751 1.00 0.00 H new ATOM 0 HA ALA A 11 4.363 -24.328 1.915 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.200 -25.080 0.439 1.00 0.00 H new ATOM 0 HB2 ALA A 11 6.809 -24.491 2.003 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.717 -26.240 1.686 1.00 0.00 H new ATOM 123 N GLU A 12 3.051 -25.875 0.517 1.00 0.00 N ATOM 124 CA GLU A 12 2.180 -26.767 -0.240 1.00 0.00 C ATOM 125 C GLU A 12 2.517 -26.725 -1.727 1.00 0.00 C ATOM 126 O GLU A 12 1.999 -25.889 -2.468 1.00 0.00 O ATOM 127 CB GLU A 12 0.713 -26.385 -0.027 1.00 0.00 C ATOM 128 CG GLU A 12 0.119 -26.942 1.256 1.00 0.00 C ATOM 129 CD GLU A 12 -1.339 -26.565 1.435 1.00 0.00 C ATOM 130 OE1 GLU A 12 -1.649 -25.356 1.392 1.00 0.00 O ATOM 131 OE2 GLU A 12 -2.169 -27.480 1.617 1.00 0.00 O ATOM 0 H GLU A 12 2.880 -24.882 0.357 1.00 0.00 H new ATOM 0 HA GLU A 12 2.340 -27.783 0.122 1.00 0.00 H new ATOM 0 HB2 GLU A 12 0.627 -25.298 -0.015 1.00 0.00 H new ATOM 0 HB3 GLU A 12 0.127 -26.742 -0.874 1.00 0.00 H new ATOM 0 HG2 GLU A 12 0.212 -28.028 1.254 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.693 -26.575 2.107 1.00 0.00 H new ATOM 138 N GLN A 13 3.389 -27.631 -2.156 1.00 0.00 N ATOM 139 CA GLN A 13 3.797 -27.697 -3.555 1.00 0.00 C ATOM 140 C GLN A 13 2.601 -27.499 -4.480 1.00 0.00 C ATOM 141 O GLN A 13 1.485 -27.909 -4.164 1.00 0.00 O ATOM 142 CB GLN A 13 4.469 -29.039 -3.850 1.00 0.00 C ATOM 143 CG GLN A 13 3.674 -30.238 -3.358 1.00 0.00 C ATOM 144 CD GLN A 13 2.711 -30.767 -4.403 1.00 0.00 C ATOM 145 OE1 GLN A 13 2.953 -30.647 -5.604 1.00 0.00 O ATOM 146 NE2 GLN A 13 1.611 -31.357 -3.949 1.00 0.00 N ATOM 0 H GLN A 13 3.827 -28.330 -1.556 1.00 0.00 H new ATOM 0 HA GLN A 13 4.511 -26.894 -3.737 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.622 -29.131 -4.925 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.455 -29.052 -3.386 1.00 0.00 H new ATOM 0 HG2 GLN A 13 4.362 -31.032 -3.069 1.00 0.00 H new ATOM 0 HG3 GLN A 13 3.117 -29.958 -2.464 1.00 0.00 H new ATOM 0 HE21 GLN A 13 1.451 -31.434 -2.945 1.00 0.00 H new ATOM 0 HE22 GLN A 13 0.926 -31.733 -4.605 1.00 0.00 H new ATOM 155 N ASN A 14 2.843 -26.867 -5.624 1.00 0.00 N ATOM 156 CA ASN A 14 1.785 -26.614 -6.596 1.00 0.00 C ATOM 157 C ASN A 14 1.958 -27.493 -7.831 1.00 0.00 C ATOM 158 O ASN A 14 2.917 -28.259 -7.930 1.00 0.00 O ATOM 159 CB ASN A 14 1.780 -25.139 -7.003 1.00 0.00 C ATOM 160 CG ASN A 14 0.888 -24.296 -6.112 1.00 0.00 C ATOM 161 OD1 ASN A 14 0.323 -24.790 -5.136 1.00 0.00 O ATOM 162 ND2 ASN A 14 0.759 -23.017 -6.444 1.00 0.00 N ATOM 0 H ASN A 14 3.762 -26.521 -5.901 1.00 0.00 H new ATOM 0 HA ASN A 14 0.831 -26.859 -6.129 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.798 -24.751 -6.965 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.444 -25.051 -8.036 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.173 -22.401 -5.881 1.00 0.00 H new ATOM 0 HD22 ASN A 14 1.246 -22.651 -7.262 1.00 0.00 H new ATOM 169 N TRP A 15 1.025 -27.377 -8.768 1.00 0.00 N ATOM 170 CA TRP A 15 1.075 -28.161 -9.997 1.00 0.00 C ATOM 171 C TRP A 15 -0.016 -27.722 -10.968 1.00 0.00 C ATOM 172 O TRP A 15 -1.192 -28.029 -10.773 1.00 0.00 O ATOM 173 CB TRP A 15 0.926 -29.650 -9.683 1.00 0.00 C ATOM 174 CG TRP A 15 -0.477 -30.047 -9.337 1.00 0.00 C ATOM 175 CD1 TRP A 15 -1.069 -29.978 -8.108 1.00 0.00 C ATOM 176 CD2 TRP A 15 -1.463 -30.575 -10.231 1.00 0.00 C ATOM 177 NE1 TRP A 15 -2.364 -30.432 -8.184 1.00 0.00 N ATOM 178 CE2 TRP A 15 -2.630 -30.803 -9.476 1.00 0.00 C ATOM 179 CE3 TRP A 15 -1.475 -30.876 -11.595 1.00 0.00 C ATOM 180 CZ2 TRP A 15 -3.793 -31.319 -10.041 1.00 0.00 C ATOM 181 CZ3 TRP A 15 -2.630 -31.388 -12.155 1.00 0.00 C ATOM 182 CH2 TRP A 15 -3.776 -31.604 -11.379 1.00 0.00 C ATOM 0 H TRP A 15 0.225 -26.748 -8.701 1.00 0.00 H new ATOM 0 HA TRP A 15 2.044 -27.991 -10.467 1.00 0.00 H new ATOM 0 HB2 TRP A 15 1.258 -30.230 -10.544 1.00 0.00 H new ATOM 0 HB3 TRP A 15 1.584 -29.906 -8.852 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -0.590 -29.619 -7.209 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -3.021 -30.484 -7.405 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -0.597 -30.711 -12.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -4.677 -31.488 -9.444 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -2.649 -31.626 -13.208 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.664 -32.004 -11.846 1.00 0.00 H new ATOM 193 N TRP A 16 0.382 -27.004 -12.012 1.00 0.00 N ATOM 194 CA TRP A 16 -0.564 -26.523 -13.013 1.00 0.00 C ATOM 195 C TRP A 16 0.146 -26.203 -14.323 1.00 0.00 C ATOM 196 O TRP A 16 1.349 -25.943 -14.339 1.00 0.00 O ATOM 197 CB TRP A 16 -1.296 -25.282 -12.498 1.00 0.00 C ATOM 198 CG TRP A 16 -2.678 -25.132 -13.059 1.00 0.00 C ATOM 199 CD1 TRP A 16 -3.096 -24.207 -13.972 1.00 0.00 C ATOM 200 CD2 TRP A 16 -3.823 -25.931 -12.741 1.00 0.00 C ATOM 201 NE1 TRP A 16 -4.432 -24.382 -14.241 1.00 0.00 N ATOM 202 CE2 TRP A 16 -4.901 -25.434 -13.500 1.00 0.00 C ATOM 203 CE3 TRP A 16 -4.041 -27.019 -11.892 1.00 0.00 C ATOM 204 CZ2 TRP A 16 -6.176 -25.988 -13.431 1.00 0.00 C ATOM 205 CZ3 TRP A 16 -5.308 -27.568 -11.825 1.00 0.00 C ATOM 206 CH2 TRP A 16 -6.362 -27.053 -12.592 1.00 0.00 C ATOM 0 H TRP A 16 1.352 -26.742 -12.188 1.00 0.00 H new ATOM 0 HA TRP A 16 -1.291 -27.313 -13.200 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -1.356 -25.330 -11.411 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -0.713 -24.396 -12.747 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -2.469 -23.449 -14.417 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -4.985 -23.820 -14.888 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -3.234 -27.424 -11.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -6.990 -25.591 -14.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -5.489 -28.408 -11.171 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -7.340 -27.505 -12.519 1.00 0.00 H new ATOM 217 N GLU A 17 -0.606 -26.223 -15.419 1.00 0.00 N ATOM 218 CA GLU A 17 -0.045 -25.934 -16.734 1.00 0.00 C ATOM 219 C GLU A 17 -0.036 -24.433 -17.004 1.00 0.00 C ATOM 220 O GLU A 17 -0.354 -23.987 -18.106 1.00 0.00 O ATOM 221 CB GLU A 17 -0.845 -26.654 -17.823 1.00 0.00 C ATOM 222 CG GLU A 17 -2.315 -26.271 -17.852 1.00 0.00 C ATOM 223 CD GLU A 17 -3.033 -26.806 -19.076 1.00 0.00 C ATOM 224 OE1 GLU A 17 -2.405 -26.867 -20.153 1.00 0.00 O ATOM 225 OE2 GLU A 17 -4.223 -27.164 -18.955 1.00 0.00 O ATOM 0 H GLU A 17 -1.604 -26.436 -15.423 1.00 0.00 H new ATOM 0 HA GLU A 17 0.984 -26.294 -16.749 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.401 -26.433 -18.794 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -0.762 -27.730 -17.672 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.803 -26.650 -16.954 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.404 -25.185 -17.829 1.00 0.00 H new ATOM 232 N GLY A 18 0.332 -23.657 -15.989 1.00 0.00 N ATOM 233 CA GLY A 18 0.376 -22.214 -16.136 1.00 0.00 C ATOM 234 C GLY A 18 1.122 -21.538 -15.003 1.00 0.00 C ATOM 235 O GLY A 18 1.076 -21.975 -13.853 1.00 0.00 O ATOM 0 H GLY A 18 0.600 -24.002 -15.067 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.854 -21.963 -17.083 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.641 -21.825 -16.180 1.00 0.00 H new ATOM 239 N PRO A 19 1.831 -20.446 -15.324 1.00 0.00 N ATOM 240 CA PRO A 19 2.605 -19.686 -14.337 1.00 0.00 C ATOM 241 C PRO A 19 1.713 -18.937 -13.353 1.00 0.00 C ATOM 242 O PRO A 19 0.671 -18.389 -13.715 1.00 0.00 O ATOM 243 CB PRO A 19 3.401 -18.699 -15.195 1.00 0.00 C ATOM 244 CG PRO A 19 2.593 -18.539 -16.437 1.00 0.00 C ATOM 245 CD PRO A 19 1.932 -19.868 -16.674 1.00 0.00 C ATOM 0 HA PRO A 19 3.227 -20.334 -13.720 1.00 0.00 H new ATOM 0 HB2 PRO A 19 3.533 -17.746 -14.683 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.397 -19.082 -15.417 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.851 -17.749 -16.321 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.225 -18.261 -17.281 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.951 -19.752 -17.136 1.00 0.00 H new ATOM 0 HD3 PRO A 19 2.524 -20.498 -17.337 1.00 0.00 H new ATOM 253 N PRO A 20 2.129 -18.911 -12.078 1.00 0.00 N ATOM 254 CA PRO A 20 1.382 -18.231 -11.015 1.00 0.00 C ATOM 255 C PRO A 20 1.418 -16.714 -11.161 1.00 0.00 C ATOM 256 O PRO A 20 2.119 -16.181 -12.020 1.00 0.00 O ATOM 257 CB PRO A 20 2.108 -18.664 -9.739 1.00 0.00 C ATOM 258 CG PRO A 20 3.492 -18.991 -10.183 1.00 0.00 C ATOM 259 CD PRO A 20 3.360 -19.542 -11.576 1.00 0.00 C ATOM 0 HA PRO A 20 0.324 -18.492 -11.029 1.00 0.00 H new ATOM 0 HB2 PRO A 20 2.109 -17.868 -8.994 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.624 -19.527 -9.282 1.00 0.00 H new ATOM 0 HG2 PRO A 20 4.125 -18.104 -10.173 1.00 0.00 H new ATOM 0 HG3 PRO A 20 3.954 -19.720 -9.517 1.00 0.00 H new ATOM 0 HD2 PRO A 20 4.222 -19.287 -12.192 1.00 0.00 H new ATOM 0 HD3 PRO A 20 3.281 -20.629 -11.572 1.00 0.00 H new ATOM 267 N GLN A 21 0.658 -16.025 -10.316 1.00 0.00 N ATOM 268 CA GLN A 21 0.604 -14.568 -10.352 1.00 0.00 C ATOM 269 C GLN A 21 2.004 -13.969 -10.275 1.00 0.00 C ATOM 270 O GLN A 21 2.871 -14.482 -9.566 1.00 0.00 O ATOM 271 CB GLN A 21 -0.254 -14.040 -9.201 1.00 0.00 C ATOM 272 CG GLN A 21 0.435 -14.110 -7.847 1.00 0.00 C ATOM 273 CD GLN A 21 -0.319 -13.356 -6.769 1.00 0.00 C ATOM 274 OE1 GLN A 21 -0.848 -12.270 -7.009 1.00 0.00 O ATOM 275 NE2 GLN A 21 -0.373 -13.930 -5.573 1.00 0.00 N ATOM 0 H GLN A 21 0.072 -16.452 -9.599 1.00 0.00 H new ATOM 0 HA GLN A 21 0.153 -14.270 -11.298 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -0.527 -13.005 -9.407 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -1.181 -14.612 -9.158 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.539 -15.154 -7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 21 1.442 -13.702 -7.934 1.00 0.00 H new ATOM 0 HE21 GLN A 21 0.080 -14.831 -5.419 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.867 -13.470 -4.808 1.00 0.00 H new ATOM 284 N ASP A 22 2.219 -12.882 -11.008 1.00 0.00 N ATOM 285 CA ASP A 22 3.514 -12.213 -11.022 1.00 0.00 C ATOM 286 C ASP A 22 3.399 -10.795 -10.471 1.00 0.00 C ATOM 287 O ASP A 22 3.281 -9.831 -11.228 1.00 0.00 O ATOM 288 CB ASP A 22 4.078 -12.177 -12.443 1.00 0.00 C ATOM 289 CG ASP A 22 4.572 -13.534 -12.904 1.00 0.00 C ATOM 290 OD1 ASP A 22 3.991 -14.553 -12.477 1.00 0.00 O ATOM 291 OD2 ASP A 22 5.541 -13.577 -13.692 1.00 0.00 O ATOM 0 H ASP A 22 1.513 -12.446 -11.600 1.00 0.00 H new ATOM 0 HA ASP A 22 4.194 -12.778 -10.384 1.00 0.00 H new ATOM 0 HB2 ASP A 22 3.308 -11.822 -13.128 1.00 0.00 H new ATOM 0 HB3 ASP A 22 4.898 -11.461 -12.487 1.00 0.00 H new ATOM 296 N LEU A 23 3.433 -10.675 -9.148 1.00 0.00 N ATOM 297 CA LEU A 23 3.332 -9.375 -8.495 1.00 0.00 C ATOM 298 C LEU A 23 4.309 -8.379 -9.110 1.00 0.00 C ATOM 299 O LEU A 23 4.123 -7.166 -9.006 1.00 0.00 O ATOM 300 CB LEU A 23 3.602 -9.513 -6.995 1.00 0.00 C ATOM 301 CG LEU A 23 2.711 -10.501 -6.241 1.00 0.00 C ATOM 302 CD1 LEU A 23 3.234 -10.720 -4.829 1.00 0.00 C ATOM 303 CD2 LEU A 23 1.273 -10.004 -6.208 1.00 0.00 C ATOM 0 H LEU A 23 3.530 -11.462 -8.507 1.00 0.00 H new ATOM 0 HA LEU A 23 2.319 -9.000 -8.642 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.641 -9.815 -6.859 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.492 -8.531 -6.535 1.00 0.00 H new ATOM 0 HG LEU A 23 2.732 -11.456 -6.767 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.588 -11.426 -4.307 1.00 0.00 H new ATOM 0 HD12 LEU A 23 4.247 -11.120 -4.874 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.243 -9.771 -4.293 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.653 -10.719 -5.668 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.234 -9.037 -5.706 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.901 -9.899 -7.227 1.00 0.00 H new ATOM 315 N SER A 24 5.350 -8.899 -9.752 1.00 0.00 N ATOM 316 CA SER A 24 6.358 -8.055 -10.383 1.00 0.00 C ATOM 317 C SER A 24 5.724 -7.136 -11.423 1.00 0.00 C ATOM 318 O SER A 24 6.161 -6.001 -11.614 1.00 0.00 O ATOM 319 CB SER A 24 7.438 -8.918 -11.039 1.00 0.00 C ATOM 320 OG SER A 24 8.663 -8.212 -11.141 1.00 0.00 O ATOM 0 H SER A 24 5.518 -9.900 -9.849 1.00 0.00 H new ATOM 0 HA SER A 24 6.816 -7.438 -9.610 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.586 -9.827 -10.456 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.109 -9.226 -12.031 1.00 0.00 H new ATOM 0 HG SER A 24 9.337 -8.785 -11.562 1.00 0.00 H new ATOM 326 N VAL A 25 4.691 -7.636 -12.093 1.00 0.00 N ATOM 327 CA VAL A 25 3.994 -6.861 -13.113 1.00 0.00 C ATOM 328 C VAL A 25 3.496 -5.534 -12.551 1.00 0.00 C ATOM 329 O VAL A 25 3.346 -4.555 -13.282 1.00 0.00 O ATOM 330 CB VAL A 25 2.800 -7.642 -13.693 1.00 0.00 C ATOM 331 CG1 VAL A 25 3.249 -9.001 -14.207 1.00 0.00 C ATOM 332 CG2 VAL A 25 1.705 -7.793 -12.647 1.00 0.00 C ATOM 0 H VAL A 25 4.318 -8.574 -11.948 1.00 0.00 H new ATOM 0 HA VAL A 25 4.713 -6.667 -13.909 1.00 0.00 H new ATOM 0 HB VAL A 25 2.394 -7.080 -14.534 1.00 0.00 H new ATOM 0 HG11 VAL A 25 2.392 -9.538 -14.613 1.00 0.00 H new ATOM 0 HG12 VAL A 25 3.996 -8.866 -14.989 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.682 -9.575 -13.388 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.869 -8.347 -13.073 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.097 -8.333 -11.785 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.364 -6.807 -12.332 1.00 0.00 H new ATOM 342 N HIS A 26 3.242 -5.509 -11.247 1.00 0.00 N ATOM 343 CA HIS A 26 2.761 -4.301 -10.585 1.00 0.00 C ATOM 344 C HIS A 26 3.841 -3.224 -10.569 1.00 0.00 C ATOM 345 O HIS A 26 4.963 -3.448 -11.025 1.00 0.00 O ATOM 346 CB HIS A 26 2.320 -4.618 -9.156 1.00 0.00 C ATOM 347 CG HIS A 26 1.400 -5.796 -9.060 1.00 0.00 C ATOM 348 ND1 HIS A 26 0.297 -5.957 -9.873 1.00 0.00 N ATOM 349 CD2 HIS A 26 1.424 -6.874 -8.243 1.00 0.00 C ATOM 350 CE1 HIS A 26 -0.318 -7.083 -9.558 1.00 0.00 C ATOM 351 NE2 HIS A 26 0.346 -7.659 -8.572 1.00 0.00 N ATOM 0 H HIS A 26 3.361 -6.311 -10.628 1.00 0.00 H new ATOM 0 HA HIS A 26 1.906 -3.925 -11.146 1.00 0.00 H new ATOM 0 HB2 HIS A 26 3.203 -4.807 -8.545 1.00 0.00 H new ATOM 0 HB3 HIS A 26 1.823 -3.744 -8.736 1.00 0.00 H new ATOM 0 HD1 HIS A 26 0.002 -5.308 -10.603 1.00 0.00 H new ATOM 0 HD2 HIS A 26 2.155 -7.079 -7.475 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.212 -7.467 -10.027 1.00 0.00 H new ATOM 359 N LEU A 27 3.495 -2.054 -10.043 1.00 0.00 N ATOM 360 CA LEU A 27 4.435 -0.941 -9.969 1.00 0.00 C ATOM 361 C LEU A 27 5.050 -0.839 -8.577 1.00 0.00 C ATOM 362 O LEU A 27 6.271 -0.773 -8.431 1.00 0.00 O ATOM 363 CB LEU A 27 3.732 0.371 -10.325 1.00 0.00 C ATOM 364 CG LEU A 27 3.369 0.559 -11.798 1.00 0.00 C ATOM 365 CD1 LEU A 27 2.528 1.812 -11.985 1.00 0.00 C ATOM 366 CD2 LEU A 27 4.626 0.626 -12.653 1.00 0.00 C ATOM 0 H LEU A 27 2.571 -1.852 -9.662 1.00 0.00 H new ATOM 0 HA LEU A 27 5.234 -1.125 -10.687 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.819 0.443 -9.734 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.374 1.198 -10.021 1.00 0.00 H new ATOM 0 HG LEU A 27 2.780 -0.300 -12.119 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.279 1.929 -13.040 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.610 1.724 -11.403 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.091 2.682 -11.646 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.348 0.760 -13.698 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.241 1.466 -12.330 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.190 -0.300 -12.543 1.00 0.00 H new ATOM 378 N TRP A 28 4.198 -0.831 -7.559 1.00 0.00 N ATOM 379 CA TRP A 28 4.659 -0.740 -6.178 1.00 0.00 C ATOM 380 C TRP A 28 5.571 -1.911 -5.830 1.00 0.00 C ATOM 381 O TRP A 28 6.416 -1.809 -4.940 1.00 0.00 O ATOM 382 CB TRP A 28 3.465 -0.706 -5.222 1.00 0.00 C ATOM 383 CG TRP A 28 2.260 -1.423 -5.750 1.00 0.00 C ATOM 384 CD1 TRP A 28 1.207 -0.871 -6.422 1.00 0.00 C ATOM 385 CD2 TRP A 28 1.984 -2.825 -5.650 1.00 0.00 C ATOM 386 NE1 TRP A 28 0.292 -1.845 -6.744 1.00 0.00 N ATOM 387 CE2 TRP A 28 0.746 -3.052 -6.283 1.00 0.00 C ATOM 388 CE3 TRP A 28 2.663 -3.909 -5.088 1.00 0.00 C ATOM 389 CZ2 TRP A 28 0.176 -4.319 -6.367 1.00 0.00 C ATOM 390 CZ3 TRP A 28 2.095 -5.166 -5.173 1.00 0.00 C ATOM 391 CH2 TRP A 28 0.862 -5.363 -5.809 1.00 0.00 C ATOM 0 H TRP A 28 3.185 -0.886 -7.663 1.00 0.00 H new ATOM 0 HA TRP A 28 5.228 0.183 -6.071 1.00 0.00 H new ATOM 0 HB2 TRP A 28 3.757 -1.153 -4.272 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.201 0.332 -5.019 1.00 0.00 H new ATOM 0 HD1 TRP A 28 1.108 0.177 -6.665 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.583 -1.693 -7.245 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.614 -3.767 -4.