USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 849 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: B 106 G O2' : rot 9:sc= 0.145 USER MOD Set 1.2: B 107 U O3' : rot -109:sc= 0.166 USER MOD Set 2.1: A 50 TYR OH : rot 136:sc= 0.14 USER MOD Set 2.2: A 99 HIS : no HD1:sc= -0.359 X(o=-0.22,f=-0.39) USER MOD Set 3.1: A 44 TYR OH : rot 30:sc= 1.01 USER MOD Set 3.2: B 105 A O2' : rot -99:sc= 1.19 USER MOD Set 4.1: A 37 TYR OH : rot 89:sc= 0.744 USER MOD Set 4.2: A 75 MET CE :methyl -132:sc= -1.5 (180deg=-8.52!) USER MOD Set 5.1: A 22 THR OG1 : rot 180:sc= 1.04 USER MOD Set 5.2: A 25 THR OG1 : rot 66:sc= 1.05 USER MOD Set 6.1: A 13 MET CE :methyl 177:sc= -0.429 (180deg=-0.5) USER MOD Set 6.2: A 63 HIS : no HE2:sc= -0.879 K(o=-1.3,f=-3) USER MOD Single : A 1 MET CE :methyl 145:sc= -0.0275 (180deg=-0.412) USER MOD Single : A 1 MET N :NH3+ -160:sc= -0.0305 (180deg=-0.366) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 0:sc= -0.0401 USER MOD Single : A 14 THR OG1 : rot -150:sc= 0.00357 USER MOD Single : A 15 SER OG : rot 81:sc= 0.00169 USER MOD Single : A 17 LYS NZ :NH3+ 161:sc= 2.21 (180deg=1.32) USER MOD Single : A 20 ASN : amide:sc= 0.73 K(o=0.73,f=-0.0045) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0.263 USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0298 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.036 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 111:sc= 1.24 USER MOD Single : A 65 LYS NZ :NH3+ -132:sc= 1.25 (180deg=0.238) USER MOD Single : A 72 MET CE :methyl -139:sc= 0 (180deg=-1.18) USER MOD Single : A 88 GLN : amide:sc= 0.288 K(o=0.29,f=-2.4!) USER MOD Single : A 89 MET CE :methyl 127:sc= -0.0763 (180deg=-0.18) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= 0.48 K(o=0.48,f=-5.4!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : B 102 U O2' : rot -20:sc= 0.329 USER MOD Single : B 102 U O5' : rot 180:sc= 0 USER MOD Single : B 103 C O2' : rot 26:sc= 0.207 USER MOD Single : B 104 C O2' : rot -151:sc= 1.23 USER MOD Single : B 107 U O2' : rot -25:sc= 0.483 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.803 19.413 3.457 1.00 0.00 N ATOM 2 CA MET A 1 0.358 18.231 4.226 1.00 0.00 C ATOM 3 C MET A 1 -1.128 18.340 4.556 1.00 0.00 C ATOM 4 O MET A 1 -1.513 19.084 5.455 1.00 0.00 O ATOM 5 CB MET A 1 1.172 18.082 5.521 1.00 0.00 C ATOM 6 CG MET A 1 2.636 17.769 5.212 1.00 0.00 C ATOM 7 SD MET A 1 3.703 17.665 6.672 1.00 0.00 S ATOM 8 CE MET A 1 2.938 16.265 7.530 1.00 0.00 C ATOM 0 H1 MET A 1 1.686 19.189 2.956 1.00 0.00 H new ATOM 0 H2 MET A 1 0.070 19.674 2.767 1.00 0.00 H new ATOM 0 H3 MET A 1 0.966 20.209 4.107 1.00 0.00 H new ATOM 0 HA MET A 1 0.522 17.347 3.610 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.108 19.001 6.104 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.747 17.286 6.133 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.687 16.824 4.672 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.027 18.538 4.546 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.709 15.681 8.033 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.225 16.635 8.267 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.419 15.635 6.808 1.00 0.00 H new ATOM 18 N SER A 2 -1.965 17.592 3.830 1.00 0.00 N ATOM 19 CA SER A 2 -3.404 17.579 4.060 1.00 0.00 C ATOM 20 C SER A 2 -4.011 16.277 3.541 1.00 0.00 C ATOM 21 O SER A 2 -3.377 15.552 2.771 1.00 0.00 O ATOM 22 CB SER A 2 -4.052 18.772 3.361 1.00 0.00 C ATOM 23 OG SER A 2 -3.787 18.726 1.975 1.00 0.00 O ATOM 0 H SER A 2 -1.661 16.983 3.071 1.00 0.00 H new ATOM 0 HA SER A 2 -3.590 17.649 5.132 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.128 18.764 3.534 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.669 19.702 3.782 1.00 0.00 H new ATOM 0 HG SER A 2 -4.208 19.494 1.536 1.00 0.00 H new ATOM 29 N TYR A 3 -5.244 15.985 3.966 1.00 0.00 N ATOM 30 CA TYR A 3 -5.946 14.764 3.598 1.00 0.00 C ATOM 31 C TYR A 3 -7.439 15.038 3.455 1.00 0.00 C ATOM 32 O TYR A 3 -7.892 16.164 3.652 1.00 0.00 O ATOM 33 CB TYR A 3 -5.688 13.685 4.655 1.00 0.00 C ATOM 34 CG TYR A 3 -4.212 13.431 4.870 1.00 0.00 C ATOM 35 CD1 TYR A 3 -3.498 14.195 5.805 1.00 0.00 C ATOM 36 CD2 TYR A 3 -3.556 12.448 4.116 1.00 0.00 C ATOM 37 CE1 TYR A 3 -2.118 14.008 5.956 1.00 0.00 C ATOM 38 CE2 TYR A 3 -2.179 12.237 4.275 1.00 0.00 C ATOM 39 CZ TYR A 3 -1.453 13.035 5.183 1.00 0.00 C ATOM 40 OH TYR A 3 -0.105 12.872 5.306 1.00 0.00 O ATOM 0 H TYR A 3 -5.782 16.597 4.579 1.00 0.00 H new ATOM 0 HA TYR A 3 -5.574 14.408 2.637 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -6.143 13.988 5.598 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -6.173 12.758 4.350 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -4.013 14.928 6.409 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -4.114 11.851 3.410 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -1.565 14.608 6.663 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -1.678 11.468 3.706 1.00 0.00 H new ATOM 0 HH TYR A 3 0.242 13.506 5.968 1.00 0.00 H new ATOM 50 N GLY A 4 -8.211 14.006 3.109 1.00 0.00 N ATOM 51 CA GLY A 4 -9.640 14.149 2.898 1.00 0.00 C ATOM 52 C GLY A 4 -10.314 12.799 2.714 1.00 0.00 C ATOM 53 O GLY A 4 -9.651 11.761 2.703 1.00 0.00 O ATOM 0 H GLY A 4 -7.861 13.058 2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.084 14.666 3.749 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.819 14.769 2.019 1.00 0.00 H new ATOM 57 N ARG A 5 -11.641 12.820 2.570 1.00 0.00 N ATOM 58 CA ARG A 5 -12.446 11.635 2.362 1.00 0.00 C ATOM 59 C ARG A 5 -11.940 10.853 1.144 1.00 0.00 C ATOM 60 O ARG A 5 -11.421 11.440 0.193 1.00 0.00 O ATOM 61 CB ARG A 5 -13.913 12.051 2.208 1.00 0.00 C ATOM 62 CG ARG A 5 -14.141 12.838 0.914 1.00 0.00 C ATOM 63 CD ARG A 5 -15.573 13.372 0.861 1.00 0.00 C ATOM 64 NE ARG A 5 -15.834 14.024 -0.428 1.00 0.00 N ATOM 65 CZ ARG A 5 -16.373 15.237 -0.584 1.00 0.00 C ATOM 66 NH1 ARG A 5 -16.709 15.982 0.466 1.00 0.00 N ATOM 67 NH2 ARG A 5 -16.579 15.716 -1.807 1.00 0.00 N ATOM 0 H ARG A 5 -12.187 13.681 2.597 1.00 0.00 H new ATOM 0 HA ARG A 5 -12.365 10.971 3.222 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -14.546 11.164 2.212 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -14.211 12.659 3.062 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -13.435 13.666 0.855 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -13.953 12.197 0.053 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -16.278 12.554 1.010 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -15.732 14.082 1.673 1.00 0.00 H new ATOM 0 HE ARG A 5 -15.584 13.510 -1.273 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -16.556 15.630 1.411 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -17.119 16.905 0.326 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -16.326 15.158 -2.623 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -16.990 16.641 -1.930 1.00 0.00 H new ATOM 81 N PRO A 6 -12.093 9.527 1.174 1.00 0.00 N ATOM 82 CA PRO A 6 -11.647 8.626 0.124 1.00 0.00 C ATOM 83 C PRO A 6 -12.513 8.764 -1.128 1.00 0.00 C ATOM 84 O PRO A 6 -13.656 9.218 -1.038 1.00 0.00 O ATOM 85 CB PRO A 6 -11.781 7.233 0.735 1.00 0.00 C ATOM 86 CG PRO A 6 -12.916 7.385 1.745 1.00 0.00 C ATOM 87 CD PRO A 6 -12.713 8.806 2.265 1.00 0.00 C ATOM 0 HA PRO A 6 -10.628 8.840 -0.198 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -12.017 6.485 -0.022 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -10.856 6.917 1.217 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -13.893 7.260 1.278 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -12.848 6.647 2.545 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -13.662 9.261 2.548 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -12.079 8.814 3.152 1.00 0.00 H new ATOM 95 N PRO A 7 -11.985 8.376 -2.300 1.00 0.00 N ATOM 96 CA PRO A 7 -12.719 8.359 -3.555 1.00 0.00 C ATOM 97 C PRO A 7 -14.024 7.563 -3.453 1.00 0.00 C ATOM 98 O PRO A 7 -14.160 6.713 -2.573 1.00 0.00 O ATOM 99 CB PRO A 7 -11.767 7.720 -4.566 1.00 0.00 C ATOM 100 CG PRO A 7 -10.385 8.015 -3.996 1.00 0.00 C ATOM 101 CD PRO A 7 -10.621 7.924 -2.494 1.00 0.00 C ATOM 0 HA PRO A 7 -13.019 9.366 -3.847 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.942 6.648 -4.659 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -11.891 8.150 -5.560 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -9.644 7.291 -4.335 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -10.026 9.001 -4.291 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.489 6.903 -2.135 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -9.916 8.549 -1.945 1.00 0.00 H new ATOM 109 N PRO A 8 -14.985 7.830 -4.345 1.00 0.00 N ATOM 110 CA PRO A 8 -16.245 7.112 -4.413 1.00 0.00 C ATOM 111 C PRO A 8 -16.052 5.722 -5.015 1.00 0.00 C ATOM 112 O PRO A 8 -14.975 5.395 -5.515 1.00 0.00 O ATOM 113 CB PRO A 8 -17.137 7.976 -5.306 1.00 0.00 C ATOM 114 CG PRO A 8 -16.135 8.627 -6.262 1.00 0.00 C ATOM 115 CD PRO A 8 -14.918 8.859 -5.367 1.00 0.00 C ATOM 0 HA PRO A 8 -16.681 6.954 -3.426 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -17.875 7.377 -5.840 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -17.687 8.720 -4.729 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -15.899 7.978 -7.105 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -16.517 9.560 -6.675 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -13.992 8.786 -5.937 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -14.941 9.854 -4.924 1.00 0.00 H new ATOM 123 N ASP A 9 -17.109 4.906 -4.965 1.00 0.00 N ATOM 124 CA ASP A 9 -17.147 3.551 -5.505 1.00 0.00 C ATOM 125 C ASP A 9 -16.043 2.662 -4.934 1.00 0.00 C ATOM 126 O ASP A 9 -15.727 1.616 -5.503 1.00 0.00 O ATOM 127 CB ASP A 9 -17.117 3.595 -7.035 1.00 0.00 C ATOM 128 CG ASP A 9 -18.278 4.412 -7.591 1.00 0.00 C ATOM 129 OD1 ASP A 9 -19.436 3.972 -7.404 1.00 0.00 O ATOM 130 OD2 ASP A 9 -18.002 5.468 -8.205 1.00 0.00 O ATOM 0 H ASP A 9 -17.990 5.184 -4.532 1.00 0.00 H new ATOM 0 HA ASP A 9 -18.085 3.092 -5.193 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -16.174 4.026 -7.370 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -17.162 2.580 -7.431 1.00 0.00 H new ATOM 135 N VAL A 10 -15.444 3.067 -3.807 1.00 0.00 N ATOM 136 CA VAL A 10 -14.387 2.301 -3.165 1.00 0.00 C ATOM 137 C VAL A 10 -14.901 0.940 -2.684 1.00 0.00 C ATOM 138 O VAL A 10 -14.117 0.053 -2.347 1.00 0.00 O ATOM 139 CB VAL A 10 -13.783 3.128 -2.024 1.00 0.00 C ATOM 140 CG1 VAL A 10 -14.777 3.321 -0.878 1.00 0.00 C ATOM 141 CG2 VAL A 10 -12.505 2.485 -1.486 1.00 0.00 C ATOM 0 H VAL A 10 -15.682 3.932 -3.322 1.00 0.00 H new ATOM 0 HA VAL A 10 -13.601 2.092 -3.891 1.00 0.00 H new ATOM 0 HB VAL A 10 -13.540 4.105 -2.442 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -14.312 3.912 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.661 3.840 -1.247 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -15.067 2.348 -0.480 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -12.102 3.096 -0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -12.731 1.488 -1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.769 2.412 -2.287 1.00 0.00 H new ATOM 151 N GLU A 11 -16.228 0.766 -2.658 1.00 0.00 N ATOM 152 CA GLU A 11 -16.872 -0.486 -2.284 1.00 0.00 C ATOM 153 C GLU A 11 -16.708 -1.547 -3.374 1.00 0.00 C ATOM 154 O GLU A 11 -17.148 -2.682 -3.199 1.00 0.00 O ATOM 155 CB GLU A 11 -18.366 -0.229 -2.074 1.00 0.00 C ATOM 156 CG GLU A 11 -18.617 0.925 -1.104 1.00 0.00 C ATOM 157 CD GLU A 11 -18.060 0.650 0.292 1.00 0.00 C ATOM 158 OE1 GLU A 11 -18.234 -0.489 0.778 1.00 0.00 O ATOM 159 OE2 GLU A 11 -17.463 1.589 0.862 1.00 0.00 O ATOM 0 H GLU A 11 -16.888 1.505 -2.901 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.403 -0.853 -1.371 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -18.834 -0.005 -3.033 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.839 -1.133 -1.692 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.163 1.833 -1.500 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.689 1.109 -1.034 1.00 0.00 H new ATOM 166 N GLY A 12 -16.078 -1.182 -4.495 1.00 0.00 N ATOM 167 CA GLY A 12 -15.953 -2.062 -5.651 1.00 0.00 C ATOM 168 C GLY A 12 -14.638 -1.861 -6.404 1.00 0.00 C ATOM 169 O GLY A 12 -14.614 -1.959 -7.630 1.00 0.00 O ATOM 0 H GLY A 12 -15.642 -0.269 -4.622 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.025 -3.099 -5.323 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.787 -1.884 -6.330 1.00 0.00 H new ATOM 173 N MET A 13 -13.543 -1.583 -5.686 1.00 0.00 N ATOM 174 CA MET A 13 -12.228 -1.422 -6.295 1.00 0.00 C ATOM 175 C MET A 13 -11.189 -2.265 -5.552 1.00 0.00 C ATOM 176 O MET A 13 -11.480 -2.852 -4.510 1.00 0.00 O ATOM 177 CB MET A 13 -11.839 0.059 -6.340 1.00 0.00 C ATOM 178 CG MET A 13 -12.771 0.815 -7.281 1.00 0.00 C ATOM 179 SD MET A 13 -12.235 2.496 -7.684 1.00 0.00 S ATOM 180 CE MET A 13 -12.385 3.268 -6.053 1.00 0.00 C ATOM 0 H MET A 13 -13.549 -1.465 -4.673 1.00 0.00 H new ATOM 0 HA MET A 13 -12.264 -1.782 -7.323 1.00 0.00 H new ATOM 0 HB2 MET A 13 -11.893 0.488 -5.339 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.807 0.162 -6.676 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.870 0.248 -8.206 1.00 0.00 H new ATOM 0 HG3 MET A 13 -13.762 0.862 -6.829 1.00 0.00 H new ATOM 0 HE1 MET A 13 -12.041 4.301 -6.106 1.00 0.00 H new ATOM 0 HE2 MET A 13 -13.428 3.249 -5.736 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.777 2.720 -5.334 1.00 0.00 H new ATOM 190 N