USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1022 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 TYR OH : rot -82:sc= 0.836 USER MOD Set 1.2: A 47 SER OG : rot -81:sc= 2.29 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0.0547 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 MET CE :methyl -126:sc= -0.61 (180deg=-1.32) USER MOD Single : A 30 THR OG1 : rot -150:sc= -0.136 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc=-0.00807 X(o=-0.0081,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 35 ASN : amide:sc= -6.75! C(o=-6.7!,f=-10!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 82:sc= 0.4 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 57:sc= 1.23 USER MOD Single : A 48 SER OG : rot 115:sc= 0.0394 USER MOD Single : A 52 THR OG1 : rot 115:sc= 0.212! USER MOD Single : A 55 HIS : no HD1:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 56 THR OG1 : rot 120:sc= -0.744 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.275 X(o=-0.27,f=-0.035) USER MOD Single : A 63 LYS NZ :NH3+ -131:sc= 0.986 (180deg=0.00843) USER MOD Single : A 65 ASN : amide:sc= 0.351 X(o=0.35,f=-0.04) USER MOD Single : A 67 TYR OH : rot -34:sc= 1.5 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0857) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -0.992 X(o=-0.99,f=-0.5) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 142:sc= -0.342 (180deg=-2.32!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.588 X(o=-0.59,f=-0.24) USER MOD Single : A 100 MET CE :methyl -122:sc= -2.98 (180deg=-5.33!) USER MOD Single : A 102 TYR OH : rot -2:sc= 0.104 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -158:sc= -0.741 (180deg=-1.42) USER MOD Single : A 112 THR OG1 : rot -43:sc= 0.28 USER MOD Single : A 113 MET CE :methyl -145:sc= -2.92 (180deg=-5.51!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.37) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0546 USER MOD Single : A 127 LYS NZ :NH3+ -131:sc= -0.104 (180deg=-1.52!) USER MOD Single : A 132 ASN : amide:sc= -4.29! C(o=-4.3!,f=-7.7!) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.0631 USER MOD Single : A 138 THR OG1 : rot -74:sc= 0.129 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 6.558 1.059 4.569 1.00 22.31 N ATOM 2 CA SER A 12 6.947 -0.313 4.875 1.00 31.12 C ATOM 3 C SER A 12 5.845 -1.291 4.479 1.00 60.10 C ATOM 4 O SER A 12 4.661 -0.962 4.527 1.00 35.34 O ATOM 5 CB SER A 12 7.260 -0.456 6.366 1.00 72.31 C ATOM 6 OG SER A 12 7.841 -1.718 6.646 1.00 1.10 O ATOM 0 HA SER A 12 7.842 -0.548 4.299 1.00 31.12 H new ATOM 0 HB2 SER A 12 7.940 0.338 6.676 1.00 72.31 H new ATOM 0 HB3 SER A 12 6.345 -0.337 6.946 1.00 72.31 H new ATOM 0 HG SER A 12 8.033 -1.784 7.605 1.00 1.10 H new ATOM 12 N GLY A 13 6.245 -2.497 4.086 1.00 4.24 N ATOM 13 CA GLY A 13 5.281 -3.505 3.687 1.00 21.11 C ATOM 14 C GLY A 13 5.879 -4.544 2.760 1.00 63.42 C ATOM 15 O GLY A 13 6.699 -4.221 1.899 1.00 20.10 O ATOM 0 H GLY A 13 7.220 -2.793 4.037 1.00 4.24 H new ATOM 0 HA2 GLY A 13 4.887 -3.999 4.575 1.00 21.11 H new ATOM 0 HA3 GLY A 13 4.439 -3.022 3.191 1.00 21.11 H new ATOM 19 N LEU A 14 5.471 -5.796 2.935 1.00 30.20 N ATOM 20 CA LEU A 14 5.973 -6.888 2.108 1.00 43.23 C ATOM 21 C LEU A 14 5.563 -6.700 0.651 1.00 43.24 C ATOM 22 O LEU A 14 4.674 -5.906 0.342 1.00 5.22 O ATOM 23 CB LEU A 14 5.452 -8.229 2.627 1.00 3.01 C ATOM 24 CG LEU A 14 6.379 -8.986 3.579 1.00 64.25 C ATOM 25 CD1 LEU A 14 7.648 -9.416 2.858 1.00 1.33 C ATOM 26 CD2 LEU A 14 6.716 -8.129 4.790 1.00 31.00 C ATOM 0 H LEU A 14 4.794 -6.080 3.643 1.00 30.20 H new ATOM 0 HA LEU A 14 7.062 -6.882 2.164 1.00 43.23 H new ATOM 0 HB2 LEU A 14 4.504 -8.055 3.136 1.00 3.01 H new ATOM 0 HB3 LEU A 14 5.241 -8.870 1.771 1.00 3.01 H new ATOM 0 HG LEU A 14 5.861 -9.880 3.925 1.00 64.25 H new ATOM 0 HD11 LEU A 14 8.296 -9.953 3.551 1.00 1.33 H new ATOM 0 HD12 LEU A 14 7.389 -10.068 2.024 1.00 1.33 H new ATOM 0 HD13 LEU A 14 8.169 -8.535 2.483 1.00 1.33 H new ATOM 0 HD21 LEU A 14 7.376 -8.684 5.456 1.00 31.00 H new ATOM 0 HD22 LEU A 14 7.214 -7.217 4.463 1.00 31.00 H new ATOM 0 HD23 LEU A 14 5.799 -7.871 5.320 1.00 31.00 H new ATOM 38 N VAL A 15 6.216 -7.437 -0.242 1.00 72.43 N ATOM 39 CA VAL A 15 5.917 -7.355 -1.667 1.00 1.20 C ATOM 40 C VAL A 15 5.125 -8.571 -2.134 1.00 24.01 C ATOM 41 O VAL A 15 5.456 -9.715 -1.822 1.00 62.32 O ATOM 42 CB VAL A 15 7.205 -7.241 -2.505 1.00 34.53 C ATOM 43 CG1 VAL A 15 8.120 -8.427 -2.240 1.00 61.12 C ATOM 44 CG2 VAL A 15 6.869 -7.136 -3.985 1.00 22.23 C ATOM 0 H VAL A 15 6.956 -8.098 -0.004 1.00 72.43 H new ATOM 0 HA VAL A 15 5.317 -6.457 -1.813 1.00 1.20 H new ATOM 0 HB VAL A 15 7.732 -6.333 -2.210 1.00 34.53 H new ATOM 0 HG11 VAL A 15 9.025 -8.330 -2.840 1.00 61.12 H new ATOM 0 HG12 VAL A 15 8.387 -8.452 -1.183 1.00 61.12 H new ATOM 0 HG13 VAL A 15 7.605 -9.350 -2.506 1.00 61.12 H new ATOM 0 HG21 VAL A 15 7.790 -7.056 -4.562 1.00 22.23 H new ATOM 0 HG22 VAL A 15 6.321 -8.025 -4.298 1.00 22.23 H new ATOM 0 HG23 VAL A 15 6.255 -6.252 -4.157 1.00 22.23 H new ATOM 54 N PRO A 16 4.054 -8.321 -2.901 1.00 14.35 N ATOM 55 CA PRO A 16 3.192 -9.383 -3.428 1.00 43.14 C ATOM 56 C PRO A 16 3.888 -10.214 -4.501 1.00 51.34 C ATOM 57 O PRO A 16 3.726 -9.963 -5.696 1.00 1.12 O ATOM 58 CB PRO A 16 2.011 -8.616 -4.028 1.00 33.51 C ATOM 59 CG PRO A 16 2.560 -7.271 -4.357 1.00 73.45 C ATOM 60 CD PRO A 16 3.600 -6.981 -3.312 1.00 24.24 C ATOM 0 HA PRO A 16 2.906 -10.097 -2.656 1.00 43.14 H new ATOM 0 HB2 PRO A 16 1.626 -9.115 -4.917 1.00 33.51 H new ATOM 0 HB3 PRO A 16 1.185 -8.544 -3.320 1.00 33.51 H new ATOM 0 HG2 PRO A 16 2.997 -7.262 -5.356 1.00 73.45 H new ATOM 0 HG3 PRO A 16 1.774 -6.516 -4.346 1.00 73.45 H new ATOM 0 HD2 PRO A 16 4.419 -6.385 -3.715 1.00 24.24 H new ATOM 0 HD3 PRO A 16 3.183 -6.423 -2.474 1.00 24.24 H new ATOM 68 N ARG A 17 4.662 -11.203 -4.068 1.00 34.51 N ATOM 69 CA ARG A 17 5.382 -12.071 -4.992 1.00 44.30 C ATOM 70 C ARG A 17 5.371 -13.516 -4.502 1.00 40.24 C ATOM 71 O ARG A 17 6.240 -14.310 -4.860 1.00 0.12 O ATOM 72 CB ARG A 17 6.825 -11.588 -5.158 1.00 33.42 C ATOM 73 CG ARG A 17 6.938 -10.216 -5.800 1.00 52.44 C ATOM 74 CD ARG A 17 7.947 -10.215 -6.938 1.00 52.41 C ATOM 75 NE ARG A 17 7.587 -9.265 -7.988 1.00 20.21 N ATOM 76 CZ ARG A 17 6.630 -9.486 -8.882 1.00 35.12 C ATOM 77 NH1 ARG A 17 5.939 -10.618 -8.853 1.00 3.31 N ATOM 78 NH2 ARG A 17 6.360 -8.574 -9.807 1.00 5.42 N ATOM 0 H ARG A 17 4.807 -11.424 -3.083 1.00 34.51 H new ATOM 0 HA ARG A 17 4.878 -12.030 -5.958 1.00 44.30 H new ATOM 0 HB2 ARG A 17 7.305 -11.563 -4.180 1.00 33.42 H new ATOM 0 HB3 ARG A 17 7.373 -12.309 -5.764 1.00 33.42 H new ATOM 0 HG2 ARG A 17 5.963 -9.908 -6.177 1.00 52.44 H new ATOM 0 HG3 ARG A 17 7.235 -9.485 -5.048 1.00 52.44 H new ATOM 0 HD2 ARG A 17 8.934 -9.967 -6.547 1.00 52.41 H new ATOM 0 HD3 ARG A 17 8.015 -11.216 -7.363 1.00 52.41 H new ATOM 0 HE ARG A 17 8.099 -8.384 -8.037 1.00 20.21 H new ATOM 0 HH11 ARG A 17 6.142 -11.321 -8.143 1.00 3.31 H new ATOM 0 HH12 ARG A 17 5.205 -10.785 -9.541 1.00 3.31 H new ATOM 0 HH21 ARG A 17 6.888 -7.702 -9.832 1.00 5.42 H new ATOM 0 HH22 ARG A 17 5.625 -8.745 -10.493 1.00 5.42 H new ATOM 92 N GLY A 18 4.380 -13.849 -3.681 1.00 71.52 N ATOM 93 CA GLY A 18 4.274 -15.198 -3.155 1.00 43.04 C ATOM 94 C GLY A 18 5.258 -15.461 -2.033 1.00 22.22 C ATOM 95 O GLY A 18 4.860 -15.752 -0.905 1.00 22.41 O ATOM 0 H GLY A 18 3.649 -13.209 -3.371 1.00 71.52 H new ATOM 0 HA2 GLY A 18 3.260 -15.364 -2.791 1.00 43.04 H new ATOM 0 HA3 GLY A 18 4.445 -15.913 -3.960 1.00 43.04 H new ATOM 99 N SER A 19 6.547 -15.360 -2.342 1.00 21.33 N ATOM 100 CA SER A 19 7.591 -15.595 -1.351 1.00 62.12 C ATOM 101 C SER A 19 7.870 -14.330 -0.545 1.00 34.20 C ATOM 102 O SER A 19 8.007 -13.241 -1.104 1.00 35.42 O ATOM 103 CB SER A 19 8.875 -16.070 -2.035 1.00 74.50 C ATOM 104 OG SER A 19 8.665 -16.287 -3.420 1.00 13.23 O ATOM 0 H SER A 19 6.893 -15.117 -3.270 1.00 21.33 H new ATOM 0 HA SER A 19 7.242 -16.370 -0.669 1.00 62.12 H new ATOM 0 HB2 SER A 19 9.661 -15.328 -1.895 1.00 74.50 H new ATOM 0 HB3 SER A 19 9.220 -16.992 -1.567 1.00 74.50 H new ATOM 0 HG SER A 19 9.500 -16.588 -3.834 1.00 13.23 H new ATOM 110 N HIS A 20 7.952 -14.482 0.773 1.00 31.20 N ATOM 111 CA HIS A 20 8.214 -13.353 1.658 1.00 45.21 C ATOM 112 C HIS A 20 9.714 -13.168 1.873 1.00 73.11 C ATOM 113 O HIS A 20 10.175 -13.024 3.005 1.00 53.13 O ATOM 114 CB HIS A 20 7.516 -13.558 3.002 1.00 1.04 C ATOM 115 CG HIS A 20 6.094 -14.011 2.876 1.00 62.32 C ATOM 116 ND1 HIS A 20 5.050 -13.150 2.614 1.00 41.41 N ATOM 117 CD2 HIS A 20 5.546 -15.245 2.975 1.00 42.01 C ATOM 118 CE1 HIS A 20 3.921 -13.833 2.559 1.00 21.41 C ATOM 119 NE2 HIS A 20 4.195 -15.107 2.774 1.00 33.54 N ATOM 0 H HIS A 20 7.841 -15.376 1.251 1.00 31.20 H new ATOM 0 HA HIS A 20 7.819 -12.454 1.186 1.00 45.21 H new ATOM 0 HB2 HIS A 20 8.073 -14.293 3.583 1.00 1.04 H new ATOM 0 HB3 HIS A 20 7.543 -12.623 3.562 1.00 1.04 H new ATOM 0 HD2 HIS A 20 6.073 -16.166 3.175 1.00 42.01 H new ATOM 0 HE1 HIS A 20 2.941 -13.420 2.370 1.00 21.41 H new ATOM 0 HE2 HIS A 20 3.513 -15.866 2.788 1.00 33.54 H new ATOM 127 N MET A 21 10.469 -13.175 0.779 1.00 13.32 N ATOM 128 CA MET A 21 11.916 -13.007 0.849 1.00 73.50 C ATOM 129 C MET A 21 12.316 -11.580 0.488 1.00 21.53 C ATOM 130 O MET A 21 13.498 -11.237 0.491 1.00 23.24 O ATOM 131 CB MET A 21 12.611 -13.997 -0.088 1.00 53.03 C ATOM 132 CG MET A 21 12.749 -15.393 0.496 1.00 34.42 C ATOM 133 SD MET A 21 11.213 -16.334 0.417 1.00 73.52 S ATOM 134 CE MET A 21 11.185 -17.076 2.047 1.00 64.11 C ATOM 0 H MET A 21 10.103 -13.295 -0.166 1.00 13.32 H new ATOM 0 HA MET A 21 12.231 -13.205 1.874 1.00 73.50 H new ATOM 0 HB2 MET A 21 12.050 -14.056 -1.021 1.00 53.03 H new ATOM 0 HB3 MET A 21 13.602 -13.616 -0.335 1.00 53.03 H new ATOM 0 HG2 MET A 21 13.529 -15.932 -0.042 1.00 34.42 H new ATOM 0 HG3 MET A 21 13.072 -15.318 1.534 1.00 34.42 H new ATOM 0 HE1 MET A 21 11.075 -18.156 1.953 1.00 64.11 H new ATOM 0 HE2 MET A 21 12.117 -16.850 2.566 1.00 64.11 H new ATOM 0 HE3 MET A 21 10.347 -16.674 2.616 1.00 64.11 H new ATOM 144 N VAL A 22 11.324 -10.753 0.177 1.00 15.44 N ATOM 145 CA VAL A 22 11.573 -9.362 -0.185 1.00 34.52 C ATOM 146 C VAL A 22 10.452 -8.456 0.312 1.00 50.13 C ATOM 147 O VAL A 22 9.327 -8.905 0.530 1.00 31.51 O ATOM 148 CB VAL A 22 11.715 -9.197 -1.710 1.00 13.45 C ATOM 149 CG1 VAL A 22 12.311 -7.838 -2.046 1.00 35.03 C ATOM 150 CG2 VAL A 22 12.562 -10.318 -2.290 1.00 65.23 C ATOM 0 H VAL A 22 10.340 -11.021 0.168 1.00 15.44 H new ATOM 0 HA VAL A 22 12.509 -9.072 0.293 1.00 34.52 H new ATOM 0 HB VAL A 22 10.723 -9.253 -2.159 1.00 13.45 H new ATOM 0 HG11 VAL A 22 12.404 -7.739 -3.127 1.00 35.03 H new ATOM 0 HG12 VAL A 22 11.661 -7.051 -1.664 1.00 35.03 H new ATOM 0 HG13 VAL A 22 13.296 -7.749 -1.587 1.00 35.03 H new ATOM 0 HG21 VAL A 22 12.652 -10.186 -3.368 1.00 65.23 H new ATOM 0 HG22 VAL A 22 13.554 -10.296 -1.838 1.00 65.23 H new ATOM 0 HG23 VAL A 22 12.089 -11.277 -2.080 1.00 65.23 H new ATOM 160 N ARG A 23 10.767 -7.177 0.488 1.00 41.14 N ATOM 161 CA ARG A 23 9.787 -6.206 0.959 1.00 34.42 C ATOM 162 C ARG A 23 10.112 -4.809 0.441 1.00 42.34 C ATOM 163 O ARG A 23 11.279 -4.432 0.335 1.00 43.55 O ATOM 