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.775 -4.473 -6.856 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.610 -6.011 -4.742 1.00 0.00 H new ATOM 0 HH2 TRP A 28 0.445 -6.358 -5.860 1.00 0.00 H new ATOM 402 N TYR A 29 5.395 -3.022 -6.537 1.00 0.00 N ATOM 403 CA TYR A 29 6.202 -4.214 -6.301 1.00 0.00 C ATOM 404 C TYR A 29 7.653 -3.978 -6.707 1.00 0.00 C ATOM 405 O TYR A 29 7.957 -3.791 -7.885 1.00 0.00 O ATOM 406 CB TYR A 29 5.631 -5.403 -7.074 1.00 0.00 C ATOM 407 CG TYR A 29 6.043 -6.745 -6.512 1.00 0.00 C ATOM 408 CD1 TYR A 29 5.330 -7.334 -5.475 1.00 0.00 C ATOM 409 CD2 TYR A 29 7.145 -7.423 -7.016 1.00 0.00 C ATOM 410 CE1 TYR A 29 5.703 -8.560 -4.958 1.00 0.00 C ATOM 411 CE2 TYR A 29 7.525 -8.649 -6.506 1.00 0.00 C ATOM 412 CZ TYR A 29 6.801 -9.213 -5.477 1.00 0.00 C ATOM 413 OH TYR A 29 7.176 -10.434 -4.965 1.00 0.00 O ATOM 0 H TYR A 29 4.701 -3.122 -7.278 1.00 0.00 H new ATOM 0 HA TYR A 29 6.174 -4.436 -5.234 1.00 0.00 H new ATOM 0 HB2 TYR A 29 4.543 -5.337 -7.074 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.954 -5.339 -8.113 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.470 -6.825 -5.066 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.715 -6.984 -7.821 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.138 -9.004 -4.152 1.00 0.00 H new ATOM 0 HE2 TYR A 29 8.384 -9.163 -6.911 1.00 0.00 H new ATOM 0 HH TYR A 29 7.968 -10.759 -5.442 1.00 0.00 H new ATOM 423 N ALA A 30 8.546 -3.990 -5.723 1.00 0.00 N ATOM 424 CA ALA A 30 9.966 -3.781 -5.977 1.00 0.00 C ATOM 425 C ALA A 30 10.783 -5.001 -5.566 1.00 0.00 C ATOM 426 O ALA A 30 11.890 -4.873 -5.046 1.00 0.00 O ATOM 427 CB ALA A 30 10.457 -2.543 -5.241 1.00 0.00 C ATOM 0 H ALA A 30 8.311 -4.142 -4.742 1.00 0.00 H new ATOM 0 HA ALA A 30 10.100 -3.631 -7.048 1.00 0.00 H new ATOM 0 HB1 ALA A 30 11.519 -2.399 -5.440 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.902 -1.671 -5.586 1.00 0.00 H new ATOM 0 HB3 ALA A 30 10.302 -2.671 -4.170 1.00 0.00 H new ATOM 433 N GLY A 31 10.228 -6.186 -5.803 1.00 0.00 N ATOM 434 CA GLY A 31 10.919 -7.413 -5.450 1.00 0.00 C ATOM 435 C GLY A 31 11.685 -7.293 -4.148 1.00 0.00 C ATOM 436 O GLY A 31 11.340 -6.500 -3.271 1.00 0.00 O ATOM 0 H GLY A 31 9.313 -6.318 -6.233 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.195 -8.224 -5.368 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.609 -7.681 -6.250 1.00 0.00 H new ATOM 440 N PRO A 32 12.751 -8.095 -4.008 1.00 0.00 N ATOM 441 CA PRO A 32 13.590 -8.094 -2.805 1.00 0.00 C ATOM 442 C PRO A 32 14.411 -6.817 -2.672 1.00 0.00 C ATOM 443 O PRO A 32 15.530 -6.732 -3.176 1.00 0.00 O ATOM 444 CB PRO A 32 14.508 -9.301 -3.013 1.00 0.00 C ATOM 445 CG PRO A 32 14.566 -9.483 -4.490 1.00 0.00 C ATOM 446 CD PRO A 32 13.220 -9.064 -5.012 1.00 0.00 C ATOM 0 HA PRO A 32 12.995 -8.145 -1.893 1.00 0.00 H new ATOM 0 HB2 PRO A 32 15.499 -9.121 -2.597 1.00 0.00 H new ATOM 0 HB3 PRO A 32 14.112 -10.189 -2.520 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.360 -8.877 -4.927 1.00 0.00 H new ATOM 0 HG3 PRO A 32 14.779 -10.521 -4.747 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.295 -8.613 -6.001 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.541 -9.912 -5.099 1.00 0.00 H new ATOM 454 N MET A 33 13.848 -5.825 -1.989 1.00 0.00 N ATOM 455 CA MET A 33 14.530 -4.552 -1.789 1.00 0.00 C ATOM 456 C MET A 33 14.803 -4.309 -0.308 1.00 0.00 C ATOM 457 O MET A 33 13.958 -4.587 0.542 1.00 0.00 O ATOM 458 CB MET A 33 13.693 -3.405 -2.359 1.00 0.00 C ATOM 459 CG MET A 33 14.425 -2.073 -2.383 1.00 0.00 C ATOM 460 SD MET A 33 13.883 -1.007 -3.733 1.00 0.00 S ATOM 461 CE MET A 33 12.263 -0.516 -3.148 1.00 0.00 C ATOM 0 H MET A 33 12.922 -5.879 -1.565 1.00 0.00 H new ATOM 0 HA MET A 33 15.484 -4.593 -2.315 1.00 0.00 H new ATOM 0 HB2 MET A 33 13.385 -3.660 -3.373 1.00 0.00 H new ATOM 0 HB3 MET A 33 12.784 -3.300 -1.767 1.00 0.00 H new ATOM 0 HG2 MET A 33 14.268 -1.560 -1.434 1.00 0.00 H new ATOM 0 HG3 MET A 33 15.496 -2.253 -2.475 1.00 0.00 H new ATOM 0 HE1 MET A 33 11.728 -0.002 -3.946 1.00 0.00 H new ATOM 0 HE2 MET A 33 11.702 -1.400 -2.846 1.00 0.00 H new ATOM 0 HE3 MET A 33 12.372 0.153 -2.295 1.00 0.00 H new ATOM 471 N GLU A 34 15.990 -3.791 -0.007 1.00 0.00 N ATOM 472 CA GLU A 34 16.373 -3.512 1.372 1.00 0.00 C ATOM 473 C GLU A 34 15.591 -2.325 1.926 1.00 0.00 C ATOM 474 O GLU A 34 15.005 -1.548 1.172 1.00 0.00 O ATOM 475 CB GLU A 34 17.875 -3.233 1.461 1.00 0.00 C ATOM 476 CG GLU A 34 18.714 -4.479 1.690 1.00 0.00 C ATOM 477 CD GLU A 34 18.933 -4.773 3.161 1.00 0.00 C ATOM 478 OE1 GLU A 34 19.476 -3.898 3.867 1.00 0.00 O ATOM 479 OE2 GLU A 34 18.561 -5.879 3.606 1.00 0.00 O ATOM 0 H GLU A 34 16.702 -3.556 -0.699 1.00 0.00 H new ATOM 0 HA GLU A 34 16.137 -4.391 1.972 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.201 -2.750 0.540 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.057 -2.528 2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.225 -5.333 1.222 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.680 -4.357 1.200 1.00 0.00 H new ATOM 486 N ARG A 35 15.586 -2.192 3.248 1.00 0.00 N ATOM 487 CA ARG A 35 14.874 -1.102 3.904 1.00 0.00 C ATOM 488 C ARG A 35 15.394 0.251 3.427 1.00 0.00 C ATOM 489 O ARG A 35 14.625 1.099 2.975 1.00 0.00 O ATOM 490 CB ARG A 35 15.020 -1.209 5.423 1.00 0.00 C ATOM 491 CG ARG A 35 14.512 0.012 6.171 1.00 0.00 C ATOM 492 CD ARG A 35 15.637 0.992 6.466 1.00 0.00 C ATOM 493 NE ARG A 35 16.562 0.478 7.472 1.00 0.00 N ATOM 494 CZ ARG A 35 16.285 0.431 8.770 1.00 0.00 C ATOM 495 NH1 ARG A 35 15.115 0.867 9.217 1.00 0.00 N ATOM 496 NH2 ARG A 35 17.179 -0.051 9.624 1.00 0.00 N ATOM 0 H ARG A 35 16.067 -2.826 3.886 1.00 0.00 H new ATOM 0 HA ARG A 35 13.819 -1.181 3.641 1.00 0.00 H new ATOM 0 HB2 ARG A 35 14.478 -2.089 5.770 1.00 0.00 H new ATOM 0 HB3 ARG A 35 16.071 -1.364 5.669 1.00 0.00 H new ATOM 0 HG2 ARG A 35 13.742 0.508 5.580 1.00 0.00 H new ATOM 0 HG3 ARG A 35 14.046 -0.300 7.105 1.00 0.00 H new ATOM 0 HD2 ARG A 35 16.183 1.204 5.547 1.00 0.00 H new ATOM 0 HD3 ARG A 35 15.214 1.936 6.811 1.00 0.00 H new ATOM 0 HE ARG A 35 17.471 0.136 7.161 1.00 0.00 H new ATOM 0 HH11 ARG A 35 14.426 1.239 8.563 1.00 0.00 H new ATOM 0 HH12 ARG A 35 14.904 0.830 10.214 1.00 0.00 H new ATOM 0 HH21 ARG A 35 18.080 -0.386 9.284 1.00 0.00 H new ATOM 0 HH22 ARG A 35 16.965 -0.086 10.621 1.00 0.00 H new ATOM 510 N ALA A 36 16.705 0.446 3.530 1.00 0.00 N ATOM 511 CA ALA A 36 17.327 1.694 3.108 1.00 0.00 C ATOM 512 C ALA A 36 16.898 2.071 1.695 1.00 0.00 C ATOM 513 O ALA A 36 16.498 3.206 1.439 1.00 0.00 O ATOM 514 CB ALA A 36 18.843 1.582 3.190 1.00 0.00 C ATOM 0 H ALA A 36 17.356 -0.245 3.902 1.00 0.00 H new ATOM 0 HA ALA A 36 16.995 2.483 3.783 1.00 0.00 H new ATOM 0 HB1 ALA A 36 19.295 2.521 2.872 1.00 0.00 H new ATOM 0 HB2 ALA A 36 19.137 1.368 4.217 1.00 0.00 H new ATOM 0 HB3 ALA A 36 19.184 0.777 2.539 1.00 0.00 H new ATOM 520 N GLY A 37 16.985 1.112 0.778 1.00 0.00 N ATOM 521 CA GLY A 37 16.603 1.364 -0.599 1.00 0.00 C ATOM 522 C GLY A 37 15.282 2.098 -0.709 1.00 0.00 C ATOM 523 O GLY A 37 15.186 3.119 -1.390 1.00 0.00 O ATOM 0 H GLY A 37 17.313 0.165 0.965 1.00 0.00 H new ATOM 0 HA2 GLY A 37 17.382 1.949 -1.088 1.00 0.00 H new ATOM 0 HA3 GLY A 37 16.534 0.416 -1.133 1.00 0.00 H new ATOM 527 N ALA A 38 14.260 1.578 -0.038 1.00 0.00 N ATOM 528 CA ALA A 38 12.938 2.191 -0.063 1.00 0.00 C ATOM 529 C ALA A 38 12.970 3.590 0.543 1.00 0.00 C ATOM 530 O ALA A 38 12.276 4.493 0.078 1.00 0.00 O ATOM 531 CB ALA A 38 11.936 1.316 0.677 1.00 0.00 C ATOM 0 H ALA A 38 14.322 0.733 0.530 1.00 0.00 H new ATOM 0 HA ALA A 38 12.626 2.281 -1.104 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.953 1.786 0.650 1.00 0.00 H new ATOM 0 HB2 ALA A 38 11.884 0.338 0.198 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.253 1.196 1.713 1.00 0.00 H new ATOM 537 N GLU A 39 13.779 3.760 1.584 1.00 0.00 N ATOM 538 CA GLU A 39 13.899 5.050 2.254 1.00 0.00 C ATOM 539 C GLU A 39 14.608 6.064 1.360 1.00 0.00 C ATOM 540 O GLU A 39 14.459 7.273 1.536 1.00 0.00 O ATOM 541 CB GLU A 39 14.661 4.896 3.572 1.00 0.00 C ATOM 542 CG GLU A 39 13.912 4.087 4.618 1.00 0.00 C ATOM 543 CD GLU A 39 14.360 4.402 6.031 1.00 0.00 C ATOM 544 OE1 GLU A 39 15.559 4.218 6.330 1.00 0.00 O ATOM 545 OE2 GLU A 39 13.512 4.835 6.840 1.00 0.00 O ATOM 0 H GLU A 39 14.360 3.022 1.981 1.00 0.00 H new ATOM 0 HA GLU A 39 12.894 5.416 2.464 1.00 0.00 H new ATOM 0 HB2 GLU A 39 15.620 4.418 3.373 1.00 0.00 H new ATOM 0 HB3 GLU A 39 14.876 5.886 3.975 1.00 0.00 H new ATOM 0 HG2 GLU A 39 12.844 4.284 4.527 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.058 3.025 4.423 1.00 0.00 H new ATOM 552 N SER A 40 15.379 5.561 0.402 1.00 0.00 N ATOM 553 CA SER A 40 16.114 6.422 -0.518 1.00 0.00 C ATOM 554 C SER A 40 15.323 6.645 -1.803 1.00 0.00 C ATOM 555 O SER A 40 15.462 7.678 -2.458 1.00 0.00 O ATOM 556 CB SER A 40 17.477 5.808 -0.844 1.00 0.00 C ATOM 557 OG SER A 40 18.161 6.575 -1.820 1.00 0.00 O ATOM 0 H SER A 40 15.511 4.562 0.242 1.00 0.00 H new ATOM 0 HA SER A 40 16.264 7.387 -0.033 1.00 0.00 H new ATOM 0 HB2 SER A 40 18.079 5.748 0.063 1.00 0.00 H new ATOM 0 HB3 SER A 40 17.343 4.789 -1.206 1.00 0.00 H new ATOM 0 HG SER A 40 19.030 6.163 -2.010 1.00 0.00 H new ATOM 563 N ILE A 41 14.494 5.669 -2.157 1.00 0.00 N ATOM 564 CA ILE A 41 13.680 5.758 -3.363 1.00 0.00 C ATOM 565 C ILE A 41 12.525 6.735 -3.175 1.00 0.00 C ATOM 566 O ILE A 41 12.341 7.658 -3.970 1.00 0.00 O ATOM 567 CB ILE A 41 13.115 4.383 -3.764 1.00 0.00 C ATOM 568 CG1 ILE A 41 14.233 3.484 -4.298 1.00 0.00 C ATOM 569 CG2 ILE A 41 12.016 4.544 -4.803 1.00 0.00 C ATOM 570 CD1 ILE A 41 13.938 2.007 -4.159 1.00 0.00 C ATOM 0 H ILE A 41 14.368 4.807 -1.626 1.00 0.00 H new ATOM 0 HA ILE A 41 14.332 6.119 -4.158 1.00 0.00 H new ATOM 0 HB ILE A 41 12.686 3.911 -2.880 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.403 3.715 -5.350 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.157 3.713 -3.768 1.00 0.00 H new ATOM 0 HG21 ILE A 41 11.627 3.563 -5.076 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.211 5.152 -4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 41 12.422 5.033 -5.689 1.00 0.00 H new ATOM 0 HD11 ILE A 41 14.773 1.430 -4.558 1.00 0.00 H new ATOM 0 HD12 ILE A 41 13.797 1.762 -3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 41 13.031 1.763 -4.713 1.00 0.00 H new ATOM 582 N LEU A 42 11.748 6.527 -2.117 1.00 0.00 N ATOM 583 CA LEU A 42 10.610 7.390 -1.822 1.00 0.00 C ATOM 584 C LEU A 42 11.073 8.722 -1.240 1.00 0.00 C ATOM 585 O LEU A 42 10.289 9.662 -1.113 1.00 0.00 O ATOM 586 CB LEU A 42 9.658 6.697 -0.846 1.00 0.00 C ATOM 587 CG LEU A 42 9.242 5.272 -1.212 1.00 0.00 C ATOM 588 CD1 LEU A 42 8.466 4.632 -0.071 1.00 0.00 C ATOM 589 CD2 LEU A 42 8.415 5.269 -2.490 1.00 0.00 C ATOM 0 H LEU A 42 11.886 5.768 -1.450 1.00 0.00 H new ATOM 0 HA LEU A 42 10.083 7.586 -2.756 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.129 6.675 0.137 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.758 7.305 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 42 10.144 4.684 -1.385 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.178 3.618 -0.350 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.092 4.599 0.821 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.571 5.219 0.135 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.128 4.246 -2.735 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.519 5.873 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 42 9.005 5.686 -3.306 1.00 0.00 H new ATOM 601 N ALA A 43 12.352 8.795 -0.888 1.00 0.00 N ATOM 602 CA ALA A 43 12.921 10.012 -0.323 1.00 0.00 C ATOM 603 C ALA A 43 12.518 11.236 -1.139 1.00 0.00 C ATOM 604 O ALA A 43 11.922 12.175 -0.613 1.00 0.00 O ATOM 605 CB ALA A 43 14.437 9.901 -0.248 1.00 0.00 C ATOM 0 H ALA A 43 13.014 8.025 -0.984 1.00 0.00 H new ATOM 0 HA ALA A 43 12.527 10.134 0.686 1.00 0.00 H new ATOM 0 HB1 ALA A 43 14.848 10.817 0.176 1.00 0.00 H new ATOM 0 HB2 ALA A 43 14.709 9.055 0.383 1.00 0.00 H new ATOM 0 HB3 ALA A 43 14.841 9.751 -1.249 1.00 0.00 H new ATOM 611 N ASN A 44 12.849 11.219 -2.426 1.00 0.00 N ATOM 612 CA ASN A 44 12.522 12.329 -3.314 1.00 0.00 C ATOM 613 C ASN A 44 11.057 12.274 -3.737 1.00 0.00 C ATOM 614 O ASN A 44 10.419 13.308 -3.936 1.00 0.00 O ATOM 615 CB ASN A 44 13.423 12.303 -4.550 1.00 0.00 C ATOM 616 CG ASN A 44 14.870 12.009 -4.205 1.00 0.00 C ATOM 617 OD1 ASN A 44 15.647 12.917 -3.911 1.00 0.00 O ATOM 618 ND2 ASN A 44 15.239 10.733 -4.239 1.00 0.00 N ATOM 0 H ASN A 44 13.343 10.449 -2.877 1.00 0.00 H new ATOM 0 HA ASN A 44 12.690 13.259 -2.770 1.00 0.00 H new ATOM 0 HB2 ASN A 44 13.058 11.548 -5.246 1.00 0.00 H new ATOM 0 HB3 ASN A 44 13.362 13.264 -5.061 1.00 0.00 H new ATOM 0 HD21 ASN A 44 16.200 10.474 -4.016 1.00 0.00 H new ATOM 0 HD22 ASN A 44 14.561 10.013 -4.488 1.00 0.00 H new ATOM 625 N ARG A 45 10.531 11.061 -3.872 1.00 0.00 N ATOM 626 CA ARG A 45 9.142 10.871 -4.272 1.00 0.00 C ATOM 627 C ARG A 45 8.226 11.841 -3.531 1.00 0.00 C ATOM 628 O ARG A 45 8.627 12.461 -2.547 1.00 0.00 O ATOM 629 CB ARG A 45 8.704 9.431 -4.000 1.00 0.00 C ATOM 630 CG ARG A 45 9.379 8.409 -4.900 1.00 0.00 C ATOM 631 CD ARG A 45 8.900 8.530 -6.338 1.00 0.00 C ATOM 632 NE ARG A 45 9.696 7.714 -7.251 1.00 0.00 N ATOM 633 CZ ARG A 45 9.320 7.418 -8.490 1.00 0.00 C ATOM 634 NH1 ARG A 45 8.166 7.870 -8.962 1.00 0.00 N ATOM 635 NH2 ARG A 45 10.099 6.669 -9.260 1.00 0.00 N ATOM 0 H ARG A 45 11.046 10.195 -3.710 1.00 0.00 H new ATOM 0 HA ARG A 45 9.067 11.071 -5.341 1.00 0.00 H new ATOM 0 HB2 ARG A 45 8.919 9.185 -2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 45 7.624 9.358 -4.128 1.00 0.00 H new ATOM 0 HG2 ARG A 45 10.460 8.547 -4.863 1.00 0.00 H new ATOM 0 HG3 ARG A 45 9.173 7.405 -4.530 1.00 0.00 