THR A 14 -9.971 -2.324 -6.100 1.00 0.00 N ATOM 191 CA THR A 14 -8.903 -3.192 -5.615 1.00 0.00 C ATOM 192 C THR A 14 -8.580 -2.959 -4.136 1.00 0.00 C ATOM 193 O THR A 14 -8.233 -3.906 -3.429 1.00 0.00 O ATOM 194 CB THR A 14 -7.662 -2.970 -6.482 1.00 0.00 C ATOM 195 OG1 THR A 14 -8.012 -3.103 -7.843 1.00 0.00 O ATOM 196 CG2 THR A 14 -6.585 -4.000 -6.162 1.00 0.00 C ATOM 0 H THR A 14 -9.699 -1.760 -6.905 1.00 0.00 H new ATOM 0 HA THR A 14 -9.239 -4.226 -5.692 1.00 0.00 H new ATOM 0 HB THR A 14 -7.277 -1.971 -6.277 1.00 0.00 H new ATOM 0 HG1 THR A 14 -7.240 -3.434 -8.348 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.713 -3.822 -6.791 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.300 -3.915 -5.113 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.971 -5.001 -6.353 1.00 0.00 H new ATOM 203 N SER A 15 -8.695 -1.706 -3.679 1.00 0.00 N ATOM 204 CA SER A 15 -8.487 -1.313 -2.288 1.00 0.00 C ATOM 205 C SER A 15 -7.275 -1.990 -1.645 1.00 0.00 C ATOM 206 O SER A 15 -7.345 -2.442 -0.505 1.00 0.00 O ATOM 207 CB SER A 15 -9.766 -1.558 -1.487 1.00 0.00 C ATOM 208 OG SER A 15 -10.810 -0.772 -2.017 1.00 0.00 O ATOM 0 H SER A 15 -8.941 -0.922 -4.284 1.00 0.00 H new ATOM 0 HA SER A 15 -8.259 -0.247 -2.278 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.035 -2.613 -1.525 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.605 -1.308 -0.438 1.00 0.00 H new ATOM 0 HG SER A 15 -11.182 -1.213 -2.809 1.00 0.00 H new ATOM 214 N LEU A 16 -6.162 -2.064 -2.377 1.00 0.00 N ATOM 215 CA LEU A 16 -4.931 -2.679 -1.891 1.00 0.00 C ATOM 216 C LEU A 16 -4.340 -1.794 -0.802 1.00 0.00 C ATOM 217 O LEU A 16 -3.929 -0.672 -1.093 1.00 0.00 O ATOM 218 CB LEU A 16 -3.994 -2.833 -3.091 1.00 0.00 C ATOM 219 CG LEU A 16 -2.616 -3.453 -2.834 1.00 0.00 C ATOM 220 CD1 LEU A 16 -1.609 -2.404 -2.375 1.00 0.00 C ATOM 221 CD2 LEU A 16 -2.673 -4.590 -1.824 1.00 0.00 C ATOM 0 H LEU A 16 -6.091 -1.697 -3.326 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.102 -3.662 -1.453 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.502 -3.440 -3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.843 -1.847 -3.530 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.286 -3.866 -3.787 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.643 -2.878 -2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.505 -1.639 -3.144 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.958 -1.944 -1.450 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.672 -4.996 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.056 -4.215 -0.875 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.332 -5.375 -2.196 1.00 0.00 H new ATOM 233 N LYS A 17 -4.291 -2.281 0.445 1.00 0.00 N ATOM 234 CA LYS A 17 -3.855 -1.453 1.558 1.00 0.00 C ATOM 235 C LYS A 17 -2.437 -1.762 2.034 1.00 0.00 C ATOM 236 O LYS A 17 -1.845 -2.758 1.626 1.00 0.00 O ATOM 237 CB LYS A 17 -4.871 -1.492 2.705 1.00 0.00 C ATOM 238 CG LYS A 17 -4.637 -2.593 3.751 1.00 0.00 C ATOM 239 CD LYS A 17 -5.605 -2.346 4.912 1.00 0.00 C ATOM 240 CE LYS A 17 -5.299 -3.238 6.111 1.00 0.00 C ATOM 241 NZ LYS A 17 -4.032 -2.858 6.759 1.00 0.00 N ATOM 0 H LYS A 17 -4.547 -3.235 0.699 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.811 -0.431 1.181 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.862 -0.526 3.210 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.867 -1.621 2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.807 -3.577 3.315 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.605 -2.574 4.102 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.549 -1.300 5.214 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.626 -2.527 4.577 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.113 -3.170 6.833 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.246 -4.278 5.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -4.006 -3.244 7.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -3.234 -3.240 6.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -3.960 -1.821 6.799 1.00 0.00 H new ATOM 255 N VAL A 18 -1.910 -0.894 2.900 1.00 0.00 N ATOM 256 CA VAL A 18 -0.549 -0.972 3.406 1.00 0.00 C ATOM 257 C VAL A 18 -0.533 -0.649 4.895 1.00 0.00 C ATOM 258 O VAL A 18 -1.232 0.273 5.318 1.00 0.00 O ATOM 259 CB VAL A 18 0.290 0.087 2.693 1.00 0.00 C ATOM 260 CG1 VAL A 18 1.715 0.126 3.242 1.00 0.00 C ATOM 261 CG2 VAL A 18 0.307 -0.107 1.178 1.00 0.00 C ATOM 0 H VAL A 18 -2.433 -0.102 3.274 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.156 -1.974 3.236 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.187 1.047 2.893 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.287 0.889 2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.689 0.362 4.306 1.00 0.00 H new ATOM 0 HG13 VAL A 18 2.187 -0.846 3.098 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.917 0.671 0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.727 -1.085 0.941 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.711 -0.046 0.792 1.00 0.00 H new ATOM 271 N ASP A 19 0.265 -1.404 5.660 1.00 0.00 N ATOM 272 CA ASP A 19 0.357 -1.298 7.113 1.00 0.00 C ATOM 273 C ASP A 19 1.673 -1.879 7.655 1.00 0.00 C ATOM 274 O ASP A 19 2.557 -2.275 6.898 1.00 0.00 O ATOM 275 CB ASP A 19 -0.840 -2.029 7.730 1.00 0.00 C ATOM 276 CG ASP A 19 -0.916 -3.491 7.306 1.00 0.00 C ATOM 277 OD1 ASP A 19 -1.456 -3.742 6.205 1.00 0.00 O ATOM 278 OD2 ASP A 19 -0.435 -4.342 8.086 1.00 0.00 O ATOM 0 H ASP A 19 0.877 -2.121 5.272 1.00 0.00 H new ATOM 0 HA ASP A 19 0.344 -0.243 7.386 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -0.775 -1.973 8.817 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -1.760 -1.522 7.439 1.00 0.00 H new ATOM 283 N ASN A 20 1.784 -1.920 8.989 1.00 0.00 N ATOM 284 CA ASN A 20 2.889 -2.483 9.768 1.00 0.00 C ATOM 285 C ASN A 20 4.132 -1.591 9.840 1.00 0.00 C ATOM 286 O ASN A 20 5.080 -1.942 10.541 1.00 0.00 O ATOM 287 CB ASN A 20 3.244 -3.900 9.295 1.00 0.00 C ATOM 288 CG ASN A 20 3.786 -4.742 10.440 1.00 0.00 C ATOM 289 OD1 ASN A 20 3.018 -5.280 11.235 1.00 0.00 O ATOM 290 ND2 ASN A 20 5.104 -4.873 10.544 1.00 0.00 N ATOM 0 H ASN A 20 1.055 -1.535 9.590 1.00 0.00 H new ATOM 0 HA ASN A 20 2.517 -2.540 10.791 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.359 -4.379 8.875 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.985 -3.845 8.498 1.00 0.00 H new ATOM 0 HD21 ASN A 20 5.503 -5.432 11.298 1.00 0.00 H new ATOM 0 HD22 ASN A 20 5.717 -4.415 9.869 1.00 0.00 H new ATOM 297 N LEU A 21 4.157 -0.453 9.137 1.00 0.00 N ATOM 298 CA LEU A 21 5.259 0.497 9.208 1.00 0.00 C ATOM 299 C LEU A 21 5.537 0.937 10.646 1.00 0.00 C ATOM 300 O LEU A 21 4.751 0.676 11.553 1.00 0.00 O ATOM 301 CB LEU A 21 5.029 1.680 8.249 1.00 0.00 C ATOM 302 CG LEU A 21 3.687 2.431 8.324 1.00 0.00 C ATOM 303 CD1 LEU A 21 2.485 1.547 7.987 1.00 0.00 C ATOM 304 CD2 LEU A 21 3.456 3.080 9.684 1.00 0.00 C ATOM 0 H LEU A 21 3.410 -0.170 8.503 1.00 0.00 H new ATOM 0 HA LEU A 21 6.165 -0.008 8.872 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.825 2.405 8.418 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.146 1.310 7.231 1.00 0.00 H new ATOM 0 HG LEU A 21 3.767 3.210 7.566 1.00 0.00 H new ATOM 0 HD11 LEU A 21 1.570 2.135 8.058 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.590 1.160 6.973 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.437 0.715 8.689 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.496 3.596 9.683 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.454 2.312 10.458 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.253 3.796 9.885 1.00 0.00 H new ATOM 316 N THR A 22 6.668 1.610 10.855 1.00 0.00 N ATOM 317 CA THR A 22 7.120 1.976 12.193 1.00 0.00 C ATOM 318 C THR A 22 6.243 3.053 12.816 1.00 0.00 C ATOM 319 O THR A 22 5.485 3.736 12.128 1.00 0.00 O ATOM 320 CB THR A 22 8.567 2.482 12.148 1.00 0.00 C ATOM 321 OG1 THR A 22 8.618 3.699 11.439 1.00 0.00 O ATOM 322 CG2 THR A 22 9.491 1.478 11.471 1.00 0.00 C ATOM 0 H THR A 22 7.291 1.914 10.107 1.00 0.00 H new ATOM 0 HA THR A 22 7.054 1.078 12.807 1.00 0.00 H new ATOM 0 HB THR A 22 8.903 2.623 13.175 1.00 0.00 H new ATOM 0 HG1 THR A 22 9.542 4.023 11.412 1.00 0.00 H new ATOM 0 HG21 THR A 22 10.508 1.871 11.458 1.00 0.00 H new ATOM 0 HG22 THR A 22 9.473 0.538 12.022 1.00 0.00 H new ATOM 0 HG23 THR A 22 9.155 1.306 10.448 1.00 0.00 H new ATOM 329 N TYR A 23 6.360 3.201 14.137 1.00 0.00 N ATOM 330 CA TYR A 23 5.696 4.257 14.880 1.00 0.00 C ATOM 331 C TYR A 23 6.381 5.606 14.639 1.00 0.00 C ATOM 332 O TYR A 23 6.039 6.597 15.283 1.00 0.00 O ATOM 333 CB TYR A 23 5.698 3.897 16.373 1.00 0.00 C ATOM 334 CG TYR A 23 7.081 3.821 16.984 1.00 0.00 C ATOM 335 CD1 TYR A 23 7.821 2.632 16.896 1.00 0.00 C ATOM 336 CD2 TYR A 23 7.619 4.936 17.641 1.00 0.00 C ATOM 337 CE1 TYR A 23 9.108 2.563 17.451 1.00 0.00 C ATOM 338 CE2 TYR A 23 8.900 4.874 18.202 1.00 0.00 C ATOM 339 CZ TYR A 23 9.654 3.688 18.104 1.00 0.00 C ATOM 340 OH TYR A 23 10.907 3.629 18.636 1.00 0.00 O ATOM 0 H TYR A 23 6.924 2.583 14.720 1.00 0.00 H new ATOM 0 HA TYR A 23 4.666 4.349 14.535 1.00 0.00 H new ATOM 0 HB2 TYR A 23 5.112 4.638 16.916 1.00 0.00 H new ATOM 0 HB3 TYR A 23 5.200 2.937 16.506 1.00 0.00 H new ATOM 0 HD1 TYR A 23 7.400 1.770 16.401 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.043 5.847 17.715 1.00 0.00 H new ATOM 0 HE1 TYR A 23 9.680 1.650 17.378 1.00 0.00 H new ATOM 0 HE2 TYR A 23 9.310 5.735 18.710 1.00 0.00 H new ATOM 0 HH TYR A 23 11.128 4.490 19.048 1.00 0.00 H new ATOM 350 N ARG A 24 7.345 5.647 13.709 1.00 0.00 N ATOM 351 CA ARG A 24 8.134 6.835 13.402 1.00 0.00 C ATOM 352 C ARG A 24 7.941 7.276 11.957 1.00 0.00 C ATOM 353 O ARG A 24 8.302 8.395 11.602 1.00 0.00 O ATOM 354 CB ARG A 24 9.613 6.544 13.671 1.00 0.00 C ATOM 355 CG ARG A 24 9.895 6.218 15.138 1.00 0.00 C ATOM 356 CD ARG A 24 9.556 7.402 16.042 1.00 0.00 C ATOM 357 NE ARG A 24 10.352 8.590 15.710 1.00 0.00 N ATOM 358 CZ ARG A 24 11.598 8.809 16.145 1.00 0.00 C ATOM 359 NH1 ARG A 24 12.216 7.931 16.929 1.00 0.00 N ATOM 360 NH2 ARG A 24 12.238 9.920 15.792 1.00 0.00 N ATOM 0 H ARG A 24 7.598 4.838 13.142 1.00 0.00 H new ATOM 0 HA ARG A 24 7.794 7.649 14.043 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.933 5.708 13.050 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.208 7.408 13.374 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.311 5.348 15.439 1.00 0.00 H new ATOM 0 HG3 ARG A 24 10.945 5.954 15.259 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.496 7.638 15.949 1.00 0.00 H new ATOM 0 HD3 ARG A 24 9.731 7.127 17.082 1.00 0.00 H new ATOM 0 HE ARG A 24 9.927 9.295 15.108 1.00 0.00 H new ATOM 0 HH11 ARG A 24 11.740 7.073 17.209 1.00 0.00 H new ATOM 0 HH12 ARG A 24 13.166 8.115 17.251 1.00 0.00 H new ATOM 0 HH21 ARG A 24 11.779 10.604 15.190 1.00 0.00 H new ATOM 0 HH22 ARG A 24 13.188 10.088 16.123 1.00 0.00 H new ATOM 374 N THR A 25 7.370 6.407 11.111 1.00 0.00 N ATOM 375 CA THR A 25 6.970 6.780 9.760 1.00 0.00 C ATOM 376 C THR A 25 5.766 7.725 9.855 1.00 0.00 C ATOM 377 O THR A 25 5.191 7.877 10.933 1.00 0.00 O ATOM 378 CB THR A 25 6.653 5.512 8.959 1.00 0.00 C ATOM 379 OG1 THR A 25 7.773 4.654 8.962 1.00 0.00 O ATOM 380 CG2 THR A 25 6.325 5.813 7.499 1.00 0.00 C ATOM 0 H THR A 25 7.176 5.434 11.348 1.00 0.00 H new ATOM 0 HA THR A 25 7.772 7.302 9.239 1.00 0.00 H new ATOM 0 HB THR A 25 5.787 5.053 9.435 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.938 4.335 9.874 1.00 0.00 H new ATOM 0 HG21 THR A 25 6.108 4.882 6.975 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.456 6.468 7.449 1.00 0.00 H new ATOM 0 HG23 THR A 25 7.177 6.304 7.028 1.00 0.00 H new ATOM 387 N SER A 26 5.382 8.359 8.749 1.00 0.00 N ATOM 388 CA SER A 26 4.288 9.324 8.735 1.00 0.00 C ATOM 389 C SER A 26 3.471 9.180 7.452 1.00 0.00 C ATOM 390 O SER A 26 3.968 8.644 6.462 1.00 0.00 O ATOM 391 CB SER A 26 4.869 10.733 8.866 1.00 0.00 C ATOM 392 OG SER A 26 5.456 10.883 10.143 1.00 0.00 O ATOM 0 H SER A 26 5.821 8.218 7.839 1.00 0.00 H new ATOM 0 HA SER A 26 3.618 9.138 9.574 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.614 10.905 8.089 1.00 0.00 H new ATOM 0 HB3 SER A 26 4.084 11.476 8.725 1.00 0.00 H new ATOM 0 HG SER A 26 5.830 11.785 10.227 1.00 0.00 H new ATOM 398 N PRO A 27 2.216 9.650 7.447 1.00 0.00 N ATOM 399 CA PRO A 27 1.304 9.460 6.330 1.00 0.00 C ATOM 400 C PRO A 27 1.711 10.268 5.099 1.00 0.00 C ATOM 401 O PRO A 27 1.313 9.925 3.987 1.00 0.00 O ATOM 402 CB PRO A 27 -0.065 9.895 6.850 1.00 0.00 C ATOM 403 CG PRO A 27 0.267 10.899 7.956 1.00 0.00 C ATOM 404 CD PRO A 27 1.580 10.379 8.529 1.00 0.00 C ATOM 0 HA PRO A 27 1.307 8.422 5.997 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.666 10.351 6.063 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.634 9.049 7.235 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.374 11.909 7.561 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.515 10.934 8.714 1.00 0.00 H new ATOM 0 HD2 PRO A 27 2.210 11.199 8.873 1.00 0.00 H new ATOM 0 HD3 PRO A 27 1.404 9.731 9.388 1.00 0.00 H new ATOM 412 N ASP A 28 2.505 11.332 5.274 1.00 0.00 N ATOM 413 CA ASP A 28 2.987 12.102 4.138 1.00 0.00 C ATOM 414 C ASP A 28 4.128 11.335 3.482 1.00 0.00 C ATOM 415 O ASP A 28 4.339 11.430 2.272 1.00 0.00 O ATOM 416 CB ASP A 28 3.491 13.455 4.622 1.00 0.00 C ATOM 417 CG ASP A 28 3.902 14.345 3.454 1.00 0.00 C ATOM 418 OD1 ASP A 28 2.992 14.798 2.723 1.00 0.00 O ATOM 419 OD2 ASP A 28 5.126 14.567 3.300 1.00 0.00 O ATOM 0 H ASP A 28 2.820 11.670 6.183 1.00 0.00 H new ATOM 0 HA