164 CB ARG A 23 9.742 -6.197 2.488 1.00 14.13 C ATOM 165 CG ARG A 23 10.817 -5.331 3.124 1.00 62.31 C ATOM 166 CD ARG A 23 11.237 -5.872 4.482 1.00 40.11 C ATOM 167 NE ARG A 23 11.883 -7.178 4.375 1.00 12.54 N ATOM 168 CZ ARG A 23 12.284 -7.887 5.425 1.00 42.45 C ATOM 169 NH1 ARG A 23 12.107 -7.419 6.652 1.00 14.33 N ATOM 170 NH2 ARG A 23 12.864 -9.067 5.247 1.00 41.24 N ATOM 0 H ARG A 23 11.694 -6.789 0.311 1.00 41.14 H new ATOM 0 HA ARG A 23 8.810 -6.498 0.575 1.00 34.42 H new ATOM 0 HB2 ARG A 23 8.763 -5.843 2.812 1.00 14.13 H new ATOM 0 HB3 ARG A 23 9.848 -7.219 2.852 1.00 14.13 H new ATOM 0 HG2 ARG A 23 11.685 -5.284 2.466 1.00 62.31 H new ATOM 0 HG3 ARG A 23 10.446 -4.312 3.236 1.00 62.31 H new ATOM 0 HD2 ARG A 23 11.920 -5.168 4.957 1.00 40.11 H new ATOM 0 HD3 ARG A 23 10.362 -5.952 5.127 1.00 40.11 H new ATOM 0 HE ARG A 23 12.034 -7.567 3.444 1.00 12.54 H new ATOM 0 HH11 ARG A 23 11.662 -6.512 6.793 1.00 14.33 H new ATOM 0 HH12 ARG A 23 12.416 -7.966 7.456 1.00 14.33 H new ATOM 0 HH21 ARG A 23 13.002 -9.430 4.304 1.00 41.24 H new ATOM 0 HH22 ARG A 23 13.172 -9.611 6.053 1.00 41.24 H new ATOM 184 N ARG A 24 9.073 -4.046 0.119 1.00 52.33 N ATOM 185 CA ARG A 24 9.248 -2.691 -0.390 1.00 43.15 C ATOM 186 C ARG A 24 9.719 -1.751 0.716 1.00 71.12 C ATOM 187 O ARG A 24 8.925 -1.008 1.292 1.00 31.54 O ATOM 188 CB ARG A 24 7.939 -2.175 -0.990 1.00 12.11 C ATOM 189 CG ARG A 24 7.239 -3.184 -1.885 1.00 64.53 C ATOM 190 CD ARG A 24 6.850 -2.569 -3.220 1.00 73.22 C ATOM 191 NE ARG A 24 5.569 -1.871 -3.148 1.00 71.32 N ATOM 192 CZ ARG A 24 5.160 -0.991 -4.055 1.00 35.11 C ATOM 193 NH1 ARG A 24 5.926 -0.703 -5.097 1.00 63.15 N ATOM 194 NH2 ARG A 24 3.981 -0.397 -3.920 1.00 74.30 N ATOM 0 H ARG A 24 8.101 -4.343 0.202 1.00 52.33 H new ATOM 0 HA ARG A 24 10.010 -2.718 -1.169 1.00 43.15 H new ATOM 0 HB2 ARG A 24 7.266 -1.891 -0.181 1.00 12.11 H new ATOM 0 HB3 ARG A 24 8.144 -1.272 -1.566 1.00 12.11 H new ATOM 0 HG2 ARG A 24 7.894 -4.038 -2.054 1.00 64.53 H new ATOM 0 HG3 ARG A 24 6.348 -3.560 -1.383 1.00 64.53 H new ATOM 0 HD2 ARG A 24 7.625 -1.872 -3.538 1.00 73.22 H new ATOM 0 HD3 ARG A 24 6.795 -3.351 -3.977 1.00 73.22 H new ATOM 0 HE ARG A 24 4.955 -2.070 -2.358 1.00 71.32 H new ATOM 0 HH11 ARG A 24 6.833 -1.158 -5.205 1.00 63.15 H new ATOM 0 HH12 ARG A 24 5.609 -0.027 -5.792 1.00 63.15 H new ATOM 0 HH21 ARG A 24 3.388 -0.616 -3.119 1.00 74.30 H new ATOM 0 HH22 ARG A 24 3.668 0.279 -4.617 1.00 74.30 H new ATOM 208 N ALA A 25 11.015 -1.790 1.007 1.00 41.05 N ATOM 209 CA ALA A 25 11.592 -0.941 2.042 1.00 74.41 C ATOM 210 C ALA A 25 12.299 0.264 1.433 1.00 44.13 C ATOM 211 O ALA A 25 12.168 0.535 0.239 1.00 13.21 O ATOM 212 CB ALA A 25 12.556 -1.742 2.904 1.00 22.11 C ATOM 0 H ALA A 25 11.686 -2.401 0.540 1.00 41.05 H new ATOM 0 HA ALA A 25 10.781 -0.573 2.670 1.00 74.41 H new ATOM 0 HB1 ALA A 25 12.980 -1.096 3.673 1.00 22.11 H new ATOM 0 HB2 ALA A 25 12.022 -2.567 3.377 1.00 22.11 H new ATOM 0 HB3 ALA A 25 13.358 -2.138 2.281 1.00 22.11 H new ATOM 218 N ARG A 26 13.049 0.985 2.260 1.00 24.41 N ATOM 219 CA ARG A 26 13.776 2.163 1.803 1.00 64.44 C ATOM 220 C ARG A 26 15.171 1.784 1.312 1.00 0.43 C ATOM 221 O ARG A 26 15.492 0.604 1.171 1.00 41.14 O ATOM 222 CB ARG A 26 13.882 3.192 2.929 1.00 51.41 C ATOM 223 CG ARG A 26 13.542 4.608 2.493 1.00 4.43 C ATOM 224 CD ARG A 26 12.086 4.943 2.773 1.00 54.12 C ATOM 225 NE ARG A 26 11.831 5.129 4.199 1.00 75.42 N ATOM 226 CZ ARG A 26 10.651 5.488 4.694 1.00 45.42 C ATOM 227 NH1 ARG A 26 9.625 5.700 3.882 1.00 34.31 N ATOM 228 NH2 ARG A 26 10.498 5.637 6.003 1.00 33.13 N ATOM 0 H ARG A 26 13.169 0.774 3.251 1.00 24.41 H new ATOM 0 HA ARG A 26 13.223 2.601 0.972 1.00 64.44 H new ATOM 0 HB2 ARG A 26 13.215 2.901 3.740 1.00 51.41 H new ATOM 0 HB3 ARG A 26 14.896 3.177 3.329 1.00 51.41 H new ATOM 0 HG2 ARG A 26 14.186 5.315 3.016 1.00 4.43 H new ATOM 0 HG3 ARG A 26 13.744 4.720 1.428 1.00 4.43 H new ATOM 0 HD2 ARG A 26 11.813 5.851 2.235 1.00 54.12 H new ATOM 0 HD3 ARG A 26 11.451 4.143 2.393 1.00 54.12 H new ATOM 0 HE ARG A 26 12.601 4.975 4.851 1.00 75.42 H new ATOM 0 HH11 ARG A 26 9.740 5.588 2.875 1.00 34.31 H new ATOM 0 HH12 ARG A 26 8.720 5.975 4.264 1.00 34.31 H new ATOM 0 HH21 ARG A 26 11.286 5.476 6.630 1.00 33.13 H new ATOM 0 HH22 ARG A 26 9.592 5.913 6.382 1.00 33.13 H new ATOM 242 N CYS A 27 15.996 2.794 1.054 1.00 32.24 N ATOM 243 CA CYS A 27 17.355 2.569 0.579 1.00 25.21 C ATOM 244 C CYS A 27 18.203 3.827 0.739 1.00 1.55 C ATOM 245 O CYS A 27 17.762 4.931 0.417 1.00 31.04 O ATOM 246 CB CYS A 27 17.340 2.135 -0.888 1.00 31.41 C ATOM 247 SG CYS A 27 18.368 0.673 -1.242 1.00 5.33 S ATOM 0 H CYS A 27 15.746 3.777 1.166 1.00 32.24 H new ATOM 0 HA CYS A 27 17.796 1.775 1.182 1.00 25.21 H new ATOM 0 HB2 CYS A 27 16.312 1.923 -1.182 1.00 31.41 H new ATOM 0 HB3 CYS A 27 17.684 2.965 -1.505 1.00 31.41 H new ATOM 252 N TYR A 28 19.422 3.654 1.239 1.00 74.52 N ATOM 253 CA TYR A 28 20.331 4.775 1.444 1.00 33.22 C ATOM 254 C TYR A 28 21.766 4.380 1.112 1.00 44.12 C ATOM 255 O TYR A 28 22.167 3.224 1.248 1.00 61.13 O ATOM 256 CB TYR A 28 20.247 5.268 2.890 1.00 43.13 C ATOM 257 CG TYR A 28 20.770 4.273 3.900 1.00 23.54 C ATOM 258 CD1 TYR A 28 22.136 4.102 4.094 1.00 14.23 C ATOM 259 CD2 TYR A 28 19.900 3.502 4.661 1.00 74.35 C ATOM 260 CE1 TYR A 28 22.618 3.193 5.016 1.00 3.30 C ATOM 261 CE2 TYR A 28 20.373 2.592 5.586 1.00 62.45 C ATOM 262 CZ TYR A 28 21.733 2.441 5.760 1.00 61.25 C ATOM 263 OH TYR A 28 22.209 1.534 6.679 1.00 51.21 O ATOM 0 H TYR A 28 19.803 2.747 1.510 1.00 74.52 H new ATOM 0 HA TYR A 28 20.031 5.581 0.774 1.00 33.22 H new ATOM 0 HB2 TYR A 28 20.811 6.196 2.982 1.00 43.13 H new ATOM 0 HB3 TYR A 28 19.209 5.501 3.126 1.00 43.13 H new ATOM 0 HD1 TYR A 28 22.832 4.690 3.514 1.00 14.23 H new ATOM 0 HD2 TYR A 28 18.834 3.616 4.527 1.00 74.35 H new ATOM 0 HE1 TYR A 28 23.682 3.072 5.153 1.00 3.30 H new ATOM 0 HE2 TYR A 28 19.682 2.002 6.170 1.00 62.45 H new ATOM 0 HH TYR A 28 22.452 0.702 6.222 1.00 51.21 H new ATOM 273 N PRO A 29 22.561 5.364 0.666 1.00 42.15 N ATOM 274 CA PRO A 29 23.965 5.146 0.305 1.00 22.32 C ATOM 275 C PRO A 29 24.838 4.860 1.522 1.00 23.52 C ATOM 276 O PRO A 29 25.072 5.738 2.353 1.00 53.20 O ATOM 277 CB PRO A 29 24.374 6.469 -0.347 1.00 20.11 C ATOM 278 CG PRO A 29 23.451 7.481 0.239 1.00 3.13 C ATOM 279 CD PRO A 29 22.150 6.766 0.479 1.00 65.11 C ATOM 0 HA PRO A 29 24.089 4.279 -0.344 1.00 22.32 H new ATOM 0 HB2 PRO A 29 25.415 6.711 -0.132 1.00 20.11 H new ATOM 0 HB3 PRO A 29 24.275 6.423 -1.431 1.00 20.11 H new ATOM 0 HG2 PRO A 29 23.853 7.883 1.169 1.00 3.13 H new ATOM 0 HG3 PRO A 29 23.314 8.323 -0.439 1.00 3.13 H new ATOM 0 HD2 PRO A 29 21.634 7.154 1.357 1.00 65.11 H new ATOM 0 HD3 PRO A 29 21.469 6.876 -0.365 1.00 65.11 H new ATOM 287 N THR A 30 25.320 3.624 1.622 1.00 14.33 N ATOM 288 CA THR A 30 26.166 3.222 2.738 1.00 5.11 C ATOM 289 C THR A 30 27.445 4.051 2.785 1.00 13.31 C ATOM 290 O THR A 30 27.600 4.922 3.641 1.00 10.12 O ATOM 291 CB THR A 30 26.539 1.730 2.651 1.00 31.04 C ATOM 292 OG1 THR A 30 25.732 1.080 1.663 1.00 40.31 O ATOM 293 CG2 THR A 30 26.350 1.046 3.997 1.00 21.00 C ATOM 0 H THR A 30 25.138 2.885 0.943 1.00 14.33 H new ATOM 0 HA THR A 30 25.591 3.393 3.648 1.00 5.11 H new ATOM 0 HB THR A 30 27.589 1.657 2.368 1.00 31.04 H new ATOM 0 HG1 THR A 30 25.604 0.141 1.912 1.00 40.31 H new ATOM 0 HG21 THR A 30 26.619 -0.007 3.911 1.00 21.00 H new ATOM 0 HG22 THR A 30 26.987 1.524 4.741 1.00 21.00 H new ATOM 0 HG23 THR A 30 25.308 1.130 4.305 1.00 21.00 H new ATOM 301 N SER A 31 28.358 3.776 1.859 1.00 33.11 N ATOM 302 CA SER A 31 29.625 4.495 1.797 1.00 13.11 C ATOM 303 C SER A 31 29.684 5.385 0.560 1.00 51.35 C ATOM 304 O SER A 31 28.800 5.338 -0.295 1.00 44.21 O ATOM 305 CB SER A 31 30.795 3.510 1.787 1.00 72.52 C ATOM 306 OG SER A 31 31.428 3.457 3.053 1.00 21.44 O ATOM 0 H SER A 31 28.244 3.060 1.141 1.00 33.11 H new ATOM 0 HA SER A 31 29.700 5.127 2.682 1.00 13.11 H new ATOM 0 HB2 SER A 31 30.436 2.517 1.514 1.00 72.52 H new ATOM 0 HB3 SER A 31 31.518 3.807 1.028 1.00 72.52 H new ATOM 0 HG SER A 31 32.171 2.819 3.021 1.00 21.44 H new ATOM 312 N ASN A 32 30.733 6.197 0.472 1.00 71.22 N ATOM 313 CA ASN A 32 30.909 7.099 -0.660 1.00 54.14 C ATOM 314 C ASN A 32 31.092 6.316 -1.957 1.00 13.01 C ATOM 315 O ASN A 32 30.444 6.602 -2.963 1.00 70.14 O ATOM 316 CB ASN A 32 32.114 8.013 -0.429 1.00 32.22 C ATOM 317 CG ASN A 32 31.718 9.471 -0.304 1.00 10.41 C ATOM 318 OD1 ASN A 32 32.155 10.314 -1.088 1.00 10.12 O ATOM 319 ND2 ASN A 32 30.886 9.776 0.686 1.00 65.12 N ATOM 0 H ASN A 32 31.474 6.249 1.171 1.00 71.22 H new ATOM 0 HA ASN A 32 30.010 7.709 -0.748 1.00 54.14 H new ATOM 0 HB2 ASN A 32 32.634 7.702 0.477 1.00 32.22 H new ATOM 0 HB3 ASN A 32 32.816 7.900 -1.255 1.00 32.22 H new ATOM 0 HD21 ASN A 32 30.585 10.741 0.820 1.00 65.12 H new ATOM 0 HD22 ASN A 32 30.549 9.045 1.312 1.00 65.12 H new ATOM 326 N ALA A 33 31.978 5.326 -1.924 1.00 2.52 N ATOM 327 CA ALA A 33 32.245 4.500 -3.095 1.00 12.33 C ATOM 328 C ALA A 33 31.455 3.197 -3.038 1.00 64.21 C ATOM 329 O ALA A 33 30.751 2.843 -3.984 1.00 51.24 O ATOM 330 CB ALA A 33 33.734 4.213 -3.210 1.00 25.33 C ATOM 0 H ALA A 33 32.523 5.077 -1.099 1.00 2.52 H new ATOM 0 HA ALA A 33 31.924 5.051 -3.979 1.00 12.33 H new ATOM 0 HB1 ALA A 33 33.919 3.595 -4.089 1.00 25.33 H new ATOM 0 HB2 ALA A 33 34.279 5.152 -3.305 1.00 25.33 H new ATOM 0 HB3 ALA A 33 34.073 3.686 -2.318 1.00 25.33 H new ATOM 336 N THR A 34 31.578 2.484 -1.922 1.00 54.15 N ATOM 337 CA THR A 34 30.877 1.219 -1.743 1.00 61.33 C ATOM 338 C THR A 34 30.953 0.749 -0.295 1.00 71.42 C ATOM 339 O THR A 34 31.868 1.117 0.439 1.00 24.45 O ATOM 340 CB THR A 34 31.455 0.122 -2.658 1.00 10.30 C ATOM 341 OG1 THR A 34 30.926 -1.155 -2.286 1.00 21.33 O ATOM 342 CG2 THR A 34 32.974 0.092 -2.574 1.00 14.22 C ATOM 0 H THR A 34 32.157 2.762 -1.129 1.00 54.15 H new ATOM 0 HA THR A 34 29.835 1.394 -2.011 1.00 61.33 H new ATOM 0 HB THR A 34 31.168 0.348 -3.685 1.00 10.30 H new ATOM 0 HG1 THR A 34 31.297 -1.846 -2.873 1.00 21.33 H new ATOM 0 HG21 THR A 34 33.359 -0.690 -3.228 1.00 14.22 H new ATOM 0 HG22 THR A 34 33.375 1.056 -2.886 1.00 14.22 H new ATOM 0 HG23 THR A 34 33.278 -0.112 -1.547 1.00 14.22 H new ATOM 350 N ASN A 35 29.985 -0.068 0.109 1.00 53.54 N ATOM 351 CA ASN A 35 29.942 -0.588 1.470 1.00 23.42 C ATOM 352 C ASN A 35 30.972 -1.698 1.660 1.00 4.45 C ATOM 353 O ASN A 35 31.193 -2.516 0.767 1.00 33.43 O ATOM 354 CB ASN A 35 28.543 -1.116 1.793 1.00 11.34 C ATOM 355 CG ASN A 35 28.483 -1.807 3.142 1.00 53.30 C ATOM 356 OD1 ASN A 35 27.906 -2.887 3.273 1.00 4.44 O ATOM 357 ND2 ASN A 35 29.079 -1.185 4.152 1.00 2.24 N ATOM 0 H ASN A 35 29.220 -0.384 -0.487 1.00 53.54 H new ATOM 0 HA ASN A 35 30.182 0.228 2.152 1.00 23.42 H new ATOM 0 HB2 ASN A 35 27.833 -0.289 1.780 1.00 11.34 H new ATOM 0 HB3 ASN A 35 28.233 -1.815 1.016 1.00 11.34 H new ATOM 0 HD21 ASN A 35 29.071 -1.601 5.083 1.00 2.24 H new ATOM 0 HD22 ASN A 35 29.545 -0.291 3.997 1.00 2.24 H new ATOM 364 N THR A 36 31.602 -1.719 2.832 1.00 75.15 N ATOM 365 CA THR A 36 32.608 -2.727 3.140 1.00 45.52 C ATOM 366 C THR A 36 32.261 -3.477 4.420 1.00 30.51 C ATOM 367 O THR