H new ATOM 0 HD2 ARG A 45 7.855 8.227 -6.399 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.948 9.574 -6.649 1.00 0.00 H new ATOM 0 HE ARG A 45 10.590 7.352 -6.919 1.00 0.00 H new ATOM 0 HH11 ARG A 45 7.565 8.446 -8.373 1.00 0.00 H new ATOM 0 HH12 ARG A 45 7.880 7.641 -9.914 1.00 0.00 H new ATOM 0 HH21 ARG A 45 10.987 6.320 -8.901 1.00 0.00 H new ATOM 0 HH22 ARG A 45 9.809 6.442 -10.211 1.00 0.00 H new ATOM 649 N SER A 46 6.993 11.967 -4.013 1.00 0.00 N ATOM 650 CA SER A 46 6.021 12.865 -3.400 1.00 0.00 C ATOM 651 C SER A 46 5.219 12.142 -2.323 1.00 0.00 C ATOM 652 O SER A 46 4.790 11.004 -2.511 1.00 0.00 O ATOM 653 CB SER A 46 5.076 13.430 -4.463 1.00 0.00 C ATOM 654 OG SER A 46 5.553 14.667 -4.963 1.00 0.00 O ATOM 0 H SER A 46 6.644 11.459 -4.826 1.00 0.00 H new ATOM 0 HA SER A 46 6.565 13.687 -2.934 1.00 0.00 H new ATOM 0 HB2 SER A 46 4.977 12.717 -5.282 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.082 13.566 -4.036 1.00 0.00 H new ATOM 0 HG SER A 46 4.933 15.006 -5.642 1.00 0.00 H new ATOM 660 N ASP A 47 5.019 12.813 -1.193 1.00 0.00 N ATOM 661 CA ASP A 47 4.268 12.236 -0.084 1.00 0.00 C ATOM 662 C ASP A 47 3.105 11.393 -0.597 1.00 0.00 C ATOM 663 O ASP A 47 2.284 11.862 -1.384 1.00 0.00 O ATOM 664 CB ASP A 47 3.746 13.342 0.835 1.00 0.00 C ATOM 665 CG ASP A 47 2.436 13.929 0.348 1.00 0.00 C ATOM 666 OD1 ASP A 47 2.410 14.466 -0.779 1.00 0.00 O ATOM 667 OD2 ASP A 47 1.437 13.854 1.095 1.00 0.00 O ATOM 0 H ASP A 47 5.366 13.757 -1.021 1.00 0.00 H new ATOM 0 HA ASP A 47 4.940 11.590 0.482 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.610 12.942 1.840 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.492 14.134 0.906 1.00 0.00 H new ATOM 672 N GLY A 48 3.042 10.144 -0.145 1.00 0.00 N ATOM 673 CA GLY A 48 1.977 9.254 -0.569 1.00 0.00 C ATOM 674 C GLY A 48 2.479 8.126 -1.449 1.00 0.00 C ATOM 675 O GLY A 48 1.812 7.102 -1.600 1.00 0.00 O ATOM 0 H GLY A 48 3.710 9.733 0.507 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.487 8.835 0.310 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.224 9.826 -1.111 1.00 0.00 H new ATOM 679 N THR A 49 3.659 8.313 -2.032 1.00 0.00 N ATOM 680 CA THR A 49 4.249 7.305 -2.903 1.00 0.00 C ATOM 681 C THR A 49 4.597 6.041 -2.125 1.00 0.00 C ATOM 682 O THR A 49 5.625 5.979 -1.450 1.00 0.00 O ATOM 683 CB THR A 49 5.520 7.834 -3.595 1.00 0.00 C ATOM 684 OG1 THR A 49 5.258 9.111 -4.190 1.00 0.00 O ATOM 685 CG2 THR A 49 6.001 6.862 -4.661 1.00 0.00 C ATOM 0 H THR A 49 4.225 9.154 -1.916 1.00 0.00 H new ATOM 0 HA THR A 49 3.503 7.068 -3.661 1.00 0.00 H new ATOM 0 HB THR A 49 6.301 7.937 -2.842 1.00 0.00 H new ATOM 0 HG1 THR A 49 5.358 9.813 -3.514 1.00 0.00 H new ATOM 0 HG21 THR A 49 6.899 7.257 -5.135 1.00 0.00 H new ATOM 0 HG22 THR A 49 6.227 5.900 -4.201 1.00 0.00 H new ATOM 0 HG23 THR A 49 5.222 6.731 -5.412 1.00 0.00 H new ATOM 693 N PHE A 50 3.734 5.035 -2.224 1.00 0.00 N ATOM 694 CA PHE A 50 3.951 3.772 -1.528 1.00 0.00 C ATOM 695 C PHE A 50 4.753 2.805 -2.394 1.00 0.00 C ATOM 696 O PHE A 50 4.784 2.929 -3.620 1.00 0.00 O ATOM 697 CB PHE A 50 2.611 3.140 -1.145 1.00 0.00 C ATOM 698 CG PHE A 50 1.861 2.568 -2.314 1.00 0.00 C ATOM 699 CD1 PHE A 50 1.177 3.398 -3.188 1.00 0.00 C ATOM 700 CD2 PHE A 50 1.842 1.201 -2.540 1.00 0.00 C ATOM 701 CE1 PHE A 50 0.486 2.874 -4.264 1.00 0.00 C ATOM 702 CE2 PHE A 50 1.153 0.672 -3.615 1.00 0.00 C ATOM 703 CZ PHE A 50 0.475 1.510 -4.479 1.00 0.00 C ATOM 0 H PHE A 50 2.879 5.070 -2.779 1.00 0.00 H new ATOM 0 HA PHE A 50 4.520 3.978 -0.622 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.787 2.350 -0.415 1.00 0.00 H new ATOM 0 HB3 PHE A 50 1.990 3.892 -0.658 1.00 0.00 H new ATOM 0 HD1 PHE A 50 1.184 4.466 -3.026 1.00 0.00 H new ATOM 0 HD2 PHE A 50 2.372 0.541 -1.868 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -0.045 3.531 -4.937 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.145 -0.395 -3.779 1.00 0.00 H new ATOM 0 HZ PHE A 50 -0.063 1.099 -5.321 1.00 0.00 H new ATOM 713 N LEU A 51 5.401 1.841 -1.750 1.00 0.00 N ATOM 714 CA LEU A 51 6.204 0.851 -2.460 1.00 0.00 C ATOM 715 C LEU A 51 6.318 -0.438 -1.652 1.00 0.00 C ATOM 716 O LEU A 51 6.586 -0.409 -0.451 1.00 0.00 O ATOM 717 CB LEU A 51 7.598 1.410 -2.749 1.00 0.00 C ATOM 718 CG LEU A 51 8.670 1.119 -1.698 1.00 0.00 C ATOM 719 CD1 LEU A 51 9.062 -0.350 -1.729 1.00 0.00 C ATOM 720 CD2 LEU A 51 9.888 2.003 -1.920 1.00 0.00 C ATOM 0 H LEU A 51 5.386 1.723 -0.737 1.00 0.00 H new ATOM 0 HA LEU A 51 5.707 0.624 -3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.937 1.010 -3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.517 2.491 -2.866 1.00 0.00 H new ATOM 0 HG LEU A 51 8.258 1.343 -0.714 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.826 -0.539 -0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.186 -0.965 -1.521 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.455 -0.601 -2.714 1.00 0.00 H new ATOM 0 HD21 LEU A 51 10.641 1.782 -1.163 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.302 1.811 -2.910 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.596 3.050 -1.846 1.00 0.00 H new ATOM 732 N VAL A 52 6.114 -1.569 -2.321 1.00 0.00 N ATOM 733 CA VAL A 52 6.198 -2.869 -1.667 1.00 0.00 C ATOM 734 C VAL A 52 7.488 -3.591 -2.041 1.00 0.00 C ATOM 735 O VAL A 52 7.975 -3.470 -3.165 1.00 0.00 O ATOM 736 CB VAL A 52 4.998 -3.761 -2.037 1.00 0.00 C ATOM 737 CG1 VAL A 52 5.004 -5.036 -1.207 1.00 0.00 C ATOM 738 CG2 VAL A 52 3.693 -3.002 -1.853 1.00 0.00 C ATOM 0 H VAL A 52 5.890 -1.611 -3.315 1.00 0.00 H new ATOM 0 HA VAL A 52 6.187 -2.684 -0.593 1.00 0.00 H new ATOM 0 HB VAL A 52 5.085 -4.039 -3.087 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.149 -5.653 -1.482 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.925 -5.588 -1.394 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.942 -4.782 -0.149 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.856 -3.648 -2.119 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.596 -2.692 -0.812 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.691 -2.121 -2.495 1.00 0.00 H new ATOM 748 N ARG A 53 8.036 -4.341 -1.091 1.00 0.00 N ATOM 749 CA ARG A 53 9.270 -5.082 -1.320 1.00 0.00 C ATOM 750 C ARG A 53 9.342 -6.311 -0.419 1.00 0.00 C ATOM 751 O ARG A 53 8.565 -6.445 0.526 1.00 0.00 O ATOM 752 CB ARG A 53 10.483 -4.183 -1.072 1.00 0.00 C ATOM 753 CG ARG A 53 10.569 -3.655 0.351 1.00 0.00 C ATOM 754 CD ARG A 53 11.289 -2.316 0.405 1.00 0.00 C ATOM 755 NE ARG A 53 11.068 -1.627 1.674 1.00 0.00 N ATOM 756 CZ ARG A 53 11.650 -1.982 2.814 1.00 0.00 C ATOM 757 NH1 ARG A 53 12.485 -3.011 2.844 1.00 0.00 N ATOM 758 NH2 ARG A 53 11.399 -1.305 3.927 1.00 0.00 N ATOM 0 H ARG A 53 7.645 -4.452 -0.155 1.00 0.00 H new ATOM 0 HA ARG A 53 9.278 -5.413 -2.358 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.391 -4.742 -1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 53 10.447 -3.340 -1.762 1.00 0.00 H new ATOM 0 HG2 ARG A 53 9.565 -3.547 0.761 1.00 0.00 H new ATOM 0 HG3 ARG A 53 11.093 -4.377 0.977 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.358 -2.473 0.259 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.944 -1.686 -0.415 1.00 0.00 H new ATOM 0 HE ARG A 53 10.432 -0.830 1.685 1.00 0.00 H new ATOM 0 HH11 ARG A 53 12.682 -3.533 1.990 1.00 0.00 H new ATOM 0 HH12 ARG A 53 12.930 -3.281 3.721 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.759 -0.511 3.908 1.00 0.00 H new ATOM 0 HH22 ARG A 53 11.846 -1.578 4.802 1.00 0.00 H new ATOM 772 N GLN A 54 10.279 -7.205 -0.718 1.00 0.00 N ATOM 773 CA GLN A 54 10.451 -8.423 0.064 1.00 0.00 C ATOM 774 C GLN A 54 11.553 -8.252 1.103 1.00 0.00 C ATOM 775 O GLN A 54 12.433 -7.404 0.955 1.00 0.00 O ATOM 776 CB GLN A 54 10.777 -9.602 -0.854 1.00 0.00 C ATOM 777 CG GLN A 54 10.401 -10.953 -0.266 1.00 0.00 C ATOM 778 CD GLN A 54 8.924 -11.261 -0.411 1.00 0.00 C ATOM 779 OE1 GLN A 54 8.265 -11.540 0.708 1.00 0.00 O flip ATOM 780 NE2 GLN A 54 8.380 -11.249 -1.515 1.00 0.00 N flip ATOM 0 H GLN A 54 10.931 -7.108 -1.497 1.00 0.00 H new ATOM 0 HA GLN A 54 9.515 -8.625 0.585 1.00 0.00 H new ATOM 0 HB2 GLN A 54 10.255 -9.469 -1.801 1.00 0.00 H new ATOM 0 HB3 GLN A 54 11.844 -9.596 -1.075 1.00 0.00 H new ATOM 0 HG2 GLN A 54 10.981 -11.734 -0.758 1.00 0.00 H new ATOM 0 HG3 GLN A 54 10.671 -10.973 0.790 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.924 -11.029 -2.349 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.385 -11.459 -1.596 1.00 0.00 H new ATOM 789 N ARG A 55 11.499 -9.062 2.155 1.00 0.00 N ATOM 790 CA ARG A 55 12.493 -8.999 3.220 1.00 0.00 C ATOM 791 C ARG A 55 13.804 -9.644 2.780 1.00 0.00 C ATOM 792 O ARG A 55 14.193 -10.695 3.290 1.00 0.00 O ATOM 793 CB ARG A 55 11.968 -9.692 4.479 1.00 0.00 C ATOM 794 CG ARG A 55 11.329 -8.741 5.477 1.00 0.00 C ATOM 795 CD ARG A 55 12.330 -7.716 5.988 1.00 0.00 C ATOM 796 NE ARG A 55 11.993 -7.243 7.328 1.00 0.00 N ATOM 797 CZ ARG A 55 12.338 -7.881 8.441 1.00 0.00 C ATOM 798 NH1 ARG A 55 13.027 -9.011 8.374 1.00 0.00 N ATOM 799 NH2 ARG A 55 11.995 -7.387 9.624 1.00 0.00 N ATOM 0 H ARG A 55 10.777 -9.770 2.293 1.00 0.00 H new ATOM 0 HA ARG A 55 12.682 -7.949 3.444 1.00 0.00 H new ATOM 0 HB2 ARG A 55 11.237 -10.447 4.190 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.791 -10.216 4.965 1.00 0.00 H new ATOM 0 HG2 ARG A 55 10.489 -8.229 5.007 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.927 -9.309 6.316 1.00 0.00 H new ATOM 0 HD2 ARG A 55 13.327 -8.157 5.999 1.00 0.00 H new ATOM 0 HD3 ARG A 55 12.364 -6.869 5.302 1.00 0.00 H new ATOM 0 HE ARG A 55 11.464 -6.375 7.414 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.294 -9.393 7.466 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.291 -9.499 9.230 1.00 0.00 H new ATOM 0 HH21 ARG A 55 11.466 -6.517 9.679 1.00 0.00 H new ATOM 0 HH22 ARG A 55 12.260 -7.878 10.478 1.00 0.00 H new ATOM 813 N VAL A 56 14.480 -9.009 1.829 1.00 0.00 N ATOM 814 CA VAL A 56 15.747 -9.520 1.320 1.00 0.00 C ATOM 815 C VAL A 56 15.799 -11.041 1.402 1.00 0.00 C ATOM 816 O VAL A 56 16.772 -11.615 1.893 1.00 0.00 O ATOM 817 CB VAL A 56 16.942 -8.934 2.096 1.00 0.00 C ATOM 818 CG1 VAL A 56 17.255 -7.527 1.611 1.00 0.00 C ATOM 819 CG2 VAL A 56 16.660 -8.941 3.591 1.00 0.00 C ATOM 0 H VAL A 56 14.171 -8.139 1.395 1.00 0.00 H new ATOM 0 HA VAL A 56 15.815 -9.213 0.276 1.00 0.00 H new ATOM 0 HB VAL A 56 17.816 -9.559 1.911 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.102 -7.129 2.170 1.00 0.00 H new ATOM 0 HG12 VAL A 56 17.502 -7.555 0.550 1.00 0.00 H new ATOM 0 HG13 VAL A 56 16.386 -6.887 1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 56 17.514 -8.524 4.124 1.00 0.00 H new ATOM 0 HG22 VAL A 56 15.775 -8.340 3.797 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.489 -9.965 3.924 1.00 0.00 H new ATOM 829 N LYS A 57 14.745 -11.691 0.919 1.00 0.00 N ATOM 830 CA LYS A 57 14.669 -13.147 0.936 1.00 0.00 C ATOM 831 C LYS A 57 13.455 -13.637 0.153 1.00 0.00 C ATOM 832 O LYS A 57 12.376 -13.050 0.231 1.00 0.00 O ATOM 833 CB LYS A 57 14.600 -13.658 2.377 1.00 0.00 C ATOM 834 CG LYS A 57 15.925 -14.186 2.899 1.00 0.00 C ATOM 835 CD LYS A 57 16.016 -15.697 2.763 1.00 0.00 C ATOM 836 CE LYS A 57 17.249 -16.247 3.463 1.00 0.00 C ATOM 837 NZ LYS A 57 17.627 -17.591 2.946 1.00 0.00 N ATOM 0 H LYS A 57 13.931 -11.232 0.511 1.00 0.00 H new ATOM 0 HA LYS A 57 15.568 -13.539 0.461 1.00 0.00 H new ATOM 0 HB2 LYS A 57 14.260 -12.850 3.024 1.00 0.00 H new ATOM 0 HB3 LYS A 57 13.854 -14.450 2.437 1.00 0.00 H new ATOM 0 HG2 LYS A 57 16.744 -13.721 2.351 1.00 0.00 H new ATOM 0 HG3 LYS A 57 16.042 -13.906 3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 57 15.122 -16.156 3.185 1.00 0.00 H new ATOM 0 HD3 LYS A 57 16.045 -15.967 1.707 1.00 0.00 H new ATOM 0 HE2 LYS A 57 18.082 -15.558 3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 57 17.060 -16.310 4.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 18.472 -17.931 3.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 16.842 -18.255 3.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 17.832 -17.526 1.928 1.00 0.00 H new ATOM 851 N ASP A 58 13.639 -14.717 -0.599 1.00 0.00 N ATOM 852 CA ASP A 58 12.558 -15.288 -1.394 1.00 0.00 C ATOM 853 C ASP A 58 11.288 -15.432 -0.561 1.00 0.00 C ATOM 854 O ASP A 58 11.211 -16.279 0.328 1.00 0.00 O ATOM 855 CB ASP A 58 12.973 -16.649 -1.954 1.00 0.00 C ATOM 856 CG ASP A 58 13.860 -17.423 -0.999 1.00 0.00 C ATOM 857 OD1 ASP A 58 15.062 -17.096 -0.907 1.00 0.00 O ATOM 858 OD2 ASP A 58 13.351 -18.355 -0.341 1.00 0.00 O ATOM 0 H ASP A 58 14.526 -15.214 -0.675 1.00 0.00 H new ATOM 0 HA ASP A 58 12.352 -14.610 -2.223 1.00 0.00 H new ATOM 0 HB2 ASP A 58 12.081 -17.236 -2.173 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.499 -16.505 -2.898 1.00 0.00 H new ATOM 863 N ALA A 59 10.296 -14.598 -0.854 1.00 0.00 N ATOM 864 CA ALA A 59 9.030 -14.633 -0.133 1.00 0.00 C ATOM 865 C ALA A 59 9.257 -14.637 1.375 1.00 0.00 C ATOM 866 O ALA A 59 8.483 -15.229 2.127 1.00 0.00 O ATOM 867 CB ALA A 59 8.219 -15.851 -0.550 1.00 0.00 C ATOM 0 H ALA A 59 10.345 -13.889 -1.586 1.00 0.00 H new ATOM 0 HA ALA A 59 8.470 -13.733 -0.387 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.276 -15.865 -0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.018 -15.805 -1.620 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.782 -16.757 -0.325 1.00 0.00 H new ATOM 873 N ALA A 60 10.323 -13.974 1.810 1.00 0.00 N ATOM 874 CA ALA A 60 10.651 -13.901 3.228 1.00 0.00 C ATOM 875 C ALA A 60 9.535 -13.222 4.015 1.00 0.00 C ATOM 876 O ALA A 60 8.914 -13.835 4.882 1.00 0.00 O ATOM 877 CB ALA A 60 11.966 -13.162 3.429 1.00 0.00 C ATOM 0 H ALA A 60 10.974 -13.480 1.200 1.00 0.00 H new ATOM 0 HA ALA A 60 10.758 -14.919 3.603 1.00 0.00 H new ATOM 0 HB1 ALA A 60 12.198 -13.115 4.493 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.764 -13.690 2.906 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.879 -12.151 3.032 1.00 0.00 H new ATOM 883 N GLU A 61 9.288 -11.952 3.707 1.00 0.00 N ATOM 884 CA GLU A 61 8.248 -11.190 4.387 1.00 0.00 C ATOM 885 C GLU A 61 8.016 -9.849 3.698 1.00 0.00 C ATOM 886 O GLU A 61 8.821 -8.926 3.825 1.00 0.00 O ATOM 887 CB GLU A 61 8.626 -10.964 5.853 1.00 0.00 C ATOM 888 CG GLU A 61 8.003 -9.717 6.457 1.00 0.00 C ATOM 889 CD GLU A 61 7.770 -9.845 7.950 1.00 0.00 C ATOM 890 OE1 GLU A 61 8.763 -9.830 8.707 1.00 0.00 O ATOM 891 OE2 GLU A 61 6.597 -9.962 8.360 1.00 0.00 O ATOM 0 H GLU A 61 9.794 -11.430 2.991 1.00 0.00 H new ATOM 0 HA GLU A 61 7.324 -11.766 4.342 1.00 0.00 H new ATOM 0 HB2 GLU A 61 8.319 -11.832 6.436 1.00 0.00 H new ATOM 0 HB3 GLU A 61 9.711 -10.893 5.933 1.00 0.00 H new ATOM 0 HG2 GLU A 61 8.652 -8.862 6.266 1.00 0.00 H new ATOM 0 HG3 GLU A 61 7.054 -9.513 5.961 1.00 0.00 H new ATOM 898 N PHE A 62 6.912 -9.750 2.966 1.00 0.00 N ATOM 899 CA PHE A 62 6.574 -8.522 2.254 1.00 0.00 C ATOM 900 C PHE A 62 6.411 -7.357 3.225 1.00 0.00 C ATOM 901 O PHE A 62 5.953 -7.535 4.353 1.00 0.00 O ATOM 902 CB PHE A 62 5.288 -8.713 1.448 1.00 0.00 C ATOM 903 CG PHE A 62 5.383 -9.799 0.414 1.00 0.00 C ATOM 904 CD1 PHE A 62 5.153 -11.121 0.757 1.00 0.00 C ATOM 905 CD2 PHE A 62 5.702 -9.497 -0.900 1.00 0.00 C ATOM 906 CE1 PHE A 62 5.240 -12.123 -0.191 1.00 0.00 