ASP A 28 2.182 12.257 3.420 1.00 0.00 H new ATOM 0 HB2 ASP A 28 2.711 13.949 5.202 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.341 13.311 5.289 1.00 0.00 H new ATOM 424 N THR A 29 4.863 10.571 4.294 1.00 0.00 N ATOM 425 CA THR A 29 5.948 9.762 3.783 1.00 0.00 C ATOM 426 C THR A 29 5.364 8.638 2.950 1.00 0.00 C ATOM 427 O THR A 29 5.823 8.414 1.832 1.00 0.00 O ATOM 428 CB THR A 29 6.770 9.160 4.923 1.00 0.00 C ATOM 429 OG1 THR A 29 6.741 10.006 6.055 1.00 0.00 O ATOM 430 CG2 THR A 29 8.219 9.019 4.476 1.00 0.00 C ATOM 0 H THR A 29 4.720 10.502 5.302 1.00 0.00 H new ATOM 0 HA THR A 29 6.602 10.393 3.181 1.00 0.00 H new ATOM 0 HB THR A 29 6.346 8.189 5.180 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.270 9.606 6.776 1.00 0.00 H new ATOM 0 HG21 THR A 29 8.809 8.590 5.286 1.00 0.00 H new ATOM 0 HG22 THR A 29 8.269 8.366 3.605 1.00 0.00 H new ATOM 0 HG23 THR A 29 8.617 10.000 4.217 1.00 0.00 H new ATOM 437 N LEU A 30 4.356 7.933 3.474 1.00 0.00 N ATOM 438 CA LEU A 30 3.767 6.829 2.730 1.00 0.00 C ATOM 439 C LEU A 30 3.119 7.342 1.451 1.00 0.00 C ATOM 440 O LEU A 30 3.070 6.622 0.462 1.00 0.00 O ATOM 441 CB LEU A 30 2.726 6.100 3.572 1.00 0.00 C ATOM 442 CG LEU A 30 3.291 5.593 4.897 1.00 0.00 C ATOM 443 CD1 LEU A 30 2.137 5.030 5.717 1.00 0.00 C ATOM 444 CD2 LEU A 30 4.336 4.504 4.655 1.00 0.00 C ATOM 0 H LEU A 30 3.942 8.106 4.390 1.00 0.00 H new ATOM 0 HA LEU A 30 4.564 6.130 2.477 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.891 6.771 3.771 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.330 5.258 3.004 1.00 0.00 H new ATOM 0 HG LEU A 30 3.775 6.412 5.429 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.514 4.660 6.670 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.402 5.814 5.897 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.668 4.212 5.171 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.727 4.156 5.611 1.00 0.00 H new ATOM 0 HD22 LEU A 30 3.876 3.670 4.125 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.151 4.909 4.056 1.00 0.00 H new ATOM 456 N ARG A 31 2.622 8.583 1.457 1.00 0.00 N ATOM 457 CA ARG A 31 1.996 9.142 0.267 1.00 0.00 C ATOM 458 C ARG A 31 3.019 9.186 -0.866 1.00 0.00 C ATOM 459 O ARG A 31 2.695 8.827 -1.990 1.00 0.00 O ATOM 460 CB ARG A 31 1.427 10.533 0.597 1.00 0.00 C ATOM 461 CG ARG A 31 1.083 11.345 -0.660 1.00 0.00 C ATOM 462 CD ARG A 31 0.053 10.637 -1.529 1.00 0.00 C ATOM 463 NE ARG A 31 -0.049 11.278 -2.842 1.00 0.00 N ATOM 464 CZ ARG A 31 -0.939 12.215 -3.188 1.00 0.00 C ATOM 465 NH1 ARG A 31 -1.849 12.652 -2.320 1.00 0.00 N ATOM 466 NH2 ARG A 31 -0.905 12.711 -4.421 1.00 0.00 N ATOM 0 H ARG A 31 2.643 9.208 2.263 1.00 0.00 H new ATOM 0 HA ARG A 31 1.166 8.518 -0.063 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.531 10.419 1.208 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.152 11.085 1.194 1.00 0.00 H new ATOM 0 HG2 ARG A 31 0.700 12.323 -0.367 1.00 0.00 H new ATOM 0 HG3 ARG A 31 1.990 11.518 -1.240 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.331 9.590 -1.651 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.919 10.653 -1.035 1.00 0.00 H new ATOM 0 HE ARG A 31 0.618 10.984 -3.556 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.875 12.272 -1.374 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.520 13.367 -2.601 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.208 12.377 -5.086 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.576 13.426 -4.702 1.00 0.00 H new ATOM 480 N ARG A 32 4.249 9.617 -0.581 1.00 0.00 N ATOM 481 CA ARG A 32 5.267 9.768 -1.616 1.00 0.00 C ATOM 482 C ARG A 32 5.982 8.444 -1.873 1.00 0.00 C ATOM 483 O ARG A 32 6.288 8.108 -3.016 1.00 0.00 O ATOM 484 CB ARG A 32 6.265 10.829 -1.146 1.00 0.00 C ATOM 485 CG ARG A 32 7.400 11.016 -2.150 1.00 0.00 C ATOM 486 CD ARG A 32 8.378 12.056 -1.605 1.00 0.00 C ATOM 487 NE ARG A 32 9.497 12.263 -2.536 1.00 0.00 N ATOM 488 CZ ARG A 32 9.485 13.125 -3.557 1.00 0.00 C ATOM 489 NH1 ARG A 32 8.419 13.881 -3.804 1.00 0.00 N ATOM 490 NH2 ARG A 32 10.552 13.233 -4.342 1.00 0.00 N ATOM 0 H ARG A 32 4.562 9.867 0.357 1.00 0.00 H new ATOM 0 HA ARG A 32 4.800 10.074 -2.552 1.00 0.00 H new ATOM 0 HB2 ARG A 32 5.747 11.777 -1.000 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.677 10.539 -0.180 1.00 0.00 H new ATOM 0 HG2 ARG A 32 7.913 10.069 -2.320 1.00 0.00 H new ATOM 0 HG3 ARG A 32 7.003 11.340 -3.112 1.00 0.00 H new ATOM 0 HD2 ARG A 32 7.857 12.999 -1.440 1.00 0.00 H new ATOM 0 HD3 ARG A 32 8.760 11.730 -0.638 1.00 0.00 H new ATOM 0 HE ARG A 32 10.342 11.710 -2.392 1.00 0.00 H new ATOM 0 HH11 ARG A 32 7.593 13.808 -3.210 1.00 0.00 H new ATOM 0 HH12 ARG A 32 8.427 14.534 -4.588 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.376 12.659 -4.164 1.00 0.00 H new ATOM 0 HH22 ARG A 32 10.547 13.890 -5.122 1.00 0.00 H new ATOM 504 N VAL A 33 6.240 7.696 -0.801 1.00 0.00 N ATOM 505 CA VAL A 33 6.890 6.391 -0.861 1.00 0.00 C ATOM 506 C VAL A 33 6.104 5.426 -1.739 1.00 0.00 C ATOM 507 O VAL A 33 6.702 4.566 -2.375 1.00 0.00 O ATOM 508 CB VAL A 33 6.991 5.843 0.566 1.00 0.00 C ATOM 509 CG1 VAL A 33 7.265 4.345 0.605 1.00 0.00 C ATOM 510 CG2 VAL A 33 8.090 6.573 1.331 1.00 0.00 C ATOM 0 H VAL A 33 5.999 7.985 0.147 1.00 0.00 H new ATOM 0 HA VAL A 33 7.882 6.498 -1.300 1.00 0.00 H new ATOM 0 HB VAL A 33 6.022 6.014 1.035 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.326 4.013 1.641 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.457 3.814 0.101 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.208 4.134 0.100 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.153 6.176 2.344 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.044 6.428 0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 33 7.859 7.637 1.372 1.00 0.00 H new ATOM 520 N PHE A 34 4.777 5.557 -1.780 1.00 0.00 N ATOM 521 CA PHE A 34 3.928 4.625 -2.501 1.00 0.00 C ATOM 522 C PHE A 34 3.353 5.249 -3.767 1.00 0.00 C ATOM 523 O PHE A 34 2.771 4.548 -4.592 1.00 0.00 O ATOM 524 CB PHE A 34 2.816 4.162 -1.568 1.00 0.00 C ATOM 525 CG PHE A 34 3.260 3.073 -0.610 1.00 0.00 C ATOM 526 CD1 PHE A 34 3.878 3.406 0.603 1.00 0.00 C ATOM 527 CD2 PHE A 34 3.059 1.728 -0.946 1.00 0.00 C ATOM 528 CE1 PHE A 34 4.305 2.392 1.475 1.00 0.00 C ATOM 529 CE2 PHE A 34 3.478 0.716 -0.073 1.00 0.00 C ATOM 530 CZ PHE A 34 4.106 1.046 1.136 1.00 0.00 C ATOM 0 H PHE A 34 4.269 6.310 -1.315 1.00 0.00 H new ATOM 0 HA PHE A 34 4.525 3.771 -2.819 1.00 0.00 H new ATOM 0 HB2 PHE A 34 2.451 5.015 -0.996 1.00 0.00 H new ATOM 0 HB3 PHE A 34 1.979 3.796 -2.163 1.00 0.00 H new ATOM 0 HD1 PHE A 34 4.026 4.443 0.867 1.00 0.00 H new ATOM 0 HD2 PHE A 34 2.580 1.471 -1.879 1.00 0.00 H new ATOM 0 HE1 PHE A 34 4.787 2.649 2.407 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.317 -0.320 -0.332 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.436 0.265 1.805 1.00 0.00 H new ATOM 540 N GLU A 35 3.510 6.563 -3.931 1.00 0.00 N ATOM 541 CA GLU A 35 3.039 7.243 -5.134 1.00 0.00 C ATOM 542 C GLU A 35 3.856 6.826 -6.357 1.00 0.00 C ATOM 543 O GLU A 35 3.360 6.878 -7.482 1.00 0.00 O ATOM 544 CB GLU A 35 3.082 8.763 -4.929 1.00 0.00 C ATOM 545 CG GLU A 35 2.729 9.535 -6.194 1.00 0.00 C ATOM 546 CD GLU A 35 2.486 11.008 -5.882 1.00 0.00 C ATOM 547 OE1 GLU A 35 1.353 11.332 -5.459 1.00 0.00 O ATOM 548 OE2 GLU A 35 3.433 11.807 -6.074 1.00 0.00 O ATOM 0 H GLU A 35 3.958 7.174 -3.248 1.00 0.00 H new ATOM 0 HA GLU A 35 2.006 6.949 -5.318 1.00 0.00 H new ATOM 0 HB2 GLU A 35 2.389 9.038 -4.134 1.00 0.00 H new ATOM 0 HB3 GLU A 35 4.079 9.053 -4.597 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.537 9.441 -6.920 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.838 9.104 -6.651 1.00 0.00 H new ATOM 555 N LYS A 36 5.110 6.406 -6.153 1.00 0.00 N ATOM 556 CA LYS A 36 5.984 5.997 -7.244 1.00 0.00 C ATOM 557 C LYS A 36 5.525 4.685 -7.877 1.00 0.00 C ATOM 558 O LYS A 36 5.901 4.371 -9.003 1.00 0.00 O ATOM 559 CB LYS A 36 7.418 5.879 -6.723 1.00 0.00 C ATOM 560 CG LYS A 36 7.593 4.681 -5.784 1.00 0.00 C ATOM 561 CD LYS A 36 9.026 4.592 -5.249 1.00 0.00 C ATOM 562 CE LYS A 36 9.376 5.820 -4.404 1.00 0.00 C ATOM 563 NZ LYS A 36 10.751 5.728 -3.879 1.00 0.00 N ATOM 0 H LYS A 36 5.540 6.342 -5.230 1.00 0.00 H new ATOM 0 HA LYS A 36 5.942 6.756 -8.026 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.103 5.782 -7.566 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.689 6.794 -6.197 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.897 4.766 -4.950 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.344 3.762 -6.314 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.138 3.689 -4.648 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.724 4.509 -6.082 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.273 6.722 -5.007 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.672 5.908 -3.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.963 6.572 -3.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.840 4.879 -3.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.422 5.667 -4.671 1.00 0.00 H new ATOM 577 N TYR A 37 4.714 3.922 -7.142 1.00 0.00 N ATOM 578 CA TYR A 37 4.168 2.656 -7.613 1.00 0.00 C ATOM 579 C TYR A 37 2.957 2.885 -8.525 1.00 0.00 C ATOM 580 O TYR A 37 2.473 1.940 -9.148 1.00 0.00 O ATOM 581 CB TYR A 37 3.808 1.773 -6.414 1.00 0.00 C ATOM 582 CG TYR A 37 5.023 1.368 -5.616 1.00 0.00 C ATOM 583 CD1 TYR A 37 5.631 2.287 -4.745 1.00 0.00 C ATOM 584 CD2 TYR A 37 5.557 0.081 -5.754 1.00 0.00 C ATOM 585 CE1 TYR A 37 6.781 1.932 -4.030 1.00 0.00 C ATOM 586 CE2 TYR A 37 6.710 -0.282 -5.042 1.00 0.00 C ATOM 587 CZ TYR A 37 7.336 0.647 -4.188 1.00 0.00 C ATOM 588 OH TYR A 37 8.470 0.311 -3.518 1.00 0.00 O ATOM 0 H TYR A 37 4.418 4.170 -6.198 1.00 0.00 H new ATOM 0 HA TYR A 37 4.924 2.142 -8.207 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.113 2.308 -5.767 1.00 0.00 H new ATOM 0 HB3 TYR A 37 3.292 0.879 -6.766 1.00 0.00 H new ATOM 0 HD1 TYR A 37 5.209 3.274 -4.626 1.00 0.00 H new ATOM 0 HD2 TYR A 37 5.081 -0.633 -6.409 1.00 0.00 H new ATOM 0 HE1 TYR A 37 7.242 2.642 -3.359 1.00 0.00 H new ATOM 0 HE2 TYR A 37 7.119 -1.276 -5.149 1.00 0.00 H new ATOM 0 HH TYR A 37 8.234 -0.068 -2.645 1.00 0.00 H new ATOM 598 N GLY A 38 2.469 4.128 -8.613 1.00 0.00 N ATOM 599 CA GLY A 38 1.400 4.496 -9.531 1.00 0.00 C ATOM 600 C GLY A 38 0.620 5.683 -8.989 1.00 0.00 C ATOM 601 O GLY A 38 0.894 6.832 -9.337 1.00 0.00 O ATOM 0 H GLY A 38 2.809 4.904 -8.046 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.819 4.743 -10.506 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.730 3.649 -9.677 1.00 0.00 H new ATOM 605 N ARG A 39 -0.355 5.387 -8.129 1.00 0.00 N ATOM 606 CA ARG A 39 -1.086 6.378 -7.355 1.00 0.00 C ATOM 607 C ARG A 39 -1.558 5.682 -6.087 1.00 0.00 C ATOM 608 O ARG A 39 -2.195 4.636 -6.159 1.00 0.00 O ATOM 609 CB ARG A 39 -2.256 6.960 -8.165 1.00 0.00 C ATOM 610 CG ARG A 39 -3.397 5.961 -8.399 1.00 0.00 C ATOM 611 CD ARG A 39 -4.504 6.552 -9.270 1.00 0.00 C ATOM 612 NE ARG A 39 -5.071 7.767 -8.671 1.00 0.00 N ATOM 613 CZ ARG A 39 -6.083 8.464 -9.198 1.00 0.00 C ATOM 614 NH1 ARG A 39 -6.659 8.077 -10.331 1.00 0.00 N ATOM 615 NH2 ARG A 39 -6.524 9.562 -8.587 1.00 0.00 N ATOM 0 H ARG A 39 -0.661 4.431 -7.951 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.451 7.227 -7.103 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -2.649 7.833 -7.644 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -1.883 7.306 -9.129 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -3.001 5.063 -8.875 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -3.814 5.656 -7.439 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -4.106 6.784 -10.258 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -5.292 5.812 -9.410 1.00 0.00 H new ATOM 0 HE ARG A 39 -4.667 8.101 -7.796 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -6.330 7.239 -10.810 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -7.430 8.618 -10.722 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -6.090 9.871 -7.717 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -7.296 10.094 -8.989 1.00 0.00 H new ATOM 629 N VAL A 40 -1.244 6.260 -4.930 1.00 0.00 N ATOM 630 CA VAL A 40 -1.613 5.675 -3.644 1.00 0.00 C ATOM 631 C VAL A 40 -3.112 5.441 -3.539 1.00 0.00 C ATOM 632 O VAL A 40 -3.540 4.636 -2.718 1.00 0.00 O ATOM 633 CB VAL A 40 -1.140 6.542 -2.475 1.00 0.00 C ATOM 634 CG1 VAL A 40 0.366 6.749 -2.564 1.00 0.00 C ATOM 635 CG2 VAL A 40 -1.847 7.901 -2.448 1.00 0.00 C ATOM 0 H VAL A 40 -0.731 7.139 -4.857 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.110 4.710 -3.587 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.391 6.019 -1.552 1.00 0.00 H new ATOM 0 HG11 VAL A 40 0.698 7.367 -1.730 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.869 5.783 -2.523 1.00 0.00 H new ATOM 0 HG13 VAL A 40 0.610 7.246 -3.503 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.482 8.484 -1.603 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.641 8.437 -3.375 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.922 7.750 -2.347 1.00 0.00 H new ATOM 645 N GLY A 41 -3.902 6.142 -4.365 1.00 0.00 N ATOM 646 CA GLY A 41 -5.352 6.032 -4.426 1.00 0.00 C ATOM 647 C GLY A 41 -6.026 6.710 -3.239 1.00 0.00 C ATOM 648 O GLY A 41 -6.950 7.500 -3.419 1.00 0.00 O ATOM 0 H GLY A 41 -3.529 6.822 -5.028 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.711 6.481 -5.352 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.635 4.980 -4.451 1.00 0.00 H new ATOM 652 