A 36 31.810 -2.881 5.399 1.00 62.42 O ATOM 368 CB THR A 36 34.006 -2.096 3.291 1.00 32.30 C ATOM 369 OG1 THR A 36 33.908 -0.669 3.237 1.00 12.30 O ATOM 370 CG2 THR A 36 34.942 -2.587 2.197 1.00 21.11 C ATOM 0 H THR A 36 31.432 -1.049 3.582 1.00 75.15 H new ATOM 0 HA THR A 36 32.621 -3.427 2.305 1.00 45.52 H new ATOM 0 HB THR A 36 34.413 -2.395 4.257 1.00 32.30 H new ATOM 0 HG1 THR A 36 34.800 -0.276 3.335 1.00 12.30 H new ATOM 0 HG21 THR A 36 35.923 -2.128 2.324 1.00 21.11 H new ATOM 0 HG22 THR A 36 35.038 -3.671 2.259 1.00 21.11 H new ATOM 0 HG23 THR A 36 34.537 -2.314 1.222 1.00 21.11 H new ATOM 378 N CYS A 37 32.474 -4.789 4.407 1.00 32.15 N ATOM 379 CA CYS A 37 32.183 -5.623 5.568 1.00 45.42 C ATOM 380 C CYS A 37 33.428 -6.384 6.016 1.00 72.04 C ATOM 381 O CYS A 37 33.777 -7.417 5.443 1.00 53.41 O ATOM 382 CB CYS A 37 31.058 -6.607 5.246 1.00 71.54 C ATOM 383 SG CYS A 37 30.555 -7.648 6.654 1.00 55.13 S ATOM 0 H CYS A 37 32.847 -5.298 3.605 1.00 32.15 H new ATOM 0 HA CYS A 37 31.864 -4.972 6.382 1.00 45.42 H new ATOM 0 HB2 CYS A 37 30.191 -6.048 4.893 1.00 71.54 H new ATOM 0 HB3 CYS A 37 31.377 -7.252 4.427 1.00 71.54 H new ATOM 388 N PHE A 38 34.093 -5.867 7.043 1.00 21.13 N ATOM 389 CA PHE A 38 35.299 -6.497 7.568 1.00 31.12 C ATOM 390 C PHE A 38 36.301 -6.769 6.450 1.00 21.32 C ATOM 391 O PHE A 38 36.731 -7.904 6.250 1.00 61.42 O ATOM 392 CB PHE A 38 34.948 -7.804 8.283 1.00 55.33 C ATOM 393 CG PHE A 38 33.958 -7.629 9.399 1.00 1.02 C ATOM 394 CD1 PHE A 38 33.857 -6.421 10.070 1.00 1.03 C ATOM 395 CD2 PHE A 38 33.129 -8.672 9.777 1.00 33.52 C ATOM 396 CE1 PHE A 38 32.948 -6.258 11.099 1.00 41.05 C ATOM 397 CE2 PHE A 38 32.217 -8.515 10.805 1.00 64.25 C ATOM 398 CZ PHE A 38 32.126 -7.306 11.465 1.00 4.13 C ATOM 0 H PHE A 38 33.818 -5.013 7.529 1.00 21.13 H new ATOM 0 HA PHE A 38 35.755 -5.812 8.282 1.00 31.12 H new ATOM 0 HB2 PHE A 38 34.544 -8.509 7.557 1.00 55.33 H new ATOM 0 HB3 PHE A 38 35.860 -8.246 8.683 1.00 55.33 H new ATOM 0 HD1 PHE A 38 34.495 -5.597 9.786 1.00 1.03 H new ATOM 0 HD2 PHE A 38 33.195 -9.619 9.263 1.00 33.52 H new ATOM 0 HE1 PHE A 38 32.881 -5.312 11.616 1.00 41.05 H new ATOM 0 HE2 PHE A 38 31.577 -9.337 11.091 1.00 64.25 H new ATOM 0 HZ PHE A 38 31.413 -7.180 12.266 1.00 4.13 H new ATOM 408 N GLY A 39 36.668 -5.718 5.724 1.00 44.13 N ATOM 409 CA GLY A 39 37.616 -5.864 4.634 1.00 2.44 C ATOM 410 C GLY A 39 37.031 -6.611 3.453 1.00 71.13 C ATOM 411 O GLY A 39 37.746 -6.956 2.512 1.00 32.30 O ATOM 0 H GLY A 39 36.326 -4.768 5.871 1.00 44.13 H new ATOM 0 HA2 GLY A 39 37.946 -4.877 4.309 1.00 2.44 H new ATOM 0 HA3 GLY A 39 38.499 -6.393 4.993 1.00 2.44 H new ATOM 415 N SER A 40 35.727 -6.863 3.501 1.00 33.41 N ATOM 416 CA SER A 40 35.047 -7.580 2.429 1.00 75.13 C ATOM 417 C SER A 40 34.004 -6.691 1.758 1.00 73.35 C ATOM 418 O SER A 40 32.842 -6.660 2.165 1.00 4.41 O ATOM 419 CB SER A 40 34.380 -8.845 2.974 1.00 3.41 C ATOM 420 OG SER A 40 35.161 -9.430 4.002 1.00 42.33 O ATOM 0 H SER A 40 35.120 -6.581 4.271 1.00 33.41 H new ATOM 0 HA SER A 40 35.792 -7.863 1.685 1.00 75.13 H new ATOM 0 HB2 SER A 40 33.390 -8.601 3.359 1.00 3.41 H new ATOM 0 HB3 SER A 40 34.240 -9.563 2.166 1.00 3.41 H new ATOM 0 HG SER A 40 34.983 -8.971 4.849 1.00 42.33 H new ATOM 426 N LYS A 41 34.427 -5.970 0.725 1.00 11.43 N ATOM 427 CA LYS A 41 33.532 -5.080 -0.005 1.00 71.23 C ATOM 428 C LYS A 41 32.277 -5.821 -0.456 1.00 61.21 C ATOM 429 O LYS A 41 32.359 -6.852 -1.125 1.00 23.52 O ATOM 430 CB LYS A 41 34.249 -4.485 -1.219 1.00 65.41 C ATOM 431 CG LYS A 41 35.479 -3.670 -0.859 1.00 41.32 C ATOM 432 CD LYS A 41 36.407 -3.505 -2.051 1.00 24.01 C ATOM 433 CE LYS A 41 35.906 -2.431 -3.004 1.00 32.01 C ATOM 434 NZ LYS A 41 36.445 -2.615 -4.380 1.00 1.32 N ATOM 0 H LYS A 41 35.385 -5.985 0.374 1.00 11.43 H new ATOM 0 HA LYS A 41 33.236 -4.273 0.666 1.00 71.23 H new ATOM 0 HB2 LYS A 41 34.542 -5.293 -1.889 1.00 65.41 H new ATOM 0 HB3 LYS A 41 33.552 -3.852 -1.768 1.00 65.41 H new ATOM 0 HG2 LYS A 41 35.173 -2.689 -0.496 1.00 41.32 H new ATOM 0 HG3 LYS A 41 36.014 -4.158 -0.045 1.00 41.32 H new ATOM 0 HD2 LYS A 41 37.406 -3.245 -1.702 1.00 24.01 H new ATOM 0 HD3 LYS A 41 36.491 -4.453 -2.582 1.00 24.01 H new ATOM 0 HE2 LYS A 41 34.817 -2.452 -3.035 1.00 32.01 H new ATOM 0 HE3 LYS A 41 36.195 -1.449 -2.629 1.00 32.01 H new ATOM 0 HZ1 LYS A 41 36.080 -1.863 -4.999 1.00 1.32 H new ATOM 0 HZ2 LYS A 41 37.484 -2.569 -4.355 1.00 1.32 H new ATOM 0 HZ3 LYS A 41 36.148 -3.541 -4.748 1.00 1.32 H new ATOM 448 N LEU A 42 31.117 -5.289 -0.088 1.00 20.34 N ATOM 449 CA LEU A 42 29.844 -5.900 -0.456 1.00 1.44 C ATOM 450 C LEU A 42 29.486 -5.582 -1.904 1.00 4.31 C ATOM 451 O LEU A 42 29.911 -4.572 -2.467 1.00 35.23 O ATOM 452 CB LEU A 42 28.733 -5.410 0.475 1.00 23.33 C ATOM 453 CG LEU A 42 28.880 -5.785 1.950 1.00 30.54 C ATOM 454 CD1 LEU A 42 29.294 -7.242 2.092 1.00 4.21 C ATOM 455 CD2 LEU A 42 29.887 -4.873 2.635 1.00 24.30 C ATOM 0 H LEU A 42 31.031 -4.436 0.465 1.00 20.34 H new ATOM 0 HA LEU A 42 29.945 -6.981 -0.355 1.00 1.44 H new ATOM 0 HB2 LEU A 42 28.677 -4.324 0.401 1.00 23.33 H new ATOM 0 HB3 LEU A 42 27.783 -5.804 0.113 1.00 23.33 H new ATOM 0 HG LEU A 42 27.913 -5.655 2.436 1.00 30.54 H new ATOM 0 HD11 LEU A 42 29.394 -7.491 3.149 1.00 4.21 H new ATOM 0 HD12 LEU A 42 28.536 -7.881 1.639 1.00 4.21 H new ATOM 0 HD13 LEU A 42 30.249 -7.399 1.591 1.00 4.21 H new ATOM 0 HD21 LEU A 42 29.978 -5.155 3.684 1.00 24.30 H new ATOM 0 HD22 LEU A 42 30.857 -4.970 2.147 1.00 24.30 H new ATOM 0 HD23 LEU A 42 29.548 -3.839 2.565 1.00 24.30 H new ATOM 467 N PRO A 43 28.685 -6.462 -2.523 1.00 2.33 N ATOM 468 CA PRO A 43 28.250 -6.295 -3.913 1.00 1.15 C ATOM 469 C PRO A 43 27.271 -5.138 -4.079 1.00 11.15 C ATOM 470 O PRO A 43 26.912 -4.771 -5.198 1.00 22.22 O ATOM 471 CB PRO A 43 27.564 -7.626 -4.232 1.00 5.33 C ATOM 472 CG PRO A 43 27.115 -8.147 -2.910 1.00 50.24 C ATOM 473 CD PRO A 43 28.142 -7.687 -1.913 1.00 30.01 C ATOM 0 HA PRO A 43 29.083 -6.059 -4.575 1.00 1.15 H new ATOM 0 HB2 PRO A 43 26.721 -7.485 -4.909 1.00 5.33 H new ATOM 0 HB3 PRO A 43 28.251 -8.319 -4.718 1.00 5.33 H new ATOM 0 HG2 PRO A 43 26.126 -7.766 -2.656 1.00 50.24 H new ATOM 0 HG3 PRO A 43 27.044 -9.235 -2.923 1.00 50.24 H new ATOM 0 HD2 PRO A 43 27.695 -7.487 -0.939 1.00 30.01 H new ATOM 0 HD3 PRO A 43 28.918 -8.437 -1.760 1.00 30.01 H new ATOM 481 N TYR A 44 26.842 -4.567 -2.959 1.00 3.54 N ATOM 482 CA TYR A 44 25.903 -3.452 -2.980 1.00 54.13 C ATOM 483 C TYR A 44 26.517 -2.209 -2.344 1.00 41.20 C ATOM 484 O TYR A 44 27.489 -2.298 -1.595 1.00 62.40 O ATOM 485 CB TYR A 44 24.614 -3.829 -2.248 1.00 20.42 C ATOM 486 CG TYR A 44 24.833 -4.768 -1.083 1.00 14.25 C ATOM 487 CD1 TYR A 44 25.235 -4.285 0.157 1.00 35.41 C ATOM 488 CD2 TYR A 44 24.638 -6.136 -1.221 1.00 64.51 C ATOM 489 CE1 TYR A 44 25.436 -5.139 1.225 1.00 42.15 C ATOM 490 CE2 TYR A 44 24.836 -6.997 -0.159 1.00 22.12 C ATOM 491 CZ TYR A 44 25.235 -6.494 1.062 1.00 43.33 C ATOM 492 OH TYR A 44 25.435 -7.348 2.122 1.00 52.01 O ATOM 0 H TYR A 44 27.130 -4.858 -2.025 1.00 3.54 H new ATOM 0 HA TYR A 44 25.670 -3.227 -4.021 1.00 54.13 H new ATOM 0 HB2 TYR A 44 24.132 -2.921 -1.886 1.00 20.42 H new ATOM 0 HB3 TYR A 44 23.927 -4.294 -2.955 1.00 20.42 H new ATOM 0 HD1 TYR A 44 25.393 -3.225 0.288 1.00 35.41 H new ATOM 0 HD2 TYR A 44 24.326 -6.534 -2.175 1.00 64.51 H new ATOM 0 HE1 TYR A 44 25.749 -4.748 2.182 1.00 42.15 H new ATOM 0 HE2 TYR A 44 24.679 -8.058 -0.284 1.00 22.12 H new ATOM 0 HH TYR A 44 24.864 -7.079 2.871 1.00 52.01 H new ATOM 502 N GLU A 45 25.941 -1.050 -2.648 1.00 41.03 N ATOM 503 CA GLU A 45 26.432 0.212 -2.107 1.00 31.35 C ATOM 504 C GLU A 45 25.333 0.936 -1.334 1.00 41.33 C ATOM 505 O GLU A 45 25.542 2.036 -0.820 1.00 55.13 O ATOM 506 CB GLU A 45 26.955 1.107 -3.232 1.00 75.21 C ATOM 507 CG GLU A 45 25.856 1.695 -4.101 1.00 41.54 C ATOM 508 CD GLU A 45 26.218 1.702 -5.574 1.00 71.30 C ATOM 509 OE1 GLU A 45 26.639 0.643 -6.085 1.00 75.33 O ATOM 510 OE2 GLU A 45 26.081 2.765 -6.215 1.00 32.52 O ATOM 0 H GLU A 45 25.134 -0.959 -3.266 1.00 41.03 H new ATOM 0 HA GLU A 45 27.249 -0.010 -1.421 1.00 31.35 H new ATOM 0 HB2 GLU A 45 27.537 1.920 -2.798 1.00 75.21 H new ATOM 0 HB3 GLU A 45 27.633 0.529 -3.860 1.00 75.21 H new ATOM 0 HG2 GLU A 45 24.940 1.122 -3.959 1.00 41.54 H new ATOM 0 HG3 GLU A 45 25.648 2.715 -3.777 1.00 41.54 H new ATOM 517 N LEU A 46 24.163 0.313 -1.257 1.00 73.35 N ATOM 518 CA LEU A 46 23.029 0.897 -0.549 1.00 5.23 C ATOM 519 C LEU A 46 22.607 0.017 0.623 1.00 24.22 C ATOM 520 O LEU A 46 23.093 -1.104 0.777 1.00 2.33 O ATOM 521 CB LEU A 46 21.851 1.093 -1.504 1.00 42.43 C ATOM 522 CG LEU A 46 22.079 2.070 -2.659 1.00 13.14 C ATOM 523 CD1 LEU A 46 20.886 2.068 -3.603 1.00 23.24 C ATOM 524 CD2 LEU A 46 22.338 3.472 -2.128 1.00 2.34 C ATOM 0 H LEU A 46 23.974 -0.597 -1.676 1.00 73.35 H new ATOM 0 HA LEU A 46 23.337 1.867 -0.159 1.00 5.23 H new ATOM 0 HB2 LEU A 46 21.583 0.123 -1.923 1.00 42.43 H new ATOM 0 HB3 LEU A 46 20.994 1.439 -0.926 1.00 42.43 H new ATOM 0 HG LEU A 46 22.958 1.746 -3.216 1.00 13.14 H new ATOM 0 HD11 LEU A 46 21.066 2.769 -4.418 1.00 23.24 H new ATOM 0 HD12 LEU A 46 20.745 1.067 -4.010 1.00 23.24 H new ATOM 0 HD13 LEU A 46 19.991 2.367 -3.058 1.00 23.24 H new ATOM 0 HD21 LEU A 46 22.498 4.154 -2.963 1.00 2.34 H new ATOM 0 HD22 LEU A 46 21.478 3.806 -1.547 1.00 2.34 H new ATOM 0 HD23 LEU A 46 23.224 3.463 -1.493 1.00 2.34 H new ATOM 536 N SER A 47 21.698 0.531 1.446 1.00 64.24 N ATOM 537 CA SER A 47 21.212 -0.208 2.605 1.00 54.03 C ATOM 538 C SER A 47 19.842 0.305 3.040 1.00 61.22 C ATOM 539 O SER A 47 19.454 1.426 2.713 1.00 44.52 O ATOM 540 CB SER A 47 22.204 -0.092 3.763 1.00 32.04 C ATOM 541 OG SER A 47 21.570 -0.348 5.005 1.00 63.21 O ATOM 0 H SER A 47 21.284 1.456 1.331 1.00 64.24 H new ATOM 0 HA SER A 47 21.116 -1.256 2.323 1.00 54.03 H new ATOM 0 HB2 SER A 47 23.023 -0.797 3.617 1.00 32.04 H new ATOM 0 HB3 SER A 47 22.641 0.907 3.773 1.00 32.04 H new ATOM 0 HG SER A 47 21.104 0.459 5.307 1.00 63.21 H new ATOM 547 N SER A 48 19.114 -0.526 3.779 1.00 11.54 N ATOM 548 CA SER A 48 17.786 -0.159 4.257 1.00 73.02 C ATOM 549 C SER A 48 17.676 -0.359 5.765 1.00 24.04 C ATOM 550 O SER A 48 17.659 -1.490 6.254 1.00 14.40 O ATOM 551 CB SER A 48 16.717 -0.988 3.542 1.00 31.33 C ATOM 552 OG SER A 48 15.417 -0.506 3.835 1.00 50.01 O ATOM 0 H SER A 48 19.421 -1.457 4.060 1.00 11.54 H new ATOM 0 HA SER A 48 17.626 0.896 4.036 1.00 73.02 H new ATOM 0 HB2 SER A 48 16.886 -0.955 2.466 1.00 31.33 H new ATOM 0 HB3 SER A 48 16.798 -2.032 3.846 1.00 31.33 H new ATOM 0 HG SER A 48 15.008 -0.152 3.018 1.00 50.01 H new ATOM 558 N LEU A 49 17.603 0.746 6.498 1.00 5.44 N ATOM 559 CA LEU A 49 17.496 0.695 7.952 1.00 32.44 C ATOM 560 C LEU A 49 16.257 -0.086 8.379 1.00 14.31 C ATOM 561 O LEU A 49 16.187 -0.596 9.497 1.00 14.35 O ATOM 562 CB LEU A 49 17.445 2.110 8.530 1.00 24.15 C ATOM 563 CG LEU A 49 18.796 2.762 8.828 1.00 42.04 C ATOM 564 CD1 LEU A 49 18.601 4.108 9.509 1.00 71.33 C ATOM 565 CD2 LEU A 49 19.653 1.846 9.689 1.00 71.41 C ATOM 0 H LEU A 49 17.616 1.689 6.109 1.00 5.44 H new ATOM 0 HA LEU A 49 18.377 0.183 8.339 1.00 32.44 H new ATOM 0 HB2 LEU A 49 16.903 2.747 