C ATOM 907 CE2 PHE A 62 5.790 -10.494 -1.853 1.00 0.00 C ATOM 908 CZ PHE A 62 5.558 -11.808 -1.498 1.00 0.00 C ATOM 0 H PHE A 62 6.236 -10.505 2.850 1.00 0.00 H new ATOM 0 HA PHE A 62 7.392 -8.291 1.571 1.00 0.00 H new ATOM 0 HB2 PHE A 62 4.471 -8.944 2.132 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.035 -7.774 0.955 1.00 0.00 H new ATOM 0 HD1 PHE A 62 4.903 -11.372 1.777 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.884 -8.471 -1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 62 5.060 -13.150 0.089 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.040 -10.246 -2.874 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.625 -12.589 -2.241 1.00 0.00 H new ATOM 918 N ALA A 63 6.791 -6.164 2.779 1.00 0.00 N ATOM 919 CA ALA A 63 6.686 -4.970 3.607 1.00 0.00 C ATOM 920 C ALA A 63 6.311 -3.752 2.769 1.00 0.00 C ATOM 921 O ALA A 63 6.924 -3.486 1.735 1.00 0.00 O ATOM 922 CB ALA A 63 7.993 -4.723 4.345 1.00 0.00 C ATOM 0 H ALA A 63 7.174 -5.999 1.848 1.00 0.00 H new ATOM 0 HA ALA A 63 5.894 -5.133 4.338 1.00 0.00 H new ATOM 0 HB1 ALA A 63 7.900 -3.828 4.960 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.219 -5.579 4.982 1.00 0.00 H new ATOM 0 HB3 ALA A 63 8.798 -4.586 3.623 1.00 0.00 H new ATOM 928 N ILE A 64 5.301 -3.017 3.221 1.00 0.00 N ATOM 929 CA ILE A 64 4.845 -1.827 2.512 1.00 0.00 C ATOM 930 C ILE A 64 5.443 -0.563 3.120 1.00 0.00 C ATOM 931 O ILE A 64 5.262 -0.286 4.306 1.00 0.00 O ATOM 932 CB ILE A 64 3.309 -1.715 2.530 1.00 0.00 C ATOM 933 CG1 ILE A 64 2.682 -2.886 1.770 1.00 0.00 C ATOM 934 CG2 ILE A 64 2.868 -0.389 1.928 1.00 0.00 C ATOM 935 CD1 ILE A 64 1.282 -3.225 2.232 1.00 0.00 C ATOM 0 H ILE A 64 4.783 -3.224 4.075 1.00 0.00 H new ATOM 0 HA ILE A 64 5.182 -1.926 1.480 1.00 0.00 H new ATOM 0 HB ILE A 64 2.968 -1.753 3.565 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.657 -2.647 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.317 -3.765 1.885 1.00 0.00 H new ATOM 0 HG21 ILE A 64 1.780 -0.324 1.948 1.00 0.00 H new ATOM 0 HG22 ILE A 64 3.291 0.432 2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.217 -0.323 0.897 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.900 -4.064 1.650 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.303 -3.495 3.288 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.633 -2.360 2.092 1.00 0.00 H new ATOM 947 N SER A 65 6.155 0.202 2.299 1.00 0.00 N ATOM 948 CA SER A 65 6.781 1.437 2.755 1.00 0.00 C ATOM 949 C SER A 65 6.420 2.601 1.838 1.00 0.00 C ATOM 950 O SER A 65 6.650 2.547 0.629 1.00 0.00 O ATOM 951 CB SER A 65 8.301 1.272 2.814 1.00 0.00 C ATOM 952 OG SER A 65 8.658 0.057 3.450 1.00 0.00 O ATOM 0 H SER A 65 6.313 -0.012 1.314 1.00 0.00 H new ATOM 0 HA SER A 65 6.407 1.656 3.755 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.711 1.292 1.804 1.00 0.00 H new ATOM 0 HB3 SER A 65 8.740 2.111 3.353 1.00 0.00 H new ATOM 0 HG SER A 65 8.724 -0.656 2.780 1.00 0.00 H new ATOM 958 N ILE A 66 5.853 3.652 2.421 1.00 0.00 N ATOM 959 CA ILE A 66 5.461 4.830 1.656 1.00 0.00 C ATOM 960 C ILE A 66 6.034 6.101 2.273 1.00 0.00 C ATOM 961 O ILE A 66 6.548 6.085 3.392 1.00 0.00 O ATOM 962 CB ILE A 66 3.929 4.960 1.570 1.00 0.00 C ATOM 963 CG1 ILE A 66 3.410 5.886 2.672 1.00 0.00 C ATOM 964 CG2 ILE A 66 3.274 3.590 1.670 1.00 0.00 C ATOM 965 CD1 ILE A 66 3.719 5.395 4.069 1.00 0.00 C ATOM 0 H ILE A 66 5.655 3.712 3.420 1.00 0.00 H new ATOM 0 HA ILE A 66 5.864 4.703 0.651 1.00 0.00 H new ATOM 0 HB ILE A 66 3.671 5.395 0.605 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.846 6.876 2.539 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.331 5.996 2.565 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.191 3.699 1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 66 3.623 2.959 0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 66 3.538 3.129 2.622 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.322 6.100 4.799 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.260 4.418 4.221 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.799 5.312 4.195 1.00 0.00 H new ATOM 977 N LYS A 67 5.940 7.203 1.537 1.00 0.00 N ATOM 978 CA LYS A 67 6.446 8.486 2.011 1.00 0.00 C ATOM 979 C LYS A 67 5.383 9.226 2.817 1.00 0.00 C ATOM 980 O LYS A 67 4.323 9.572 2.295 1.00 0.00 O ATOM 981 CB LYS A 67 6.896 9.348 0.830 1.00 0.00 C ATOM 982 CG LYS A 67 7.620 10.618 1.244 1.00 0.00 C ATOM 983 CD LYS A 67 8.985 10.313 1.838 1.00 0.00 C ATOM 984 CE LYS A 67 9.468 11.443 2.735 1.00 0.00 C ATOM 985 NZ LYS A 67 9.662 12.709 1.976 1.00 0.00 N ATOM 0 H LYS A 67 5.518 7.234 0.609 1.00 0.00 H new ATOM 0 HA LYS A 67 7.301 8.294 2.659 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.552 8.758 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.024 9.615 0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.736 11.270 0.378 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.018 11.160 1.973 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.935 9.388 2.412 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.704 10.151 1.035 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.745 11.606 3.535 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.407 11.155 3.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.358 13.306 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.008 12.491 1.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.756 13.216 1.910 1.00 0.00 H new ATOM 999 N TYR A 68 5.673 9.465 4.091 1.00 0.00 N ATOM 1000 CA TYR A 68 4.741 10.163 4.969 1.00 0.00 C ATOM 1001 C TYR A 68 5.488 11.039 5.970 1.00 0.00 C ATOM 1002 O TYR A 68 6.538 10.657 6.484 1.00 0.00 O ATOM 1003 CB TYR A 68 3.859 9.159 5.713 1.00 0.00 C ATOM 1004 CG TYR A 68 2.575 9.756 6.242 1.00 0.00 C ATOM 1005 CD1 TYR A 68 2.523 10.332 7.506 1.00 0.00 C ATOM 1006 CD2 TYR A 68 1.414 9.744 5.480 1.00 0.00 C ATOM 1007 CE1 TYR A 68 1.352 10.879 7.994 1.00 0.00 C ATOM 1008 CE2 TYR A 68 0.239 10.289 5.959 1.00 0.00 C ATOM 1009 CZ TYR A 68 0.213 10.855 7.217 1.00 0.00 C ATOM 1010 OH TYR A 68 -0.956 11.398 7.698 1.00 0.00 O ATOM 0 H TYR A 68 6.546 9.186 4.539 1.00 0.00 H new ATOM 0 HA TYR A 68 4.111 10.803 4.352 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.617 8.334 5.043 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.424 8.738 6.545 1.00 0.00 H new ATOM 0 HD1 TYR A 68 3.413 10.352 8.117 1.00 0.00 H new ATOM 0 HD2 TYR A 68 1.430 9.301 4.495 1.00 0.00 H new ATOM 0 HE1 TYR A 68 1.329 11.323 8.978 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -0.654 10.272 5.352 1.00 0.00 H new ATOM 0 HH TYR A 68 -1.604 10.682 7.866 1.00 0.00 H new ATOM 1020 N ASN A 69 4.937 12.218 6.241 1.00 0.00 N ATOM 1021 CA ASN A 69 5.550 13.150 7.180 1.00 0.00 C ATOM 1022 C ASN A 69 7.022 13.373 6.844 1.00 0.00 C ATOM 1023 O ASN A 69 7.849 13.576 7.732 1.00 0.00 O ATOM 1024 CB ASN A 69 5.416 12.627 8.612 1.00 0.00 C ATOM 1025 CG ASN A 69 5.284 13.746 9.627 1.00 0.00 C ATOM 1026 OD1 ASN A 69 6.054 14.706 9.612 1.00 0.00 O ATOM 1027 ND2 ASN A 69 4.304 13.626 10.515 1.00 0.00 N ATOM 0 H ASN A 69 4.068 12.550 5.824 1.00 0.00 H new ATOM 0 HA ASN A 69 5.029 14.104 7.098 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.544 11.976 8.678 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.287 12.019 8.857 1.00 0.00 H new ATOM 0 HD21 ASN A 69 4.166 14.348 11.223 1.00 0.00 H new ATOM 0 HD22 ASN A 69 3.689 12.812 10.489 1.00 0.00 H new ATOM 1034 N VAL A 70 7.341 13.333 5.554 1.00 0.00 N ATOM 1035 CA VAL A 70 8.712 13.532 5.099 1.00 0.00 C ATOM 1036 C VAL A 70 9.620 12.407 5.582 1.00 0.00 C ATOM 1037 O VAL A 70 10.830 12.587 5.714 1.00 0.00 O ATOM 1038 CB VAL A 70 9.276 14.879 5.589 1.00 0.00 C ATOM 1039 CG1 VAL A 70 8.163 15.908 5.720 1.00 0.00 C ATOM 1040 CG2 VAL A 70 10.006 14.700 6.912 1.00 0.00 C ATOM 0 H VAL A 70 6.669 13.165 4.806 1.00 0.00 H new ATOM 0 HA VAL A 70 8.687 13.532 4.009 1.00 0.00 H new ATOM 0 HB VAL A 70 9.991 15.244 4.852 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.580 16.853 6.067 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.688 16.056 4.750 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.422 15.553 6.437 1.00 0.00 H new ATOM 0 HG21 VAL A 70 10.398 15.661 7.244 1.00 0.00 H new ATOM 0 HG22 VAL A 70 9.314 14.313 7.660 1.00 0.00 H new ATOM 0 HG23 VAL A 70 10.829 13.998 6.781 1.00 0.00 H new ATOM 1050 N GLU A 71 9.027 11.247 5.844 1.00 0.00 N ATOM 1051 CA GLU A 71 9.783 10.092 6.313 1.00 0.00 C ATOM 1052 C GLU A 71 9.257 8.805 5.685 1.00 0.00 C ATOM 1053 O GLU A 71 8.047 8.595 5.594 1.00 0.00 O ATOM 1054 CB GLU A 71 9.713 9.993 7.839 1.00 0.00 C ATOM 1055 CG GLU A 71 8.405 10.501 8.422 1.00 0.00 C ATOM 1056 CD GLU A 71 8.466 10.674 9.927 1.00 0.00 C ATOM 1057 OE1 GLU A 71 9.287 9.988 10.571 1.00 0.00 O ATOM 1058 OE2 GLU A 71 7.691 11.496 10.461 1.00 0.00 O ATOM 0 H GLU A 71 8.026 11.082 5.740 1.00 0.00 H new ATOM 0 HA GLU A 71 10.822 10.225 6.012 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.853 8.953 8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 71 10.538 10.560 8.270 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.152 11.455 7.960 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.605 9.804 8.172 1.00 0.00 H new ATOM 1065 N VAL A 72 10.174 7.946 5.252 1.00 0.00 N ATOM 1066 CA VAL A 72 9.804 6.679 4.632 1.00 0.00 C ATOM 1067 C VAL A 72 9.464 5.631 5.686 1.00 0.00 C ATOM 1068 O VAL A 72 10.352 5.016 6.276 1.00 0.00 O ATOM 1069 CB VAL A 72 10.935 6.141 3.736 1.00 0.00 C ATOM 1070 CG1 VAL A 72 10.555 4.790 3.150 1.00 0.00 C ATOM 1071 CG2 VAL A 72 11.259 7.137 2.633 1.00 0.00 C ATOM 0 H VAL A 72 11.179 8.104 5.319 1.00 0.00 H new ATOM 0 HA VAL A 72 8.925 6.872 4.018 1.00 0.00 H new ATOM 0 HB VAL A 72 11.827 6.007 4.348 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.366 4.426 2.520 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.376 4.080 3.958 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.650 4.894 2.552 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.060 6.741 2.009 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.372 7.304 2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.577 8.080 3.077 1.00 0.00 H new ATOM 1081 N LYS A 73 8.170 5.432 5.918 1.00 0.00 N ATOM 1082 CA LYS A 73 7.710 4.456 6.899 1.00 0.00 C ATOM 1083 C LYS A 73 7.677 3.054 6.299 1.00 0.00 C ATOM 1084 O LYS A 73 7.597 2.924 5.078 1.00 0.00 O ATOM 1085 CB LYS A 73 6.319 4.836 7.412 1.00 0.00 C ATOM 1086 CG LYS A 73 6.165 6.317 7.713 1.00 0.00 C ATOM 1087 CD LYS A 73 6.921 6.712 8.970 1.00 0.00 C ATOM 1088 CE LYS A 73 6.198 7.811 9.733 1.00 0.00 C ATOM 1089 NZ LYS A 73 6.770 8.011 11.094 1.00 0.00 N ATOM 0 H LYS A 73 7.422 5.934 5.440 1.00 0.00 H new ATOM 0 HA LYS A 73 8.412 4.458 7.733 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.575 4.545 6.670 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.106 4.266 8.316 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.531 6.901 6.869 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.108 6.557 7.832 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.041 5.840 9.613 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.922 7.051 8.703 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.260 8.744 9.172 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.141 7.560 9.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.208 8.720 11.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.750 7.111 11.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.753 8.342 11.012 1.00 0.00 H new ATOM 1103 N HIS A 74 7.737 2.048 7.159 1.00 0.00 N ATOM 1104 CA HIS A 74 7.712 0.670 6.700 1.00 0.00 C ATOM 1105 C HIS A 74 6.628 -0.102 7.454 1.00 0.00 C ATOM 1106 O HIS A 74 6.390 0.103 8.645 1.00 0.00 O ATOM 1107 CB HIS A 74 9.095 0.028 6.829 1.00 0.00 C ATOM 1108 CG HIS A 74 10.217 0.870 6.269 1.00 0.00 C ATOM 1109 ND1 HIS A 74 10.489 0.950 4.914 1.00 0.00 N ATOM 1110 CD2 HIS A 74 11.131 1.667 6.893 1.00 0.00 C ATOM 1111 CE1 HIS A 74 11.523 1.760 4.743 1.00 0.00 C ATOM 1112 NE2 HIS A 74 11.920 2.203 5.970 1.00 0.00 N ATOM 0 H HIS A 74 7.803 2.160 8.171 1.00 0.00 H new ATOM 0 HA HIS A 74 7.460 0.641 5.640 1.00 0.00 H new ATOM 0 HB2 HIS A 74 9.295 -0.172 7.882 1.00 0.00 H new ATOM 0 HB3 HIS A 74 9.087 -0.935 6.318 1.00 0.00 H new ATOM 0 HD1 HIS A 74 9.980 0.467 4.173 1.00 0.00 H new ATOM 0 HD2 HIS A 74 11.201 1.834 7.958 1.00 0.00 H new ATOM 0 HE1 HIS A 74 11.973 2.023 3.797 1.00 0.00 H new ATOM 1120 N ILE A 75 5.971 -1.002 6.729 1.00 0.00 N ATOM 1121 CA ILE A 75 4.910 -1.819 7.304 1.00 0.00 C ATOM 1122 C ILE A 75 5.088 -3.288 6.939 1.00 0.00 C ATOM 1123 O ILE A 75 5.180 -3.641 5.763 1.00 0.00 O ATOM 1124 CB ILE A 75 3.521 -1.349 6.834 1.00 0.00 C ATOM 1125 CG1 ILE A 75 3.318 0.130 7.168 1.00 0.00 C ATOM 1126 CG2 ILE A 75 2.431 -2.196 7.474 1.00 0.00 C ATOM 1127 CD1 ILE A 75 1.886 0.593 7.016 1.00 0.00 C ATOM 0 H ILE A 75 6.155 -1.183 5.742 1.00 0.00 H new ATOM 0 HA ILE A 75 4.976 -1.706 8.386 1.00 0.00 H new ATOM 0 HB ILE A 75 3.460 -1.469 5.752 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.643 0.311 8.193 1.00 0.00 H new ATOM 0 HG13 ILE A 75 3.956 0.731 6.521 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.455 -1.852 7.132 1.00 0.00 H new ATOM 0 HG22 ILE A 75 2.568 -3.240 7.190 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.489 -2.104 8.559 1.00 0.00 H new ATOM 0 HD11 ILE A 75 1.817 1.651 7.269 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.563 0.445 5.986 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.245 0.018 7.684 1.00 0.00 H new ATOM 1139 N LYS A 76 5.135 -4.144 7.955 1.00 0.00 N ATOM 1140 CA LYS A 76 5.299 -5.577 7.742 1.00 0.00 C ATOM 1141 C LYS A 76 4.013 -6.198 7.208 1.00 0.00 C ATOM 1142 O LYS A 76 2.914 -5.745 7.529 1.00 0.00 O ATOM 1143 CB LYS A 76 5.706 -6.264 9.048 1.00 0.00 C ATOM 1144 CG LYS A 76 4.526 -6.749 9.873 1.00 0.00 C ATOM 1145 CD LYS A 76 3.962 -5.640 10.745 1.00 0.00 C ATOM 1146 CE LYS A 76 3.363 -6.192 12.030 1.00 0.00 C ATOM 1147 NZ LYS A 76 4.398 -6.394 13.082 1.00 0.00 N ATOM 0 H LYS A 76 5.062 -3.869 8.935 1.00 0.00 H new ATOM 0 HA LYS A 76 6.086 -5.722 7.002 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.350 -7.112 8.817 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.296 -5.569 9.646 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.746 -7.123 9.210 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.838 -7.584 10.501 1.00 0.00 H new ATOM 0 HD2 LYS A 76 4.752 -4.928 10.987 1.00 0.00 H new ATOM 0 HD3 LYS A 76 3.198 -5.093 10.192 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.599 -5.507 12.398 1.00 0.00 H new ATOM 0 HE3 LYS A 76 2.867 -7.140 11.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 3.950 -6.771 13.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 5.113 -7.067 12.