N ASP A 42 -5.558 6.404 -2.026 1.00 0.00 N ATOM 653 CA ASP A 42 -6.022 7.021 -0.797 1.00 0.00 C ATOM 654 C ASP A 42 -4.983 6.777 0.296 1.00 0.00 C ATOM 655 O ASP A 42 -4.125 5.906 0.157 1.00 0.00 O ATOM 656 CB ASP A 42 -7.370 6.409 -0.415 1.00 0.00 C ATOM 657 CG ASP A 42 -7.967 7.084 0.808 1.00 0.00 C ATOM 658 OD1 ASP A 42 -7.979 8.333 0.809 1.00 0.00 O ATOM 659 OD2 ASP A 42 -8.403 6.355 1.729 1.00 0.00 O ATOM 0 H ASP A 42 -4.831 5.705 -1.876 1.00 0.00 H new ATOM 0 HA ASP A 42 -6.151 8.096 -0.926 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -8.061 6.498 -1.253 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -7.244 5.344 -0.218 1.00 0.00 H new ATOM 664 N VAL A 43 -5.048 7.541 1.390 1.00 0.00 N ATOM 665 CA VAL A 43 -4.087 7.425 2.480 1.00 0.00 C ATOM 666 C VAL A 43 -4.741 7.848 3.796 1.00 0.00 C ATOM 667 O VAL A 43 -5.393 8.888 3.869 1.00 0.00 O ATOM 668 CB VAL A 43 -2.841 8.259 2.152 1.00 0.00 C ATOM 669 CG1 VAL A 43 -3.207 9.671 1.676 1.00 0.00 C ATOM 670 CG2 VAL A 43 -1.904 8.339 3.357 1.00 0.00 C ATOM 0 H VAL A 43 -5.764 8.251 1.541 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.770 6.389 2.596 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.325 7.753 1.336 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.296 10.228 1.455 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.819 9.604 0.777 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -3.766 10.185 2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.029 8.935 3.099 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.426 8.804 4.193 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -1.588 7.335 3.640 1.00 0.00 H new ATOM 680 N TYR A 44 -4.564 7.031 4.841 1.00 0.00 N ATOM 681 CA TYR A 44 -5.128 7.300 6.152 1.00 0.00 C ATOM 682 C TYR A 44 -4.287 6.666 7.258 1.00 0.00 C ATOM 683 O TYR A 44 -3.359 5.910 6.977 1.00 0.00 O ATOM 684 CB TYR A 44 -6.560 6.777 6.214 1.00 0.00 C ATOM 685 CG TYR A 44 -7.300 7.310 7.418 1.00 0.00 C ATOM 686 CD1 TYR A 44 -7.522 8.690 7.530 1.00 0.00 C ATOM 687 CD2 TYR A 44 -7.742 6.437 8.426 1.00 0.00 C ATOM 688 CE1 TYR A 44 -8.165 9.207 8.662 1.00 0.00 C ATOM 689 CE2 TYR A 44 -8.393 6.953 9.557 1.00 0.00 C ATOM 690 CZ TYR A 44 -8.599 8.342 9.684 1.00 0.00 C ATOM 691 OH TYR A 44 -9.210 8.850 10.790 1.00 0.00 O ATOM 0 H TYR A 44 -4.024 6.167 4.793 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.129 8.379 6.310 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -7.091 7.062 5.306 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -6.548 5.688 6.248 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.197 9.355 6.743 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -7.581 5.373 8.331 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -8.328 10.271 8.751 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -8.737 6.284 10.332 1.00 0.00 H new ATOM 0 HH TYR A 44 -9.688 9.671 10.551 1.00 0.00 H new ATOM 701 N ILE A 45 -4.624 6.975 8.512 1.00 0.00 N ATOM 702 CA ILE A 45 -4.023 6.385 9.701 1.00 0.00 C ATOM 703 C ILE A 45 -5.143 6.162 10.720 1.00 0.00 C ATOM 704 O ILE A 45 -5.571 7.114 11.377 1.00 0.00 O ATOM 705 CB ILE A 45 -2.899 7.275 10.249 1.00 0.00 C ATOM 706 CG1 ILE A 45 -1.688 7.163 9.312 1.00 0.00 C ATOM 707 CG2 ILE A 45 -2.508 6.835 11.667 1.00 0.00 C ATOM 708 CD1 ILE A 45 -0.466 7.929 9.821 1.00 0.00 C ATOM 0 H ILE A 45 -5.344 7.663 8.730 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.554 5.430 9.466 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.241 8.309 10.297 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.426 6.112 9.190 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.962 7.540 8.327 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.710 7.477 12.040 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.374 6.914 12.324 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.162 5.802 11.645 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.357 7.811 9.116 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.713 8.986 9.917 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.169 7.536 10.793 1.00 0.00 H new ATOM 720 N PRO A 46 -5.617 4.913 10.852 1.00 0.00 N ATOM 721 CA PRO A 46 -6.638 4.453 11.797 1.00 0.00 C ATOM 722 C PRO A 46 -6.385 4.760 13.276 1.00 0.00 C ATOM 723 O PRO A 46 -7.068 4.209 14.141 1.00 0.00 O ATOM 724 CB PRO A 46 -6.713 2.941 11.597 1.00 0.00 C ATOM 725 CG PRO A 46 -6.291 2.758 10.147 1.00 0.00 C ATOM 726 CD PRO A 46 -5.198 3.809 10.006 1.00 0.00 C ATOM 0 HA PRO A 46 -7.560 4.993 11.582 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.048 2.412 12.279 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.719 2.561 11.774 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.918 1.752 9.953 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -7.116 2.931 9.456 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.231 3.416 10.322 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.089 4.127 8.969 1.00 0.00 H new ATOM 734 N ARG A 47 -5.419 5.627 13.577 1.00 0.00 N ATOM 735 CA ARG A 47 -5.088 6.029 14.933 1.00 0.00 C ATOM 736 C ARG A 47 -6.357 6.459 15.664 1.00 0.00 C ATOM 737 O ARG A 47 -7.214 7.118 15.077 1.00 0.00 O ATOM 738 CB ARG A 47 -4.047 7.146 14.823 1.00 0.00 C ATOM 739 CG ARG A 47 -3.543 7.684 16.154 1.00 0.00 C ATOM 740 CD ARG A 47 -2.466 8.724 15.843 1.00 0.00 C ATOM 741 NE ARG A 47 -1.703 9.079 17.039 1.00 0.00 N ATOM 742 CZ ARG A 47 -0.938 10.168 17.151 1.00 0.00 C ATOM 743 NH1 ARG A 47 -0.824 11.028 16.147 1.00 0.00 N ATOM 744 NH2 ARG A 47 -0.274 10.395 18.281 1.00 0.00 N ATOM 0 H ARG A 47 -4.837 6.075 12.869 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.666 5.212 15.518 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.196 6.775 14.252 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.478 7.970 14.254 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -4.359 8.133 16.721 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -3.135 6.879 16.765 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -1.791 8.334 15.082 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.931 9.618 15.428 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.759 8.453 17.842 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -1.325 10.862 15.274 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.236 11.855 16.248 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -0.350 9.739 19.058 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.311 11.226 18.371 1.00 0.00 H new ATOM 758 N ASP A 48 -6.479 6.088 16.942 1.00 0.00 N ATOM 759 CA ASP A 48 -7.684 6.335 17.721 1.00 0.00 C ATOM 760 C ASP A 48 -8.092 7.803 17.660 1.00 0.00 C ATOM 761 O ASP A 48 -7.254 8.700 17.772 1.00 0.00 O ATOM 762 CB ASP A 48 -7.473 5.888 19.167 1.00 0.00 C ATOM 763 CG ASP A 48 -7.127 4.407 19.249 1.00 0.00 C ATOM 764 OD1 ASP A 48 -8.074 3.589 19.202 1.00 0.00 O ATOM 765 OD2 ASP A 48 -5.916 4.107 19.358 1.00 0.00 O ATOM 0 H ASP A 48 -5.743 5.609 17.460 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.497 5.752 17.289 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.673 6.475 19.617 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -8.376 6.084 19.745 1.00 0.00 H new ATOM 770 N ARG A 49 -9.392 8.029 17.482 1.00 0.00 N ATOM 771 CA ARG A 49 -9.976 9.347 17.265 1.00 0.00 C ATOM 772 C ARG A 49 -10.095 10.162 18.556 1.00 0.00 C ATOM 773 O ARG A 49 -10.582 11.287 18.521 1.00 0.00 O ATOM 774 CB ARG A 49 -11.339 9.118 16.594 1.00 0.00 C ATOM 775 CG ARG A 49 -11.922 10.383 15.962 1.00 0.00 C ATOM 776 CD ARG A 49 -13.191 9.987 15.206 1.00 0.00 C ATOM 777 NE ARG A 49 -13.782 11.124 14.496 1.00 0.00 N ATOM 778 CZ ARG A 49 -14.472 12.110 15.070 1.00 0.00 C ATOM 779 NH1 ARG A 49 -14.694 12.128 16.384 1.00 0.00 N ATOM 780 NH2 ARG A 49 -14.947 13.102 14.320 1.00 0.00 N ATOM 0 H ARG A 49 -10.084 7.280 17.485 1.00 0.00 H new ATOM 0 HA ARG A 49 -9.327 9.946 16.626 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -11.234 8.352 15.826 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.041 8.733 17.334 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.150 11.123 16.729 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -11.200 10.839 15.284 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.957 9.196 14.493 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -13.919 9.579 15.907 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.656 11.164 13.485 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -14.333 11.377 16.973 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -15.225 12.893 16.801 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.782 13.104 13.313 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -15.476 13.860 14.752 1.00 0.00 H new ATOM 794 N TYR A 50 -9.657 9.610 19.692 1.00 0.00 N ATOM 795 CA TYR A 50 -9.787 10.292 20.981 1.00 0.00 C ATOM 796 C TYR A 50 -8.644 9.986 21.947 1.00 0.00 C ATOM 797 O TYR A 50 -8.512 10.669 22.964 1.00 0.00 O ATOM 798 CB TYR A 50 -11.082 9.856 21.665 1.00 0.00 C ATOM 799 CG TYR A 50 -12.312 9.878 20.797 1.00 0.00 C ATOM 800 CD1 TYR A 50 -12.976 11.086 20.546 1.00 0.00 C ATOM 801 CD2 TYR A 50 -12.786 8.675 20.250 1.00 0.00 C ATOM 802 CE1 TYR A 50 -14.124 11.095 19.739 1.00 0.00 C ATOM 803 CE2 TYR A 50 -13.934 8.678 19.451 1.00 0.00 C ATOM 804 CZ TYR A 50 -14.604 9.887 19.188 1.00 0.00 C ATOM 805 OH TYR A 50 -15.718 9.903 18.404 1.00 0.00 O ATOM 0 H TYR A 50 -9.210 8.694 19.744 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.775 11.359 20.757 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -10.947 8.845 22.049 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -11.254 10.503 22.525 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -12.606 12.007 20.972 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -12.265 7.749 20.446 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -14.639 12.023 19.540 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -14.306 7.753 19.036 1.00 0.00 H new ATOM 0 HH TYR A 50 -15.569 9.345 17.612 1.00 0.00 H new ATOM 815 N THR A 51 -7.824 8.971 21.652 1.00 0.00 N ATOM 816 CA THR A 51 -6.784 8.522 22.569 1.00 0.00 C ATOM 817 C THR A 51 -5.432 8.411 21.863 1.00 0.00 C ATOM 818 O THR A 51 -4.399 8.292 22.519 1.00 0.00 O ATOM 819 CB THR A 51 -7.199 7.187 23.184 1.00 0.00 C ATOM 820 OG1 THR A 51 -7.210 6.192 22.189 1.00 0.00 O ATOM 821 CG2 THR A 51 -8.613 7.272 23.771 1.00 0.00 C ATOM 0 H THR A 51 -7.866 8.446 20.779 1.00 0.00 H new ATOM 0 HA THR A 51 -6.667 9.259 23.363 1.00 0.00 H new ATOM 0 HB THR A 51 -6.485 6.946 23.972 1.00 0.00 H new ATOM 0 HG1 THR A 51 -7.475 5.336 22.585 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.886 6.309 24.203 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.640 8.038 24.546 1.00 0.00 H new ATOM 0 HG23 THR A 51 -9.320 7.529 22.982 1.00 0.00 H new ATOM 828 N LYS A 52 -5.450 8.459 20.525 1.00 0.00 N ATOM 829 CA LYS A 52 -4.282 8.490 19.658 1.00 0.00 C ATOM 830 C LYS A 52 -3.230 7.403 19.920 1.00 0.00 C ATOM 831 O LYS A 52 -2.065 7.587 19.567 1.00 0.00 O ATOM 832 CB LYS A 52 -3.674 9.897 19.725 1.00 0.00 C ATOM 833 CG LYS A 52 -4.685 10.952 19.271 1.00 0.00 C ATOM 834 CD LYS A 52 -4.033 12.336 19.313 1.00 0.00 C ATOM 835 CE LYS A 52 -5.040 13.397 18.873 1.00 0.00 C ATOM 836 NZ LYS A 52 -4.449 14.749 18.913 1.00 0.00 N ATOM 0 H LYS A 52 -6.324 8.478 20.000 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.628 8.257 18.651 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.353 10.110 20.745 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.786 9.944 19.095 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -5.028 10.731 18.260 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -5.562 10.932 19.917 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.681 12.552 20.322 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.160 12.357 18.660 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -5.383 13.178 17.862 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -5.915 13.361 19.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -5.158 15.447 18.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -4.144 14.966 19.