7.831 1.00 24.15 H new ATOM 0 HB3 LEU A 49 16.865 2.083 9.453 1.00 24.15 H new ATOM 0 HG LEU A 49 19.313 2.928 7.883 1.00 42.04 H new ATOM 0 HD11 LEU A 49 19.573 4.557 9.713 1.00 71.33 H new ATOM 0 HD12 LEU A 49 18.027 4.766 8.856 1.00 71.33 H new ATOM 0 HD13 LEU A 49 18.062 3.967 10.446 1.00 71.33 H new ATOM 0 HD21 LEU A 49 20.610 2.327 9.891 1.00 71.41 H new ATOM 0 HD22 LEU A 49 19.141 1.648 10.631 1.00 71.41 H new ATOM 0 HD23 LEU A 49 19.823 0.906 9.163 1.00 71.41 H new ATOM 577 N ASP A 50 15.282 -0.176 7.481 1.00 64.25 N ATOM 578 CA ASP A 50 14.047 -0.898 7.762 1.00 13.55 C ATOM 579 C ASP A 50 14.342 -2.320 8.229 1.00 10.52 C ATOM 580 O ASP A 50 13.568 -2.910 8.983 1.00 34.34 O ATOM 581 CB ASP A 50 13.155 -0.930 6.520 1.00 2.11 C ATOM 582 CG ASP A 50 11.769 -1.466 6.816 1.00 35.25 C ATOM 583 OD1 ASP A 50 10.949 -0.713 7.383 1.00 41.31 O ATOM 584 OD2 ASP A 50 11.502 -2.639 6.481 1.00 23.12 O ATOM 0 H ASP A 50 15.323 0.242 6.552 1.00 64.25 H new ATOM 0 HA ASP A 50 13.524 -0.374 8.562 1.00 13.55 H new ATOM 0 HB2 ASP A 50 13.072 0.077 6.110 1.00 2.11 H new ATOM 0 HB3 ASP A 50 13.625 -1.548 5.755 1.00 2.11 H new ATOM 589 N LEU A 51 15.465 -2.864 7.775 1.00 24.35 N ATOM 590 CA LEU A 51 15.863 -4.218 8.146 1.00 60.24 C ATOM 591 C LEU A 51 16.018 -4.346 9.658 1.00 72.24 C ATOM 592 O LEU A 51 15.975 -5.448 10.207 1.00 54.34 O ATOM 593 CB LEU A 51 17.175 -4.593 7.454 1.00 51.43 C ATOM 594 CG LEU A 51 17.214 -5.969 6.788 1.00 12.22 C ATOM 595 CD1 LEU A 51 17.109 -5.834 5.277 1.00 30.10 C ATOM 596 CD2 LEU A 51 18.485 -6.711 7.172 1.00 23.34 C ATOM 0 H LEU A 51 16.116 -2.389 7.150 1.00 24.35 H new ATOM 0 HA LEU A 51 15.079 -4.902 7.821 1.00 60.24 H new ATOM 0 HB2 LEU A 51 17.392 -3.839 6.697 1.00 51.43 H new ATOM 0 HB3 LEU A 51 17.977 -4.545 8.190 1.00 51.43 H new ATOM 0 HG LEU A 51 16.359 -6.546 7.140 1.00 12.22 H new ATOM 0 HD11 LEU A 51 17.138 -6.823 4.820 1.00 30.10 H new ATOM 0 HD12 LEU A 51 16.170 -5.344 5.020 1.00 30.10 H new ATOM 0 HD13 LEU A 51 17.943 -5.238 4.906 1.00 30.10 H new ATOM 0 HD21 LEU A 51 18.496 -7.688 6.689 1.00 23.34 H new ATOM 0 HD22 LEU A 51 19.353 -6.137 6.849 1.00 23.34 H new ATOM 0 HD23 LEU A 51 18.518 -6.841 8.254 1.00 23.34 H new ATOM 608 N THR A 52 16.196 -3.212 10.327 1.00 4.43 N ATOM 609 CA THR A 52 16.356 -3.196 11.776 1.00 64.22 C ATOM 610 C THR A 52 15.225 -2.425 12.446 1.00 42.53 C ATOM 611 O THR A 52 14.176 -2.988 12.758 1.00 60.25 O ATOM 612 CB THR A 52 17.703 -2.570 12.186 1.00 73.13 C ATOM 613 OG1 THR A 52 18.066 -1.539 11.260 1.00 34.35 O ATOM 614 CG2 THR A 52 18.798 -3.625 12.233 1.00 51.12 C ATOM 0 H THR A 52 16.233 -2.292 9.889 1.00 4.43 H new ATOM 0 HA THR A 52 16.330 -4.234 12.108 1.00 64.22 H new ATOM 0 HB THR A 52 17.591 -2.141 13.182 1.00 73.13 H new ATOM 0 HG1 THR A 52 18.067 -0.673 11.719 1.00 34.35 H new ATOM 0 HG21 THR A 52 19.739 -3.159 12.525 1.00 51.12 H new ATOM 0 HG22 THR A 52 18.532 -4.393 12.960 1.00 51.12 H new ATOM 0 HG23 THR A 52 18.908 -4.080 11.248 1.00 51.12 H new ATOM 622 N ASP A 53 15.445 -1.133 12.664 1.00 53.45 N ATOM 623 CA ASP A 53 14.442 -0.283 13.295 1.00 1.42 C ATOM 624 C ASP A 53 15.012 1.100 13.594 1.00 44.53 C ATOM 625 O ASP A 53 14.668 1.721 14.600 1.00 45.43 O ATOM 626 CB ASP A 53 13.935 -0.928 14.586 1.00 61.22 C ATOM 627 CG ASP A 53 12.442 -1.187 14.556 1.00 73.45 C ATOM 628 OD1 ASP A 53 11.669 -0.227 14.755 1.00 42.14 O ATOM 629 OD2 ASP A 53 12.045 -2.351 14.334 1.00 44.03 O ATOM 0 H ASP A 53 16.309 -0.652 12.413 1.00 53.45 H new ATOM 0 HA ASP A 53 13.608 -0.171 12.602 1.00 1.42 H new ATOM 0 HB2 ASP A 53 14.461 -1.869 14.750 1.00 61.22 H new ATOM 0 HB3 ASP A 53 14.171 -0.280 15.430 1.00 61.22 H new ATOM 634 N PHE A 54 15.887 1.577 12.713 1.00 35.05 N ATOM 635 CA PHE A 54 16.506 2.886 12.884 1.00 65.14 C ATOM 636 C PHE A 54 16.036 3.855 11.803 1.00 13.23 C ATOM 637 O PHE A 54 15.508 3.442 10.770 1.00 44.42 O ATOM 638 CB PHE A 54 18.031 2.761 12.843 1.00 31.22 C ATOM 639 CG PHE A 54 18.562 1.633 13.681 1.00 3.32 C ATOM 640 CD1 PHE A 54 18.584 1.730 15.063 1.00 33.02 C ATOM 641 CD2 PHE A 54 19.041 0.477 13.087 1.00 71.32 C ATOM 642 CE1 PHE A 54 19.072 0.694 15.837 1.00 14.04 C ATOM 643 CE2 PHE A 54 19.530 -0.563 13.856 1.00 54.53 C ATOM 644 CZ PHE A 54 19.546 -0.453 15.233 1.00 61.34 C ATOM 0 H PHE A 54 16.183 1.077 11.875 1.00 35.05 H new ATOM 0 HA PHE A 54 16.205 3.278 13.855 1.00 65.14 H new ATOM 0 HB2 PHE A 54 18.348 2.617 11.810 1.00 31.22 H new ATOM 0 HB3 PHE A 54 18.474 3.697 13.185 1.00 31.22 H new ATOM 0 HD1 PHE A 54 18.216 2.626 15.541 1.00 33.02 H new ATOM 0 HD2 PHE A 54 19.032 0.387 12.011 1.00 71.32 H new ATOM 0 HE1 PHE A 54 19.082 0.782 16.913 1.00 14.04 H new ATOM 0 HE2 PHE A 54 19.899 -1.460 13.381 1.00 54.53 H new ATOM 0 HZ PHE A 54 19.929 -1.263 15.836 1.00 61.34 H new ATOM 654 N HIS A 55 16.230 5.147 12.050 1.00 34.13 N ATOM 655 CA HIS A 55 15.825 6.176 11.099 1.00 1.22 C ATOM 656 C HIS A 55 17.043 6.805 10.429 1.00 51.12 C ATOM 657 O HIS A 55 16.936 7.403 9.357 1.00 21.42 O ATOM 658 CB HIS A 55 15.002 7.255 11.803 1.00 53.31 C ATOM 659 CG HIS A 55 13.536 7.182 11.503 1.00 62.45 C ATOM 660 ND1 HIS A 55 12.566 7.198 12.482 1.00 75.23 N ATOM 661 CD2 HIS A 55 12.878 7.093 10.323 1.00 34.44 C ATOM 662 CE1 HIS A 55 11.373 7.120 11.918 1.00 3.20 C ATOM 663 NE2 HIS A 55 11.535 7.056 10.609 1.00 71.33 N ATOM 0 H HIS A 55 16.665 5.506 12.900 1.00 34.13 H new ATOM 0 HA HIS A 55 15.212 5.705 10.331 1.00 1.22 H new ATOM 0 HB2 HIS A 55 15.149 7.168 12.880 1.00 53.31 H new ATOM 0 HB3 HIS A 55 15.376 8.236 11.509 1.00 53.31 H new ATOM 0 HD2 HIS A 55 13.325 7.058 9.341 1.00 34.44 H new ATOM 0 HE1 HIS A 55 10.427 7.110 12.439 1.00 3.20 H new ATOM 0 HE2 HIS A 55 10.784 6.990 9.922 1.00 71.33 H new ATOM 671 N THR A 56 18.201 6.668 11.067 1.00 30.42 N ATOM 672 CA THR A 56 19.438 7.224 10.534 1.00 22.42 C ATOM 673 C THR A 56 20.578 6.216 10.626 1.00 23.20 C ATOM 674 O THR A 56 20.567 5.329 11.479 1.00 72.22 O ATOM 675 CB THR A 56 19.843 8.509 11.280 1.00 43.34 C ATOM 676 OG1 THR A 56 21.229 8.792 11.052 1.00 74.40 O ATOM 677 CG2 THR A 56 19.587 8.373 12.773 1.00 61.42 C ATOM 0 H THR A 56 18.308 6.176 11.954 1.00 30.42 H new ATOM 0 HA THR A 56 19.252 7.464 9.487 1.00 22.42 H new ATOM 0 HB THR A 56 19.237 9.330 10.898 1.00 43.34 H new ATOM 0 HG1 THR A 56 21.317 9.667 10.620 1.00 74.40 H new ATOM 0 HG21 THR A 56 19.881 9.293 13.278 1.00 61.42 H new ATOM 0 HG22 THR A 56 18.527 8.188 12.945 1.00 61.42 H new ATOM 0 HG23 THR A 56 20.170 7.541 13.168 1.00 61.42 H new ATOM 685 N GLU A 57 21.561 6.359 9.743 1.00 44.22 N ATOM 686 CA GLU A 57 22.709 5.460 9.726 1.00 61.14 C ATOM 687 C GLU A 57 23.468 5.521 11.048 1.00 31.32 C ATOM 688 O GLU A 57 23.920 4.499 11.566 1.00 41.14 O ATOM 689 CB GLU A 57 23.647 5.816 8.570 1.00 31.02 C ATOM 690 CG GLU A 57 23.078 5.487 7.201 1.00 74.55 C ATOM 691 CD GLU A 57 22.877 6.719 6.340 1.00 2.02 C ATOM 692 OE1 GLU A 57 21.914 7.472 6.596 1.00 23.30 O ATOM 693 OE2 GLU A 57 23.684 6.931 5.411 1.00 62.42 O ATOM 0 H GLU A 57 21.586 7.088 9.030 1.00 44.22 H new ATOM 0 HA GLU A 57 22.340 4.444 9.585 1.00 61.14 H new ATOM 0 HB2 GLU A 57 23.875 6.881 8.613 1.00 31.02 H new ATOM 0 HB3 GLU A 57 24.589 5.283 8.700 1.00 31.02 H new ATOM 0 HG2 GLU A 57 23.749 4.797 6.690 1.00 74.55 H new ATOM 0 HG3 GLU A 57 22.124 4.974 7.322 1.00 74.55 H new ATOM 700 N LYS A 58 23.604 6.726 11.590 1.00 2.13 N ATOM 701 CA LYS A 58 24.307 6.923 12.853 1.00 70.14 C ATOM 702 C LYS A 58 23.686 6.076 13.959 1.00 60.12 C ATOM 703 O LYS A 58 24.385 5.595 14.850 1.00 33.02 O ATOM 704 CB LYS A 58 24.279 8.400 13.250 1.00 3.45 C ATOM 705 CG LYS A 58 22.904 8.893 13.665 1.00 54.12 C ATOM 706 CD LYS A 58 22.698 10.352 13.292 1.00 23.14 C ATOM 707 CE LYS A 58 22.543 11.226 14.528 1.00 73.24 C ATOM 708 NZ LYS A 58 22.576 12.676 14.189 1.00 21.51 N ATOM 0 H LYS A 58 23.237 7.582 11.174 1.00 2.13 H new ATOM 0 HA LYS A 58 25.342 6.609 12.717 1.00 70.14 H new ATOM 0 HB2 LYS A 58 24.976 8.560 14.072 1.00 3.45 H new ATOM 0 HB3 LYS A 58 24.633 9.000 12.411 1.00 3.45 H new ATOM 0 HG2 LYS A 58 22.138 8.283 13.187 1.00 54.12 H new ATOM 0 HG3 LYS A 58 22.782 8.771 14.741 1.00 54.12 H new ATOM 0 HD2 LYS A 58 23.545 10.701 12.702 1.00 23.14 H new ATOM 0 HD3 LYS A 58 21.812 10.447 12.664 1.00 23.14 H new ATOM 0 HE2 LYS A 58 21.601 10.990 15.024 1.00 73.24 H new ATOM 0 HE3 LYS A 58 23.341 11.000 15.235 1.00 73.24 H new ATOM 0 HZ1 LYS A 58 22.467 13.238 15.057 1.00 21.51 H new ATOM 0 HZ2 LYS A 58 23.485 12.907 13.739 1.00 21.51 H new ATOM 0 HZ3 LYS A 58 21.799 12.897 13.534 1.00 21.51 H new ATOM 722 N GLU A 59 22.370 5.897 13.893 1.00 3.13 N ATOM 723 CA GLU A 59 21.657 5.107 14.890 1.00 51.10 C ATOM 724 C GLU A 59 22.078 3.642 14.826 1.00 61.20 C ATOM 725 O GLU A 59 22.411 3.035 15.845 1.00 70.54 O ATOM 726 CB GLU A 59 20.146 5.224 14.680 1.00 52.51 C ATOM 727 CG GLU A 59 19.463 6.150 15.674 1.00 63.55 C ATOM 728 CD GLU A 59 18.114 5.626 16.126 1.00 52.22 C ATOM 729 OE1 GLU A 59 17.243 5.403 15.260 1.00 72.35 O ATOM 730 OE2 GLU A 59 17.929 5.440 17.347 1.00 44.01 O ATOM 0 H GLU A 59 21.777 6.288 13.161 1.00 3.13 H new ATOM 0 HA GLU A 59 21.911 5.498 15.875 1.00 51.10 H new ATOM 0 HB2 GLU A 59 19.955 5.585 13.669 1.00 52.51 H new ATOM 0 HB3 GLU A 59 19.699 4.232 14.754 1.00 52.51 H new ATOM 0 HG2 GLU A 59 20.107 6.283 16.543 1.00 63.55 H new ATOM 0 HG3 GLU A 59 19.334 7.133 15.220 1.00 63.55 H new ATOM 737 N LEU A 60 22.060 3.079 13.623 1.00 43.54 N ATOM 738 CA LEU A 60 22.440 1.685 13.424 1.00 33.11 C ATOM 739 C LEU A 60 23.916 1.472 13.741 1.00 24.22 C ATOM 740 O LEU A 60 24.270 0.616 14.551 1.00 61.32 O ATOM 741 CB LEU A 60 22.148 1.257 11.985 1.00 65.52 C ATOM 742 CG LEU A 60 22.515 -0.184 11.626 1.00 43.11 C ATOM 743 CD1 LEU A 60 21.610 -0.706 10.521 1.00 13.12 C ATOM 744 CD2 LEU A 60 23.976 -0.274 11.208 1.00 33.10 C ATOM 0 H LEU A 60 21.786 3.567 12.770 1.00 43.54 H new ATOM 0 HA LEU A 60 21.850 1.072 14.105 1.00 33.11 H new ATOM 0 HB2 LEU A 60 21.084 1.398 11.794 1.00 65.52 H new ATOM 0 HB3 LEU A 60 22.684 1.926 11.312 1.00 65.52 H new ATOM 0 HG LEU A 60 22.371 -0.806 12.510 1.00 43.11 H new ATOM 0 HD11 LEU A 60 21.886 -1.732 10.279 1.00 13.12 H new ATOM 0 HD12 LEU A 60 20.573 -0.679 10.856 1.00 13.12 H new ATOM 0 HD13 LEU A 60 21.721 -0.082 9.634 1.00 13.12 H new ATOM 0 HD21 LEU A 60 24.219 -1.306 10.956 1.00 33.10 H new ATOM 0 HD22 LEU A 60 24.146 0.361 10.339 1.00 33.10 H new ATOM 0 HD23 LEU A 60 24.611 0.058 12.029 1.00 33.10 H new ATOM 756 N ASN A 61 24.774 2.258 13.099 1.00 52.32 N ATOM 757 CA ASN A 61 26.213 2.157 13.314 1.00 73.22 C ATOM 758 C ASN A 61 26.550 2.260 14.798 1.00 35.42 C ATOM 759 O ASN A 61 27.376 1.505 15.312 1.00 51.05 O ATOM 760 CB ASN A 61 26.944 3.253 12.536 1.00 21.13 C ATOM 761 CG ASN A 61 27.923 2.689 11.525 1.00 44.11 C ATOM 762 OD1 ASN A 61 29.064 3.142 11.429 1.00 1.14 O ATOM 763 ND2 ASN A 61 27.481 1.695 10.763 1.00 13.24 N ATOM 0 H ASN A 61 24.498 2.972 12.425 1.00 52.32 H new ATOM 0 HA ASN A 61 26.542 1.183 12.952 1.00 73.22 H new ATOM 0 HB2 ASN A 61 26.214 3.878 12.021 1.00 21.13 H new ATOM 0 HB3 ASN A 61 27.478 3.896 13.235 1.00 21.13 H new ATOM 0 HD21 ASN A 61 28.095 1.276 10.064 1.00 13.24 H new ATOM 0 HD22 ASN A 61 26.528 