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 4.854 -5.485 13.299 1.00 0.00 H new ATOM 1161 N ILE A 77 4.158 -7.237 6.392 1.00 0.00 N ATOM 1162 CA ILE A 77 3.007 -7.922 5.816 1.00 0.00 C ATOM 1163 C ILE A 77 2.925 -9.365 6.302 1.00 0.00 C ATOM 1164 O ILE A 77 3.737 -10.206 5.918 1.00 0.00 O ATOM 1165 CB ILE A 77 3.059 -7.912 4.277 1.00 0.00 C ATOM 1166 CG1 ILE A 77 3.046 -6.475 3.753 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.893 -8.702 3.703 1.00 0.00 C ATOM 1168 CD1 ILE A 77 3.250 -6.375 2.258 1.00 0.00 C ATOM 0 H ILE A 77 5.061 -7.623 6.115 1.00 0.00 H new ATOM 0 HA ILE A 77 2.120 -7.380 6.145 1.00 0.00 H new ATOM 0 HB ILE A 77 3.987 -8.386 3.957 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.095 -6.011 4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.827 -5.906 4.257 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.943 -8.686 2.614 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.944 -9.733 4.053 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.954 -8.254 4.029 1.00 0.00 H new ATOM 0 HD11 ILE A 77 3.229 -5.328 1.957 1.00 0.00 H new ATOM 0 HD12 ILE A 77 4.214 -6.810 1.992 1.00 0.00 H new ATOM 0 HD13 ILE A 77 2.454 -6.916 1.745 1.00 0.00 H new ATOM 1180 N MET A 78 1.939 -9.643 7.148 1.00 0.00 N ATOM 1181 CA MET A 78 1.749 -10.986 7.685 1.00 0.00 C ATOM 1182 C MET A 78 1.017 -11.873 6.683 1.00 0.00 C ATOM 1183 O MET A 78 0.059 -11.442 6.039 1.00 0.00 O ATOM 1184 CB MET A 78 0.968 -10.928 8.998 1.00 0.00 C ATOM 1185 CG MET A 78 1.393 -9.786 9.908 1.00 0.00 C ATOM 1186 SD MET A 78 1.156 -10.165 11.655 1.00 0.00 S ATOM 1187 CE MET A 78 -0.064 -8.934 12.106 1.00 0.00 C ATOM 0 H MET A 78 1.259 -8.957 7.477 1.00 0.00 H new ATOM 0 HA MET A 78 2.732 -11.417 7.875 1.00 0.00 H new ATOM 0 HB2 MET A 78 -0.094 -10.828 8.775 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.095 -11.871 9.529 1.00 0.00 H new ATOM 0 HG2 MET A 78 2.443 -9.556 9.729 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.823 -8.892 9.653 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.315 -9.040 13.162 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.341 -7.938 11.927 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.962 -9.074 11.504 1.00 0.00 H new ATOM 1197 N THR A 79 1.473 -13.115 6.554 1.00 0.00 N ATOM 1198 CA THR A 79 0.862 -14.062 5.630 1.00 0.00 C ATOM 1199 C THR A 79 0.315 -15.278 6.370 1.00 0.00 C ATOM 1200 O THR A 79 0.958 -15.805 7.277 1.00 0.00 O ATOM 1201 CB THR A 79 1.868 -14.534 4.563 1.00 0.00 C ATOM 1202 OG1 THR A 79 3.173 -14.657 5.140 1.00 0.00 O ATOM 1203 CG2 THR A 79 1.914 -13.561 3.395 1.00 0.00 C ATOM 0 H THR A 79 2.264 -13.489 7.078 1.00 0.00 H new ATOM 0 HA THR A 79 0.041 -13.540 5.139 1.00 0.00 H new ATOM 0 HB THR A 79 1.542 -15.506 4.193 1.00 0.00 H new ATOM 0 HG1 THR A 79 3.806 -14.959 4.456 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.631 -13.915 2.654 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.926 -13.492 2.940 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.218 -12.577 3.753 1.00 0.00 H new ATOM 1211 N ALA A 80 -0.875 -15.718 5.976 1.00 0.00 N ATOM 1212 CA ALA A 80 -1.507 -16.874 6.600 1.00 0.00 C ATOM 1213 C ALA A 80 -2.527 -17.514 5.665 1.00 0.00 C ATOM 1214 O ALA A 80 -3.412 -16.837 5.141 1.00 0.00 O ATOM 1215 CB ALA A 80 -2.168 -16.470 7.910 1.00 0.00 C ATOM 0 H ALA A 80 -1.421 -15.292 5.227 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.733 -17.612 6.809 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.636 -17.343 8.366 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -1.416 -16.066 8.588 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.926 -15.711 7.716 1.00 0.00 H new ATOM 1221 N GLU A 81 -2.398 -18.821 5.460 1.00 0.00 N ATOM 1222 CA GLU A 81 -3.309 -19.550 4.586 1.00 0.00 C ATOM 1223 C GLU A 81 -3.176 -19.074 3.142 1.00 0.00 C ATOM 1224 O GLU A 81 -4.109 -19.192 2.350 1.00 0.00 O ATOM 1225 CB GLU A 81 -4.753 -19.378 5.060 1.00 0.00 C ATOM 1226 CG GLU A 81 -4.912 -19.451 6.570 1.00 0.00 C ATOM 1227 CD GLU A 81 -6.364 -19.511 7.002 1.00 0.00 C ATOM 1228 OE1 GLU A 81 -7.055 -20.480 6.624 1.00 0.00 O ATOM 1229 OE2 GLU A 81 -6.809 -18.590 7.717 1.00 0.00 O ATOM 0 H GLU A 81 -1.672 -19.396 5.887 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.044 -20.606 4.628 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.129 -18.417 4.710 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.371 -20.149 4.600 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -4.389 -20.331 6.944 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.438 -18.581 7.024 1.00 0.00 H new ATOM 1236 N GLY A 82 -2.007 -18.536 2.808 1.00 0.00 N ATOM 1237 CA GLY A 82 -1.772 -18.050 1.461 1.00 0.00 C ATOM 1238 C GLY A 82 -2.284 -16.638 1.257 1.00 0.00 C ATOM 1239 O GLY A 82 -2.267 -16.118 0.140 1.00 0.00 O ATOM 0 H GLY A 82 -1.219 -18.428 3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -0.703 -18.080 1.248 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.258 -18.716 0.748 1.00 0.00 H new ATOM 1243 N LEU A 83 -2.743 -16.014 2.337 1.00 0.00 N ATOM 1244 CA LEU A 83 -3.264 -14.654 2.272 1.00 0.00 C ATOM 1245 C LEU A 83 -2.215 -13.646 2.729 1.00 0.00 C ATOM 1246 O LEU A 83 -1.247 -14.004 3.401 1.00 0.00 O ATOM 1247 CB LEU A 83 -4.521 -14.526 3.134 1.00 0.00 C ATOM 1248 CG LEU A 83 -5.656 -15.500 2.815 1.00 0.00 C ATOM 1249 CD1 LEU A 83 -6.465 -15.805 4.066 1.00 0.00 C ATOM 1250 CD2 LEU A 83 -6.552 -14.934 1.723 1.00 0.00 C ATOM 0 H LEU A 83 -2.765 -16.429 3.268 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.519 -14.439 1.234 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.237 -14.660 4.178 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -4.903 -13.510 3.036 1.00 0.00 H new ATOM 0 HG LEU A 83 -5.220 -16.431 2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.268 -16.500 3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.816 -16.253 4.819 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.891 -14.882 4.458 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -7.354 -15.640 1.508 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.980 -13.989 2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.964 -14.767 0.820 1.00 0.00 H new ATOM 1262 N TYR A 84 -2.415 -12.384 2.363 1.00 0.00 N ATOM 1263 CA TYR A 84 -1.485 -11.324 2.736 1.00 0.00 C ATOM 1264 C TYR A 84 -2.213 -10.187 3.447 1.00 0.00 C ATOM 1265 O TYR A 84 -3.174 -9.625 2.921 1.00 0.00 O ATOM 1266 CB TYR A 84 -0.767 -10.788 1.497 1.00 0.00 C ATOM 1267 CG TYR A 84 -0.006 -11.848 0.732 1.00 0.00 C ATOM 1268 CD1 TYR A 84 -0.640 -12.634 -0.222 1.00 0.00 C ATOM 1269 CD2 TYR A 84 1.347 -12.065 0.966 1.00 0.00 C ATOM 1270 CE1 TYR A 84 0.051 -13.604 -0.923 1.00 0.00 C ATOM 1271 CE2 TYR A 84 2.046 -13.031 0.269 1.00 0.00 C ATOM 1272 CZ TYR A 84 1.394 -13.798 -0.674 1.00 0.00 C ATOM 1273 OH TYR A 84 2.086 -14.763 -1.369 1.00 0.00 O ATOM 0 H TYR A 84 -3.212 -12.071 1.809 1.00 0.00 H new ATOM 0 HA TYR A 84 -0.749 -11.745 3.421 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.499 -10.328 0.833 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.074 -10.003 1.800 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.691 -12.484 -0.419 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.860 -11.468 1.705 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.457 -14.207 -1.661 1.00 0.00 H new ATOM 0 HE2 TYR A 84 3.098 -13.185 0.461 1.00 0.00 H new ATOM 0 HH TYR A 84 3.021 -14.770 -1.076 1.00 0.00 H new ATOM 1283 N ARG A 85 -1.747 -9.854 4.646 1.00 0.00 N ATOM 1284 CA ARG A 85 -2.352 -8.785 5.431 1.00 0.00 C ATOM 1285 C ARG A 85 -1.402 -8.308 6.525 1.00 0.00 C ATOM 1286 O ARG A 85 -0.943 -9.099 7.350 1.00 0.00 O ATOM 1287 CB ARG A 85 -3.666 -9.261 6.053 1.00 0.00 C ATOM 1288 CG ARG A 85 -3.611 -10.687 6.576 1.00 0.00 C ATOM 1289 CD ARG A 85 -4.802 -11.001 7.466 1.00 0.00 C ATOM 1290 NE ARG A 85 -4.717 -12.340 8.043 1.00 0.00 N ATOM 1291 CZ ARG A 85 -3.811 -12.694 8.948 1.00 0.00 C ATOM 1292 NH1 ARG A 85 -2.919 -11.813 9.378 1.00 0.00 N ATOM 1293 NH2 ARG A 85 -3.797 -13.932 9.426 1.00 0.00 N ATOM 0 H ARG A 85 -0.952 -10.309 5.095 1.00 0.00 H new ATOM 0 HA ARG A 85 -2.556 -7.949 4.762 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -3.934 -8.593 6.872 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.459 -9.186 5.308 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -3.589 -11.383 5.737 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.688 -10.835 7.137 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -4.860 -10.264 8.267 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -5.721 -10.914 6.886 1.00 0.00 H new ATOM 0 HE ARG A 85 -5.390 -13.042 7.734 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -2.927 -10.860 9.014 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -2.225 -12.088 10.073 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.482 -14.613 9.099 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -3.101 -14.203 10.121 1.00 0.00 H new ATOM 1307 N ILE A 86 -1.111 -7.012 6.526 1.00 0.00 N ATOM 1308 CA ILE A 86 -0.216 -6.431 7.519 1.00 0.00 C ATOM 1309 C ILE A 86 -0.786 -6.577 8.925 1.00 0.00 C ATOM 1310 O ILE A 86 -0.054 -6.515 9.914 1.00 0.00 O ATOM 1311 CB ILE A 86 0.047 -4.940 7.236 1.00 0.00 C ATOM 1312 CG1 ILE A 86 -1.265 -4.154 7.265 1.00 0.00 C ATOM 1313 CG2 ILE A 86 0.743 -4.770 5.893 1.00 0.00 C ATOM 1314 CD1 ILE A 86 -1.078 -2.660 7.122 1.00 0.00 C ATOM 0 H ILE A 86 -1.482 -6.344 5.850 1.00 0.00 H new ATOM 0 HA ILE A 86 0.725 -6.977 7.453 1.00 0.00 H new ATOM 0 HB ILE A 86 0.701 -4.548 8.014 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.910 -4.510 6.462 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.781 -4.359 8.203 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.922 -3.711 5.707 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.694 -5.302 5.906 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.112 -5.175 5.102 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.050 -2.167 7.151 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.459 -2.291 7.940 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.590 -2.444 6.172 1.00 0.00 H new ATOM 1326 N THR A 87 -2.098 -6.774 9.009 1.00 0.00 N ATOM 1327 CA THR A 87 -2.768 -6.930 10.294 1.00 0.00 C ATOM 1328 C THR A 87 -3.787 -8.063 10.249 1.00 0.00 C ATOM 1329 O THR A 87 -4.331 -8.378 9.191 1.00 0.00 O ATOM 1330 CB THR A 87 -3.479 -5.631 10.718 1.00 0.00 C ATOM 1331 OG1 THR A 87 -4.139 -5.822 11.974 1.00 0.00 O ATOM 1332 CG2 THR A 87 -4.491 -5.200 9.668 1.00 0.00 C ATOM 0 H THR A 87 -2.718 -6.829 8.201 1.00 0.00 H new ATOM 0 HA THR A 87 -1.996 -7.168 11.026 1.00 0.00 H new ATOM 0 HB THR A 87 -2.728 -4.848 10.818 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.587 -4.991 12.238 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.980 -4.281 9.990 1.00 0.00 H new ATOM 0 HG22 THR A 87 -3.981 -5.027 8.720 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.238 -5.983 9.540 1.00 0.00 H new ATOM 1340 N GLU A 88 -4.040 -8.671 11.403 1.00 0.00 N ATOM 1341 CA GLU A 88 -4.995 -9.769 11.494 1.00 0.00 C ATOM 1342 C GLU A 88 -6.424 -9.242 11.581 1.00 0.00 C ATOM 1343 O GLU A 88 -7.219 -9.700 12.402 1.00 0.00 O ATOM 1344 CB GLU A 88 -4.687 -10.643 12.712 1.00 0.00 C ATOM 1345 CG GLU A 88 -4.785 -9.900 14.034 1.00 0.00 C ATOM 1346 CD GLU A 88 -4.241 -10.706 15.198 1.00 0.00 C ATOM 1347 OE1 GLU A 88 -3.019 -10.965 15.220 1.00 0.00 O ATOM 1348 OE2 GLU A 88 -5.037 -11.079 16.085 1.00 0.00 O ATOM 0 H GLU A 88 -3.597 -8.422 12.288 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.903 -10.372 10.591 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.377 -11.487 12.727 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -3.683 -11.054 12.609 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.237 -8.961 13.960 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.827 -9.647 14.228 1.00 0.00 H new ATOM 1355 N LYS A 89 -6.745 -8.274 10.728 1.00 0.00 N ATOM 1356 CA LYS A 89 -8.077 -7.683 10.707 1.00 0.00 C ATOM 1357 C LYS A 89 -8.804 -8.028 9.411 1.00 0.00 C ATOM 1358 O LYS A 89 -10.017 -8.241 9.404 1.00 0.00 O ATOM 1359 CB LYS A 89 -7.987 -6.164 10.864 1.00 0.00 C ATOM 1360 CG LYS A 89 -7.698 -5.716 12.286 1.00 0.00 C ATOM 1361 CD LYS A 89 -8.980 -5.463 13.062 1.00 0.00 C ATOM 1362 CE LYS A 89 -9.483 -4.042 12.859 1.00 0.00 C ATOM 1363 NZ LYS A 89 -10.914 -3.899 13.247 1.00 0.00 N ATOM 0 H LYS A 89 -6.100 -7.883 10.042 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.643 -8.095 11.542 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -7.205 -5.785 10.206 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -8.925 -5.717 10.535 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -7.107 -6.477 12.795 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -7.097 -4.807 12.267 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -9.745 -6.170 12.743 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.805 -5.640 14.123 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -8.876 -3.354 13.449 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -9.360 -3.759 11.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -11.219 -2.916 13.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -11.496 -4.536 12.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -11.028 -4.144 14.251 1.00 0.00 H new ATOM 1377 N LYS A 90 -8.056 -8.083 8.314 1.00 0.00 N ATOM 1378 CA LYS A 90 -8.627 -8.405 7.012 1.00 0.00 C ATOM 1379 C LYS A 90 -7.569 -8.991 6.083 1.00 0.00 C ATOM 1380 O LYS A 90 -6.559 -8.349 5.795 1.00 0.00 O ATOM 1381 CB LYS A 90 -9.242 -7.155 6.379 1.00 0.00 C ATOM 1382 CG LYS A 90 -9.682 -7.356 4.939 1.00 0.00 C ATOM 1383 CD LYS A 90 -11.105 -7.883 4.859 1.00 0.00 C ATOM 1384 CE LYS A 90 -11.800 -7.421 3.588 1.00 0.00 C ATOM 1385 NZ LYS A 90 -13.075 -8.153 3.355 1.00 0.00 N ATOM 0 H LYS A 90 -7.051 -7.908 8.301 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.408 -9.151 7.160 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.101 -6.843 6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.516 -6.343 6.418 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.612 -6.411 4.401 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.006 -8.054 4.445 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.093 -8.972 4.893 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.669 -7.543 5.727 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.002 -6.352 3.653 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.136 -7.569 2.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.518 -7.809 2.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -12.880 -9.171 3.