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -3.629 14.788 18.275 1.00 0.00 H new ATOM 850 N GLU A 53 -3.605 6.276 20.530 1.00 0.00 N ATOM 851 CA GLU A 53 -2.665 5.234 20.942 1.00 0.00 C ATOM 852 C GLU A 53 -2.261 4.283 19.816 1.00 0.00 C ATOM 853 O GLU A 53 -1.475 3.365 20.052 1.00 0.00 O ATOM 854 CB GLU A 53 -3.291 4.394 22.056 1.00 0.00 C ATOM 855 CG GLU A 53 -3.905 5.304 23.110 1.00 0.00 C ATOM 856 CD GLU A 53 -4.386 4.511 24.319 1.00 0.00 C ATOM 857 OE1 GLU A 53 -5.537 4.016 24.277 1.00 0.00 O ATOM 858 OE2 GLU A 53 -3.598 4.396 25.286 1.00 0.00 O ATOM 0 H GLU A 53 -4.577 6.061 20.753 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.768 5.757 21.272 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -4.055 3.736 21.641 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.534 3.756 22.511 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.170 6.043 23.427 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -4.741 5.852 22.677 1.00 0.00 H new ATOM 865 N SER A 54 -2.782 4.479 18.605 1.00 0.00 N ATOM 866 CA SER A 54 -2.586 3.520 17.519 1.00 0.00 C ATOM 867 C SER A 54 -1.824 4.098 16.324 1.00 0.00 C ATOM 868 O SER A 54 -2.085 3.719 15.185 1.00 0.00 O ATOM 869 CB SER A 54 -3.927 2.919 17.093 1.00 0.00 C ATOM 870 OG SER A 54 -4.525 2.246 18.178 1.00 0.00 O ATOM 0 H SER A 54 -3.343 5.293 18.352 1.00 0.00 H new ATOM 0 HA SER A 54 -1.951 2.726 17.911 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.589 3.707 16.734 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.777 2.227 16.264 1.00 0.00 H new ATOM 0 HG SER A 54 -5.318 2.740 18.473 1.00 0.00 H new ATOM 876 N ARG A 55 -0.876 5.014 16.572 1.00 0.00 N ATOM 877 CA ARG A 55 0.005 5.542 15.526 1.00 0.00 C ATOM 878 C ARG A 55 0.977 4.464 15.023 1.00 0.00 C ATOM 879 O ARG A 55 1.805 4.735 14.158 1.00 0.00 O ATOM 880 CB ARG A 55 0.782 6.743 16.079 1.00 0.00 C ATOM 881 CG ARG A 55 1.267 7.648 14.948 1.00 0.00 C ATOM 882 CD ARG A 55 2.162 8.760 15.495 1.00 0.00 C ATOM 883 NE ARG A 55 2.555 9.698 14.431 1.00 0.00 N ATOM 884 CZ ARG A 55 3.454 9.427 13.477 1.00 0.00 C ATOM 885 NH1 ARG A 55 4.083 8.257 13.440 1.00 0.00 N ATOM 886 NH2 ARG A 55 3.728 10.335 12.547 1.00 0.00 N ATOM 0 H ARG A 55 -0.701 5.406 17.497 1.00 0.00 H new ATOM 0 HA ARG A 55 -0.605 5.858 14.680 1.00 0.00 H new ATOM 0 HB2 ARG A 55 0.146 7.312 16.757 1.00 0.00 H new ATOM 0 HB3 ARG A 55 1.635 6.393 16.661 1.00 0.00 H new ATOM 0 HG2 ARG A 55 1.817 7.059 14.214 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.412 8.083 14.431 1.00 0.00 H new ATOM 0 HD2 ARG A 55 1.636 9.299 16.283 1.00 0.00 H new ATOM 0 HD3 ARG A 55 3.053 8.324 15.947 1.00 0.00 H new ATOM 0 HE ARG A 55 2.112 10.617 14.420 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.884 7.548 14.146 1.00 0.00 H new ATOM 0 HH12 ARG A 55 4.765 8.068 12.706 1.00 0.00 H new ATOM 0 HH21 ARG A 55 3.254 11.238 12.560 1.00 0.00 H new ATOM 0 HH22 ARG A 55 4.413 10.129 11.820 1.00 0.00 H new ATOM 900 N GLY A 56 0.883 3.248 15.561 1.00 0.00 N ATOM 901 CA GLY A 56 1.783 2.145 15.248 1.00 0.00 C ATOM 902 C GLY A 56 1.709 1.670 13.797 1.00 0.00 C ATOM 903 O GLY A 56 2.538 0.861 13.386 1.00 0.00 O ATOM 0 H GLY A 56 0.163 3.000 16.240 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.806 2.452 15.467 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.554 1.306 15.905 1.00 0.00 H new ATOM 907 N PHE A 57 0.739 2.151 13.015 1.00 0.00 N ATOM 908 CA PHE A 57 0.598 1.746 11.624 1.00 0.00 C ATOM 909 C PHE A 57 -0.203 2.781 10.840 1.00 0.00 C ATOM 910 O PHE A 57 -0.584 3.819 11.377 1.00 0.00 O ATOM 911 CB PHE A 57 -0.059 0.369 11.565 1.00 0.00 C ATOM 912 CG PHE A 57 -1.535 0.401 11.854 1.00 0.00 C ATOM 913 CD1 PHE A 57 -1.995 0.648 13.154 1.00 0.00 C ATOM 914 CD2 PHE A 57 -2.444 0.194 10.808 1.00 0.00 C ATOM 915 CE1 PHE A 57 -3.373 0.694 13.406 1.00 0.00 C ATOM 916 CE2 PHE A 57 -3.818 0.251 11.060 1.00 0.00 C ATOM 917 CZ PHE A 57 -4.286 0.489 12.359 1.00 0.00 C ATOM 0 H PHE A 57 0.039 2.824 13.328 1.00 0.00 H new ATOM 0 HA PHE A 57 1.583 1.683 11.162 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.101 -0.060 10.576 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.430 -0.290 12.282 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.291 0.802 13.958 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -2.084 -0.009 9.810 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -3.733 0.887 14.406 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -4.520 0.111 10.251 1.00 0.00 H new ATOM 0 HZ PHE A 57 -5.348 0.515 12.555 1.00 0.00 H new ATOM 927 N ALA A 58 -0.453 2.484 9.565 1.00 0.00 N ATOM 928 CA ALA A 58 -1.212 3.347 8.673 1.00 0.00 C ATOM 929 C ALA A 58 -2.082 2.513 7.737 1.00 0.00 C ATOM 930 O ALA A 58 -2.119 1.290 7.837 1.00 0.00 O ATOM 931 CB ALA A 58 -0.250 4.227 7.875 1.00 0.00 C ATOM 0 H ALA A 58 -0.128 1.625 9.121 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.869 3.985 9.264 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.818 4.874 7.206 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.337 4.839 8.560 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.418 3.597 7.289 1.00 0.00 H new ATOM 937 N PHE A 59 -2.780 3.189 6.825 1.00 0.00 N ATOM 938 CA PHE A 59 -3.709 2.560 5.912 1.00 0.00 C ATOM 939 C PHE A 59 -3.691 3.273 4.559 1.00 0.00 C ATOM 940 O PHE A 59 -4.572 4.083 4.268 1.00 0.00 O ATOM 941 CB PHE A 59 -5.099 2.607 6.558 1.00 0.00 C ATOM 942 CG PHE A 59 -6.160 1.706 5.962 1.00 0.00 C ATOM 943 CD1 PHE A 59 -6.150 1.336 4.609 1.00 0.00 C ATOM 944 CD2 PHE A 59 -7.181 1.239 6.794 1.00 0.00 C ATOM 945 CE1 PHE A 59 -7.138 0.479 4.101 1.00 0.00 C ATOM 946 CE2 PHE A 59 -8.174 0.394 6.288 1.00 0.00 C ATOM 947 CZ PHE A 59 -8.146 0.002 4.948 1.00 0.00 C ATOM 0 H PHE A 59 -2.709 4.199 6.705 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.428 1.523 5.725 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.992 2.354 7.613 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -5.461 3.634 6.512 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.378 1.713 3.955 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.203 1.532 7.833 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.121 0.188 3.061 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -8.964 0.044 6.935 1.00 0.00 H new ATOM 0 HZ PHE A 59 -8.901 -0.669 4.565 1.00 0.00 H new ATOM 957 N VAL A 60 -2.690 2.983 3.722 1.00 0.00 N ATOM 958 CA VAL A 60 -2.727 3.452 2.337 1.00 0.00 C ATOM 959 C VAL A 60 -3.711 2.550 1.598 1.00 0.00 C ATOM 960 O VAL A 60 -3.979 1.458 2.085 1.00 0.00 O ATOM 961 CB VAL A 60 -1.333 3.415 1.703 1.00 0.00 C ATOM 962 CG1 VAL A 60 -1.372 3.820 0.231 1.00 0.00 C ATOM 963 CG2 VAL A 60 -0.394 4.373 2.432 1.00 0.00 C ATOM 0 H VAL A 60 -1.864 2.439 3.972 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.050 4.492 2.283 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.974 2.389 1.784 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.365 3.782 -0.184 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.017 3.134 -0.318 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.762 4.834 0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.593 4.336 1.971 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.787 5.388 2.367 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.316 4.080 3.479 1.00 0.00 H new ATOM 973 N ARG A 61 -4.255 2.967 0.445 1.00 0.00 N ATOM 974 CA ARG A 61 -5.235 2.160 -0.269 1.00 0.00 C ATOM 975 C ARG A 61 -5.306 2.508 -1.761 1.00 0.00 C ATOM 976 O ARG A 61 -5.885 3.525 -2.133 1.00 0.00 O ATOM 977 CB ARG A 61 -6.604 2.354 0.392 1.00 0.00 C ATOM 978 CG ARG A 61 -7.717 1.720 -0.441 1.00 0.00 C ATOM 979 CD ARG A 61 -9.060 1.767 0.288 1.00 0.00 C ATOM 980 NE ARG A 61 -9.310 3.084 0.883 1.00 0.00 N ATOM 981 CZ ARG A 61 -10.342 3.354 1.678 1.00 0.00 C ATOM 982 NH1 ARG A 61 -11.316 2.467 1.854 1.00 0.00 N ATOM 983 NH2 ARG A 61 -10.397 4.524 2.305 1.00 0.00 N ATOM 0 H ARG A 61 -4.030 3.854 -0.005 1.00 0.00 H new ATOM 0 HA ARG A 61 -4.928 1.116 -0.210 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -6.595 1.912 1.388 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -6.802 3.418 0.518 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -7.801 2.242 -1.394 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -7.460 0.685 -0.666 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.861 1.525 -0.410 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -9.077 1.006 1.068 1.00 0.00 H new ATOM 0 HE ARG A 61 -8.654 3.837 0.675 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -11.278 1.566 1.377 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -12.102 2.687 2.466 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -9.651 5.208 2.175 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -11.185 4.739 2.916 1.00 0.00 H new ATOM 997 N PHE A 62 -4.713 1.658 -2.603 1.00 0.00 N ATOM 998 CA PHE A 62 -4.734 1.831 -4.054 1.00 0.00 C ATOM 999 C PHE A 62 -6.074 1.359 -4.615 1.00 0.00 C ATOM 1000 O PHE A 62 -6.823 0.667 -3.924 1.00 0.00 O ATOM 1001 CB PHE A 62 -3.619 1.013 -4.712 1.00 0.00 C ATOM 1002 CG PHE A 62 -2.200 1.413 -4.364 1.00 0.00 C ATOM 1003 CD1 PHE A 62 -1.670 1.124 -3.098 1.00 0.00 C ATOM 1004 CD2 PHE A 62 -1.399 2.056 -5.318 1.00 0.00 C ATOM 1005 CE1 PHE A 62 -0.340 1.449 -2.797 1.00 0.00 C ATOM 1006 CE2 PHE A 62 -0.067 2.376 -5.021 1.00 0.00 C ATOM 1007 CZ PHE A 62 0.465 2.057 -3.769 1.00 0.00 C ATOM 0 H PHE A 62 -4.204 0.829 -2.295 1.00 0.00 H new ATOM 0 HA PHE A 62 -4.586 2.889 -4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.756 -0.034 -4.440 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -3.738 1.080 -5.793 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.289 0.649 -2.352 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.810 2.306 -6.285 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.063 1.231 -1.819 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.548 2.869 -5.760 1.00 0.00 H new ATOM 0 HZ PHE A 62 1.499 2.280 -3.550 1.00 0.00 H new ATOM 1017 N HIS A 63 -6.376 1.731 -5.864 1.00 0.00 N ATOM 1018 CA HIS A 63 -7.651 1.421 -6.499 1.00 0.00 C ATOM 1019 C HIS A 63 -7.485 0.823 -7.897 1.00 0.00 C ATOM 1020 O HIS A 63 -8.469 0.683 -8.619 1.00 0.00 O ATOM 1021 CB HIS A 63 -8.501 2.686 -6.593 1.00 0.00 C ATOM 1022 CG HIS A 63 -8.674 3.407 -5.287 1.00 0.00 C ATOM 1023 ND1 HIS A 63 -9.321 2.904 -4.155 1.00 0.00 N ATOM 1024 CD2 HIS A 63 -8.212 4.664 -5.028 1.00 0.00 C ATOM 1025 CE1 HIS A 63 -9.229 3.880 -3.238 1.00 0.00 C ATOM 1026 NE2 HIS A 63 -8.572 4.942 -3.730 1.00 0.00 N ATOM 0 H HIS A 63 -5.737 2.257 -6.460 1.00 0.00 H new ATOM 0 HA HIS A 63 -8.142 0.672 -5.877 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -8.044 3.365 -7.313 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -9.484 2.422 -6.983 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -9.767 1.993 -4.049 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.673 5.310 -5.705 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -9.630 3.819 -2.237 1.00 0.00 H new ATOM 1034 N ASP A 64 -6.255 0.468 -8.281 1.00 0.00 N ATOM 1035 CA ASP A 64 -5.992 -0.112 -9.587 1.00 0.00 C ATOM 1036 C ASP A 64 -5.087 -1.327 -9.422 1.00 0.00 C ATOM 1037 O ASP A 64 -4.052 -1.258 -8.765 1.00 0.00 O ATOM 1038 CB ASP A 64 -5.367 0.945 -10.501 1.00 0.00 C ATOM 1039 CG ASP A 64 -5.354 0.506 -11.965 1.00 0.00 C ATOM 1040 OD1 ASP A 64 -5.115 -0.695 -12.217 1.00 0.00 O ATOM 1041 OD2 ASP A 64 -5.587 1.386 -12.824 1.00 0.00 O ATOM 0 H ASP A 64 -5.426 0.576 -7.697 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.921 -0.443 -10.051 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -5.923 1.878 -10.408 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.347 1.148 -10.175 1.00 0.00 H new ATOM 1046 N LYS A 65 -5.492 -2.451 -10.024 1.00 0.00 N ATOM 1047 CA LYS A 65 -4.855 -3.739 -9.804 1.00 0.00 C ATOM 1048 C LYS A 65 -3.390 -3.762 -10.220 1.00 0.00 C ATOM 1049 O LYS A 65 -2.597 -4.469 -9.603 1.00 0.00 O ATOM 1050 CB LYS A 65 -5.647 -4.830 -10.528 1.00 0.00 C ATOM 1051 CG LYS A 65 -5.530 -4.712 -12.050 1.00 0.00 C ATOM 1052 CD LYS A 65 -6.424 -5.732 -12.755 1.00 0.00 C ATOM 1053 CE LYS A 65 -6.107 -7.168 -12.333 1.00 0.00 C ATOM 1054 NZ LYS A 65 -4.732 -7.561 -12.697 1.00 0.00 N ATOM 0 H LYS A 65 -6.274 -2.485 -10.678 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.862 -3.928 -8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.287 -5.809 -10.212 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.696 -4.768 -10.239 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -5.807 -3.705 -12.361 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.493 -4.864 -12.350 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -7.468 -5.512 -12.533 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -6.301 -5.637 -13.834 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.239 -7.267 -11.256 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.815 -7.849 -12.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -4.749 -8.489 -13.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.328 -6.854 -13.