1.351 10.876 1.00 13.24 H new ATOM 770 N ASP A 62 25.904 3.198 15.482 1.00 33.31 N ATOM 771 CA ASP A 62 26.133 3.399 16.908 1.00 31.32 C ATOM 772 C ASP A 62 25.590 2.225 17.717 1.00 72.44 C ATOM 773 O ASP A 62 26.175 1.827 18.724 1.00 20.41 O ATOM 774 CB ASP A 62 25.478 4.700 17.373 1.00 3.42 C ATOM 775 CG ASP A 62 26.240 5.928 16.914 1.00 63.12 C ATOM 776 OD1 ASP A 62 27.194 5.772 16.124 1.00 43.25 O ATOM 777 OD2 ASP A 62 25.883 7.044 17.345 1.00 1.33 O ATOM 0 H ASP A 62 25.218 3.831 15.072 1.00 33.31 H new ATOM 0 HA ASP A 62 27.209 3.464 17.072 1.00 31.32 H new ATOM 0 HB2 ASP A 62 24.458 4.746 16.993 1.00 3.42 H new ATOM 0 HB3 ASP A 62 25.413 4.702 18.461 1.00 3.42 H new ATOM 782 N LYS A 63 24.466 1.674 17.269 1.00 3.22 N ATOM 783 CA LYS A 63 23.843 0.545 17.950 1.00 52.42 C ATOM 784 C LYS A 63 24.771 -0.665 17.958 1.00 31.01 C ATOM 785 O LYS A 63 24.750 -1.470 18.891 1.00 42.35 O ATOM 786 CB LYS A 63 22.520 0.182 17.272 1.00 53.21 C ATOM 787 CG LYS A 63 22.046 -1.228 17.579 1.00 14.45 C ATOM 788 CD LYS A 63 22.360 -2.183 16.440 1.00 10.32 C ATOM 789 CE LYS A 63 23.178 -3.372 16.920 1.00 72.14 C ATOM 790 NZ LYS A 63 22.448 -4.170 17.944 1.00 64.23 N ATOM 0 H LYS A 63 23.968 1.991 16.437 1.00 3.22 H new ATOM 0 HA LYS A 63 23.648 0.837 18.982 1.00 52.42 H new ATOM 0 HB2 LYS A 63 21.754 0.890 17.587 1.00 53.21 H new ATOM 0 HB3 LYS A 63 22.632 0.292 16.193 1.00 53.21 H new ATOM 0 HG2 LYS A 63 22.522 -1.582 18.493 1.00 14.45 H new ATOM 0 HG3 LYS A 63 20.972 -1.220 17.762 1.00 14.45 H new ATOM 0 HD2 LYS A 63 21.431 -2.536 15.993 1.00 10.32 H new ATOM 0 HD3 LYS A 63 22.908 -1.654 15.660 1.00 10.32 H new ATOM 0 HE2 LYS A 63 23.425 -4.009 16.071 1.00 72.14 H new ATOM 0 HE3 LYS A 63 24.121 -3.019 17.339 1.00 72.14 H new ATOM 0 HZ1 LYS A 63 23.071 -4.341 18.759 1.00 64.23 H new ATOM 0 HZ2 LYS A 63 21.605 -3.647 18.256 1.00 64.23 H new ATOM 0 HZ3 LYS A 63 22.158 -5.080 17.533 1.00 64.23 H new ATOM 804 N LEU A 64 25.585 -0.788 16.916 1.00 50.34 N ATOM 805 CA LEU A 64 26.523 -1.900 16.804 1.00 54.33 C ATOM 806 C LEU A 64 27.339 -2.054 18.083 1.00 64.15 C ATOM 807 O LEU A 64 27.724 -3.162 18.455 1.00 14.33 O ATOM 808 CB LEU A 64 27.457 -1.687 15.611 1.00 55.00 C ATOM 809 CG LEU A 64 26.779 -1.504 14.252 1.00 22.04 C ATOM 810 CD1 LEU A 64 27.670 -2.028 13.137 1.00 43.22 C ATOM 811 CD2 LEU A 64 25.428 -2.204 14.231 1.00 2.04 C ATOM 0 H LEU A 64 25.615 -0.131 16.136 1.00 50.34 H new ATOM 0 HA LEU A 64 25.949 -2.814 16.649 1.00 54.33 H new ATOM 0 HB2 LEU A 64 28.072 -0.809 15.809 1.00 55.00 H new ATOM 0 HB3 LEU A 64 28.131 -2.541 15.546 1.00 55.00 H new ATOM 0 HG LEU A 64 26.616 -0.439 14.089 1.00 22.04 H new ATOM 0 HD11 LEU A 64 27.172 -1.890 12.178 1.00 43.22 H new ATOM 0 HD12 LEU A 64 28.613 -1.482 13.138 1.00 43.22 H new ATOM 0 HD13 LEU A 64 27.865 -3.089 13.295 1.00 43.22 H new ATOM 0 HD21 LEU A 64 24.960 -2.063 13.257 1.00 2.04 H new ATOM 0 HD22 LEU A 64 25.567 -3.269 14.416 1.00 2.04 H new ATOM 0 HD23 LEU A 64 24.787 -1.782 15.005 1.00 2.04 H new ATOM 823 N ASN A 65 27.599 -0.935 18.751 1.00 22.34 N ATOM 824 CA ASN A 65 28.369 -0.946 19.990 1.00 30.50 C ATOM 825 C ASN A 65 27.768 -1.924 20.995 1.00 32.13 C ATOM 826 O ASN A 65 28.491 -2.604 21.724 1.00 74.33 O ATOM 827 CB ASN A 65 28.421 0.458 20.596 1.00 73.35 C ATOM 828 CG ASN A 65 29.386 1.369 19.861 1.00 34.35 C ATOM 829 OD1 ASN A 65 30.572 1.064 19.737 1.00 72.41 O ATOM 830 ND2 ASN A 65 28.880 2.494 19.372 1.00 54.45 N ATOM 0 H ASN A 65 27.288 -0.010 18.456 1.00 22.34 H new ATOM 0 HA ASN A 65 29.383 -1.270 19.755 1.00 30.50 H new ATOM 0 HB2 ASN A 65 27.424 0.897 20.575 1.00 73.35 H new ATOM 0 HB3 ASN A 65 28.717 0.388 21.643 1.00 73.35 H new ATOM 0 HD21 ASN A 65 29.481 3.147 18.869 1.00 54.45 H new ATOM 0 HD22 ASN A 65 27.890 2.706 19.499 1.00 54.45 H new ATOM 837 N ASP A 66 26.441 -1.989 21.028 1.00 4.14 N ATOM 838 CA ASP A 66 25.742 -2.884 21.943 1.00 62.33 C ATOM 839 C ASP A 66 26.096 -4.340 21.654 1.00 34.00 C ATOM 840 O ASP A 66 26.382 -5.113 22.569 1.00 44.14 O ATOM 841 CB ASP A 66 24.230 -2.682 21.832 1.00 22.00 C ATOM 842 CG ASP A 66 23.639 -2.047 23.075 1.00 54.21 C ATOM 843 OD1 ASP A 66 23.482 -2.760 24.088 1.00 53.22 O ATOM 844 OD2 ASP A 66 23.332 -0.837 23.035 1.00 54.35 O ATOM 0 H ASP A 66 25.828 -1.433 20.432 1.00 4.14 H new ATOM 0 HA ASP A 66 26.059 -2.646 22.959 1.00 62.33 H new ATOM 0 HB2 ASP A 66 24.013 -2.054 20.968 1.00 22.00 H new ATOM 0 HB3 ASP A 66 23.750 -3.644 21.655 1.00 22.00 H new ATOM 849 N TYR A 67 26.072 -4.707 20.378 1.00 72.23 N ATOM 850 CA TYR A 67 26.386 -6.071 19.969 1.00 41.13 C ATOM 851 C TYR A 67 27.886 -6.336 20.063 1.00 34.12 C ATOM 852 O TYR A 67 28.314 -7.461 20.321 1.00 35.51 O ATOM 853 CB TYR A 67 25.902 -6.322 18.540 1.00 53.33 C ATOM 854 CG TYR A 67 27.024 -6.527 17.547 1.00 33.43 C ATOM 855 CD1 TYR A 67 27.648 -7.762 17.421 1.00 42.13 C ATOM 856 CD2 TYR A 67 27.459 -5.487 16.735 1.00 15.03 C ATOM 857 CE1 TYR A 67 28.674 -7.954 16.516 1.00 42.12 C ATOM 858 CE2 TYR A 67 28.483 -5.670 15.827 1.00 72.34 C ATOM 859 CZ TYR A 67 29.088 -6.905 15.721 1.00 73.31 C ATOM 860 OH TYR A 67 30.108 -7.093 14.817 1.00 5.03 O ATOM 0 H TYR A 67 25.838 -4.079 19.609 1.00 72.23 H new ATOM 0 HA TYR A 67 25.871 -6.753 20.645 1.00 41.13 H new ATOM 0 HB2 TYR A 67 25.257 -7.201 18.533 1.00 53.33 H new ATOM 0 HB3 TYR A 67 25.293 -5.477 18.218 1.00 53.33 H new ATOM 0 HD1 TYR A 67 27.326 -8.586 18.041 1.00 42.13 H new ATOM 0 HD2 TYR A 67 26.988 -4.518 16.815 1.00 15.03 H new ATOM 0 HE1 TYR A 67 29.149 -8.920 16.431 1.00 42.12 H new ATOM 0 HE2 TYR A 67 28.808 -4.851 15.203 1.00 72.34 H new ATOM 0 HH TYR A 67 30.756 -7.731 15.183 1.00 5.03 H new ATOM 870 N TYR A 68 28.679 -5.291 19.853 1.00 34.52 N ATOM 871 CA TYR A 68 30.131 -5.410 19.913 1.00 74.05 C ATOM 872 C TYR A 68 30.568 -6.114 21.194 1.00 51.53 C ATOM 873 O TYR A 68 31.556 -6.847 21.206 1.00 1.21 O ATOM 874 CB TYR A 68 30.780 -4.028 19.829 1.00 10.45 C ATOM 875 CG TYR A 68 31.298 -3.683 18.451 1.00 34.52 C ATOM 876 CD1 TYR A 68 32.420 -4.316 17.931 1.00 3.51 C ATOM 877 CD2 TYR A 68 30.663 -2.727 17.668 1.00 0.34 C ATOM 878 CE1 TYR A 68 32.897 -4.004 16.673 1.00 51.43 C ATOM 879 CE2 TYR A 68 31.132 -2.409 16.408 1.00 32.42 C ATOM 880 CZ TYR A 68 32.249 -3.050 15.915 1.00 23.20 C ATOM 881 OH TYR A 68 32.720 -2.738 14.660 1.00 2.34 O ATOM 0 H TYR A 68 28.341 -4.353 19.640 1.00 34.52 H new ATOM 0 HA TYR A 68 30.457 -6.009 19.063 1.00 74.05 H new ATOM 0 HB2 TYR A 68 30.052 -3.275 20.133 1.00 10.45 H new ATOM 0 HB3 TYR A 68 31.605 -3.980 20.540 1.00 10.45 H new ATOM 0 HD1 TYR A 68 32.928 -5.065 18.521 1.00 3.51 H new ATOM 0 HD2 TYR A 68 29.788 -2.224 18.051 1.00 0.34 H new ATOM 0 HE1 TYR A 68 33.772 -4.504 16.285 1.00 51.43 H new ATOM 0 HE2 TYR A 68 30.627 -1.663 15.813 1.00 32.42 H new ATOM 0 HH TYR A 68 32.150 -2.049 14.259 1.00 2.34 H new ATOM 891 N ALA A 69 29.823 -5.884 22.270 1.00 23.54 N ATOM 892 CA ALA A 69 30.131 -6.497 23.557 1.00 70.55 C ATOM 893 C ALA A 69 30.236 -8.014 23.431 1.00 50.40 C ATOM 894 O ALA A 69 31.005 -8.655 24.149 1.00 51.43 O ATOM 895 CB ALA A 69 29.075 -6.123 24.586 1.00 71.12 C ATOM 0 H ALA A 69 29.002 -5.278 22.277 1.00 23.54 H new ATOM 0 HA ALA A 69 31.097 -6.118 23.890 1.00 70.55 H new ATOM 0 HB1 ALA A 69 29.318 -6.588 25.542 1.00 71.12 H new ATOM 0 HB2 ALA A 69 29.050 -5.040 24.705 1.00 71.12 H new ATOM 0 HB3 ALA A 69 28.099 -6.473 24.250 1.00 71.12 H new ATOM 901 N LEU A 70 29.458 -8.582 22.516 1.00 45.10 N ATOM 902 CA LEU A 70 29.464 -10.024 22.297 1.00 75.23 C ATOM 903 C LEU A 70 30.842 -10.503 21.852 1.00 51.52 C ATOM 904 O LEU A 70 31.151 -11.692 21.922 1.00 72.33 O ATOM 905 CB LEU A 70 28.416 -10.404 21.248 1.00 23.14 C ATOM 906 CG LEU A 70 27.996 -11.874 21.222 1.00 14.01 C ATOM 907 CD1 LEU A 70 26.497 -12.004 21.449 1.00 64.53 C ATOM 908 CD2 LEU A 70 28.396 -12.520 19.903 1.00 14.35 C ATOM 0 H LEU A 70 28.816 -8.066 21.914 1.00 45.10 H new ATOM 0 HA LEU A 70 29.219 -10.511 23.241 1.00 75.23 H new ATOM 0 HB2 LEU A 70 27.527 -9.796 21.414 1.00 23.14 H new ATOM 0 HB3 LEU A 70 28.803 -10.140 20.264 1.00 23.14 H new ATOM 0 HG LEU A 70 28.512 -12.394 22.029 1.00 14.01 H new ATOM 0 HD11 LEU A 70 26.216 -13.057 21.427 1.00 64.53 H new ATOM 0 HD12 LEU A 70 26.238 -11.579 22.419 1.00 64.53 H new ATOM 0 HD13 LEU A 70 25.962 -11.469 20.664 1.00 64.53 H new ATOM 0 HD21 LEU A 70 28.089 -13.566 19.902 1.00 14.35 H new ATOM 0 HD22 LEU A 70 27.908 -11.998 19.080 1.00 14.35 H new ATOM 0 HD23 LEU A 70 29.477 -12.459 19.781 1.00 14.35 H new ATOM 920 N LYS A 71 31.668 -9.567 21.396 1.00 63.31 N ATOM 921 CA LYS A 71 33.016 -9.891 20.943 1.00 73.23 C ATOM 922 C LYS A 71 33.749 -10.739 21.977 1.00 33.03 C ATOM 923 O LYS A 71 34.562 -11.596 21.629 1.00 13.01 O ATOM 924 CB LYS A 71 33.805 -8.609 20.666 1.00 31.44 C ATOM 925 CG LYS A 71 34.208 -7.860 21.925 1.00 65.53 C ATOM 926 CD LYS A 71 35.089 -6.664 21.603 1.00 32.35 C ATOM 927 CE LYS A 71 34.262 -5.467 21.161 1.00 1.32 C ATOM 928 NZ LYS A 71 33.645 -4.761 22.318 1.00 10.03 N ATOM 0 H LYS A 71 31.428 -8.578 21.330 1.00 63.31 H new ATOM 0 HA LYS A 71 32.934 -10.466 20.021 1.00 73.23 H new ATOM 0 HB2 LYS A 71 34.702 -8.859 20.099 1.00 31.44 H new ATOM 0 HB3 LYS A 71 33.204 -7.951 20.038 1.00 31.44 H new ATOM 0 HG2 LYS A 71 33.315 -7.524 22.452 1.00 65.53 H new ATOM 0 HG3 LYS A 71 34.739 -8.534 22.597 1.00 65.53 H new ATOM 0 HD2 LYS A 71 35.677 -6.397 22.481 1.00 32.35 H new ATOM 0 HD3 LYS A 71 35.794 -6.931 20.816 1.00 32.35 H new ATOM 0 HE2 LYS A 71 34.895 -4.773 20.608 1.00 1.32 H new ATOM 0 HE3 LYS A 71 33.479 -5.798 20.479 1.00 1.32 H new ATOM 0 HZ1 LYS A 71 33.219 -3.870 21.994 1.00 10.03 H new ATOM 0 HZ2 LYS A 71 32.910 -5.363 22.740 1.00 10.03 H new ATOM 0 HZ3 LYS A 71 34.375 -4.556 23.030 1.00 10.03 H new ATOM 942 N HIS A 72 33.455 -10.496 23.251 1.00 41.53 N ATOM 943 CA HIS A 72 34.085 -11.239 24.336 1.00 2.32 C ATOM 944 C HIS A 72 33.965 -12.742 24.106 1.00 24.33 C ATOM 945 O HIS A 72 34.825 -13.516 24.529 1.00 41.33 O ATOM 946 CB HIS A 72 33.450 -10.864 25.675 1.00 1.54 C ATOM 947 CG HIS A 72 34.283 -9.923 26.491 1.00 61.12 C ATOM 948 ND1 HIS A 72 35.387 -10.327 27.211 1.00 24.10 N ATOM 949 CD2 HIS A 72 34.169 -8.590 26.696 1.00 32.12 C ATOM 950 CE1 HIS A 72 35.915 -9.284 27.826 1.00 43.44 C ATOM 951 NE2 HIS A 72 35.195 -8.217 27.529 1.00 32.02 N ATOM 0 H HIS A 72 32.785 -9.791 23.557 1.00 41.53 H new ATOM 0 HA HIS A 72 35.143 -10.976 24.358 1.00 2.32 H new ATOM 0 HB2 HIS A 72 32.477 -10.409 25.491 1.00 1.54 H new ATOM 0 HB3 HIS A 72 33.273 -11.772 26.251 1.00 1.54 H new ATOM 0 HD2 HIS A 72 33.412 -7.941 26.282 1.00 32.12 H new ATOM 0 HE1 HIS A 72 36.787 -9.301 28.463 1.00 43.44 H new ATOM 0 HE2 HIS A 72 35.372 -7.270 27.864 1.00 32.02 H new ATOM 959 N VAL A 73 32.893 -13.150 23.435 1.00 41.12 N ATOM 960 CA VAL A 73 32.661 -14.560 23.149 1.00 72.54 C ATOM 961 C VAL A 73 32.855 -14.860 21.666 1.00 5.25 C ATOM 962 O VAL A 73 31.992 -14.585 20.833 1.00 13.34 O ATOM 963 CB VAL A 73 31.242 -14.992 23.566 1.00 4.22 C ATOM 964 CG1 VAL A 73 30.986 -16.438 23.170 1.00 15.24 C ATOM 965 CG2 VAL A 73 31.045 -14.797 25.062 1.00 44.31 C ATOM 0 H VAL A 73 32.171 -12.523 23.079 1.00 41.12 H new ATOM 0 HA VAL A 73 33.391 -15.124 23.730 1.00 72.54 H new ATOM 0 HB VAL A 73 30.521 -14.364 23.043 1.00 4.22 H new ATOM 0 HG11 VAL A 73 29.979 -16.725 23.473 1.00 15.24 H new ATOM 0 HG12 VAL A 73 31.084 -16.542 22.089 1.00 15.24 H new ATOM 0 HG13 VAL A 73 31.712 -17.084 23.664 1.00 15.24 H new ATOM 0 HG21 VAL A 73 30.038 -15.107 25.340 1.00 44.31 H new ATOM 0 HG22 VAL A 73 31.773 -15.399 25.606 1.00 44.31 H new ATOM 0 HG23 VAL A 73 31.183 -13.745 25.313 1.00 44.31 H new ATOM 975 N PRO A 74 34.017 -15.438 21.327 1.00 3.12 N ATOM 976 CA PRO A 74 34.353 -15.789 19.944 1.00 52.40 C ATOM 977 C PRO A 74 33.511 -16.946 19.419 1.00 72.40 C ATOM 978 O PRO A 74 33.275 -17.061 18.216 1.00 64.20 O ATOM 979 CB PRO A 74 35.826 -16.194 20.028 1.00 24.24 C ATOM 980 CG PRO A 74 36.016 -16.641 21.437 1.00 43.02 C ATOM 981 CD PRO A 74 35.093 -15.794 22.268 1.00 73.10 C ATOM 0 HA PRO A 74 34.163 -14.965 19.257 1.00 52.40 H new ATOM 0 HB2 PRO A 74 36.058 -16.994 19.324 1.00 24.24 H new ATOM 0 HB3 PRO A 74 36.481 -15.357 19.786 1.00 24.24 H new ATOM 0 HG2 PRO A 74 35.779 -17.699 21.546 1.00 43.02 H new ATOM 0 HG3 PRO A 74 37.052 -16.513 21.751 1.00 43.02 H new ATOM 0 HD2 PRO A 74 34.709 -16.343 23.128 1.00 73.10 H new ATOM 0 HD3 PRO A 74 35.598 -14.909 22.654 1.00 73.10 H new ATOM 989 N LYS A 75 33.059 -17.803 20.328 1.00 33.15 N ATOM 990 CA LYS A 75 32.241 -18.952 19.958 1.00 12.02 C ATOM 991 C LYS A 75 30.935 -18.504 19.309 1.00 43.11 C ATOM 992 O LYS A 75 30.353 -19.226 18.499 1.00 41.21 O ATOM 993 CB LYS A 75 31.942 -19.810 21.190 1.00 41.40 C ATOM 994 CG LYS A 75 33.027 -20.827 21.500 1.00 15.24 C ATOM 995 CD LYS A 75 34.385 -20.164 21.655 1.00 0.04 C ATOM 996 CE LYS A 75 35.480 -21.189 21.908 1.00 71.22 C ATOM 997 NZ LYS A 75 35.559 -21.574 23.344 1.00 2.43 N ATOM 0 H LYS A 75 33.246 -17.723 21.328 1.00 33.15 H new ATOM 0 HA LYS A 75 32.800 -19.547 19.236 1.00 12.02 H new ATOM 0 HB2 LYS A 75 31.809 -19.158 22.053 1.00 41.40 H new ATOM 0 HB3 LYS A 75 30.998 -20.333 21.038 1.00 41.40 H new ATOM 0 HG2 LYS A 75 32.775 -21.361 22.416 1.00 15.24 H new ATOM 0 HG3 LYS A 75 33.072 -21.568 20.701 1.00 15.24 H new ATOM 0 HD2 LYS A 75 34.618 -19.595 20.755 1.00 0.04 H new ATOM 0 HD3 LYS A 75 34.352 -19.454 22.481 1.00 0.04 H new ATOM 0 HE2 LYS A 75 35.293 -22.077 21.304 1.00 71.22 H new ATOM 0 HE3 LYS A 75 36.439 -20.782 21.588 1.00 71.22 H new ATOM 0 HZ1 LYS A 75 36.317 -22.274 23.475 1.00 2.43 H new ATOM 0 HZ2 LYS A 75 35.763 -20.731 23.919 1.00 2.43 H new ATOM 0 HZ3 LYS A 75 34.652 -21.986 23.643 1.00 2.43 H new ATOM 1011 N CYS A 76 30.481 -17.308 19.668 1.00 20.04 N ATOM 1012 CA CYS A 76 29.245 -16.763 19.120 1.00 1.44 C ATOM 1013 C CYS A 76 29.531 -15.558 18.228 1.00 15.13 C ATOM 1014 O CYS A 76 28.778 -15.269 17.298 1.00 34.42 O ATOM 1015 CB CYS A 76 28.295 -16.360 20.251 1.00 64.54 C ATOM 1016 SG CYS A 76 26.957 -17.557 20.558 1.00 74.02 S ATOM 0 H CYS A 76 30.951 -16.697 20.336 1.00 20.04 H new ATOM 0 HA CYS A 76 28.772 -17.537 18.516 1.00 1.44 H new ATOM 0 HB2 CYS A 76 28.871 -16.232 21.167 1.00 64.54 H new ATOM 0 HB3 CYS A 76 27.855 -15.392 20.014 1.00 64.54 H new ATOM 1021 N TRP A 77 30.622 -14.860 18.519 1.00 42.33 N ATOM 1022 CA TRP A 77 31.008 -13.686 17.743 1.00 75.22 C ATOM 1023 C TRP A 77 31.382 -14.075 16.317 1.00 71.40 C ATOM 1024 O TRP A 77 30.910 -13.471 15.355 1.00 53.13 O ATOM 1025 CB TRP A 77 32.180 -12.969 18.413 1.00 1.44 C ATOM 1026 CG TRP A 77 33.024 -12.185 17.454 1.00 20.10 C ATOM 1027 CD1 TRP A 77 34.382 -12.242 17.322 1.00 1.20 C ATOM 1028 CD2 TRP A 77 32.565 -11.226 16.495 1.00 63.33 C ATOM 1029 NE1 TRP A 77 34.795 -11.376 16.338 1.00 4.03 N ATOM 1030 CE2 TRP A 77 33.700 -10.742 15.815 1.00 51.22 C ATOM 1031 CE3 TRP A 77 31.307 -10.732 16.142 1.00 11.44 C ATOM 1032 CZ2 TRP A 77 33.611 -9.787 14.806 1.00 41.34 C ATOM 1033 CZ3 TRP A 77 31.220 -9.783 15.141 1.00 64.52 C ATOM 1034 CH2 TRP A 77 32.366 -9.320 14.481 1.00 4.33 C ATOM 0 H TRP A 77 31.255 -15.086 19.286 1.00 42.33 H new ATOM 0 HA TRP A 77 30.153 -13.011 17.703 1.00 75.22 H new ATOM 0 HB2 TRP A 77 31.795 -12.297 19.180 1.00 1.44 H new ATOM 0 HB3 TRP A 77 32.805 -13.705 18.919 1.00 1.44 H new ATOM 0 HD1 TRP A 77 35.035 -12.874 17.905 1.00 1.20 H new ATOM 0 HE1 TRP A 77 35.761 -11.229 16.045 1.00 4.03 H new ATOM 0 HE3 TRP A 77 30.418 -11.086 16.643 1.00 11.44 H new ATOM 0 HZ2 TRP A 77 34.493 -9.427 14.298 1.00 41.34 H new ATOM 0 HZ3 TRP A 77 30.253 -9.392 14.863 1.00 64.52 H new ATOM 0 HH2 TRP A 77 32.265 -8.580 13.701 1.00 4.33 H new ATOM 1045 N ALA A 78 32.233 -15.088 16.189 1.00 72.25 N ATOM 1046 CA ALA A 78 32.668 -15.559 14.880 1.00 42.25 C ATOM 1047 C ALA A 78 31.509 -16.176 14.105 1.00 51.15 C ATOM 1048 O ALA A 78 31.611 -16.413 12.901 1.00 32.23 O ATOM 1049 CB ALA A 78 33.800 -16.565 15.030 1.00 51.41 C ATOM 0 H ALA A 78 32.635 -15.598 16.976 1.00 72.25 H new ATOM 0 HA ALA A 78 33.032 -14.701 14.315 1.00 42.25 H new ATOM 0 HB1 ALA A 78 34.115 -16.908 14.044 1.00 51.41 H new ATOM 0 HB2 ALA A 78 34.642 -16.092 15.536 1.00 51.41 H new ATOM 0 HB3 ALA A 78 33.455 -17.416 15.617 1.00 51.41 H new ATOM 1055 N ALA A 79 30.408 -16.434 14.802 1.00 33.23 N ATOM 1056 CA ALA A 79 29.229 -17.023 14.179 1.00 52.31 C ATOM 1057 C ALA A 79 28.472 -15.990 13.351 1.00 42.42 C ATOM 1058 O ALA A 79 27.835 -16.327 12.353 1.00 55.22 O ATOM 1059 CB ALA A 79 28.317 -17.624 15.238 1.00 75.03 C ATOM 0 H ALA A 79 30.308 -16.244 15.799 1.00 33.23 H new ATOM 0 HA ALA A 79 29.561 -17.816 13.508 1.00 52.31 H new ATOM 0 HB1 ALA A 79 27.441 -18.060 14.758 1.00 75.03 H new ATOM 0 HB2 ALA A 79 28.855 -18.399 15.784 1.00 75.03 H new ATOM 0 HB3 ALA A 79 28.001 -16.844 15.931 1.00 75.03 H new ATOM 1065 N ILE A 80 28.547 -14.731 13.771 1.00 32.54 N ATOM 1066 CA ILE A 80 27.869 -13.650 13.068 1.00 51.23 C ATOM 1067 C ILE A 80 28.844 -12.863 12.199 1.00 43.01 C ATOM 1068 O ILE A 80 28.558 -11.738 11.791 1.00 11.31 O ATOM 1069 CB ILE A 80 27.180 -12.684 14.050 1.00 74.23 C ATOM 1070 CG1 ILE A 80 26.113 -11.860 13.325 1.00 23.30 C ATOM 1071 CG2 ILE A 80 28.206 -11.773 14.705 1.00 45.21 C ATOM 1072 CD1 ILE A 80 25.452 -10.821 14.203 1.00 22.34 C ATOM 0 H ILE A 80 29.071 -14.435 14.595 1.00 32.54 H new ATOM 0 HA ILE A 80 27.112 -14.112 12.434 1.00 51.23 H new ATOM 0 HB ILE A 80 26.693 -13.269 14.830 1.00 74.23 H new ATOM 0 HG12 ILE A 80 26.569 -11.363 12.469 1.00 23.30 H new ATOM 0 HG13 ILE A 80 25.349 -12.533 12.934 1.00 23.30 H new ATOM 0 HG21 ILE A 80 27.703 -11.096 15.396 1.00 45.21 H new ATOM 0 HG22 ILE A 80 28.932 -12.376 15.251 1.00 45.21 H new ATOM 0 HG23 ILE A 80 28.719 -11.193 13.938 1.00 45.21 H new ATOM 0 HD11 ILE A 80 24.707 -10.275 13.623 1.00 22.34 H new ATOM 0 HD12 ILE A 80 24.967 -11.313 15.046 1.00 22.34 H new ATOM 0 HD13 ILE A 80 26.205 -10.125 14.573 1.00 22.34 H new ATOM 1084 N GLN A 81 29.996 -13.464 11.919 1.00 61.04 N ATOM 1085 CA GLN A 81 31.013 -12.819 11.097 1.00 64.32 C ATOM 1086 C GLN A 81 30.498 -12.578 9.682 1.00 72.32 C ATOM 1087 O GLN A 81 30.417 -11.444 9.209 1.00 21.31 O ATOM 1088 CB GLN A 81 32.281 -13.675 11.052 1.00 75.13 C ATOM 1089 CG GLN A 81 33.508 -12.974 11.611 1.00 21.42 C ATOM 1090 CD GLN A 81 34.513 -13.942 12.205 1.00 74.31 C ATOM 1091 OE1 GLN A 81 34.847 -14.959 11.596 1.00 1.11 O ATOM 1092 NE2 GLN A 81 35.000 -13.631 13.400 1.00 1.22 N ATOM 0 H GLN A 81 30.248 -14.396 12.249 1.00 61.04 H new ATOM 0 HA GLN A 81 31.249 -11.855 11.547 1.00 64.32 H new ATOM 0 HB2 GLN A 81 32.110 -14.593 11.614 1.00 75.13 H new ATOM 0 HB3 GLN A 81 32.477 -13.965 10.020 1.00 75.13 H new ATOM 0 HG2 GLN A 81 33.987 -12.400 10.818 1.00 21.42 H new ATOM 0 HG3 GLN A 81 33.198 -12.263 12.376 1.00 21.42 H new ATOM 0 HE21 GLN A 81 34.695 -12.778 13.869 1.00 1.22 H new ATOM 0 HE22 GLN A 81 35.679 -14.245 13.850 1.00 1.22 H new ATOM 1101 N PRO A 82 30.140 -13.669 8.988 1.00 64.01 N ATOM 1102 CA PRO A 82 29.626 -13.602 7.617 1.00 42.32 C ATOM 1103 C PRO A 82 28.234 -12.983 7.549 1.00 3.34 C ATOM 1104 O PRO A 82 27.854 -12.393 6.537 1.00 25.15 O ATOM 1105 CB PRO A 82 29.581 -15.069 7.183 1.00 55.13 C ATOM 1106 CG PRO A 82 29.452 -15.836 8.453 1.00 22.12 C ATOM 1107 CD PRO A 82 30.210 -15.052 9.489 1.00 61.13 C ATOM 0 HA PRO A 82 30.247 -12.973 6.979 1.00 42.32 H new ATOM 0 HB2 PRO A 82 28.738 -15.259 6.518 1.00 55.13 H new ATOM 0 HB3 PRO A 82 30.484 -15.349 6.641 1.00 55.13 H new ATOM 0 HG2 PRO A 82 28.406 -15.948 8.737 1.00 22.12 H new ATOM 0 HG3 PRO A 82 29.862 -16.840 8.346 1.00 22.12 H new ATOM 0 HD2 PRO A 82 29.756 -15.146 10.476 1.00 61.13 H new ATOM 0 HD3 PRO A 82 31.241 -15.395 9.578 1.00 61.13 H new ATOM 1115 N PHE A 83 27.478 -13.120 8.633 1.00 14.12 N ATOM 1116 CA PHE A 83 26.127 -12.574 8.697 1.00 72.25 C ATOM 1117 C PHE A 83 26.155 -11.094 9.067 1.00 71.22 C ATOM 1118 O PHE A 83 25.221 -10.350 8.767 1.00 15.54 O ATOM 1119 CB PHE A 83 25.288 -13.350 9.714 1.00 73.11 C ATOM 1120 CG PHE A 83 23.839 -12.954 9.723 1.00 51.04 C ATOM 1121 CD1 PHE A 83 23.210 -12.551 8.555 1.00 3.25 C ATOM 1122 CD2 PHE A 83 23.105 -12.985 10.898 1.00 65.33 C ATOM 1123 CE1 PHE A 83 21.878 -12.185 8.561 1.00 35.01 C ATOM 1124 CE2 PHE A 83 21.772 -12.621 10.909 1.00 22.13 C ATOM 1125 CZ PHE A 83 21.157 -12.221 9.739 1.00 22.41 C ATOM 0 H PHE A 83 27.778 -13.604 9.479 1.00 14.12 H new ATOM 0 HA PHE A 83 25.674 -12.675 7.711 1.00 72.25 H new ATOM 0 HB2 PHE A 83 25.364 -14.416 9.498 1.00 73.11 H new ATOM 0 HB3 PHE A 83 25.705 -13.196 10.709 1.00 73.11 H new ATOM 0 HD1 PHE A 83 23.767 -12.523 7.630 1.00 3.25 H new ATOM 0 HD2 PHE A 83 23.580 -13.297 11.816 1.00 65.33 H new ATOM 0 HE1 PHE A 83 21.400 -11.871 7.645 1.00 35.01 H new ATOM 0 HE2 PHE A 83 21.212 -12.649 11.832 1.00 22.13 H new ATOM 0 HZ PHE A 83 20.115 -11.937 9.745 1.00 22.41 H new ATOM 1135 N LEU A 84 27.233 -10.675 9.720 1.00 13.43 N ATOM 1136 CA LEU A 84 27.384 -9.284 10.133 1.00 40.51 C ATOM 1137 C LEU A 84 27.053 -8.336 8.984 1.00 0.24 C ATOM 1138 O LEU A 84 26.620 -7.204 9.204 1.00 23.12 O ATOM 1139 CB LEU A 84 28.810 -9.029 10.624 1.00 0.04 C ATOM 1140 CG LEU A 84 28.939 -8.289 11.956 1.00 11.41 C ATOM 1141 CD1 LEU A 84 28.793 -6.789 11.749 1.00 31.04 C ATOM 1142 CD2 LEU A 84 27.904 -8.795 12.950 1.00 30.11 C ATOM 0 H LEU A 84 28.015 -11.278 9.975 1.00 13.43 H new ATOM 0 HA LEU A 84 26.686 -9.095 10.949 1.00 40.51 H new ATOM 0 HB2 LEU A 84 29.319 -9.989 10.714 1.00 0.04 H new ATOM 0 HB3 LEU A 84 29.339 -8.458 9.861 1.00 0.04 H new ATOM 0 HG LEU A 84 29.931 -8.484 12.364 1.00 11.41 H new ATOM 0 HD11 LEU A 84 28.888 -6.279 12.707 1.00 31.04 H new ATOM 0 HD12 LEU A 84 29.572 -6.438 11.072 1.00 31.04 H new ATOM 0 HD13 LEU A 84 27.815 -6.575 11.319 1.00 31.04 H new ATOM 0 HD21 LEU A 84 28.011 -8.257 13.892 1.00 30.11 H new ATOM 0 HD22 LEU A 84 26.904 -8.630 12.549 1.00 30.11 H new ATOM 0 HD23 LEU A 84 28.055 -9.861 13.122 1.00 30.11 H new ATOM 1154 N CYS A 85 27.257 -8.806 7.759 1.00 63.15 N ATOM 1155 CA CYS A 85 26.979 -8.002 6.574 1.00 23.34 C ATOM 1156 C CYS A 85 25.490 -8.020 6.242 1.00 10.15 C ATOM 1157 O CYS A 85 24.903 -6.987 5.922 1.00 71.04 O ATOM 1158 CB CYS A 85 27.785 -8.519 5.381 1.00 62.00 C ATOM 1159 SG CYS A 85 29.480 -9.042 5.798 1.00 14.23 S ATOM 0 H CYS A 85 27.614 -9.740 7.560 1.00 63.15 H new ATOM 0 HA CYS A 85 27.274 -6.974 