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.719 -7.991 4.155 1.00 0.00 H new ATOM 1399 N ALA A 91 -7.808 -10.212 5.616 1.00 0.00 N ATOM 1400 CA ALA A 91 -6.877 -10.881 4.717 1.00 0.00 C ATOM 1401 C ALA A 91 -7.383 -10.850 3.279 1.00 0.00 C ATOM 1402 O ALA A 91 -8.589 -10.803 3.036 1.00 0.00 O ATOM 1403 CB ALA A 91 -6.649 -12.317 5.166 1.00 0.00 C ATOM 0 H ALA A 91 -8.639 -10.758 5.846 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.929 -10.345 4.753 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -5.951 -12.805 4.485 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.235 -12.322 6.174 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.597 -12.855 5.161 1.00 0.00 H new ATOM 1409 N PHE A 92 -6.455 -10.874 2.328 1.00 0.00 N ATOM 1410 CA PHE A 92 -6.807 -10.846 0.914 1.00 0.00 C ATOM 1411 C PHE A 92 -6.078 -11.947 0.149 1.00 0.00 C ATOM 1412 O PHE A 92 -5.063 -12.469 0.610 1.00 0.00 O ATOM 1413 CB PHE A 92 -6.471 -9.482 0.309 1.00 0.00 C ATOM 1414 CG PHE A 92 -7.116 -8.332 1.029 1.00 0.00 C ATOM 1415 CD1 PHE A 92 -6.698 -7.971 2.300 1.00 0.00 C ATOM 1416 CD2 PHE A 92 -8.140 -7.612 0.434 1.00 0.00 C ATOM 1417 CE1 PHE A 92 -7.291 -6.914 2.964 1.00 0.00 C ATOM 1418 CE2 PHE A 92 -8.735 -6.553 1.094 1.00 0.00 C ATOM 1419 CZ PHE A 92 -8.310 -6.203 2.360 1.00 0.00 C ATOM 0 H PHE A 92 -5.452 -10.913 2.512 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.880 -11.019 0.830 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.390 -9.346 0.318 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.785 -9.469 -0.735 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.900 -8.522 2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.477 -7.881 -0.556 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.958 -6.644 3.955 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.532 -6.000 0.619 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.773 -5.375 2.877 1.00 0.00 H new ATOM 1429 N ARG A 93 -6.604 -12.296 -1.020 1.00 0.00 N ATOM 1430 CA ARG A 93 -6.005 -13.335 -1.848 1.00 0.00 C ATOM 1431 C ARG A 93 -4.553 -13.001 -2.175 1.00 0.00 C ATOM 1432 O ARG A 93 -3.684 -13.872 -2.155 1.00 0.00 O ATOM 1433 CB ARG A 93 -6.803 -13.510 -3.141 1.00 0.00 C ATOM 1434 CG ARG A 93 -8.282 -13.775 -2.913 1.00 0.00 C ATOM 1435 CD ARG A 93 -8.570 -15.263 -2.794 1.00 0.00 C ATOM 1436 NE ARG A 93 -8.396 -15.958 -4.066 1.00 0.00 N ATOM 1437 CZ ARG A 93 -9.283 -15.914 -5.055 1.00 0.00 C ATOM 1438 NH1 ARG A 93 -10.399 -15.212 -4.918 1.00 0.00 N ATOM 1439 NH2 ARG A 93 -9.053 -16.574 -6.183 1.00 0.00 N ATOM 0 H ARG A 93 -7.444 -11.874 -1.415 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.027 -14.269 -1.286 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.693 -12.613 -3.750 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.378 -14.336 -3.711 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.608 -13.267 -2.006 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -8.859 -13.357 -3.738 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.908 -15.702 -2.048 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.590 -15.407 -2.439 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.548 -16.507 -4.203 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -10.579 -14.704 -4.052 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -11.078 -15.180 -5.679 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -8.195 -17.115 -6.291 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.734 -16.540 -6.942 1.00 0.00 H new ATOM 1453 N GLY A 94 -4.297 -11.731 -2.477 1.00 0.00 N ATOM 1454 CA GLY A 94 -2.949 -11.304 -2.805 1.00 0.00 C ATOM 1455 C GLY A 94 -2.721 -9.834 -2.515 1.00 0.00 C ATOM 1456 O GLY A 94 -3.644 -9.120 -2.120 1.00 0.00 O ATOM 0 H GLY A 94 -4.999 -10.991 -2.500 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -2.234 -11.899 -2.236 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.756 -11.497 -3.860 1.00 0.00 H new ATOM 1460 N LEU A 95 -1.488 -9.379 -2.710 1.00 0.00 N ATOM 1461 CA LEU A 95 -1.139 -7.984 -2.465 1.00 0.00 C ATOM 1462 C LEU A 95 -2.068 -7.048 -3.232 1.00 0.00 C ATOM 1463 O LEU A 95 -2.761 -6.220 -2.640 1.00 0.00 O ATOM 1464 CB LEU A 95 0.313 -7.722 -2.867 1.00 0.00 C ATOM 1465 CG LEU A 95 1.373 -8.078 -1.824 1.00 0.00 C ATOM 1466 CD1 LEU A 95 1.534 -6.948 -0.819 1.00 0.00 C ATOM 1467 CD2 LEU A 95 1.011 -9.376 -1.117 1.00 0.00 C ATOM 0 H LEU A 95 -0.713 -9.956 -3.037 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.255 -7.788 -1.399 1.00 0.00 H new ATOM 0 HB2 LEU A 95 0.524 -8.284 -3.777 1.00 0.00 H new ATOM 0 HB3 LEU A 95 0.416 -6.665 -3.114 1.00 0.00 H new ATOM 0 HG LEU A 95 2.325 -8.220 -2.335 1.00 0.00 H new ATOM 0 HD11 LEU A 95 2.292 -7.219 -0.085 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.840 -6.040 -1.338 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.585 -6.773 -0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 95 1.776 -9.614 -0.378 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.048 -9.263 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.948 -10.183 -1.847 1.00 0.00 H new ATOM 1479 N THR A 96 -2.079 -7.186 -4.554 1.00 0.00 N ATOM 1480 CA THR A 96 -2.923 -6.355 -5.403 1.00 0.00 C ATOM 1481 C THR A 96 -4.223 -5.989 -4.695 1.00 0.00 C ATOM 1482 O THR A 96 -4.655 -4.837 -4.729 1.00 0.00 O ATOM 1483 CB THR A 96 -3.256 -7.062 -6.730 1.00 0.00 C ATOM 1484 OG1 THR A 96 -2.085 -7.702 -7.251 1.00 0.00 O ATOM 1485 CG2 THR A 96 -3.795 -6.071 -7.751 1.00 0.00 C ATOM 0 H THR A 96 -1.512 -7.866 -5.060 1.00 0.00 H new ATOM 0 HA THR A 96 -2.360 -5.447 -5.616 1.00 0.00 H new ATOM 0 HB THR A 96 -4.023 -7.811 -6.535 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.305 -8.150 -8.094 1.00 0.00 H new ATOM 0 HG21 THR A 96 -4.023 -6.594 -8.680 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.702 -5.607 -7.364 1.00 0.00 H new ATOM 0 HG23 THR A 96 -3.047 -5.302 -7.942 1.00 0.00 H new ATOM 1493 N GLU A 97 -4.841 -6.976 -4.055 1.00 0.00 N ATOM 1494 CA GLU A 97 -6.093 -6.756 -3.340 1.00 0.00 C ATOM 1495 C GLU A 97 -5.842 -6.058 -2.007 1.00 0.00 C ATOM 1496 O GLU A 97 -6.353 -4.965 -1.759 1.00 0.00 O ATOM 1497 CB GLU A 97 -6.812 -8.086 -3.104 1.00 0.00 C ATOM 1498 CG GLU A 97 -7.160 -8.826 -4.384 1.00 0.00 C ATOM 1499 CD GLU A 97 -8.050 -8.013 -5.304 1.00 0.00 C ATOM 1500 OE1 GLU A 97 -7.542 -7.064 -5.936 1.00 0.00 O ATOM 1501 OE2 GLU A 97 -9.256 -8.328 -5.391 1.00 0.00 O ATOM 0 H GLU A 97 -4.496 -7.935 -4.017 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.724 -6.114 -3.954 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -6.182 -8.725 -2.485 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -7.727 -7.900 -2.542 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.241 -9.086 -4.910 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.660 -9.762 -4.134 1.00 0.00 H new ATOM 1508 N LEU A 98 -5.052 -6.696 -1.150 1.00 0.00 N ATOM 1509 CA LEU A 98 -4.732 -6.137 0.159 1.00 0.00 C ATOM 1510 C LEU A 98 -4.449 -4.642 0.058 1.00 0.00 C ATOM 1511 O LEU A 98 -4.992 -3.844 0.822 1.00 0.00 O ATOM 1512 CB LEU A 98 -3.525 -6.857 0.761 1.00 0.00 C ATOM 1513 CG LEU A 98 -2.995 -6.291 2.080 1.00 0.00 C ATOM 1514 CD1 LEU A 98 -1.963 -5.205 1.818 1.00 0.00 C ATOM 1515 CD2 LEU A 98 -4.139 -5.750 2.925 1.00 0.00 C ATOM 0 H LEU A 98 -4.621 -7.601 -1.338 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.595 -6.281 0.809 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.792 -7.902 0.918 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.716 -6.841 0.031 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.512 -7.097 2.632 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.597 -4.814 2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -1.130 -5.623 1.253 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.421 -4.398 1.246 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.744 -5.351 3.860 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.651 -4.957 2.380 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.843 -6.554 3.142 1.00 0.00 H new ATOM 1527 N VAL A 99 -3.597 -4.269 -0.891 1.00 0.00 N ATOM 1528 CA VAL A 99 -3.244 -2.869 -1.095 1.00 0.00 C ATOM 1529 C VAL A 99 -4.456 -2.054 -1.532 1.00 0.00 C ATOM 1530 O VAL A 99 -4.696 -0.960 -1.023 1.00 0.00 O ATOM 1531 CB VAL A 99 -2.131 -2.718 -2.149 1.00 0.00 C ATOM 1532 CG1 VAL A 99 -1.658 -1.274 -2.224 1.00 0.00 C ATOM 1533 CG2 VAL A 99 -0.971 -3.652 -1.836 1.00 0.00 C ATOM 0 H VAL A 99 -3.138 -4.917 -1.531 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.882 -2.492 -0.138 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.537 -2.993 -3.123 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.872 -1.187 -2.974 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.494 -0.631 -2.499 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.269 -0.968 -1.253 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.194 -3.532 -2.591 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.564 -3.410 -0.854 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.323 -4.683 -1.839 1.00 0.00 H new ATOM 1543 N GLU A 100 -5.216 -2.596 -2.478 1.00 0.00 N ATOM 1544 CA GLU A 100 -6.404 -1.919 -2.983 1.00 0.00 C ATOM 1545 C GLU A 100 -7.298 -1.458 -1.835 1.00 0.00 C ATOM 1546 O GLU A 100 -7.783 -0.327 -1.827 1.00 0.00 O ATOM 1547 CB GLU A 100 -7.189 -2.844 -3.915 1.00 0.00 C ATOM 1548 CG GLU A 100 -6.818 -2.690 -5.380 1.00 0.00 C ATOM 1549 CD GLU A 100 -7.987 -2.954 -6.310 1.00 0.00 C ATOM 1550 OE1 GLU A 100 -8.838 -3.800 -5.965 1.00 0.00 O ATOM 1551 OE2 GLU A 100 -8.050 -2.315 -7.380 1.00 0.00 O ATOM 0 H GLU A 100 -5.030 -3.501 -2.910 1.00 0.00 H new ATOM 0 HA GLU A 100 -6.079 -1.042 -3.543 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -7.021 -3.878 -3.613 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -8.254 -2.647 -3.796 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.443 -1.681 -5.552 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -6.006 -3.377 -5.619 1.00 0.00 H new ATOM 1558 N PHE A 101 -7.512 -2.344 -0.868 1.00 0.00 N ATOM 1559 CA PHE A 101 -8.348 -2.030 0.285 1.00 0.00 C ATOM 1560 C PHE A 101 -7.731 -0.908 1.115 1.00 0.00 C ATOM 1561 O PHE A 101 -8.428 0.001 1.566 1.00 0.00 O ATOM 1562 CB PHE A 101 -8.544 -3.274 1.154 1.00 0.00 C ATOM 1563 CG PHE A 101 -9.519 -3.073 2.278 1.00 0.00 C ATOM 1564 CD1 PHE A 101 -9.133 -2.425 3.440 1.00 0.00 C ATOM 1565 CD2 PHE A 101 -10.822 -3.531 2.172 1.00 0.00 C ATOM 1566 CE1 PHE A 101 -10.029 -2.239 4.476 1.00 0.00 C ATOM 1567 CE2 PHE A 101 -11.723 -3.348 3.205 1.00 0.00 C ATOM 1568 CZ PHE A 101 -11.325 -2.700 4.358 1.00 0.00 C ATOM 0 H PHE A 101 -7.118 -3.285 -0.860 1.00 0.00 H new ATOM 0 HA PHE A 101 -9.318 -1.695 -0.082 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.890 -4.095 0.526 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -7.581 -3.573 1.568 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -8.121 -2.061 3.538 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.138 -4.037 1.272 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -9.715 -1.733 5.377 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -12.736 -3.711 3.110 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.027 -2.554 5.166 1.00 0.00 H new ATOM 1578 N TYR A 102 -6.420 -0.980 1.313 1.00 0.00 N ATOM 1579 CA TYR A 102 -5.708 0.027 2.092 1.00 0.00 C ATOM 1580 C TYR A 102 -5.647 1.354 1.341 1.00 0.00 C ATOM 1581 O TYR A 102 -5.431 2.408 1.938 1.00 0.00 O ATOM 1582 CB TYR A 102 -4.292 -0.454 2.415 1.00 0.00 C ATOM 1583 CG TYR A 102 -4.233 -1.429 3.568 1.00 0.00 C ATOM 1584 CD1 TYR A 102 -4.977 -1.217 4.722 1.00 0.00 C ATOM 1585 CD2 TYR A 102 -3.433 -2.563 3.504 1.00 0.00 C ATOM 1586 CE1 TYR A 102 -4.925 -2.105 5.779 1.00 0.00 C ATOM 1587 CE2 TYR A 102 -3.376 -3.458 4.555 1.00 0.00 C ATOM 1588 CZ TYR A 102 -4.123 -3.224 5.691 1.00 0.00 C ATOM 1589 OH TYR A 102 -4.070 -4.112 6.741 1.00 0.00 O ATOM 0 H TYR A 102 -5.828 -1.725 0.945 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.253 0.181 3.023 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -3.866 -0.925 1.529 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.668 0.409 2.648 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.607 -0.343 4.794 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.845 -2.748 2.617 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -5.509 -1.924 6.669 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -2.750 -4.336 4.488 1.00 0.00 H new ATOM 0 HH TYR A 102 -3.850 -3.631 7.566 1.00 0.00 H new ATOM 1599 N GLN A 103 -5.841 1.292 0.027 1.00 0.00 N ATOM 1600 CA GLN A 103 -5.809 2.488 -0.806 1.00 0.00 C ATOM 1601 C GLN A 103 -7.012 3.382 -0.523 1.00 0.00 C ATOM 1602 O GLN A 103 -7.025 4.555 -0.894 1.00 0.00 O ATOM 1603 CB GLN A 103 -5.782 2.103 -2.287 1.00 0.00 C ATOM 1604 CG GLN A 103 -4.430 1.594 -2.758 1.00 0.00 C ATOM 1605 CD GLN A 103 -4.504 0.903 -4.106 1.00 0.00 C ATOM 1606 OE1 GLN A 103 -3.413 0.257 -4.501 1.00 0.00 O flip ATOM 1607 NE2 GLN A 103 -5.531 0.948 -4.784 1.00 0.00 N flip ATOM 0 H GLN A 103 -6.022 0.427 -0.483 1.00 0.00 H new ATOM 0 HA GLN A 103 -4.903 3.043 -0.565 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -6.533 1.334 -2.468 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -6.063 2.970 -2.885 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.733 2.430 -2.820 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -4.030 0.899 -2.019 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -6.346 1.456 -4.441 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -5.566 0.477 -5.688 1.00 0.00 H new ATOM 1616 N GLN A 104 -8.019 2.819 0.136 1.00 0.00 N ATOM 1617 CA GLN A 104 -9.227 3.566 0.467 1.00 0.00 C ATOM 1618 C GLN A 104 -9.318 3.814 1.969 1.00 0.00 C ATOM 1619 O GLN A 104 -9.984 4.748 2.414 1.00 0.00 O ATOM 1620 CB GLN A 104 -10.467 2.810 -0.012 1.00 0.00 C ATOM 1621 CG GLN A 104 -10.271 1.304 -0.086 1.00 0.00 C ATOM 1622 CD GLN A 104 -11.357 0.613 -0.888 1.00 0.00 C ATOM 1623 OE1 GLN A 104 -11.137 0.204 -2.029 1.00 0.00 O ATOM 1624 NE2 GLN A 104 -12.537 0.479 -0.294 1.00 0.00 N ATOM 0 H GLN A 104 -8.023 1.849 0.451 1.00 0.00 H new ATOM 0 HA GLN A 104 -9.179 4.529 -0.041 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -11.297 3.027 0.660 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -10.750 3.180 -0.998 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -9.301 1.089 -0.534 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -10.253 0.894 0.924 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -12.675 0.833 0.653 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -13.306 0.022 -0.784 1.00 0.00 H new ATOM 1633 N ASN A 105 -8.644 2.972 2.746 1.00 0.00 N ATOM 1634 CA ASN A 105 -8.649 3.100 4.198 1.00 0.00 C ATOM 1635 C ASN A 105 -7.248 3.395 4.724 1.00 0.00 C ATOM 1636 O ASN A 105 -6.261 2.845 4.234 1.00 0.00 O ATOM 1637 CB ASN A 105 -9.189 1.821 4.842 1.00 0.00 C ATOM 1638 CG ASN A 105 -10.564 1.449 4.324 1.00 0.00 C ATOM 1639 OD1 ASN A 105 -11.579 1.754 4.950 1.00 0.00 O ATOM 1640 ND2 ASN A 105 -10.603 0.785 3.174 1.00 0.00 N ATOM 0 H ASN A 105 -8.087 2.193 2.394 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.299 3.934 4.461 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -8.497 1.001 4.650 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -9.235 1.953 5.923 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -11.500 0.507 2.776 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.736 0.553 2.689 1.00 0.00 H new ATOM 1647 N SER A 106 -7.168 4.267 5.724 1.00 0.00 N ATOM 1648 CA SER A 106 -5.887 4.638 6.315 1.00 0.00 C ATOM 1649 C SER A 106 -5.278 3.463 7.072 1.00 0.00 C ATOM 1650 O SER A 106 -5.991 2.659 7.674 1.00 0.00 O ATOM 1651 CB SER A 106 -6.062 5.831 7.256 1.00 0.00 C ATOM 1652 OG SER A 106 -5.955 7.056 6.553 1.00 0.00 O ATOM 0 H SER A 106 -7.975 4.730 6.142 1.00 0.00 H new ATOM 0 HA SER A 106 -5.210 4.918 5.508 1.00 0.00 H new ATOM 0 HB2 SER A 106 -7.034 5.773 7.745 1.00 0.00 H new ATOM 0 HB3 SER A 106 -5.307 5.792 8.042 1.00 0.00 H new ATOM 0 HG SER A 106 -6.072 7.803 7.177 1.00 0.00 H new ATOM 1658 N LEU A 107 -3.953 3.369 7.039 1.00 0.00 N ATOM 1659 CA LEU A 107 -3.245 2.292 7.722 1.00 0.00 C ATOM 1660 C LEU A 107 -3.352 2.444 9.236 1.00 0.00 C ATOM 1661 O LEU A 107 -2.994 1.538 9.989 1.00 0.00 O ATOM 1662 CB LEU A 107 -1.774 2.276 7.303 1.00 0.00 C ATOM 1663 CG LEU A 107 -1.469 1.635 5.948 1.00 0.00 C ATOM 1664 CD1 LEU A 107 -1.487 0.119 6.058 1.00 0.00 C ATOM 1665 CD2 LEU A 107 -2.464 2.108 4.899 1.00 0.00 C ATOM 0 H LEU A 107 -3.347 4.026 6.547 1.00 0.00 H new ATOM 0 HA LEU A 107 -3.708 1.348 7.436 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -1.410 3.303 7.286 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -1.205 1.749 8.068 1.00 0.00 H new ATOM 0 HG LEU A 107 -0.471 1.943 5.638 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.268 -0.319 5.084 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -0.735 -0.203 6.778 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -2.471 -0.210 6.391 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.232 1.642 3.941 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -3.473 1.830 5.203 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -2.401 3.192 4.800 1.00 0.00 H new ATOM 1677 N LYS A 108 -3.851 3.594 9.676 1.00 0.00 N ATOM 1678 CA LYS A 108 -4.010 3.865 11.100 1.00 0.00 C ATOM 1679 C LYS A 108 -4.547 2.638 11.830 1.00 0.00 C ATOM 1680 O LYS A 108 -4.158 2.360 12.965 1.00 0.00 O ATOM 1681 CB LYS A 108 -4.953 5.051 11.312 1.00 0.00 C ATOM 1682 CG LYS A 108 -6.413 4.721 11.055 1.00 0.00 C ATOM 1683 CD LYS A 108 -7.252 5.979 10.908 1.00 0.00 C ATOM 1684 CE LYS A 108 -8.731 5.650 10.772 1.00 0.00 C ATOM 1685 NZ LYS A 108 -9.589 6.845 11.008 1.00 0.00 N ATOM 0 H LYS A 108 -4.153 4.354 9.066 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.030 4.110 11.510 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -4.845 5.412 12.335 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -4.652 5.866 10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -6.497 4.119 10.150 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -6.801 4.118 11.876 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.100 6.623 11.774 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -6.921 6.538 10.033 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -8.925 5.255 9.775 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -8.996 4.867 11.