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -4.148 -7.618 -11.838 1.00 0.00 H new ATOM 1068 N ARG A 66 -3.001 -3.007 -11.252 1.00 0.00 N ATOM 1069 CA ARG A 66 -1.630 -3.085 -11.735 1.00 0.00 C ATOM 1070 C ARG A 66 -0.677 -2.396 -10.762 1.00 0.00 C ATOM 1071 O ARG A 66 0.425 -2.890 -10.521 1.00 0.00 O ATOM 1072 CB ARG A 66 -1.550 -2.502 -13.150 1.00 0.00 C ATOM 1073 CG ARG A 66 -1.784 -0.986 -13.166 1.00 0.00 C ATOM 1074 CD ARG A 66 -1.899 -0.481 -14.603 1.00 0.00 C ATOM 1075 NE ARG A 66 -0.670 -0.747 -15.350 1.00 0.00 N ATOM 1076 CZ ARG A 66 -0.442 -0.316 -16.598 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -1.357 0.397 -17.251 1.00 0.00 N ATOM 1078 NH2 ARG A 66 0.707 -0.602 -17.199 1.00 0.00 N ATOM 0 H ARG A 66 -3.602 -2.353 -11.754 1.00 0.00 H new ATOM 0 HA ARG A 66 -1.318 -4.128 -11.789 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.571 -2.721 -13.577 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -2.291 -2.989 -13.784 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -2.694 -0.746 -12.615 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.962 -0.479 -12.660 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -2.741 -0.966 -15.097 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -2.104 0.590 -14.601 1.00 0.00 H new ATOM 0 HE ARG A 66 0.059 -1.295 -14.892 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -2.245 0.622 -16.802 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -1.170 0.719 -18.201 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.416 -1.150 -16.711 1.00 0.00 H new ATOM 0 HH22 ARG A 66 0.881 -0.274 -18.149 1.00 0.00 H new ATOM 1092 N ASP A 67 -1.093 -1.261 -10.194 1.00 0.00 N ATOM 1093 CA ASP A 67 -0.275 -0.548 -9.225 1.00 0.00 C ATOM 1094 C ASP A 67 -0.354 -1.262 -7.880 1.00 0.00 C ATOM 1095 O ASP A 67 0.589 -1.227 -7.096 1.00 0.00 O ATOM 1096 CB ASP A 67 -0.786 0.887 -9.084 1.00 0.00 C ATOM 1097 CG ASP A 67 -0.772 1.643 -10.413 1.00 0.00 C ATOM 1098 OD1 ASP A 67 0.175 1.431 -11.201 1.00 0.00 O ATOM 1099 OD2 ASP A 67 -1.715 2.434 -10.626 1.00 0.00 O ATOM 0 H ASP A 67 -1.992 -0.821 -10.392 1.00 0.00 H new ATOM 0 HA ASP A 67 0.761 -0.526 -9.562 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.802 0.871 -8.689 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.170 1.420 -8.359 1.00 0.00 H new ATOM 1104 N ALA A 68 -1.486 -1.916 -7.617 1.00 0.00 N ATOM 1105 CA ALA A 68 -1.707 -2.658 -6.394 1.00 0.00 C ATOM 1106 C ALA A 68 -0.843 -3.916 -6.336 1.00 0.00 C ATOM 1107 O ALA A 68 -0.252 -4.209 -5.297 1.00 0.00 O ATOM 1108 CB ALA A 68 -3.187 -3.051 -6.351 1.00 0.00 C ATOM 0 H ALA A 68 -2.278 -1.940 -8.259 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.436 -2.036 -5.541 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -3.388 -3.613 -5.439 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.803 -2.152 -6.366 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.425 -3.668 -7.217 1.00 0.00 H new ATOM 1114 N GLU A 69 -0.759 -4.665 -7.439 1.00 0.00 N ATOM 1115 CA GLU A 69 0.005 -5.901 -7.447 1.00 0.00 C ATOM 1116 C GLU A 69 1.503 -5.612 -7.355 1.00 0.00 C ATOM 1117 O GLU A 69 2.235 -6.383 -6.741 1.00 0.00 O ATOM 1118 CB GLU A 69 -0.299 -6.716 -8.705 1.00 0.00 C ATOM 1119 CG GLU A 69 -1.704 -7.320 -8.641 1.00 0.00 C ATOM 1120 CD GLU A 69 -2.040 -8.068 -9.930 1.00 0.00 C ATOM 1121 OE1 GLU A 69 -1.618 -9.241 -10.051 1.00 0.00 O ATOM 1122 OE2 GLU A 69 -2.722 -7.463 -10.791 1.00 0.00 O ATOM 0 H GLU A 69 -1.208 -4.435 -8.326 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.289 -6.485 -6.575 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.213 -6.079 -9.585 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.438 -7.512 -8.814 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.772 -8.002 -7.793 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.436 -6.530 -8.474 1.00 0.00 H new ATOM 1129 N ASP A 70 1.970 -4.512 -7.953 1.00 0.00 N ATOM 1130 CA ASP A 70 3.374 -4.153 -7.829 1.00 0.00 C ATOM 1131 C ASP A 70 3.675 -3.643 -6.423 1.00 0.00 C ATOM 1132 O ASP A 70 4.745 -3.918 -5.876 1.00 0.00 O ATOM 1133 CB ASP A 70 3.717 -3.049 -8.832 1.00 0.00 C ATOM 1134 CG ASP A 70 3.798 -3.554 -10.273 1.00 0.00 C ATOM 1135 OD1 ASP A 70 3.909 -4.786 -10.459 1.00 0.00 O ATOM 1136 OD2 ASP A 70 3.753 -2.696 -11.183 1.00 0.00 O ATOM 0 H ASP A 70 1.407 -3.872 -8.514 1.00 0.00 H new ATOM 0 HA ASP A 70 3.972 -5.042 -8.028 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.964 -2.263 -8.770 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.671 -2.599 -8.556 1.00 0.00 H new ATOM 1141 N ALA A 71 2.734 -2.901 -5.828 1.00 0.00 N ATOM 1142 CA ALA A 71 2.941 -2.320 -4.517 1.00 0.00 C ATOM 1143 C ALA A 71 3.191 -3.406 -3.477 1.00 0.00 C ATOM 1144 O ALA A 71 3.963 -3.187 -2.549 1.00 0.00 O ATOM 1145 CB ALA A 71 1.728 -1.477 -4.131 1.00 0.00 C ATOM 0 H ALA A 71 1.825 -2.695 -6.242 1.00 0.00 H new ATOM 0 HA ALA A 71 3.823 -1.680 -4.551 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.887 -1.041 -3.145 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.591 -0.680 -4.862 1.00 0.00 H new ATOM 0 HB3 ALA A 71 0.839 -2.107 -4.111 1.00 0.00 H new ATOM 1151 N MET A 72 2.555 -4.576 -3.610 1.00 0.00 N ATOM 1152 CA MET A 72 2.779 -5.649 -2.649 1.00 0.00 C ATOM 1153 C MET A 72 3.942 -6.536 -3.090 1.00 0.00 C ATOM 1154 O MET A 72 4.622 -7.113 -2.245 1.00 0.00 O ATOM 1155 CB MET A 72 1.505 -6.481 -2.460 1.00 0.00 C ATOM 1156 CG MET A 72 1.170 -7.224 -3.742 1.00 0.00 C ATOM 1157 SD MET A 72 -0.337 -8.224 -3.665 1.00 0.00 S ATOM 1158 CE MET A 72 -0.154 -9.090 -5.246 1.00 0.00 C ATOM 0 H MET A 72 1.897 -4.796 -4.357 1.00 0.00 H new ATOM 0 HA MET A 72 3.038 -5.199 -1.691 1.00 0.00 H new ATOM 0 HB2 MET A 72 1.643 -7.191 -1.645 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.676 -5.831 -2.180 1.00 0.00 H new ATOM 0 HG2 MET A 72 1.068 -6.499 -4.550 1.00 0.00 H new ATOM 0 HG3 MET A 72 2.007 -7.873 -3.999 1.00 0.00 H new ATOM 0 HE1 MET A 72 -1.123 -9.151 -5.742 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.544 -8.545 -5.881 1.00 0.00 H new ATOM 0 HE3 MET A 72 0.227 -10.096 -5.068 1.00 0.00 H new ATOM 1168 N ASP A 73 4.180 -6.648 -4.398 1.00 0.00 N ATOM 1169 CA ASP A 73 5.276 -7.455 -4.918 1.00 0.00 C ATOM 1170 C ASP A 73 6.633 -6.834 -4.568 1.00 0.00 C ATOM 1171 O ASP A 73 7.668 -7.467 -4.765 1.00 0.00 O ATOM 1172 CB ASP A 73 5.119 -7.609 -6.433 1.00 0.00 C ATOM 1173 CG ASP A 73 6.186 -8.531 -7.022 1.00 0.00 C ATOM 1174 OD1 ASP A 73 6.198 -9.720 -6.632 1.00 0.00 O ATOM 1175 OD2 ASP A 73 6.978 -8.040 -7.859 1.00 0.00 O ATOM 0 H ASP A 73 3.623 -6.186 -5.117 1.00 0.00 H new ATOM 0 HA ASP A 73 5.241 -8.441 -4.454 1.00 0.00 H new ATOM 0 HB2 ASP A 73 4.130 -8.008 -6.657 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.183 -6.629 -6.907 1.00 0.00 H new ATOM 1180 N ALA A 74 6.633 -5.598 -4.049 1.00 0.00 N ATOM 1181 CA ALA A 74 7.865 -4.905 -3.710 1.00 0.00 C ATOM 1182 C ALA A 74 7.848 -4.267 -2.317 1.00 0.00 C ATOM 1183 O ALA A 74 8.885 -3.775 -1.874 1.00 0.00 O ATOM 1184 CB ALA A 74 8.093 -3.843 -4.773 1.00 0.00 C ATOM 0 H ALA A 74 5.786 -5.064 -3.858 1.00 0.00 H new ATOM 0 HA ALA A 74 8.675 -5.634 -3.683 1.00 0.00 H new ATOM 0 HB1 ALA A 74 9.012 -3.299 -4.553 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.178 -4.319 -5.750 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.253 -3.148 -4.780 1.00 0.00 H new ATOM 1190 N MET A 75 6.706 -4.269 -1.620 1.00 0.00 N ATOM 1191 CA MET A 75 6.651 -3.759 -0.247 1.00 0.00 C ATOM 1192 C MET A 75 6.135 -4.785 0.760 1.00 0.00 C ATOM 1193 O MET A 75 6.459 -4.669 1.943 1.00 0.00 O ATOM 1194 CB MET A 75 5.747 -2.531 -0.165 1.00 0.00 C ATOM 1195 CG MET A 75 6.184 -1.364 -1.046 1.00 0.00 C ATOM 1196 SD MET A 75 7.610 -0.432 -0.440 1.00 0.00 S ATOM 1197 CE MET A 75 7.009 1.240 -0.802 1.00 0.00 C ATOM 0 H MET A 75 5.816 -4.614 -1.980 1.00 0.00 H new ATOM 0 HA MET A 75 7.680 -3.510 0.011 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.734 -2.822 -0.445 1.00 0.00 H new ATOM 0 HB3 MET A 75 5.707 -2.193 0.871 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.416 -1.747 -2.040 1.00 0.00 H new ATOM 0 HG3 MET A 75 5.343 -0.679 -1.157 1.00 0.00 H new ATOM 0 HE1 MET A 75 7.788 1.804 -1.315 1.00 0.00 H new ATOM 0 HE2 MET A 75 6.126 1.179 -1.439 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.750 1.743 0.130 1.00 0.00 H new ATOM 1207 N ASP A 76 5.343 -5.785 0.354 1.00 0.00 N ATOM 1208 CA ASP A 76 4.884 -6.769 1.319 1.00 0.00 C ATOM 1209 C ASP A 76 6.070 -7.588 1.830 1.00 0.00 C ATOM 1210 O ASP A 76 6.818 -8.175 1.048 1.00 0.00 O ATOM 1211 CB ASP A 76 3.832 -7.683 0.694 1.00 0.00 C ATOM 1212 CG ASP A 76 3.217 -8.587 1.757 1.00 0.00 C ATOM 1213 OD1 ASP A 76 2.715 -8.030 2.759 1.00 0.00 O ATOM 1214 OD2 ASP A 76 3.260 -9.822 1.559 1.00 0.00 O ATOM 0 H ASP A 76 5.020 -5.926 -0.603 1.00 0.00 H new ATOM 0 HA ASP A 76 4.426 -6.249 2.160 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.054 -7.083 0.222 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.286 -8.289 -0.090 1.00 0.00 H new ATOM 1219 N GLY A 77 6.242 -7.626 3.152 1.00 0.00 N ATOM 1220 CA GLY A 77 7.321 -8.368 3.792 1.00 0.00 C ATOM 1221 C GLY A 77 8.646 -7.600 3.768 1.00 0.00 C ATOM 1222 O GLY A 77 9.654 -8.102 4.258 1.00 0.00 O ATOM 0 H GLY A 77 5.632 -7.140 3.809 1.00 0.00 H new ATOM 0 HA2 GLY A 77 7.048 -8.585 4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 77 7.449 -9.326 3.288 1.00 0.00 H new ATOM 1226 N ALA A 78 8.646 -6.388 3.202 1.00 0.00 N ATOM 1227 CA ALA A 78 9.827 -5.540 3.143 1.00 0.00 C ATOM 1228 C ALA A 78 10.189 -5.001 4.533 1.00 0.00 C ATOM 1229 O ALA A 78 9.587 -5.385 5.533 1.00 0.00 O ATOM 1230 CB ALA A 78 9.574 -4.393 2.160 1.00 0.00 C ATOM 0 H ALA A 78 7.820 -5.972 2.772 1.00 0.00 H new ATOM 0 HA ALA A 78 10.674 -6.131 2.795 1.00 0.00 H new ATOM 0 HB1 ALA A 78 10.456 -3.754 2.112 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.367 -4.801 1.171 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.719 -3.807 2.497 1.00 0.00 H new ATOM 1236 N VAL A 79 11.180 -4.106 4.588 1.00 0.00 N ATOM 1237 CA VAL A 79 11.677 -3.534 5.834 1.00 0.00 C ATOM 1238 C VAL A 79 11.824 -2.019 5.675 1.00 0.00 C ATOM 1239 O VAL A 79 12.163 -1.536 4.596 1.00 0.00 O ATOM 1240 CB VAL A 79 13.027 -4.181 6.179 1.00 0.00 C ATOM 1241 CG1 VAL A 79 13.612 -3.593 7.465 1.00 0.00 C ATOM 1242 CG2 VAL A 79 12.870 -5.692 6.358 1.00 0.00 C ATOM 0 H VAL A 79 11.661 -3.758 3.759 1.00 0.00 H new ATOM 0 HA VAL A 79 10.976 -3.729 6.645 1.00 0.00 H new ATOM 0 HB VAL A 79 13.704 -3.975 5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 79 14.567 -4.071 7.682 1.00 0.00 H new ATOM 0 HG12 VAL A 79 13.763 -2.521 7.339 1.00 0.00 H new ATOM 0 HG13 VAL A 79 12.923 -3.767 8.291 1.00 0.00 H new ATOM 0 HG21 VAL A 79 13.837 -6.132 6.602 1.00 0.00 H new ATOM 0 HG22 VAL A 79 12.166 -5.891 7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 79 12.495 -6.131 5.434 1.00 0.00 H new ATOM 1252 N LEU A 80 11.571 -1.278 6.756 1.00 0.00 N ATOM 1253 CA LEU A 80 11.665 0.177 6.766 1.00 0.00 C ATOM 1254 C LEU A 80 12.929 0.610 7.514 1.00 0.00 C ATOM 1255 O LEU A 80 13.727 1.380 6.985 1.00 0.00 O ATOM 1256 CB LEU A 80 10.398 0.726 7.438 1.00 0.00 C ATOM 1257 CG LEU A 80 10.194 2.244 7.382 1.00 0.00 C ATOM 1258 CD1 LEU A 80 11.184 3.025 8.242 1.00 0.00 C ATOM 1259 CD2 LEU A 80 10.264 2.756 5.943 1.00 0.00 C ATOM 0 H LEU A 80 11.294 -1.677 7.653 1.00 0.00 H new ATOM 0 HA LEU A 80 11.736 0.571 5.752 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.534 0.249 6.976 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.409 0.422 8.485 1.00 0.00 H new ATOM 0 HG LEU A 80 9.199 2.417 7.792 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.980 4.092 8.153 1.00 0.00 H new ATOM 0 HD12 LEU A 80 11.080 2.721 9.284 1.00 0.00 H new ATOM 0 HD13 LEU A 80 12.200 2.821 7.904 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.116 3.836 5.933 1.00 0.00 H new ATOM 0 HD22 LEU A 80 11.240 2.520 5.520 1.00 0.00 H new ATOM 0 HD23 LEU A 80 9.486 2.278 5.348 1.00 0.00 H new ATOM 1271 N ASP A 81 13.099 0.108 8.740 1.00 0.00 N ATOM 1272 CA ASP A 81 14.266 0.415 9.558 1.00 0.00 C ATOM 1273 C ASP A 81 14.743 -0.794 10.375 1.00 0.00 C ATOM 1274 O ASP A 81 15.777 -0.719 11.034 1.00 0.00 O ATOM 1275 CB ASP A 81 13.921 1.597 10.472 1.00 0.00 C ATOM 1276 CG ASP A 81 15.138 2.090 11.251 1.00 0.00 C ATOM 1277 OD1 ASP A 81 16.116 2.511 10.593 1.00 0.00 O ATOM 1278 OD2 ASP A 81 15.082 2.040 12.501 1.00 0.00 O ATOM 0 H ASP A 81 12.432 -0.520 9.188 1.00 0.00 H new ATOM 0 HA ASP A 81 15.095 0.679 8.901 1.00 0.00 H new ATOM 0 HB2 ASP A 81 13.519 2.414 9.873 1.00 0.00 H new ATOM 0 HB3 ASP A 81 13.139 1.299 11.171 1.00 0.00 H new ATOM 1283 N GLY A 82 14.000 -1.909 10.340 1.00 0.00 N ATOM 1284 CA GLY A 82 14.396 -3.121 11.044 1.00 0.00 C ATOM 1285 C GLY A 82 13.215 -4.040 11.349 1.00 0.00 C ATOM 1286 O GLY A 82 13.418 -5.204 11.692 1.00 0.00 O ATOM 0 H GLY A 82 13.121 -1.989 9.829 1.00 0.00 H new ATOM 0 HA2 GLY A 82 15.126 -3.663 10.443 1.00 0.00 H new ATOM 0 HA3 GLY A 82 14.890 -2.849 11.977 1.00 0.00 H new ATOM 1290 N ARG A 83 11.985 -3.528 11.225 1.00 0.00 N ATOM 1291 CA ARG A 83 10.777 -4.322 11.418 1.00 0.00 C ATOM 1292 C ARG A 83 10.315 -4.886 10.083 1.00 0.00 C ATOM 1293 O ARG A 83 11.101 -5.013 9.149 1.00 0.00 O ATOM 1294 CB ARG A 83 9.688 -3.475 12.089 1.00 0.00 C ATOM 1295 CG ARG A 83 9.251 -2.290 11.220 1.00 0.00 C ATOM 1296 CD ARG A 83 7.898 -1.775 11.704 1.00 0.00 C ATOM 1297 NE ARG A 83 7.910 -1.454 13.139 1.00 0.00 N ATOM 1298 CZ ARG A 83 6.806 -1.371 13.885 1.00 0.00 C ATOM 1299 NH1 ARG A 83 5.600 -1.531 13.345 1.00 0.00 N ATOM 1300 NH2 ARG A 83 6.904 -1.125 15.188 1.00 0.00 N ATOM 0 H ARG A 83 11.805 -2.552 10.988 1.00 0.00 H new ATOM 0 HA ARG A 83 10.991 -5.161 12.080 1.00 0.00 H new ATOM 0 HB2 ARG A 83 8.823 -4.103 12.303 1.00 0.00 H new ATOM 0 HB3 ARG A 83 10.057 -3.104 13.045 1.00 0.00 H new ATOM 0 HG2 ARG A 83 9.994 -1.494 11.271 1.00 0.00 H new ATOM 0 HG3 ARG A 83 9.183 -2.596 10.176 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.625 -0.886 11.136 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.133 -2.526 11.507 1.00 0.00 H new ATOM 0 HE ARG A 83 8.810 -1.286 13.588 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.509 -1.720 12.347 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.767 -1.464 13.929 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.821 -1.000 15.616 1.00 0.00 H new ATOM 0 HH22 ARG A 83 6.062 -1.061 15.760 1.00 0.00 H new ATOM 1314 N GLU A 84 9.033 -5.222 9.997 1.00 0.00 N ATOM 1315 CA GLU A 84 8.436 -5.765 8.792 1.00 0.00 C ATOM 1316 C GLU A 84 7.431 -4.771 8.232 1.00 0.00 C ATOM 1317 O GLU A 84 7.076 -3.800 8.895 1.00 0.00 O ATOM 1318 CB GLU A 84 7.726 -7.081 9.115 1.00 0.00 C ATOM 1319 CG GLU A 84 8.747 -8.201 9.317 1.00 0.00 C ATOM 1320 CD GLU A 84 8.048 -9.548 9.485 1.00 0.00 C ATOM 1321 OE1 GLU A 84 7.344 -9.955 8.533 1.00 0.00 O ATOM 1322 OE2 GLU A 84 8.221 -10.163 10.562 1.00 0.00 O ATOM 0 H GLU A 84 8.376 -5.123 10.771 1.00 0.00 H new ATOM 0 HA GLU A 84 9.217 -5.949 8.054 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.122 -6.964 10.015 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.045 -7.343 8.305 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.423 -8.241 8.463 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.356 -7.990 10.196 1.00 0.00 H new ATOM 1329 N LEU A 85 6.975 -5.026 7.009 1.00 0.00 N ATOM 1330 CA LEU A 85 5.986 -4.212 