6.785 1.00 23.34 H new ATOM 0 HB2 CYS A 85 27.255 -9.362 4.936 1.00 62.00 H new ATOM 0 HB3 CYS A 85 27.834 -7.737 4.623 1.00 62.00 H new ATOM 1164 N ALA A 86 24.885 -9.201 6.323 1.00 45.35 N ATOM 1165 CA ALA A 86 23.465 -9.353 6.033 1.00 0.12 C ATOM 1166 C ALA A 86 22.615 -8.971 7.240 1.00 31.12 C ATOM 1167 O ALA A 86 21.408 -9.212 7.263 1.00 31.34 O ATOM 1168 CB ALA A 86 23.164 -10.781 5.604 1.00 71.23 C ATOM 0 H ALA A 86 25.357 -10.066 6.587 1.00 45.35 H new ATOM 0 HA ALA A 86 23.212 -8.679 5.215 1.00 0.12 H new ATOM 0 HB1 ALA A 86 22.100 -10.880 5.391 1.00 71.23 H new ATOM 0 HB2 ALA A 86 23.738 -11.020 4.709 1.00 71.23 H new ATOM 0 HB3 ALA A 86 23.439 -11.467 6.405 1.00 71.23 H new ATOM 1174 N VAL A 87 23.252 -8.374 8.242 1.00 25.44 N ATOM 1175 CA VAL A 87 22.554 -7.959 9.453 1.00 4.21 C ATOM 1176 C VAL A 87 22.372 -6.446 9.490 1.00 11.32 C ATOM 1177 O VAL A 87 21.276 -5.948 9.750 1.00 2.12 O ATOM 1178 CB VAL A 87 23.311 -8.405 10.718 1.00 0.24 C ATOM 1179 CG1 VAL A 87 22.619 -7.881 11.967 1.00 12.33 C ATOM 1180 CG2 VAL A 87 23.430 -9.921 10.761 1.00 12.20 C ATOM 0 H VAL A 87 24.251 -8.167 8.239 1.00 25.44 H new ATOM 0 HA VAL A 87 21.576 -8.440 9.436 1.00 4.21 H new ATOM 0 HB VAL A 87 24.316 -7.985 10.685 1.00 0.24 H new ATOM 0 HG11 VAL A 87 23.168 -8.206 12.851 1.00 12.33 H new ATOM 0 HG12 VAL A 87 22.591 -6.792 11.938 1.00 12.33 H new ATOM 0 HG13 VAL A 87 21.601 -8.269 12.009 1.00 12.33 H new ATOM 0 HG21 VAL A 87 23.968 -10.218 11.661 1.00 12.20 H new ATOM 0 HG22 VAL A 87 22.434 -10.364 10.770 1.00 12.20 H new ATOM 0 HG23 VAL A 87 23.974 -10.268 9.882 1.00 12.20 H new ATOM 1190 N PHE A 88 23.453 -5.718 9.228 1.00 34.20 N ATOM 1191 CA PHE A 88 23.412 -4.261 9.232 1.00 44.53 C ATOM 1192 C PHE A 88 23.570 -3.708 7.818 1.00 62.50 C ATOM 1193 O PHE A 88 23.144 -2.591 7.524 1.00 64.32 O ATOM 1194 CB PHE A 88 24.513 -3.701 10.136 1.00 70.24 C ATOM 1195 CG PHE A 88 24.635 -4.422 11.448 1.00 53.51 C ATOM 1196 CD1 PHE A 88 23.648 -4.302 12.413 1.00 10.52 C ATOM 1197 CD2 PHE A 88 25.736 -5.219 11.716 1.00 35.00 C ATOM 1198 CE1 PHE A 88 23.758 -4.963 13.622 1.00 41.31 C ATOM 1199 CE2 PHE A 88 25.851 -5.883 12.923 1.00 71.02 C ATOM 1200 CZ PHE A 88 24.860 -5.755 13.877 1.00 62.44 C ATOM 0 H PHE A 88 24.368 -6.114 9.010 1.00 34.20 H new ATOM 0 HA PHE A 88 22.441 -3.951 9.618 1.00 44.53 H new ATOM 0 HB2 PHE A 88 25.466 -3.755 9.610 1.00 70.24 H new ATOM 0 HB3 PHE A 88 24.314 -2.646 10.327 1.00 70.24 H new ATOM 0 HD1 PHE A 88 22.783 -3.685 12.218 1.00 10.52 H new ATOM 0 HD2 PHE A 88 26.513 -5.323 10.973 1.00 35.00 H new ATOM 0 HE1 PHE A 88 22.983 -4.860 14.367 1.00 41.31 H new ATOM 0 HE2 PHE A 88 26.714 -6.501 13.120 1.00 71.02 H new ATOM 0 HZ PHE A 88 24.947 -6.273 14.820 1.00 62.44 H new ATOM 1210 N LYS A 89 24.186 -4.499 6.946 1.00 70.42 N ATOM 1211 CA LYS A 89 24.401 -4.093 5.562 1.00 12.32 C ATOM 1212 C LYS A 89 23.717 -5.058 4.599 1.00 52.50 C ATOM 1213 O LYS A 89 24.364 -5.759 3.821 1.00 31.13 O ATOM 1214 CB LYS A 89 25.899 -4.025 5.255 1.00 34.35 C ATOM 1215 CG LYS A 89 26.644 -2.995 6.086 1.00 53.43 C ATOM 1216 CD LYS A 89 27.345 -3.635 7.272 1.00 73.10 C ATOM 1217 CE LYS A 89 27.712 -2.602 8.327 1.00 70.45 C ATOM 1218 NZ LYS A 89 29.187 -2.482 8.495 1.00 54.20 N ATOM 0 H LYS A 89 24.546 -5.426 7.174 1.00 70.42 H new ATOM 0 HA LYS A 89 23.964 -3.103 5.428 1.00 12.32 H new ATOM 0 HB2 LYS A 89 26.341 -5.006 5.426 1.00 34.35 H new ATOM 0 HB3 LYS A 89 26.035 -3.794 4.198 1.00 34.35 H new ATOM 0 HG2 LYS A 89 27.377 -2.484 5.462 1.00 53.43 H new ATOM 0 HG3 LYS A 89 25.945 -2.238 6.441 1.00 53.43 H new ATOM 0 HD2 LYS A 89 26.697 -4.393 7.713 1.00 73.10 H new ATOM 0 HD3 LYS A 89 28.246 -4.145 6.932 1.00 73.10 H new ATOM 0 HE2 LYS A 89 27.298 -1.633 8.046 1.00 70.45 H new ATOM 0 HE3 LYS A 89 27.259 -2.878 9.279 1.00 70.45 H new ATOM 0 HZ1 LYS A 89 29.397 -1.769 9.222 1.00 54.20 H new ATOM 0 HZ2 LYS A 89 29.579 -3.400 8.787 1.00 54.20 H new ATOM 0 HZ3 LYS A 89 29.617 -2.194 7.593 1.00 54.20 H new ATOM 1232 N PRO A 90 22.377 -5.094 4.649 1.00 71.31 N ATOM 1233 CA PRO A 90 21.576 -5.968 3.786 1.00 43.22 C ATOM 1234 C PRO A 90 21.608 -5.527 2.326 1.00 35.23 C ATOM 1235 O PRO A 90 21.919 -4.376 2.021 1.00 53.21 O ATOM 1236 CB PRO A 90 20.162 -5.830 4.356 1.00 63.33 C ATOM 1237 CG PRO A 90 20.150 -4.497 5.020 1.00 54.22 C ATOM 1238 CD PRO A 90 21.540 -4.286 5.551 1.00 3.44 C ATOM 0 HA PRO A 90 21.950 -6.992 3.782 1.00 43.22 H new ATOM 0 HB2 PRO A 90 19.410 -5.887 3.569 1.00 63.33 H new ATOM 0 HB3 PRO A 90 19.941 -6.628 5.065 1.00 63.33 H new ATOM 0 HG2 PRO A 90 19.879 -3.712 4.314 1.00 54.22 H new ATOM 0 HG3 PRO A 90 19.416 -4.469 5.826 1.00 54.22 H new ATOM 0 HD2 PRO A 90 21.824 -3.234 5.527 1.00 3.44 H new ATOM 0 HD3 PRO A 90 21.629 -4.617 6.586 1.00 3.44 H new ATOM 1246 N LYS A 91 21.283 -6.450 1.427 1.00 32.24 N ATOM 1247 CA LYS A 91 21.272 -6.157 -0.001 1.00 34.41 C ATOM 1248 C LYS A 91 19.991 -5.430 -0.397 1.00 52.22 C ATOM 1249 O LYS A 91 18.917 -6.029 -0.455 1.00 33.25 O ATOM 1250 CB LYS A 91 21.407 -7.450 -0.809 1.00 21.24 C ATOM 1251 CG LYS A 91 20.932 -7.322 -2.246 1.00 23.13 C ATOM 1252 CD LYS A 91 21.806 -6.365 -3.038 1.00 41.35 C ATOM 1253 CE LYS A 91 20.970 -5.424 -3.892 1.00 52.31 C ATOM 1254 NZ LYS A 91 21.793 -4.333 -4.485 1.00 72.50 N ATOM 0 H LYS A 91 21.024 -7.408 1.663 1.00 32.24 H new ATOM 0 HA LYS A 91 22.120 -5.508 -0.220 1.00 34.41 H new ATOM 0 HB2 LYS A 91 22.451 -7.762 -0.807 1.00 21.24 H new ATOM 0 HB3 LYS A 91 20.838 -8.238 -0.316 1.00 21.24 H new ATOM 0 HG2 LYS A 91 20.940 -8.303 -2.722 1.00 23.13 H new ATOM 0 HG3 LYS A 91 19.900 -6.970 -2.259 1.00 23.13 H new ATOM 0 HD2 LYS A 91 22.425 -5.784 -2.354 1.00 41.35 H new ATOM 0 HD3 LYS A 91 22.483 -6.932 -3.676 1.00 41.35 H new ATOM 0 HE2 LYS A 91 20.488 -5.989 -4.689 1.00 52.31 H new ATOM 0 HE3 LYS A 91 20.176 -4.990 -3.284 1.00 52.31 H new ATOM 0 HZ1 LYS A 91 21.463 -4.135 -5.451 1.00 72.50 H new ATOM 0 HZ2 LYS A 91 21.701 -3.475 -3.905 1.00 72.50 H new ATOM 0 HZ3 LYS A 91 22.790 -4.627 -4.513 1.00 72.50 H new ATOM 1268 N CYS A 92 20.112 -4.135 -0.671 1.00 73.21 N ATOM 1269 CA CYS A 92 18.964 -3.326 -1.063 1.00 45.32 C ATOM 1270 C CYS A 92 19.067 -2.911 -2.528 1.00 54.12 C ATOM 1271 O CYS A 92 20.152 -2.609 -3.023 1.00 52.23 O ATOM 1272 CB CYS A 92 18.863 -2.083 -0.176 1.00 23.40 C ATOM 1273 SG CYS A 92 17.488 -0.970 -0.609 1.00 73.41 S ATOM 0 H CYS A 92 20.994 -3.624 -0.629 1.00 73.21 H new ATOM 0 HA CYS A 92 18.065 -3.929 -0.936 1.00 45.32 H new ATOM 0 HB2 CYS A 92 18.748 -2.398 0.861 1.00 23.40 H new ATOM 0 HB3 CYS A 92 19.799 -1.528 -0.239 1.00 23.40 H new ATOM 1278 N GLU A 93 17.928 -2.899 -3.215 1.00 24.10 N ATOM 1279 CA GLU A 93 17.891 -2.522 -4.623 1.00 75.01 C ATOM 1280 C GLU A 93 16.468 -2.180 -5.057 1.00 31.04 C ATOM 1281 O GLU A 93 15.508 -2.426 -4.326 1.00 53.23 O ATOM 1282 CB GLU A 93 18.442 -3.654 -5.492 1.00 60.22 C ATOM 1283 CG GLU A 93 17.719 -4.977 -5.300 1.00 52.40 C ATOM 1284 CD GLU A 93 17.771 -5.855 -6.535 1.00 40.10 C ATOM 1285 OE1 GLU A 93 18.809 -5.842 -7.229 1.00 73.14 O ATOM 1286 OE2 GLU A 93 16.773 -6.555 -6.807 1.00 23.54 O ATOM 0 H GLU A 93 17.021 -3.146 -2.820 1.00 24.10 H new ATOM 0 HA GLU A 93 18.515 -1.638 -4.752 1.00 75.01 H new ATOM 0 HB2 GLU A 93 18.375 -3.362 -6.540 1.00 60.22 H new ATOM 0 HB3 GLU A 93 19.500 -3.792 -5.267 1.00 60.22 H new ATOM 0 HG2 GLU A 93 18.164 -5.511 -4.460 1.00 52.40 H new ATOM 0 HG3 GLU A 93 16.678 -4.784 -5.040 1.00 52.40 H new ATOM 1293 N LYS A 94 16.340 -1.611 -6.250 1.00 44.43 N ATOM 1294 CA LYS A 94 15.037 -1.234 -6.784 1.00 35.43 C ATOM 1295 C LYS A 94 14.593 -2.207 -7.872 1.00 35.15 C ATOM 1296 O LYS A 94 15.095 -2.167 -8.995 1.00 75.22 O ATOM 1297 CB LYS A 94 15.083 0.188 -7.345 1.00 45.42 C ATOM 1298 CG LYS A 94 14.250 1.182 -6.555 1.00 11.02 C ATOM 1299 CD LYS A 94 14.187 2.533 -7.248 1.00 32.23 C ATOM 1300 CE LYS A 94 15.570 3.147 -7.399 1.00 21.21 C ATOM 1301 NZ LYS A 94 15.507 4.627 -7.549 1.00 55.10 N ATOM 0 H LYS A 94 17.125 -1.400 -6.867 1.00 44.43 H new ATOM 0 HA LYS A 94 14.314 -1.272 -5.969 1.00 35.43 H new ATOM 0 HB2 LYS A 94 16.118 0.529 -7.364 1.00 45.42 H new ATOM 0 HB3 LYS A 94 14.733 0.174 -8.377 1.00 45.42 H new ATOM 0 HG2 LYS A 94 13.241 0.791 -6.426 1.00 11.02 H new ATOM 0 HG3 LYS A 94 14.675 1.303 -5.558 1.00 11.02 H new ATOM 0 HD2 LYS A 94 13.730 2.418 -8.231 1.00 32.23 H new ATOM 0 HD3 LYS A 94 13.549 3.207 -6.676 1.00 32.23 H new ATOM 0 HE2 LYS A 94 16.176 2.896 -6.528 1.00 21.21 H new ATOM 0 HE3 LYS A 94 16.066 2.715 -8.268 1.00 21.21 H new ATOM 0 HZ1 LYS A 94 16.470 5.007 -7.649 1.00 55.10 H new ATOM 0 HZ2 LYS A 94 14.950 4.867 -8.394 1.00 55.10 H new ATOM 0 HZ3 LYS A 94 15.057 5.042 -6.709 1.00 55.10 H new ATOM 1315 N ILE A 95 13.649 -3.078 -7.531 1.00 34.02 N ATOM 1316 CA ILE A 95 13.136 -4.058 -8.480 1.00 30.42 C ATOM 1317 C ILE A 95 11.984 -3.483 -9.297 1.00 1.24 C ATOM 1318 O ILE A 95 10.939 -3.130 -8.752 1.00 2.23 O ATOM 1319 CB ILE A 95 12.656 -5.336 -7.766 1.00 11.35 C ATOM 1320 CG1 ILE A 95 13.836 -6.051 -7.105 1.00 1.24 C ATOM 1321 CG2 ILE A 95 11.953 -6.260 -8.749 1.00 12.34 C ATOM 1322 CD1 ILE A 95 14.095 -5.603 -5.683 1.00 73.01 C ATOM 0 H ILE A 95 13.224 -3.125 -6.605 1.00 34.02 H new ATOM 0 HA ILE A 95 13.960 -4.311 -9.147 1.00 30.42 H new ATOM 0 HB ILE A 95 11.945 -5.055 -6.989 1.00 11.35 H new ATOM 0 HG12 ILE A 95 13.649 -7.125 -7.111 1.00 1.24 H new ATOM 0 HG13 ILE A 95 14.733 -5.881 -7.700 1.00 1.24 H new ATOM 0 HG21 ILE A 95 11.620 -7.158 -8.229 1.00 12.34 H new ATOM 0 HG22 ILE A 95 11.091 -5.748 -9.177 1.00 12.34 H new ATOM 0 HG23 ILE A 95 12.643 -6.537 -9.546 1.00 12.34 H new ATOM 0 HD11 ILE A 95 14.945 -6.152 -5.278 1.00 73.01 H new ATOM 0 HD12 ILE A 95 14.314 -4.535 -5.672 1.00 73.01 H new ATOM 0 HD13 ILE A 95 13.213 -5.799 -5.073 1.00 73.01 H new ATOM 1334 N ASN A 96 12.183 -3.393 -10.608 1.00 13.23 N ATOM 1335 CA ASN A 96 11.160 -2.861 -11.501 1.00 33.11 C ATOM 1336 C ASN A 96 10.777 -1.439 -11.104 1.00 14.23 C ATOM 1337 O ASN A 96 9.688 -0.965 -11.426 1.00 32.13 O ATOM 1338 CB ASN A 96 9.921 -3.759 -11.483 1.00 51.20 C ATOM 1339 CG ASN A 96 9.021 -3.526 -12.681 1.00 71.22 C ATOM 1340 OD1 ASN A 96 9.305 -3.992 -13.785 1.00 30.23 O ATOM 1341 ND2 ASN A 96 7.928 -2.802 -12.469 1.00 5.34 N ATOM 0 H ASN A 96 13.043 -3.681 -11.075 1.00 13.23 H new ATOM 0 HA ASN A 96 11.570 -2.839 -12.511 1.00 33.11 H new ATOM 0 HB2 ASN A 96 10.233 -4.803 -11.464 1.00 51.20 H new ATOM 0 HB3 ASN A 96 9.357 -3.578 -10.568 1.00 51.20 H new ATOM 0 HD21 ASN A 96 7.285 -2.613 -13.238 1.00 5.34 H new ATOM 0 HD22 ASN A 96 7.732 -2.435 -11.538 1.00 5.34 H new ATOM 1348 N GLY A 97 11.681 -0.762 -10.402 1.00 32.00 N ATOM 1349 CA GLY A 97 11.420 0.599 -9.973 1.00 15.44 C ATOM 1350 C GLY A 97 10.822 0.664 -8.581 1.00 23.11 C ATOM 1351 O GLY A 97 10.244 1.679 -8.194 1.00 20.32 O ATOM 0 H GLY A 97 12.589 -1.132 -10.123 1.00 32.00 H new ATOM 0 HA2 GLY A 97 12.350 1.167 -9.992 1.00 15.44 H new ATOM 0 HA3 GLY A 97 10.740 1.075 -10.680 1.00 15.44 H new ATOM 1355 N GLU A 98 10.961 -0.423 -7.828 1.00 41.10 N ATOM 1356 CA GLU A 98 10.428 -0.485 -6.472 1.00 72.33 C ATOM 1357 C GLU A 98 11.539 -0.760 -5.463 1.00 33.22 C ATOM 1358 O GLU A 98 12.160 -1.823 -5.482 1.00 