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -10.589 6.580 10.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -9.423 7.207 11.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -9.354 7.583 10.314 1.00 0.00 H new ATOM 1699 N ASP A 109 -5.440 1.908 11.173 1.00 0.00 N ATOM 1700 CA ASP A 109 -6.028 0.709 11.759 1.00 0.00 C ATOM 1701 C ASP A 109 -4.948 -0.201 12.333 1.00 0.00 C ATOM 1702 O ASP A 109 -5.057 -0.673 13.466 1.00 0.00 O ATOM 1703 CB ASP A 109 -6.846 -0.048 10.711 1.00 0.00 C ATOM 1704 CG ASP A 109 -8.092 0.707 10.293 1.00 0.00 C ATOM 1705 OD1 ASP A 109 -7.970 1.655 9.488 1.00 0.00 O ATOM 1706 OD2 ASP A 109 -9.190 0.351 10.769 1.00 0.00 O ATOM 0 H ASP A 109 -5.773 2.125 10.234 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.687 1.017 12.571 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.225 -0.233 9.834 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -7.131 -1.021 11.111 1.00 0.00 H new ATOM 1711 N CYS A 110 -3.906 -0.445 11.546 1.00 0.00 N ATOM 1712 CA CYS A 110 -2.806 -1.300 11.975 1.00 0.00 C ATOM 1713 C CYS A 110 -1.803 -0.516 12.815 1.00 0.00 C ATOM 1714 O CYS A 110 -1.291 -1.015 13.818 1.00 0.00 O ATOM 1715 CB CYS A 110 -2.105 -1.913 10.762 1.00 0.00 C ATOM 1716 SG CYS A 110 -3.214 -2.308 9.390 1.00 0.00 S ATOM 0 H CYS A 110 -3.800 -0.062 10.607 1.00 0.00 H new ATOM 0 HA CYS A 110 -3.219 -2.100 12.589 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -1.341 -1.221 10.409 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -1.592 -2.823 11.074 1.00 0.00 H new ATOM 0 HG CYS A 110 -3.474 -1.227 8.717 1.00 0.00 H new ATOM 1722 N PHE A 111 -1.525 0.715 12.399 1.00 0.00 N ATOM 1723 CA PHE A 111 -0.581 1.568 13.111 1.00 0.00 C ATOM 1724 C PHE A 111 -1.139 2.979 13.273 1.00 0.00 C ATOM 1725 O PHE A 111 -0.862 3.866 12.465 1.00 0.00 O ATOM 1726 CB PHE A 111 0.755 1.618 12.367 1.00 0.00 C ATOM 1727 CG PHE A 111 1.492 0.310 12.369 1.00 0.00 C ATOM 1728 CD1 PHE A 111 2.255 -0.069 13.462 1.00 0.00 C ATOM 1729 CD2 PHE A 111 1.421 -0.542 11.279 1.00 0.00 C ATOM 1730 CE1 PHE A 111 2.934 -1.272 13.467 1.00 0.00 C ATOM 1731 CE2 PHE A 111 2.098 -1.747 11.278 1.00 0.00 C ATOM 1732 CZ PHE A 111 2.855 -2.113 12.374 1.00 0.00 C ATOM 0 H PHE A 111 -1.940 1.144 11.572 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.421 1.143 14.102 1.00 0.00 H new ATOM 0 HB2 PHE A 111 0.576 1.923 11.336 1.00 0.00 H new ATOM 0 HB3 PHE A 111 1.386 2.382 12.821 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.320 0.584 14.320 1.00 0.00 H new ATOM 0 HD2 PHE A 111 0.830 -0.261 10.420 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.526 -1.555 14.325 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.035 -2.402 10.421 1.00 0.00 H new ATOM 0 HZ PHE A 111 3.384 -3.055 12.376 1.00 0.00 H new ATOM 1742 N LYS A 112 -1.927 3.180 14.324 1.00 0.00 N ATOM 1743 CA LYS A 112 -2.524 4.482 14.595 1.00 0.00 C ATOM 1744 C LYS A 112 -1.551 5.608 14.259 1.00 0.00 C ATOM 1745 O LYS A 112 -1.816 6.428 13.380 1.00 0.00 O ATOM 1746 CB LYS A 112 -2.944 4.578 16.064 1.00 0.00 C ATOM 1747 CG LYS A 112 -3.534 5.926 16.441 1.00 0.00 C ATOM 1748 CD LYS A 112 -2.461 6.890 16.918 1.00 0.00 C ATOM 1749 CE LYS A 112 -3.058 8.222 17.344 1.00 0.00 C ATOM 1750 NZ LYS A 112 -3.974 8.072 18.508 1.00 0.00 N ATOM 0 H LYS A 112 -2.167 2.457 15.002 1.00 0.00 H new ATOM 0 HA LYS A 112 -3.406 4.587 13.963 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.676 3.798 16.276 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.077 4.381 16.695 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -4.050 6.352 15.581 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -4.279 5.792 17.226 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -1.920 6.448 17.755 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -1.736 7.053 16.120 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -2.256 8.914 17.600 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -3.602 8.660 16.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -4.173 9.008 18.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -4.864 7.634 18.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -3.526 7.469 19.227 1.00 0.00 H new ATOM 1764 N SER A 113 -0.425 5.640 14.964 1.00 0.00 N ATOM 1765 CA SER A 113 0.586 6.667 14.742 1.00 0.00 C ATOM 1766 C SER A 113 0.790 6.916 13.250 1.00 0.00 C ATOM 1767 O SER A 113 1.047 8.043 12.826 1.00 0.00 O ATOM 1768 CB SER A 113 1.911 6.256 15.387 1.00 0.00 C ATOM 1769 OG SER A 113 1.913 6.542 16.775 1.00 0.00 O ATOM 0 H SER A 113 -0.190 4.967 15.693 1.00 0.00 H new ATOM 0 HA SER A 113 0.236 7.591 15.203 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.079 5.190 15.232 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.733 6.782 14.903 1.00 0.00 H new ATOM 0 HG SER A 113 2.770 6.269 17.164 1.00 0.00 H new ATOM 1775 N LEU A 114 0.672 5.855 12.459 1.00 0.00 N ATOM 1776 CA LEU A 114 0.842 5.956 11.014 1.00 0.00 C ATOM 1777 C LEU A 114 -0.509 6.021 10.309 1.00 0.00 C ATOM 1778 O LEU A 114 -1.090 4.992 9.963 1.00 0.00 O ATOM 1779 CB LEU A 114 1.646 4.765 10.490 1.00 0.00 C ATOM 1780 CG LEU A 114 2.072 4.835 9.023 1.00 0.00 C ATOM 1781 CD1 LEU A 114 2.504 6.247 8.660 1.00 0.00 C ATOM 1782 CD2 LEU A 114 3.193 3.844 8.746 1.00 0.00 C ATOM 0 H LEU A 114 0.459 4.915 12.794 1.00 0.00 H new ATOM 0 HA LEU A 114 1.387 6.876 10.802 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.541 4.659 11.103 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.053 3.861 10.633 1.00 0.00 H new ATOM 0 HG LEU A 114 1.217 4.568 8.402 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.804 6.278 7.612 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.673 6.934 8.820 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.345 6.543 9.287 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.484 3.907 7.697 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.051 4.080 9.375 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.848 2.834 8.967 1.00 0.00 H new ATOM 1794 N ASP A 115 -1.003 7.236 10.100 1.00 0.00 N ATOM 1795 CA ASP A 115 -2.285 7.436 9.433 1.00 0.00 C ATOM 1796 C ASP A 115 -2.083 7.849 7.979 1.00 0.00 C ATOM 1797 O ASP A 115 -2.215 9.023 7.631 1.00 0.00 O ATOM 1798 CB ASP A 115 -3.107 8.496 10.168 1.00 0.00 C ATOM 1799 CG ASP A 115 -2.941 8.416 11.673 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -2.024 9.076 12.205 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -3.729 7.694 12.319 1.00 0.00 O ATOM 0 H ASP A 115 -0.536 8.097 10.383 1.00 0.00 H new ATOM 0 HA ASP A 115 -2.827 6.490 9.451 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -2.808 9.486 9.824 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -4.160 8.375 9.915 1.00 0.00 H new ATOM 1806 N THR A 116 -1.761 6.877 7.131 1.00 0.00 N ATOM 1807 CA THR A 116 -1.538 7.140 5.715 1.00 0.00 C ATOM 1808 C THR A 116 -2.332 6.172 4.845 1.00 0.00 C ATOM 1809 O THR A 116 -3.077 5.333 5.352 1.00 0.00 O ATOM 1810 CB THR A 116 -0.045 7.032 5.352 1.00 0.00 C ATOM 1811 OG1 THR A 116 0.173 7.522 4.024 1.00 0.00 O ATOM 1812 CG2 THR A 116 0.434 5.592 5.452 1.00 0.00 C ATOM 0 H THR A 116 -1.649 5.900 7.401 1.00 0.00 H new ATOM 0 HA THR A 116 -1.878 8.158 5.525 1.00 0.00 H new ATOM 0 HB THR A 116 0.523 7.636 6.060 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.276 8.496 4.048 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.491 5.541 5.191 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.294 5.232 6.471 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.140 4.969 4.765 1.00 0.00 H new ATOM 1820 N THR A 117 -2.167 6.293 3.531 1.00 0.00 N ATOM 1821 CA THR A 117 -2.869 5.430 2.590 1.00 0.00 C ATOM 1822 C THR A 117 -2.053 5.224 1.319 1.00 0.00 C ATOM 1823 O THR A 117 -1.255 6.081 0.936 1.00 0.00 O ATOM 1824 CB THR A 117 -4.246 6.009 2.215 1.00 0.00 C ATOM 1825 OG1 THR A 117 -4.186 7.440 2.196 1.00 0.00 O ATOM 1826 CG2 THR A 117 -5.311 5.554 3.200 1.00 0.00 C ATOM 0 H THR A 117 -1.553 6.981 3.095 1.00 0.00 H new ATOM 0 HA THR A 117 -3.011 4.470 3.087 1.00 0.00 H new ATOM 0 HB THR A 117 -4.512 5.643 1.223 1.00 0.00 H new ATOM 0 HG1 THR A 117 -5.065 7.801 1.955 1.00 0.00 H new ATOM 0 HG21 THR A 117 -6.275 5.976 2.914 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.374 4.466 3.191 1.00 0.00 H new ATOM 0 HG23 THR A 117 -5.049 5.894 4.202 1.00 0.00 H new ATOM 1834 N LEU A 118 -2.257 4.084 0.669 1.00 0.00 N ATOM 1835 CA LEU A 118 -1.540 3.766 -0.561 1.00 0.00 C ATOM 1836 C LEU A 118 -1.967 4.692 -1.696 1.00 0.00 C ATOM 1837 O LEU A 118 -2.889 4.382 -2.449 1.00 0.00 O ATOM 1838 CB LEU A 118 -1.788 2.309 -0.957 1.00 0.00 C ATOM 1839 CG LEU A 118 -1.274 1.251 0.020 1.00 0.00 C ATOM 1840 CD1 LEU A 118 0.234 1.363 0.181 1.00 0.00 C ATOM 1841 CD2 LEU A 118 -1.968 1.387 1.367 1.00 0.00 C ATOM 0 H LEU A 118 -2.913 3.364 0.973 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.475 3.911 -0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.861 2.166 -1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.325 2.134 -1.928 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.504 0.266 -0.386 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.583 0.603 0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.715 1.215 -0.786 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.487 2.351 0.565 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.590 0.626 2.050 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.770 2.376 1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.042 1.257 1.238 1.00 0.00 H new ATOM 1853 N GLN A 119 -1.288 5.829 -1.811 1.00 0.00 N ATOM 1854 CA GLN A 119 -1.596 6.800 -2.855 1.00 0.00 C ATOM 1855 C GLN A 119 -1.159 6.286 -4.222 1.00 0.00 C ATOM 1856 O GLN A 119 -1.989 5.911 -5.051 1.00 0.00 O ATOM 1857 CB GLN A 119 -0.913 8.136 -2.556 1.00 0.00 C ATOM 1858 CG GLN A 119 -1.033 8.569 -1.104 1.00 0.00 C ATOM 1859 CD GLN A 119 -1.066 10.076 -0.945 1.00 0.00 C ATOM 1860 OE1 GLN A 119 -0.963 10.817 -1.923 1.00 0.00 O ATOM 1861 NE2 GLN A 119 -1.210 10.539 0.291 1.00 0.00 N ATOM 0 H GLN A 119 -0.522 6.100 -1.195 1.00 0.00 H new ATOM 0 HA GLN A 119 -2.676 6.948 -2.871 1.00 0.00 H new ATOM 0 HB2 GLN A 119 0.142 8.062 -2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -1.346 8.907 -3.193 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -1.940 8.142 -0.675 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -0.193 8.166 -0.538 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -1.292 9.889 1.073 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -1.239 11.545 0.459 1.00 0.00 H new ATOM 1870 N PHE A 120 0.150 6.272 -4.452 1.00 0.00 N ATOM 1871 CA PHE A 120 0.698 5.806 -5.721 1.00 0.00 C ATOM 1872 C PHE A 120 1.986 5.017 -5.500 1.00 0.00 C ATOM 1873 O PHE A 120 2.716 5.231 -4.532 1.00 0.00 O ATOM 1874 CB PHE A 120 0.966 6.990 -6.652 1.00 0.00 C ATOM 1875 CG PHE A 120 0.063 8.164 -6.403 1.00 0.00 C ATOM 1876 CD1 PHE A 120 -1.279 8.107 -6.742 1.00 0.00 C ATOM 1877 CD2 PHE A 120 0.556 9.325 -5.830 1.00 0.00 C ATOM 1878 CE1 PHE A 120 -2.113 9.185 -6.514 1.00 0.00 C ATOM 1879 CE2 PHE A 120 -0.273 10.407 -5.599 1.00 0.00 C ATOM 1880 CZ PHE A 120 -1.609 10.337 -5.943 1.00 0.00 C ATOM 0 H PHE A 120 0.851 6.578 -3.777 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.037 5.148 -6.185 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.002 7.307 -6.534 1.00 0.00 H new ATOM 0 HB3 PHE A 120 0.848 6.664 -7.685 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.678 7.209 -7.190 1.00 0.00 H new ATOM 0 HD2 PHE A 120 1.600 9.386 -5.561 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.158 9.127 -6.782 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.123 11.306 -5.150 1.00 0.00 H new ATOM 0 HZ PHE A 120 -2.258 11.182 -5.766 1.00 0.00 H new ATOM 1890 N PRO A 121 2.271 4.081 -6.418 1.00 0.00 N ATOM 1891 CA PRO A 121 3.470 3.241 -6.346 1.00 0.00 C ATOM 1892 C PRO A 121 4.748 4.030 -6.610 1.00 0.00 C ATOM 1893 O PRO A 121 4.701 5.164 -7.089 1.00 0.00 O ATOM 1894 CB PRO A 121 3.244 2.204 -7.449 1.00 0.00 C ATOM 1895 CG PRO A 121 2.330 2.874 -8.416 1.00 0.00 C ATOM 1896 CD PRO A 121 1.445 3.772 -7.597 1.00 0.00 C ATOM 0 HA PRO A 121 3.604 2.807 -5.355 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.183 1.920 -7.924 1.00 0.00 H new ATOM 0 HB3 PRO A 121 2.799 1.292 -7.050 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.893 3.448 -9.152 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.740 2.141 -8.967 1.00 0.00 H new ATOM 0 HD2 PRO A 121 1.172 4.674 -8.144 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.516 3.275 -7.318 1.00 0.00 H new ATOM 1904 N PHE A 122 5.888 3.424 -6.297 1.00 0.00 N ATOM 1905 CA PHE A 122 7.179 4.071 -6.501 1.00 0.00 C ATOM 1906 C PHE A 122 7.573 4.045 -7.974 1.00 0.00 C ATOM 1907 O PHE A 122 8.149 5.003 -8.492 1.00 0.00 O ATOM 1908 CB PHE A 122 8.256 3.383 -5.661 1.00 0.00 C ATOM 1909 CG PHE A 122 8.720 2.074 -6.235 1.00 0.00 C ATOM 1910 CD1 PHE A 122 7.928 0.942 -6.140 1.00 0.00 C ATOM 1911 CD2 PHE A 122 9.947 1.978 -6.871 1.00 0.00 C ATOM 1912 CE1 PHE A 122 8.352 -0.263 -6.667 1.00 0.00 C ATOM 1913 CE2 PHE A 122 10.376 0.776 -7.400 1.00 0.00 C ATOM 1914 CZ PHE A 122 9.577 -0.346 -7.299 1.00 0.00 C ATOM 0 H PHE A 122 5.944 2.486 -5.901 1.00 0.00 H new ATOM 0 HA PHE A 122 7.091 5.110 -6.185 1.00 0.00 H new ATOM 0 HB2 PHE A 122 9.112 4.051 -5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 122 7.868 3.213 -4.657 1.00 0.00 H new ATOM 0 HD1 PHE A 122 6.968 1.002 -5.649 1.00 0.00 H new ATOM 0 HD2 PHE A 122 10.575 2.853 -6.954 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.726 -1.139 -6.585 1.00 0.00 H new ATOM 0 HE2 PHE A 122 11.335 0.714 -7.892 1.00 0.00 H new ATOM 0 HZ PHE A 122 9.910 -1.286 -7.713 1.00 0.00 H new ATOM 1924 N LYS A 123 7.260 2.942 -8.645 1.00 0.00 N ATOM 1925 CA LYS A 123 7.580 2.790 -10.060 1.00 0.00 C ATOM 1926 C LYS A 123 6.690 3.683 -10.918 1.00 0.00 C ATOM 1927 O LYS A 123 7.009 3.966 -12.072 1.00 0.00 O ATOM 1928 CB LYS A 123 7.417 1.329 -10.486 1.00 0.00 C ATOM 1929 CG LYS A 123 8.705 0.527 -10.412 1.00 0.00 C ATOM 1930 CD LYS A 123 8.738 -0.571 -11.462 1.00 0.00 C ATOM 1931 CE LYS A 123 8.106 -1.855 -10.946 1.00 0.00 C ATOM 1932 NZ LYS A 123 8.718 -3.063 -11.565 1.00 0.00 N ATOM 0 H LYS A 123 6.785 2.140 -8.232 1.00 0.00 H new ATOM 0 HA LYS A 123 8.617 3.092 -10.207 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.667 0.856 -9.852 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.037 1.297 -11.507 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.557 1.192 -10.552 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.804 0.086 -9.420 1.00 0.00 H new ATOM 0 HD2 LYS A 123 8.210 -0.238 -12.355 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.770 -0.764 -11.755 1.00 0.00 H new ATOM 0 HE2 LYS A 123 8.219 -1.905 -9.863 1.00 0.00 H new ATOM 0 HE3 LYS A 123 7.036 -1.842 -11.