6.329 1.00 0.00 C ATOM 1331 C LEU A 85 4.935 -5.133 5.721 1.00 0.00 C ATOM 1332 O LEU A 85 5.194 -6.321 5.519 1.00 0.00 O ATOM 1333 CB LEU A 85 6.673 -3.347 5.265 1.00 0.00 C ATOM 1334 CG LEU A 85 7.662 -2.342 5.865 1.00 0.00 C ATOM 1335 CD1 LEU A 85 8.308 -1.548 4.739 1.00 0.00 C ATOM 1336 CD2 LEU A 85 6.959 -1.365 6.804 1.00 0.00 C ATOM 0 H LEU A 85 7.293 -5.822 6.456 1.00 0.00 H new ATOM 0 HA LEU A 85 5.492 -3.537 7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 85 7.200 -3.993 4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.915 -2.809 4.696 1.00 0.00 H new ATOM 0 HG LEU A 85 8.410 -2.897 6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 85 9.013 -0.830 5.158 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.836 -2.228 4.071 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.538 -1.016 4.181 1.00 0.00 H new ATOM 0 HD21 LEU A 85 7.688 -0.665 7.213 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.197 -0.814 6.252 1.00 0.00 H new ATOM 0 HD23 LEU A 85 6.489 -1.917 7.618 1.00 0.00 H new ATOM 1348 N ARG A 86 3.749 -4.596 5.433 1.00 0.00 N ATOM 1349 CA ARG A 86 2.621 -5.394 4.987 1.00 0.00 C ATOM 1350 C ARG A 86 1.807 -4.637 3.951 1.00 0.00 C ATOM 1351 O ARG A 86 1.593 -3.435 4.080 1.00 0.00 O ATOM 1352 CB ARG A 86 1.732 -5.688 6.198 1.00 0.00 C ATOM 1353 CG ARG A 86 2.340 -6.716 7.144 1.00 0.00 C ATOM 1354 CD ARG A 86 2.553 -8.054 6.440 1.00 0.00 C ATOM 1355 NE ARG A 86 2.971 -9.059 7.413 1.00 0.00 N ATOM 1356 CZ ARG A 86 4.240 -9.389 7.668 1.00 0.00 C ATOM 1357 NH1 ARG A 86 5.245 -8.788 7.041 1.00 0.00 N ATOM 1358 NH2 ARG A 86 4.523 -10.336 8.559 1.00 0.00 N ATOM 0 H ARG A 86 3.550 -3.598 5.504 1.00 0.00 H new ATOM 0 HA ARG A 86 2.987 -6.317 4.538 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.552 -4.762 6.743 1.00 0.00 H new ATOM 0 HB3 ARG A 86 0.763 -6.048 5.852 1.00 0.00 H new ATOM 0 HG2 ARG A 86 3.292 -6.346 7.524 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.685 -6.855 8.004 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.632 -8.369 5.950 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.309 -7.950 5.662 1.00 0.00 H new ATOM 0 HE ARG A 86 2.242 -9.544 7.936 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.054 -8.061 6.352 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.208 -9.053 7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.769 -10.814 9.052 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.494 -10.583 8.749 1.00 0.00 H new ATOM 1372 N VAL A 87 1.364 -5.363 2.925 1.00 0.00 N ATOM 1373 CA VAL A 87 0.564 -4.812 1.844 1.00 0.00 C ATOM 1374 C VAL A 87 -0.341 -5.909 1.296 1.00 0.00 C ATOM 1375 O VAL A 87 0.150 -6.950 0.858 1.00 0.00 O ATOM 1376 CB VAL A 87 1.487 -4.302 0.733 1.00 0.00 C ATOM 1377 CG1 VAL A 87 0.649 -3.660 -0.367 1.00 0.00 C ATOM 1378 CG2 VAL A 87 2.464 -3.252 1.253 1.00 0.00 C ATOM 0 H VAL A 87 1.555 -6.360 2.825 1.00 0.00 H new ATOM 0 HA VAL A 87 -0.041 -3.984 2.213 1.00 0.00 H new ATOM 0 HB VAL A 87 2.050 -5.155 0.354 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.304 -3.296 -1.158 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.040 -4.398 -0.777 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.083 -2.826 0.047 1.00 0.00 H new ATOM 0 HG21 VAL A 87 3.103 -2.913 0.437 1.00 0.00 H new ATOM 0 HG22 VAL A 87 1.908 -2.405 1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 87 3.081 -3.687 2.040 1.00 0.00 H new ATOM 1388 N GLN A 88 -1.657 -5.687 1.315 1.00 0.00 N ATOM 1389 CA GLN A 88 -2.627 -6.663 0.835 1.00 0.00 C ATOM 1390 C GLN A 88 -4.004 -6.020 0.669 1.00 0.00 C ATOM 1391 O GLN A 88 -4.266 -4.949 1.219 1.00 0.00 O ATOM 1392 CB GLN A 88 -2.717 -7.863 1.785 1.00 0.00 C ATOM 1393 CG GLN A 88 -3.252 -7.507 3.176 1.00 0.00 C ATOM 1394 CD GLN A 88 -2.261 -6.692 4.001 1.00 0.00 C ATOM 1395 OE1 GLN A 88 -1.144 -7.135 4.262 1.00 0.00 O ATOM 1396 NE2 GLN A 88 -2.666 -5.495 4.414 1.00 0.00 N ATOM 0 H GLN A 88 -2.076 -4.825 1.664 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.287 -7.019 -0.138 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.362 -8.620 1.340 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -1.728 -8.308 1.889 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -4.179 -6.944 3.070 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.496 -8.424 3.712 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -3.601 -5.163 4.177 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.042 -4.909 4.968 1.00 0.00 H new ATOM 1405 N MET A 89 -4.890 -6.677 -0.089 1.00 0.00 N ATOM 1406 CA MET A 89 -6.216 -6.156 -0.388 1.00 0.00 C ATOM 1407 C MET A 89 -7.055 -5.999 0.880 1.00 0.00 C ATOM 1408 O MET A 89 -6.865 -6.722 1.859 1.00 0.00 O ATOM 1409 CB MET A 89 -6.910 -7.056 -1.418 1.00 0.00 C ATOM 1410 CG MET A 89 -6.210 -6.962 -2.775 1.00 0.00 C ATOM 1411 SD MET A 89 -4.558 -7.709 -2.850 1.00 0.00 S ATOM 1412 CE MET A 89 -3.957 -6.968 -4.391 1.00 0.00 C ATOM 0 H MET A 89 -4.701 -7.587 -0.510 1.00 0.00 H new ATOM 0 HA MET A 89 -6.109 -5.160 -0.818 1.00 0.00 H new ATOM 0 HB2 MET A 89 -6.902 -8.089 -1.070 1.00 0.00 H new ATOM 0 HB3 MET A 89 -7.955 -6.762 -1.521 1.00 0.00 H new ATOM 0 HG2 MET A 89 -6.841 -7.440 -3.524 1.00 0.00 H new ATOM 0 HG3 MET A 89 -6.128 -5.911 -3.051 1.00 0.00 H new ATOM 0 HE1 MET A 89 -2.995 -6.488 -4.213 1.00 0.00 H new ATOM 0 HE2 MET A 89 -3.840 -7.745 -5.147 1.00 0.00 H new ATOM 0 HE3 MET A 89 -4.674 -6.225 -4.741 1.00 0.00 H new ATOM 1422 N ALA A 90 -7.990 -5.044 0.856 1.00 0.00 N ATOM 1423 CA ALA A 90 -8.846 -4.740 1.990 1.00 0.00 C ATOM 1424 C ALA A 90 -9.871 -5.844 2.268 1.00 0.00 C ATOM 1425 O ALA A 90 -9.948 -6.834 1.539 1.00 0.00 O ATOM 1426 CB ALA A 90 -9.559 -3.412 1.726 1.00 0.00 C ATOM 0 H ALA A 90 -8.170 -4.460 0.039 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.218 -4.669 2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.205 -3.172 2.570 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.820 -2.621 1.599 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.161 -3.496 0.821 1.00 0.00 H new ATOM 1432 N ARG A 91 -10.662 -5.659 3.332 1.00 0.00 N ATOM 1433 CA ARG A 91 -11.722 -6.584 3.726 1.00 0.00 C ATOM 1434 C ARG A 91 -13.073 -5.879 3.827 1.00 0.00 C ATOM 1435 O ARG A 91 -14.105 -6.543 3.923 1.00 0.00 O ATOM 1436 CB ARG A 91 -11.383 -7.206 5.080 1.00 0.00 C ATOM 1437 CG ARG A 91 -10.085 -8.010 5.031 1.00 0.00 C ATOM 1438 CD ARG A 91 -9.755 -8.528 6.433 1.00 0.00 C ATOM 1439 NE ARG A 91 -8.513 -9.309 6.428 1.00 0.00 N ATOM 1440 CZ ARG A 91 -8.429 -10.602 6.094 1.00 0.00 C ATOM 1441 NH1 ARG A 91 -9.516 -11.277 5.724 1.00 0.00 N ATOM 1442 NH2 ARG A 91 -7.253 -11.217 6.124 1.00 0.00 N ATOM 0 H ARG A 91 -10.580 -4.851 3.949 1.00 0.00 H new ATOM 0 HA ARG A 91 -11.792 -7.356 2.960 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -11.294 -6.419 5.829 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -12.200 -7.855 5.396 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -10.187 -8.845 4.338 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -9.271 -7.386 4.661 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -9.657 -7.688 7.121 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -10.575 -9.146 6.798 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.653 -8.833 6.698 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -10.422 -10.808 5.694 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -9.443 -12.262 5.471 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.416 -10.704 6.401 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.186 -12.203 5.870 1.00 0.00 H new ATOM 1456 N TYR A 92 -13.067 -4.544 3.803 1.00 0.00 N ATOM 1457 CA TYR A 92 -14.269 -3.733 3.928 1.00 0.00 C ATOM 1458 C TYR A 92 -14.061 -2.404 3.206 1.00 0.00 C ATOM 1459 O TYR A 92 -12.950 -2.102 2.772 1.00 0.00 O ATOM 1460 CB TYR A 92 -14.548 -3.436 5.406 1.00 0.00 C ATOM 1461 CG TYR A 92 -14.580 -4.642 6.317 1.00 0.00 C ATOM 1462 CD1 TYR A 92 -15.734 -5.434 6.395 1.00 0.00 C ATOM 1463 CD2 TYR A 92 -13.458 -4.960 7.091 1.00 0.00 C ATOM 1464 CE1 TYR A 92 -15.764 -6.547 7.249 1.00 0.00 C ATOM 1465 CE2 TYR A 92 -13.474 -6.071 7.944 1.00 0.00 C ATOM 1466 CZ TYR A 92 -14.630 -6.870 8.023 1.00 0.00 C ATOM 1467 OH TYR A 92 -14.657 -7.958 8.849 1.00 0.00 O ATOM 0 H TYR A 92 -12.215 -3.994 3.695 1.00 0.00 H new ATOM 0 HA TYR A 92 -15.107 -4.278 3.493 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -13.786 -2.747 5.770 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -15.505 -2.920 5.481 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -16.600 -5.188 5.798 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -12.573 -4.344 7.030 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -16.654 -7.155 7.314 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -12.605 -6.313 8.537 1.00 0.00 H new ATOM 0 HH TYR A 92 -13.796 -8.040 9.310 1.00 0.00 H new ATOM 1477 N GLY A 93 -15.126 -1.605 3.086 1.00 0.00 N ATOM 1478 CA GLY A 93 -15.018 -0.242 2.586 1.00 0.00 C ATOM 1479 C GLY A 93 -14.814 0.713 3.759 1.00 0.00 C ATOM 1480 O GLY A 93 -14.157 1.743 3.613 1.00 0.00 O ATOM 0 H GLY A 93 -16.075 -1.886 3.331 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -14.183 -0.163 1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -15.919 0.028 2.035 1.00 0.00 H new ATOM 1484 N ARG A 94 -15.378 0.354 4.919 1.00 0.00 N ATOM 1485 CA ARG A 94 -15.219 1.033 6.188 1.00 0.00 C ATOM 1486 C ARG A 94 -15.437 0.004 7.297 1.00 0.00 C ATOM 1487 O ARG A 94 -16.164 -0.970 7.106 1.00 0.00 O ATOM 1488 CB ARG A 94 -16.258 2.150 6.336 1.00 0.00 C ATOM 1489 CG ARG A 94 -16.005 3.296 5.359 1.00 0.00 C ATOM 1490 CD ARG A 94 -16.926 4.461 5.721 1.00 0.00 C ATOM 1491 NE ARG A 94 -16.680 5.636 4.871 1.00 0.00 N ATOM 1492 CZ ARG A 94 -15.694 6.516 5.074 1.00 0.00 C ATOM 1493 NH1 ARG A 94 -14.826 6.362 6.068 1.00 0.00 N ATOM 1494 NH2 ARG A 94 -15.572 7.571 4.272 1.00 0.00 N ATOM 0 H ARG A 94 -15.987 -0.461 4.989 1.00 0.00 H new ATOM 0 HA ARG A 94 -14.224 1.475 6.246 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -17.255 1.743 6.168 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -16.238 2.532 7.357 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -14.962 3.610 5.407 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -16.193 2.969 4.336 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -17.965 4.149 5.617 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -16.777 4.731 6.766 1.00 0.00 H new ATOM 0 HE ARG A 94 -17.301 5.789 4.076 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -14.904 5.561 6.694 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.081 7.045 6.205 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -16.230 7.707 3.504 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.821 8.244 4.425 1.00 0.00 H new ATOM 1508 N PRO A 95 -14.814 0.211 8.460 1.00 0.00 N ATOM 1509 CA PRO A 95 -14.958 -0.612 9.651 1.00 0.00 C ATOM 1510 C PRO A 95 -16.430 -0.707 10.062 1.00 0.00 C ATOM 1511 O PRO A 95 -17.115 0.318 10.120 1.00 0.00 O ATOM 1512 CB PRO A 95 -14.096 0.082 10.718 1.00 0.00 C ATOM 1513 CG PRO A 95 -13.906 1.510 10.192 1.00 0.00 C ATOM 1514 CD PRO A 95 -13.899 1.297 8.692 1.00 0.00 C ATOM 0 HA PRO A 95 -14.633 -1.641 9.496 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -14.590 0.080 11.690 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -13.139 -0.424 10.846 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -14.714 2.171 10.506 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -12.975 1.954 10.545 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -14.215 2.197 8.165 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -12.899 1.053 8.334 1.00 0.00 H new ATOM 1522 N PRO A 96 -16.928 -1.920 10.349 1.00 0.00 N ATOM 1523 CA PRO A 96 -18.306 -2.153 10.755 1.00 0.00 C ATOM 1524 C PRO A 96 -18.748 -1.276 11.930 1.00 0.00 C ATOM 1525 O PRO A 96 -19.926 -0.933 12.029 1.00 0.00 O ATOM 1526 CB PRO A 96 -18.374 -3.634 11.131 1.00 0.00 C ATOM 1527 CG PRO A 96 -17.255 -4.266 10.306 1.00 0.00 C ATOM 1528 CD PRO A 96 -16.197 -3.169 10.270 1.00 0.00 C ATOM 0 HA PRO A 96 -18.985 -1.893 9.943 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -18.218 -3.784 12.199 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -19.345 -4.065 10.887 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.877 -5.177 10.769 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -17.593 -4.534 9.305 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -15.500 -3.269 11.102 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -15.609 -3.222 9.354 1.00 0.00 H new ATOM 1536 N ASP A 97 -17.815 -0.917 12.818 1.00 0.00 N ATOM 1537 CA ASP A 97 -18.100 -0.062 13.958 1.00 0.00 C ATOM 1538 C ASP A 97 -16.802 0.510 14.528 1.00 0.00 C ATOM 1539 O ASP A 97 -15.847 -0.224 14.774 1.00 0.00 O ATOM 1540 CB ASP A 97 -18.804 -0.882 15.038 1.00 0.00 C ATOM 1541 CG ASP A 97 -19.088 -0.043 16.280 1.00 0.00 C ATOM 1542 OD1 ASP A 97 -19.642 1.065 16.117 1.00 0.00 O ATOM 1543 OD2 ASP A 97 -18.750 -0.516 17.389 1.00 0.00 O ATOM 0 H ASP A 97 -16.841 -1.216 12.760 1.00 0.00 H new ATOM 0 HA ASP A 97 -18.739 0.760 13.635 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -19.740 -1.278 14.644 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -18.185 -1.737 15.309 1.00 0.00 H new ATOM 1548 N SER A 98 -16.779 1.828 14.741 1.00 0.00 N ATOM 1549 CA SER A 98 -15.655 2.522 15.357 1.00 0.00 C ATOM 1550 C SER A 98 -16.036 3.950 15.744 1.00 0.00 C ATOM 1551 O SER A 98 -15.382 4.556 16.588 1.00 0.00 O ATOM 1552 CB SER A 98 -14.488 2.574 14.374 1.00 0.00 C ATOM 