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 8.260 -3.917 -11.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.588 -3.028 -12.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 9.734 -3.089 -11.345 1.00 0.00 H new ATOM 1946 N GLU A 124 5.573 4.123 -10.347 1.00 0.00 N ATOM 1947 CA GLU A 124 4.638 4.985 -11.061 1.00 0.00 C ATOM 1948 C GLU A 124 5.380 5.933 -11.999 1.00 0.00 C ATOM 1949 O GLU A 124 6.375 6.559 -11.630 1.00 0.00 O ATOM 1950 CB GLU A 124 3.792 5.787 -10.071 1.00 0.00 C ATOM 1951 CG GLU A 124 2.355 5.990 -10.524 1.00 0.00 C ATOM 1952 CD GLU A 124 2.172 7.261 -11.331 1.00 0.00 C ATOM 1953 OE1 GLU A 124 2.524 8.345 -10.821 1.00 0.00 O ATOM 1954 OE2 GLU A 124 1.677 7.170 -12.474 1.00 0.00 O ATOM 0 H GLU A 124 5.294 3.897 -9.392 1.00 0.00 H new ATOM 0 HA GLU A 124 3.982 4.351 -11.658 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.792 5.276 -9.108 1.00 0.00 H new ATOM 0 HB3 GLU A 124 4.256 6.761 -9.915 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.043 5.135 -11.124 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.704 6.022 -9.651 1.00 0.00 H new ATOM 1961 N PRO A 125 4.887 6.042 -13.241 1.00 0.00 N ATOM 1962 CA PRO A 125 5.487 6.911 -14.258 1.00 0.00 C ATOM 1963 C PRO A 125 5.291 8.391 -13.944 1.00 0.00 C ATOM 1964 O PRO A 125 4.556 8.747 -13.023 1.00 0.00 O ATOM 1965 CB PRO A 125 4.736 6.532 -15.537 1.00 0.00 C ATOM 1966 CG PRO A 125 3.427 6.000 -15.064 1.00 0.00 C ATOM 1967 CD PRO A 125 3.705 5.326 -13.749 1.00 0.00 C ATOM 0 HA PRO A 125 6.566 6.775 -14.325 1.00 0.00 H new ATOM 0 HB2 PRO A 125 4.600 7.396 -16.187 1.00 0.00 H new ATOM 0 HB3 PRO A 125 5.283 5.784 -16.111 1.00 0.00 H new ATOM 0 HG2 PRO A 125 2.699 6.803 -14.945 1.00 0.00 H new ATOM 0 HG3 PRO A 125 3.009 5.295 -15.783 1.00 0.00 H new ATOM 0 HD2 PRO A 125 2.859 5.412 -13.067 1.00 0.00 H new ATOM 0 HD3 PRO A 125 3.904 4.262 -13.877 1.00 0.00 H new ATOM 1975 N GLU A 126 5.952 9.247 -14.717 1.00 0.00 N ATOM 1976 CA GLU A 126 5.849 10.689 -14.520 1.00 0.00 C ATOM 1977 C GLU A 126 4.446 11.076 -14.061 1.00 0.00 C ATOM 1978 O GLU A 126 3.449 10.581 -14.587 1.00 0.00 O ATOM 1979 CB GLU A 126 6.198 11.428 -15.813 1.00 0.00 C ATOM 1980 CG GLU A 126 5.842 12.905 -15.784 1.00 0.00 C ATOM 1981 CD GLU A 126 6.766 13.745 -16.646 1.00 0.00 C ATOM 1982 OE1 GLU A 126 7.944 13.361 -16.801 1.00 0.00 O ATOM 1983 OE2 GLU A 126 6.309 14.785 -17.164 1.00 0.00 O ATOM 0 H GLU A 126 6.564 8.968 -15.484 1.00 0.00 H new ATOM 0 HA GLU A 126 6.558 10.976 -13.744 1.00 0.00 H new ATOM 0 HB2 GLU A 126 7.266 11.324 -16.004 1.00 0.00 H new ATOM 0 HB3 GLU A 126 5.677 10.954 -16.645 1.00 0.00 H new ATOM 0 HG2 GLU A 126 4.815 13.034 -16.126 1.00 0.00 H new ATOM 0 HG3 GLU A 126 5.883 13.265 -14.756 1.00 0.00 H new ATOM 1990 N LYS A 127 4.377 11.967 -13.077 1.00 0.00 N ATOM 1991 CA LYS A 127 3.098 12.423 -12.547 1.00 0.00 C ATOM 1992 C LYS A 127 2.082 12.616 -13.667 1.00 0.00 C ATOM 1993 O LYS A 127 2.109 13.622 -14.377 1.00 0.00 O ATOM 1994 CB LYS A 127 3.280 13.734 -11.778 1.00 0.00 C ATOM 1995 CG LYS A 127 2.349 13.874 -10.586 1.00 0.00 C ATOM 1996 CD LYS A 127 1.972 15.326 -10.341 1.00 0.00 C ATOM 1997 CE LYS A 127 0.708 15.709 -11.095 1.00 0.00 C ATOM 1998 NZ LYS A 127 0.931 15.750 -12.567 1.00 0.00 N ATOM 0 H LYS A 127 5.192 12.387 -12.631 1.00 0.00 H new ATOM 0 HA LYS A 127 2.722 11.659 -11.867 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.312 13.803 -11.433 1.00 0.00 H new ATOM 0 HB3 LYS A 127 3.115 14.570 -12.458 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.447 13.287 -10.757 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.831 13.467 -9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 127 1.824 15.489 -9.274 1.00 0.00 H new ATOM 0 HD3 LYS A 127 2.792 15.973 -10.651 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -0.082 14.993 -10.867 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.362 16.684 -10.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 0.169 16.295 -13.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.846 16.203 -12.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.935 14.781 -12.945 1.00 0.00 H new ATOM 2012 N ARG A 128 1.185 11.647 -13.820 1.00 0.00 N ATOM 2013 CA ARG A 128 0.160 11.711 -14.855 1.00 0.00 C ATOM 2014 C ARG A 128 -0.928 10.670 -14.608 1.00 0.00 C ATOM 2015 O ARG A 128 -0.664 9.467 -14.610 1.00 0.00 O ATOM 2016 CB ARG A 128 0.783 11.495 -16.235 1.00 0.00 C ATOM 2017 CG ARG A 128 -0.049 12.060 -17.374 1.00 0.00 C ATOM 2018 CD ARG A 128 -0.040 13.581 -17.370 1.00 0.00 C ATOM 2019 NE ARG A 128 -0.207 14.133 -18.712 1.00 0.00 N ATOM 2020 CZ ARG A 128 -0.843 15.272 -18.964 1.00 0.00 C ATOM 2021 NH1 ARG A 128 -1.368 15.976 -17.970 1.00 0.00 N ATOM 2022 NH2 ARG A 128 -0.954 15.709 -20.212 1.00 0.00 N ATOM 0 H ARG A 128 1.147 10.808 -13.240 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.294 12.701 -14.820 1.00 0.00 H new ATOM 0 HB2 ARG A 128 1.771 11.956 -16.255 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.926 10.427 -16.396 1.00 0.00 H new ATOM 0 HG2 ARG A 128 0.339 11.695 -18.325 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -1.075 11.701 -17.290 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -0.840 13.947 -16.726 1.00 0.00 H new ATOM 0 HD3 ARG A 128 0.899 13.937 -16.946 1.00 0.00 H new ATOM 0 HE ARG A 128 0.186 13.616 -19.498 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -1.284 15.643 -17.009 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -1.856 16.850 -18.166 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -0.551 15.170 -20.979 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -1.442 16.583 -20.405 1.00 0.00 H new ATOM 2036 N THR A 129 -2.153 11.141 -14.393 1.00 0.00 N ATOM 2037 CA THR A 129 -3.280 10.251 -14.142 1.00 0.00 C ATOM 2038 C THR A 129 -4.168 10.128 -15.375 1.00 0.00 C ATOM 2039 O THR A 129 -5.065 10.944 -15.589 1.00 0.00 O ATOM 2040 CB THR A 129 -4.132 10.744 -12.957 1.00 0.00 C ATOM 2041 OG1 THR A 129 -4.574 12.085 -13.196 1.00 0.00 O ATOM 2042 CG2 THR A 129 -3.338 10.690 -11.661 1.00 0.00 C ATOM 0 H THR A 129 -2.389 12.133 -14.388 1.00 0.00 H new ATOM 0 HA THR A 129 -2.863 9.274 -13.898 1.00 0.00 H new ATOM 0 HB THR A 129 -4.997 10.088 -12.862 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.988 12.140 -14.083 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.960 11.043 -10.838 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.028 9.663 -11.467 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.456 11.325 -11.748 1.00 0.00 H new ATOM 2050 N ILE A 130 -3.913 9.104 -16.182 1.00 0.00 N ATOM 2051 CA ILE A 130 -4.691 8.874 -17.393 1.00 0.00 C ATOM 2052 C ILE A 130 -5.975 8.111 -17.085 1.00 0.00 C ATOM 2053 O ILE A 130 -6.574 7.500 -17.970 1.00 0.00 O ATOM 2054 CB ILE A 130 -3.881 8.091 -18.443 1.00 0.00 C ATOM 2055 CG1 ILE A 130 -3.784 6.616 -18.047 1.00 0.00 C ATOM 2056 CG2 ILE A 130 -2.494 8.695 -18.601 1.00 0.00 C ATOM 2057 CD1 ILE A 130 -2.922 6.373 -16.828 1.00 0.00 C ATOM 0 H ILE A 130 -3.174 8.420 -16.019 1.00 0.00 H new ATOM 0 HA ILE A 130 -4.942 9.855 -17.797 1.00 0.00 H new ATOM 0 HB ILE A 130 -4.396 8.158 -19.401 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.786 6.233 -17.855 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -3.381 6.049 -18.886 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -1.934 8.130 -19.346 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -2.583 9.732 -18.923 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -1.969 8.656 -17.647 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -2.899 5.306 -16.606 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -1.909 6.725 -17.023 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -3.336 6.912 -15.976 1.00 0.00 H new ATOM 2069 N SER A 131 -6.393 8.153 -15.824 1.00 0.00 N ATOM 2070 CA SER A 131 -7.605 7.463 -15.397 1.00 0.00 C ATOM 2071 C SER A 131 -8.269 8.199 -14.237 1.00 0.00 C ATOM 2072 O SER A 131 -7.655 9.052 -13.596 1.00 0.00 O ATOM 2073 CB SER A 131 -7.282 6.026 -14.987 1.00 0.00 C ATOM 2074 OG SER A 131 -8.384 5.167 -15.227 1.00 0.00 O ATOM 0 H SER A 131 -5.911 8.657 -15.080 1.00 0.00 H new ATOM 0 HA SER A 131 -8.299 7.445 -16.238 1.00 0.00 H new ATOM 0 HB2 SER A 131 -6.414 5.672 -15.543 1.00 0.00 H new ATOM 0 HB3 SER A 131 -7.018 5.997 -13.930 1.00 0.00 H new ATOM 0 HG SER A 131 -8.152 4.254 -14.958 1.00 0.00 H new ATOM 2080 N ARG A 132 -9.527 7.862 -13.973 1.00 0.00 N ATOM 2081 CA ARG A 132 -10.276 8.490 -12.891 1.00 0.00 C ATOM 2082 C ARG A 132 -10.254 7.620 -11.638 1.00 0.00 C ATOM 2083 O ARG A 132 -10.482 6.412 -11.705 1.00 0.00 O ATOM 2084 CB ARG A 132 -11.721 8.745 -13.323 1.00 0.00 C ATOM 2085 CG ARG A 132 -12.470 9.701 -12.409 1.00 0.00 C ATOM 2086 CD ARG A 132 -12.013 11.137 -12.610 1.00 0.00 C ATOM 2087 NE ARG A 132 -12.388 11.653 -13.924 1.00 0.00 N ATOM 2088 CZ ARG A 132 -13.639 11.930 -14.275 1.00 0.00 C ATOM 2089 NH1 ARG A 132 -14.629 11.742 -13.414 1.00 0.00 N ATOM 2090 NH2 ARG A 132 -13.901 12.396 -15.489 1.00 0.00 N ATOM 0 H ARG A 132 -10.049 7.157 -14.494 1.00 0.00 H new ATOM 0 HA ARG A 132 -9.800 9.443 -12.659 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -11.723 9.148 -14.336 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.254 7.795 -13.357 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -13.540 9.628 -12.603 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -12.314 9.410 -11.370 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -12.449 11.768 -11.835 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -10.931 11.192 -12.494 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.649 11.809 -14.610 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -14.431 11.384 -12.480 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -15.589 11.955 -13.686 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -13.142 12.542 -16.154 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -14.862 12.608 -15.757 1.00 0.00 H new ATOM 2104 N SER A 133 -9.979 8.242 -10.496 1.00 0.00 N ATOM 2105 CA SER A 133 -9.923 7.523 -9.228 1.00 0.00 C ATOM 2106 C SER A 133 -11.286 6.935 -8.877 1.00 0.00 C ATOM 2107 O SER A 133 -12.309 7.337 -9.430 1.00 0.00 O ATOM 2108 CB SER A 133 -9.454 8.455 -8.110 1.00 0.00 C ATOM 2109 OG SER A 133 -9.124 7.724 -6.942 1.00 0.00 O ATOM 0 H SER A 133 -9.792 9.242 -10.423 1.00 0.00 H new ATOM 0 HA SER A 133 -9.210 6.705 -9.333 1.00 0.00 H new ATOM 0 HB2 SER A 133 -8.586 9.022 -8.445 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.238 9.177 -7.882 1.00 0.00 H new ATOM 0 HG SER A 133 -8.825 8.342 -6.243 1.00 0.00 H new ATOM 2115 N GLY A 134 -11.291 5.979 -7.953 1.00 0.00 N ATOM 2116 CA GLY A 134 -12.533 5.350 -7.543 1.00 0.00 C ATOM 2117 C GLY A 134 -13.369 6.245 -6.650 1.00 0.00 C ATOM 2118 O GLY A 134 -12.848 6.994 -5.823 1.00 0.00 O ATOM 0 H GLY A 134 -10.457 5.629 -7.481 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.111 5.083 -8.428 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -12.310 4.422 -7.016 1.00 0.00 H new ATOM 2122 N PRO A 135 -14.699 6.175 -6.814 1.00 0.00 N ATOM 2123 CA PRO A 135 -15.637 6.980 -6.025 1.00 0.00 C ATOM 2124 C PRO A 135 -15.695 6.539 -4.566 1.00 0.00 C ATOM 2125 O PRO A 135 -15.658 5.346 -4.267 1.00 0.00 O ATOM 2126 CB PRO A 135 -16.982 6.732 -6.712 1.00 0.00 C ATOM 2127 CG PRO A 135 -16.832 5.403 -7.370 1.00 0.00 C ATOM 2128 CD PRO A 135 -15.389 5.305 -7.781 1.00 0.00 C ATOM 0 HA PRO A 135 -15.346 8.030 -5.993 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -17.800 6.727 -5.991 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -17.204 7.512 -7.441 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -17.099 4.597 -6.687 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -17.491 5.319 -8.234 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -15.025 4.279 -7.729 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -15.239 5.645 -8.806 1.00 0.00 H new ATOM 2136 N SER A 136 -15.786 7.510 -3.663 1.00 0.00 N ATOM 2137 CA SER A 136 -15.846 7.221 -2.235 1.00 0.00 C ATOM 2138 C SER A 136 -17.130 7.772 -1.623 1.00 0.00 C ATOM 2139 O SER A 136 -17.819 8.591 -2.231 1.00 0.00 O ATOM 2140 CB SER A 136 -14.631 7.818 -1.521 1.00 0.00 C ATOM 2141 OG SER A 136 -13.445 7.124 -1.867 1.00 0.00 O ATOM 0 H SER A 136 -15.820 8.503 -3.895 1.00 0.00 H new ATOM 0 HA SER A 136 -15.838 6.138 -2.108 1.00 0.00 H new ATOM 0 HB2 SER A 136 -14.531 8.871 -1.786 1.00 0.00 H new ATOM 0 HB3 SER A 136 -14.781 7.773 -0.442 1.00 0.00 H new ATOM 0 HG SER A 136 -12.683 7.525 -1.399 1.00 0.00 H new ATOM 2147 N SER A 137 -17.446 7.315 -0.415 1.00 0.00 N ATOM 2148 CA SER A 137 -18.649 7.758 0.279 1.00 0.00 C ATOM 2149 C SER A 137 -18.352 8.056 1.746 1.00 0.00 C ATOM 2150 O SER A 137 -17.780 7.230 2.455 1.00 0.00 O ATOM 2151 CB SER A 137 -19.744 6.694 0.176 1.00 0.00 C ATOM 2152 OG SER A 137 -19.372 5.511 0.861 1.00 0.00 O ATOM 0 H SER A 137 -16.885 6.638 0.103 1.00 0.00 H new ATOM 0 HA SER A 137 -18.996 8.675 -0.198 1.00 0.00 H new ATOM 0 HB2 SER A 137 -20.673 7.082 0.593 1.00 0.00 H new ATOM 0 HB3 SER A 137 -19.936 6.466 -0.872 1.00 0.00 H new ATOM 0 HG SER A 137 -18.661 5.715 1.503 1.00 0.00 H new ATOM 2158 N GLY A 138 -18.745 9.245 2.193 1.00 0.00 N ATOM 2159 CA GLY A 138 -18.512 9.633 3.572 1.00 0.00 C ATOM 2160 C GLY A 138 -17.037 9.688 3.918 1.00 0.00 C ATOM 2161 O GLY A 138 -16.596 9.064 4.883 1.00 0.00 O ATOM 0 H GLY A 138 -19.220 9.946 1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -18.961 10.610 3.752 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -19.011 8.926 4.234 1.00 0.00 H new TER 2165 GLY A 138