1553 OG SER A 98 -14.886 3.253 13.202 1.00 0.00 O ATOM 0 H SER A 98 -17.550 2.446 14.487 1.00 0.00 H new ATOM 0 HA SER A 98 -15.371 1.977 16.257 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.638 3.082 14.830 1.00 0.00 H new ATOM 0 HB3 SER A 98 -14.161 1.564 14.128 1.00 0.00 H new ATOM 0 HG SER A 98 -14.135 3.287 12.573 1.00 0.00 H new ATOM 1559 N HIS A 99 -17.096 4.481 15.124 1.00 0.00 N ATOM 1560 CA HIS A 99 -17.544 5.854 15.308 1.00 0.00 C ATOM 1561 C HIS A 99 -19.045 5.930 15.025 1.00 0.00 C ATOM 1562 O HIS A 99 -19.544 6.928 14.506 1.00 0.00 O ATOM 1563 CB HIS A 99 -16.746 6.759 14.367 1.00 0.00 C ATOM 1564 CG HIS A 99 -17.010 8.225 14.577 1.00 0.00 C ATOM 1565 ND1 HIS A 99 -17.003 8.874 15.812 1.00 0.00 N ATOM 1566 CD2 HIS A 99 -17.295 9.130 13.596 1.00 0.00 C ATOM 1567 CE1 HIS A 99 -17.284 10.161 15.545 1.00 0.00 C ATOM 1568 NE2 HIS A 99 -17.461 10.344 14.223 1.00 0.00 N ATOM 0 H HIS A 99 -17.673 3.953 14.469 1.00 0.00 H new ATOM 0 HA HIS A 99 -17.376 6.188 16.332 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -15.682 6.566 14.506 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -16.985 6.499 13.336 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -17.375 8.933 12.537 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -17.358 10.941 16.289 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -17.680 11.229 13.765 1.00 0.00 H new ATOM 1576 N HIS A 100 -19.773 4.862 15.363 1.00 0.00 N ATOM 1577 CA HIS A 100 -21.172 4.701 14.984 1.00 0.00 C ATOM 1578 C HIS A 100 -22.020 4.261 16.174 1.00 0.00 C ATOM 1579 O HIS A 100 -21.493 4.017 17.262 1.00 0.00 O ATOM 1580 CB HIS A 100 -21.247 3.666 13.859 1.00 0.00 C ATOM 1581 CG HIS A 100 -20.205 3.871 12.791 1.00 0.00 C ATOM 1582 ND1 HIS A 100 -18.924 3.305 12.796 1.00 0.00 N ATOM 1583 CD2 HIS A 100 -20.356 4.634 11.669 1.00 0.00 C ATOM 1584 CE1 HIS A 100 -18.336 3.746 11.674 1.00 0.00 C ATOM 1585 NE2 HIS A 100 -19.169 4.545 10.978 1.00 0.00 N ATOM 0 H HIS A 100 -19.403 4.084 15.909 1.00 0.00 H new ATOM 0 HA HIS A 100 -21.569 5.657 14.643 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -21.131 2.669 14.284 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -22.237 3.705 13.404 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -21.232 5.196 11.381 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -17.331 3.495 11.369 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -18.956 5.004 10.092 1.00 0.00 H new ATOM 1593 N SER A 101 -23.334 4.165 15.963 1.00 0.00 N ATOM 1594 CA SER A 101 -24.299 3.778 16.985 1.00 0.00 C ATOM 1595 C SER A 101 -25.460 3.020 16.354 1.00 0.00 C ATOM 1596 O SER A 101 -25.822 1.959 16.906 1.00 0.00 O ATOM 1597 CB SER A 101 -24.835 5.020 17.700 1.00 0.00 C ATOM 1598 OG SER A 101 -23.787 5.683 18.382 1.00 0.00 O ATOM 1599 OXT SER A 101 -25.978 3.510 15.326 1.00 0.00 O ATOM 0 H SER A 101 -23.762 4.359 15.058 1.00 0.00 H new ATOM 0 HA SER A 101 -23.797 3.133 17.706 1.00 0.00 H new ATOM 0 HB2 SER A 101 -25.292 5.695 16.977 1.00 0.00 H new ATOM 0 HB3 SER A 101 -25.614 4.734 18.406 1.00 0.00 H new ATOM 0 HG SER A 101 -24.142 6.477 18.834 1.00 0.00 H new TER 1605 SER A 101 ATOM 1606 O5' U B 102 -2.507 -7.184 11.814 1.00 0.00 O ATOM 1607 C5' U B 102 -2.471 -5.815 11.459 1.00 0.00 C ATOM 1608 C4' U B 102 -2.926 -4.951 12.633 1.00 0.00 C ATOM 1609 O4' U B 102 -1.867 -4.901 13.564 1.00 0.00 O ATOM 1610 C3' U B 102 -3.212 -3.510 12.220 1.00 0.00 C ATOM 1611 O3' U B 102 -4.554 -3.274 11.833 1.00 0.00 O ATOM 1612 C2' U B 102 -2.912 -2.757 13.515 1.00 0.00 C ATOM 1613 O2' U B 102 -4.076 -2.635 14.307 1.00 0.00 O ATOM 1614 C1' U B 102 -1.934 -3.671 14.252 1.00 0.00 C ATOM 1615 N1 U B 102 -0.588 -3.070 14.371 1.00 0.00 N ATOM 1616 C2 U B 102 0.273 -3.043 13.280 1.00 0.00 C ATOM 1617 O2 U B 102 -0.042 -3.438 12.156 1.00 0.00 O ATOM 1618 N3 U B 102 1.542 -2.537 13.517 1.00 0.00 N ATOM 1619 C4 U B 102 2.004 -2.039 14.723 1.00 0.00 C ATOM 1620 O4 U B 102 3.166 -1.647 14.833 1.00 0.00 O ATOM 1621 C5 U B 102 1.016 -2.040 15.777 1.00 0.00 C ATOM 1622 C6 U B 102 -0.220 -2.549 15.574 1.00 0.00 C ATOM 0 H5' U B 102 -3.115 -5.639 10.598 1.00 0.00 H new ATOM 0 H5'' U B 102 -1.460 -5.535 11.163 1.00 0.00 H new ATOM 0 H4' U B 102 -3.839 -5.390 13.035 1.00 0.00 H new ATOM 0 H3' U B 102 -2.630 -3.216 11.347 1.00 0.00 H new ATOM 0 H2' U B 102 -2.533 -1.754 13.320 1.00 0.00 H new ATOM 0 HO2' U B 102 -4.869 -2.756 13.744 1.00 0.00 H new ATOM 0 HO5' U B 102 -2.215 -7.727 11.053 1.00 0.00 H new ATOM 0 H1' U B 102 -2.297 -3.823 15.269 1.00 0.00 H new ATOM 0 H3 U B 102 2.194 -2.531 12.732 1.00 0.00 H new ATOM 0 H5 U B 102 1.269 -1.628 16.743 1.00 0.00 H new ATOM 0 H6 U B 102 -0.933 -2.542 16.386 1.00 0.00 H new ATOM 1634 P C B 103 -5.171 -3.919 10.495 1.00 0.00 P ATOM 1635 OP1 C B 103 -5.456 -5.346 10.765 1.00 0.00 O ATOM 1636 OP2 C B 103 -4.306 -3.549 9.354 1.00 0.00 O ATOM 1637 O5' C B 103 -6.584 -3.171 10.311 1.00 0.00 O ATOM 1638 C5' C B 103 -6.658 -1.801 9.979 1.00 0.00 C ATOM 1639 C4' C B 103 -8.086 -1.390 9.601 1.00 0.00 C ATOM 1640 O4' C B 103 -8.363 -1.745 8.254 1.00 0.00 O ATOM 1641 C3' C B 103 -9.151 -2.069 10.462 1.00 0.00 C ATOM 1642 O3' C B 103 -10.285 -1.227 10.587 1.00 0.00 O ATOM 1643 C2' C B 103 -9.474 -3.321 9.646 1.00 0.00 C ATOM 1644 O2' C B 103 -10.810 -3.740 9.842 1.00 0.00 O ATOM 1645 C1' C B 103 -9.228 -2.865 8.206 1.00 0.00 C ATOM 1646 N1 C B 103 -8.624 -3.905 7.343 1.00 0.00 N ATOM 1647 C2 C B 103 -9.067 -3.989 6.027 1.00 0.00 C ATOM 1648 O2 C B 103 -9.989 -3.285 5.616 1.00 0.00 O ATOM 1649 N3 C B 103 -8.455 -4.871 5.193 1.00 0.00 N ATOM 1650 C4 C B 103 -7.465 -5.652 5.632 1.00 0.00 C ATOM 1651 N4 C B 103 -6.859 -6.469 4.775 1.00 0.00 N ATOM 1652 C5 C B 103 -7.044 -5.625 6.993 1.00 0.00 C ATOM 1653 C6 C B 103 -7.654 -4.745 7.809 1.00 0.00 C ATOM 0 H5' C B 103 -5.986 -1.590 9.147 1.00 0.00 H new ATOM 0 H5'' C B 103 -6.318 -1.202 10.824 1.00 0.00 H new ATOM 0 H4' C B 103 -8.130 -0.312 9.756 1.00 0.00 H new ATOM 0 H3' C B 103 -8.834 -2.290 11.481 1.00 0.00 H new ATOM 0 H2' C B 103 -8.871 -4.184 9.929 1.00 0.00 H new ATOM 0 HO2' C B 103 -11.360 -2.970 10.097 1.00 0.00 H new ATOM 0 H1' C B 103 -10.196 -2.629 7.764 1.00 0.00 H new ATOM 0 H41 C B 103 -6.101 -7.072 5.094 1.00 0.00 H new ATOM 0 H42 C B 103 -7.152 -6.492 3.798 1.00 0.00 H new ATOM 0 H5 C B 103 -6.268 -6.283 7.355 1.00 0.00 H new ATOM 0 H6 C B 103 -7.371 -4.703 8.850 1.00 0.00 H new ATOM 1665 P C B 104 -10.228 0.095 11.511 1.00 0.00 P ATOM 1666 OP1 C B 104 -8.866 0.195 12.085 1.00 0.00 O ATOM 1667 OP2 C B 104 -11.393 0.063 12.426 1.00 0.00 O ATOM 1668 O5' C B 104 -10.433 1.333 10.496 1.00 0.00 O ATOM 1669 C5' C B 104 -10.488 2.653 11.007 1.00 0.00 C ATOM 1670 C4' C B 104 -10.484 3.736 9.919 1.00 0.00 C ATOM 1671 O4' C B 104 -9.555 3.421 8.895 1.00 0.00 O ATOM 1672 C3' C B 104 -11.827 3.954 9.230 1.00 0.00 C ATOM 1673 O3' C B 104 -12.790 4.726 9.926 1.00 0.00 O ATOM 1674 C2' C B 104 -11.375 4.633 7.951 1.00 0.00 C ATOM 1675 O2' C B 104 -11.149 6.014 8.145 1.00 0.00 O ATOM 1676 C1' C B 104 -10.051 3.938 7.670 1.00 0.00 C ATOM 1677 N1 C B 104 -10.359 2.862 6.705 1.00 0.00 N ATOM 1678 C2 C B 104 -10.105 3.072 5.359 1.00 0.00 C ATOM 1679 O2 C B 104 -9.558 4.104 4.974 1.00 0.00 O ATOM 1680 N3 C B 104 -10.478 2.109 4.475 1.00 0.00 N ATOM 1681 C4 C B 104 -11.056 0.982 4.893 1.00 0.00 C ATOM 1682 N4 C B 104 -11.400 0.069 3.987 1.00 0.00 N ATOM 1683 C5 C B 104 -11.301 0.737 6.279 1.00 0.00 C ATOM 1684 C6 C B 104 -10.932 1.707 7.141 1.00 0.00 C ATOM 0 H5' C B 104 -9.637 2.813 11.669 1.00 0.00 H new ATOM 0 H5'' C B 104 -11.388 2.762 11.612 1.00 0.00 H new ATOM 0 H4' C B 104 -10.220 4.646 10.458 1.00 0.00 H new ATOM 0 H3' C B 104 -12.376 3.019 9.120 1.00 0.00 H new ATOM 0 H2' C B 104 -12.111 4.559 7.151 1.00 0.00 H new ATOM 0 HO2' C B 104 -11.312 6.493 7.306 1.00 0.00 H new ATOM 0 H1' C B 104 -9.290 4.601 7.258 1.00 0.00 H new ATOM 0 H41 C B 104 -11.843 -0.801 4.282 1.00 0.00 H new ATOM 0 H42 C B 104 -11.220 0.239 2.998 1.00 0.00 H new ATOM 0 H5 C B 104 -11.759 -0.180 6.620 1.00 0.00 H new ATOM 0 H6 C B 104 -11.095 1.564 8.199 1.00 0.00 H new ATOM 1696 P A B 105 -14.261 4.946 9.292 1.00 0.00 P ATOM 1697 OP1 A B 105 -15.264 4.465 10.263 1.00 0.00 O ATOM 1698 OP2 A B 105 -14.270 4.405 7.918 1.00 0.00 O ATOM 1699 O5' A B 105 -14.428 6.539 9.145 1.00 0.00 O ATOM 1700 C5' A B 105 -15.298 7.255 9.996 1.00 0.00 C ATOM 1701 C4' A B 105 -14.627 7.640 11.315 1.00 0.00 C ATOM 1702 O4' A B 105 -14.244 6.503 12.085 1.00 0.00 O ATOM 1703 C3' A B 105 -13.380 8.502 11.088 1.00 0.00 C ATOM 1704 O3' A B 105 -13.538 9.781 11.671 1.00 0.00 O ATOM 1705 C2' A B 105 -12.313 7.721 11.845 1.00 0.00 C ATOM 1706 O2' A B 105 -11.372 8.556 12.491 1.00 0.00 O ATOM 1707 C1' A B 105 -13.146 6.938 12.848 1.00 0.00 C ATOM 1708 N9 A B 105 -12.331 5.899 13.501 1.00 0.00 N ATOM 1709 C8 A B 105 -11.459 5.019 12.928 1.00 0.00 C ATOM 1710 N7 A B 105 -10.826 4.247 13.766 1.00 0.00 N ATOM 1711 C5 A B 105 -11.302 4.665 15.004 1.00 0.00 C ATOM 1712 C6 A B 105 -11.001 4.291 16.328 1.00 0.00 C ATOM 1713 N6 A B 105 -10.109 3.350 16.645 1.00 0.00 N ATOM 1714 N1 A B 105 -11.631 4.918 17.329 1.00 0.00 N ATOM 1715 C2 A B 105 -12.511 5.865 17.035 1.00 0.00 C ATOM 1716 N3 A B 105 -12.890 6.310 15.844 1.00 0.00 N ATOM 1717 C4 A B 105 -12.239 5.657 14.854 1.00 0.00 C ATOM 0 H5' A B 105 -16.181 6.650 10.202 1.00 0.00 H new ATOM 0 H5'' A B 105 -15.641 8.156 9.488 1.00 0.00 H new ATOM 0 H4' A B 105 -15.378 8.208 11.864 1.00 0.00 H new ATOM 0 H3' A B 105 -13.156 8.672 10.035 1.00 0.00 H new ATOM 0 H2' A B 105 -11.699 7.101 11.192 1.00 0.00 H new ATOM 0 HO2' A B 105 -10.565 8.627 11.940 1.00 0.00 H new ATOM 0 H1' A B 105 -13.508 7.504 13.707 1.00 0.00 H new ATOM 0 H8 A B 105 -11.305 4.966 11.860 1.00 0.00 H new ATOM 0 H61 A B 105 -9.934 3.123 17.624 1.00 0.00 H new ATOM 0 H62 A B 105 -9.603 2.858 15.908 1.00 0.00 H new ATOM 0 H2 A B 105 -12.985 6.340 17.882 1.00 0.00 H new ATOM 1729 P G B 106 -14.224 10.986 10.859 1.00 0.00 P ATOM 1730 OP1 G B 106 -14.423 12.113 11.801 1.00 0.00 O ATOM 1731 OP2 G B 106 -15.380 10.453 10.101 1.00 0.00 O ATOM 1732 O5' G B 106 -13.084 11.415 9.809 1.00 0.00 O ATOM 1733 C5' G B 106 -11.879 12.002 10.260 1.00 0.00 C ATOM 1734 C4' G B 106 -11.053 12.585 9.112 1.00 0.00 C ATOM 1735 O4' G B 106 -10.371 11.583 8.374 1.00 0.00 O ATOM 1736 C3' G B 106 -11.906 13.403 8.143 1.00 0.00 C ATOM 1737 O3' G B 106 -11.245 14.622 7.869 1.00 0.00 O ATOM 1738 C2' G B 106 -11.995 12.541 6.890 1.00 0.00 C ATOM 1739 O2' G B 106 -11.798 13.315 5.726 1.00 0.00 O ATOM 1740 C1' G B 106 -10.874 11.514 7.052 1.00 0.00 C ATOM 1741 N9 G B 106 -11.388 10.164 6.754 1.00 0.00 N ATOM 1742 C8 G B 106 -12.514 9.546 7.226 1.00 0.00 C ATOM 1743 N7 G B 106 -12.719 8.362 6.718 1.00 0.00 N ATOM 1744 C5 G B 106 -11.635 8.171 5.861 1.00 0.00 C ATOM 1745 C6 G B 106 -11.310 7.080 5.001 1.00 0.00 C ATOM 1746 O6 G B 106 -11.922 6.028 4.831 1.00 0.00 O ATOM 1747 N1 G B 106 -10.141 7.305 4.293 1.00 0.00 N ATOM 1748 C2 G B 106 -9.383 8.446 4.378 1.00 0.00 C ATOM 1749 N2 G B 106 -8.310 8.512 3.603 1.00 0.00 N ATOM 1750 N3 G B 106 -9.671 9.473 5.183 1.00 0.00 N ATOM 1751 C4 G B 106 -10.812 9.268 5.890 1.00 0.00 C ATOM 0 H5' G B 106 -11.287 11.253 10.787 1.00 0.00 H new ATOM 0 H5'' G B 106 -12.107 12.790 10.977 1.00 0.00 H new ATOM 0 H4' G B 106 -10.322 13.238 9.590 1.00 0.00 H new ATOM 0 H3' G B 106 -12.894 13.647 8.533 1.00 0.00 H new ATOM 0 H2' G B 106 -12.975 12.076 6.781 1.00 0.00 H new ATOM 0 HO2' G B 106 -11.502 14.215 5.978 1.00 0.00 H new ATOM 0 H1' G B 106 -10.065 11.731 6.355 1.00 0.00 H new ATOM 0 H8 G B 106 -13.173 9.997 7.953 1.00 0.00 H new ATOM 0 H1 G B 106 -9.820 6.570 3.663 1.00 0.00 H new ATOM 0 H21 G B 106 -7.713 9.339 3.628 1.00 0.00 H new ATOM 0 H22 G B 106 -8.081 7.736 2.981 1.00 0.00 H new ATOM 1763 P U B 107 -11.786 16.006 8.479 1.00 0.00 P ATOM 1764 OP1 U B 107 -10.698 17.008 8.416 1.00 0.00 O ATOM 1765 OP2 U B 107 -12.446 15.720 9.776 1.00 0.00 O ATOM 1766 O5' U B 107 -12.918 16.408 7.409 1.00 0.00 O ATOM 1767 C5' U B 107 -12.561 17.029 6.191 1.00 0.00 C ATOM 1768 C4' U B 107 -13.731 16.953 5.213 1.00 0.00 C ATOM 1769 O4' U B 107 -13.630 17.949 4.200 1.00 0.00 O ATOM 1770 C3' U B 107 -13.794 15.596 4.514 1.00 0.00 C ATOM 1771 O3' U B 107 -14.603 14.663 5.197 1.00 0.00 O ATOM 1772 C2' U B 107 -14.402 15.977 3.172 1.00 0.00 C ATOM 1773 O2' U B 107 -15.806 16.117 3.277 1.00 0.00 O ATOM 1774 C1' U B 107 -13.781 17.347 2.921 1.00 0.00 C ATOM 1775 N1 U B 107 -12.514 17.202 2.148 1.00 0.00 N ATOM 1776 C2 U B 107 -11.292 17.632 2.673 1.00 0.00 C ATOM 1777 O2 U B 107 -11.161 18.151 3.778 1.00 0.00 O ATOM 1778 N3 U B 107 -10.178 17.441 1.868 1.00 0.00 N ATOM 1779 C4 U B 107 -10.167 16.890 0.599 1.00 0.00 C ATOM 1780 O4 U B 107 -9.116 16.783 -0.025 1.00 0.00 O ATOM 1781 C5 U B 107 -11.470 16.485 0.129 1.00 0.00 C ATOM 1782 C6 U B 107 -12.574 16.644 0.893 1.00 0.00 C ATOM 0 H5' U B 107 -11.686 16.539 5.765 1.00 0.00 H new ATOM 0 H5'' U B 107 -12.289 18.070 6.368 1.00 0.00 H new ATOM 0 H4' U B 107 -14.630 17.110 5.809 1.00 0.00 H new ATOM 0 H3' U B 107 -12.826 15.100 4.452 1.00 0.00 H new ATOM 0 H2' U B 107 -14.219 15.240 2.391 1.00 0.00 H new ATOM 0 HO2' U B 107 -16.134 15.572 4.023 1.00 0.00 H new ATOM 0 HO3' U B 107 -14.036 13.975 5.604 1.00 0.00 H new ATOM 0 H1' U B 107 -14.402 17.995 2.303 1.00 0.00 H new ATOM 0 H3 U B 107 -9.279 17.736 2.249 1.00 0.00 H new ATOM 0 H5 U B 107 -11.565 16.046 -0.853 1.00 0.00 H new ATOM 0 H6 U B 107 -13.530 16.324 0.506 1.00 0.00 H new TER 1794 U B 107