2.23 O ATOM 1359 CB GLU A 98 9.353 -1.570 -6.373 1.00 2.04 C ATOM 1360 CG GLU A 98 8.205 -1.381 -7.349 1.00 53.52 C ATOM 1361 CD GLU A 98 7.221 -2.534 -7.324 1.00 31.22 C ATOM 1362 OE1 GLU A 98 7.621 -3.645 -6.915 1.00 54.25 O ATOM 1363 OE2 GLU A 98 6.052 -2.327 -7.712 1.00 65.00 O ATOM 0 H GLU A 98 11.438 -1.271 -8.134 1.00 41.10 H new ATOM 0 HA GLU A 98 9.981 0.482 -6.239 1.00 72.33 H new ATOM 0 HB2 GLU A 98 9.813 -2.542 -6.550 1.00 2.04 H new ATOM 0 HB3 GLU A 98 8.957 -1.585 -5.358 1.00 2.04 H new ATOM 0 HG2 GLU A 98 7.680 -0.456 -7.112 1.00 53.52 H new ATOM 0 HG3 GLU A 98 8.605 -1.271 -8.357 1.00 53.52 H new ATOM 1370 N ASP A 99 11.783 0.205 -4.583 1.00 73.04 N ATOM 1371 CA ASP A 99 12.818 0.068 -3.565 1.00 51.04 C ATOM 1372 C ASP A 99 12.498 -1.083 -2.617 1.00 3.03 C ATOM 1373 O ASP A 99 11.595 -0.983 -1.787 1.00 20.42 O ATOM 1374 CB ASP A 99 12.963 1.370 -2.777 1.00 11.35 C ATOM 1375 CG ASP A 99 13.901 2.353 -3.449 1.00 4.02 C ATOM 1376 OD1 ASP A 99 13.426 3.154 -4.281 1.00 73.10 O ATOM 1377 OD2 ASP A 99 15.111 2.322 -3.142 1.00 63.12 O ATOM 0 H ASP A 99 11.278 1.091 -4.554 1.00 73.04 H new ATOM 0 HA ASP A 99 13.761 -0.150 -4.067 1.00 51.04 H new ATOM 0 HB2 ASP A 99 11.982 1.831 -2.659 1.00 11.35 H new ATOM 0 HB3 ASP A 99 13.332 1.146 -1.776 1.00 11.35 H new ATOM 1382 N MET A 100 13.245 -2.175 -2.747 1.00 13.14 N ATOM 1383 CA MET A 100 13.040 -3.345 -1.900 1.00 43.14 C ATOM 1384 C MET A 100 14.327 -3.720 -1.171 1.00 53.05 C ATOM 1385 O MET A 100 15.370 -3.099 -1.373 1.00 42.34 O ATOM 1386 CB MET A 100 12.552 -4.528 -2.738 1.00 53.14 C ATOM 1387 CG MET A 100 11.461 -4.160 -3.731 1.00 42.14 C ATOM 1388 SD MET A 100 9.987 -5.183 -3.555 1.00 62.42 S ATOM 1389 CE MET A 100 10.390 -6.548 -4.643 1.00 44.23 C ATOM 0 H MET A 100 13.996 -2.274 -3.430 1.00 13.14 H new ATOM 0 HA MET A 100 12.281 -3.097 -1.158 1.00 43.14 H new ATOM 0 HB2 MET A 100 13.397 -4.952 -3.280 1.00 53.14 H new ATOM 0 HB3 MET A 100 12.178 -5.305 -2.072 1.00 53.14 H new ATOM 0 HG2 MET A 100 11.190 -3.113 -3.595 1.00 42.14 H new ATOM 0 HG3 MET A 100 11.849 -4.260 -4.745 1.00 42.14 H new ATOM 0 HE1 MET A 100 9.623 -6.639 -5.412 1.00 44.23 H new ATOM 0 HE2 MET A 100 11.356 -6.365 -5.113 1.00 44.23 H new ATOM 0 HE3 MET A 100 10.436 -7.472 -4.066 1.00 44.23 H new ATOM 1399 N VAL A 101 14.245 -4.740 -0.323 1.00 1.11 N ATOM 1400 CA VAL A 101 15.403 -5.198 0.435 1.00 20.14 C ATOM 1401 C VAL A 101 15.481 -6.721 0.452 1.00 4.55 C ATOM 1402 O VAL A 101 14.464 -7.406 0.353 1.00 74.21 O ATOM 1403 CB VAL A 101 15.365 -4.681 1.886 1.00 53.34 C ATOM 1404 CG1 VAL A 101 15.199 -3.169 1.909 1.00 0.22 C ATOM 1405 CG2 VAL A 101 14.248 -5.360 2.664 1.00 51.22 C ATOM 0 H VAL A 101 13.389 -5.265 -0.144 1.00 1.11 H new ATOM 0 HA VAL A 101 16.286 -4.797 -0.063 1.00 20.14 H new ATOM 0 HB VAL A 101 16.312 -4.926 2.366 1.00 53.34 H new ATOM 0 HG11 VAL A 101 15.174 -2.821 2.942 1.00 0.22 H new ATOM 0 HG12 VAL A 101 16.036 -2.703 1.389 1.00 0.22 H new ATOM 0 HG13 VAL A 101 14.267 -2.898 1.412 1.00 0.22 H new ATOM 0 HG21 VAL A 101 14.236 -4.983 3.687 1.00 51.22 H new ATOM 0 HG22 VAL A 101 13.291 -5.147 2.187 1.00 51.22 H new ATOM 0 HG23 VAL A 101 14.416 -6.437 2.676 1.00 51.22 H new ATOM 1415 N TYR A 102 16.696 -7.243 0.580 1.00 71.33 N ATOM 1416 CA TYR A 102 16.908 -8.686 0.608 1.00 1.50 C ATOM 1417 C TYR A 102 17.203 -9.165 2.026 1.00 63.00 C ATOM 1418 O TYR A 102 17.989 -8.552 2.751 1.00 72.45 O ATOM 1419 CB TYR A 102 18.059 -9.071 -0.323 1.00 20.23 C ATOM 1420 CG TYR A 102 17.648 -9.202 -1.772 1.00 20.11 C ATOM 1421 CD1 TYR A 102 17.675 -8.105 -2.624 1.00 62.32 C ATOM 1422 CD2 TYR A 102 17.233 -10.423 -2.289 1.00 23.40 C ATOM 1423 CE1 TYR A 102 17.300 -8.220 -3.949 1.00 32.34 C ATOM 1424 CE2 TYR A 102 16.857 -10.548 -3.613 1.00 25.15 C ATOM 1425 CZ TYR A 102 16.892 -9.444 -4.438 1.00 51.31 C ATOM 1426 OH TYR A 102 16.519 -9.563 -5.757 1.00 55.32 O ATOM 0 H TYR A 102 17.548 -6.689 0.666 1.00 71.33 H new ATOM 0 HA TYR A 102 15.994 -9.170 0.264 1.00 1.50 H new ATOM 0 HB2 TYR A 102 18.846 -8.321 -0.244 1.00 20.23 H new ATOM 0 HB3 TYR A 102 18.485 -10.017 0.012 1.00 20.23 H new ATOM 0 HD1 TYR A 102 17.995 -7.146 -2.244 1.00 62.32 H new ATOM 0 HD2 TYR A 102 17.204 -11.290 -1.645 1.00 23.40 H new ATOM 0 HE1 TYR A 102 17.326 -7.357 -4.598 1.00 32.34 H new ATOM 0 HE2 TYR A 102 16.538 -11.505 -3.999 1.00 25.15 H new ATOM 0 HH TYR A 102 16.571 -8.686 -6.192 1.00 55.32 H new ATOM 1436 N LEU A 103 16.569 -10.265 2.415 1.00 33.14 N ATOM 1437 CA LEU A 103 16.762 -10.830 3.747 1.00 44.44 C ATOM 1438 C LEU A 103 17.630 -12.083 3.686 1.00 55.14 C ATOM 1439 O LEU A 103 17.724 -12.753 2.657 1.00 34.11 O ATOM 1440 CB LEU A 103 15.411 -11.161 4.383 1.00 5.32 C ATOM 1441 CG LEU A 103 14.348 -11.729 3.443 1.00 13.21 C ATOM 1442 CD1 LEU A 103 14.840 -13.012 2.793 1.00 22.53 C ATOM 1443 CD2 LEU A 103 13.048 -11.974 4.195 1.00 33.21 C ATOM 0 H LEU A 103 15.917 -10.784 1.828 1.00 33.14 H new ATOM 0 HA LEU A 103 17.272 -10.087 4.360 1.00 44.44 H new ATOM 0 HB2 LEU A 103 15.577 -11.878 5.187 1.00 5.32 H new ATOM 0 HB3 LEU A 103 15.016 -10.254 4.841 1.00 5.32 H new ATOM 0 HG LEU A 103 14.158 -10.998 2.657 1.00 13.21 H new ATOM 0 HD11 LEU A 103 14.070 -13.401 2.127 1.00 22.53 H new ATOM 0 HD12 LEU A 103 15.744 -12.806 2.220 1.00 22.53 H new ATOM 0 HD13 LEU A 103 15.060 -13.750 3.565 1.00 22.53 H new ATOM 0 HD21 LEU A 103 12.302 -12.378 3.510 1.00 33.21 H new ATOM 0 HD22 LEU A 103 13.223 -12.685 5.002 1.00 33.21 H new ATOM 0 HD23 LEU A 103 12.686 -11.034 4.612 1.00 33.21 H new ATOM 1455 N PRO A 104 18.278 -12.410 4.814 1.00 55.14 N ATOM 1456 CA PRO A 104 19.146 -13.586 4.915 1.00 62.42 C ATOM 1457 C PRO A 104 18.361 -14.893 4.871 1.00 14.44 C ATOM 1458 O PRO A 104 17.130 -14.890 4.912 1.00 4.33 O ATOM 1459 CB PRO A 104 19.821 -13.413 6.278 1.00 34.10 C ATOM 1460 CG PRO A 104 18.873 -12.577 7.066 1.00 14.40 C ATOM 1461 CD PRO A 104 18.212 -11.657 6.077 1.00 15.32 C ATOM 0 HA PRO A 104 19.846 -13.648 4.082 1.00 62.42 H new ATOM 0 HB2 PRO A 104 19.994 -14.376 6.759 1.00 34.10 H new ATOM 0 HB3 PRO A 104 20.791 -12.926 6.180 1.00 34.10 H new ATOM 0 HG2 PRO A 104 18.136 -13.198 7.575 1.00 14.40 H new ATOM 0 HG3 PRO A 104 19.398 -12.011 7.835 1.00 14.40 H new ATOM 0 HD2 PRO A 104 17.183 -11.436 6.360 1.00 15.32 H new ATOM 0 HD3 PRO A 104 18.735 -10.703 6.004 1.00 15.32 H new ATOM 1469 N SER A 105 19.079 -16.008 4.789 1.00 44.43 N ATOM 1470 CA SER A 105 18.449 -17.321 4.736 1.00 32.44 C ATOM 1471 C SER A 105 18.637 -18.067 6.054 1.00 32.01 C ATOM 1472 O SER A 105 19.458 -17.682 6.887 1.00 53.52 O ATOM 1473 CB SER A 105 19.030 -18.144 3.585 1.00 53.24 C ATOM 1474 OG SER A 105 18.651 -17.604 2.330 1.00 13.34 O ATOM 0 H SER A 105 20.098 -16.028 4.758 1.00 44.43 H new ATOM 0 HA SER A 105 17.382 -17.177 4.568 1.00 32.44 H new ATOM 0 HB2 SER A 105 20.117 -18.166 3.662 1.00 53.24 H new ATOM 0 HB3 SER A 105 18.684 -19.175 3.660 1.00 53.24 H new ATOM 0 HG SER A 105 19.036 -18.147 1.611 1.00 13.34 H new ATOM 1480 N TYR A 106 17.870 -19.137 6.236 1.00 43.53 N ATOM 1481 CA TYR A 106 17.949 -19.936 7.453 1.00 44.15 C ATOM 1482 C TYR A 106 19.390 -20.345 7.743 1.00 42.01 C ATOM 1483 O TYR A 106 19.791 -20.466 8.900 1.00 51.30 O ATOM 1484 CB TYR A 106 17.069 -21.181 7.328 1.00 3.22 C ATOM 1485 CG TYR A 106 17.662 -22.255 6.445 1.00 73.43 C ATOM 1486 CD1 TYR A 106 17.801 -22.059 5.076 1.00 20.05 C ATOM 1487 CD2 TYR A 106 18.083 -23.467 6.979 1.00 50.01 C ATOM 1488 CE1 TYR A 106 18.341 -23.038 4.266 1.00 70.54 C ATOM 1489 CE2 TYR A 106 18.625 -24.452 6.176 1.00 44.41 C ATOM 1490 CZ TYR A 106 18.752 -24.233 4.820 1.00 51.20 C ATOM 1491 OH TYR A 106 19.292 -25.210 4.016 1.00 74.42 O ATOM 0 H TYR A 106 17.187 -19.471 5.556 1.00 43.53 H new ATOM 0 HA TYR A 106 17.589 -19.327 8.282 1.00 44.15 H new ATOM 0 HB2 TYR A 106 16.895 -21.594 8.322 1.00 3.22 H new ATOM 0 HB3 TYR A 106 16.097 -20.890 6.929 1.00 3.22 H new ATOM 0 HD1 TYR A 106 17.481 -21.125 4.638 1.00 20.05 H new ATOM 0 HD2 TYR A 106 17.985 -23.642 8.040 1.00 50.01 H new ATOM 0 HE1 TYR A 106 18.441 -22.869 3.204 1.00 70.54 H new ATOM 0 HE2 TYR A 106 18.947 -25.388 6.607 1.00 44.41 H new ATOM 0 HH TYR A 106 19.531 -25.988 4.562 1.00 74.42 H new ATOM 1501 N GLU A 107 20.164 -20.556 6.682 1.00 33.15 N ATOM 1502 CA GLU A 107 21.560 -20.952 6.823 1.00 41.20 C ATOM 1503 C GLU A 107 22.377 -19.841 7.476 1.00 45.55 C ATOM 1504 O GLU A 107 23.011 -20.048 8.510 1.00 42.51 O ATOM 1505 CB GLU A 107 22.154 -21.302 5.457 1.00 1.20 C ATOM 1506 CG GLU A 107 23.233 -22.370 5.518 1.00 31.11 C ATOM 1507 CD GLU A 107 24.361 -22.116 4.538 1.00 65.23 C ATOM 1508 OE1 GLU A 107 24.086 -22.053 3.321 1.00 5.50 O ATOM 1509 OE2 GLU A 107 25.519 -21.981 4.986 1.00 31.53 O ATOM 0 H GLU A 107 19.848 -20.459 5.717 1.00 33.15 H new ATOM 0 HA GLU A 107 21.599 -21.833 7.464 1.00 41.20 H new ATOM 0 HB2 GLU A 107 21.354 -21.642 4.799 1.00 1.20 H new ATOM 0 HB3 GLU A 107 22.572 -20.400 5.010 1.00 1.20 H new ATOM 0 HG2 GLU A 107 23.638 -22.414 6.529 1.00 31.11 H new ATOM 0 HG3 GLU A 107 22.788 -23.343 5.310 1.00 31.11 H new ATOM 1516 N MET A 108 22.358 -18.662 6.862 1.00 12.44 N ATOM 1517 CA MET A 108 23.096 -17.517 7.384 1.00 63.23 C ATOM 1518 C MET A 108 22.750 -17.268 8.848 1.00 15.40 C ATOM 1519 O MET A 108 23.626 -16.977 9.663 1.00 34.42 O ATOM 1520 CB MET A 108 22.793 -16.267 6.555 1.00 31.24 C ATOM 1521 CG MET A 108 23.524 -16.229 5.223 1.00 12.21 C ATOM 1522 SD MET A 108 22.644 -15.270 3.975 1.00 13.35 S ATOM 1523 CE MET A 108 23.392 -13.658 4.198 1.00 53.42 C ATOM 0 H MET A 108 21.840 -18.475 6.003 1.00 12.44 H new ATOM 0 HA MET A 108 24.161 -17.740 7.315 1.00 63.23 H new ATOM 0 HB2 MET A 108 21.720 -16.213 6.373 1.00 31.24 H new ATOM 0 HB3 MET A 108 23.063 -15.383 7.133 1.00 31.24 H new ATOM 0 HG2 MET A 108 24.517 -15.803 5.370 1.00 12.21 H new ATOM 0 HG3 MET A 108 23.664 -17.247 4.861 1.00 12.21 H new ATOM 0 HE1 MET A 108 22.724 -12.890 3.808 1.00 53.42 H new ATOM 0 HE2 MET A 108 23.568 -13.482 5.259 1.00 53.42 H new ATOM 0 HE3 MET A 108 24.340 -13.620 3.662 1.00 53.42 H new ATOM 1533 N CYS A 109 21.467 -17.382 9.175 1.00 12.05 N ATOM 1534 CA CYS A 109 21.004 -17.168 10.541 1.00 33.12 C ATOM 1535 C CYS A 109 21.327 -18.373 11.420 1.00 2.22 C ATOM 1536 O CYS A 109 21.434 -18.253 12.641 1.00 55.12 O ATOM 1537 CB CYS A 109 19.497 -16.903 10.555 1.00 0.54 C ATOM 1538 SG CYS A 109 18.943 -15.834 11.923 1.00 22.20 S ATOM 0 H CYS A 109 20.729 -17.621 8.512 1.00 12.05 H new ATOM 0 HA CYS A 109 21.524 -16.298 10.942 1.00 33.12 H new ATOM 0 HB2 CYS A 109 19.211 -16.442 9.609 1.00 0.54 H new ATOM 0 HB3 CYS A 109 18.972 -17.856 10.617 1.00 0.54 H new ATOM 1543 N ARG A 110 21.483 -19.533 10.791 1.00 53.14 N ATOM 1544 CA ARG A 110 21.793 -20.760 11.515 1.00 41.42 C ATOM 1545 C ARG A 110 23.235 -20.746 12.014 1.00 71.20 C ATOM 1546 O ARG A 110 23.554 -21.356 13.035 1.00 63.22 O ATOM 1547 CB ARG A 110 21.564 -21.978 10.619 1.00 53.03 C ATOM 1548 CG ARG A 110 22.048 -23.283 11.229 1.00 10.13 C ATOM 1549 CD ARG A 110 21.044 -24.405 11.014 1.00 65.02 C ATOM 1550 NE ARG A 110 21.699 -25.701 10.853 1.00 55.22 N ATOM 1551 CZ ARG A 110 21.038 -26.847 10.728 1.00 44.21 C ATOM 1552 NH1 ARG A 110 19.713 -26.857 10.745 1.00 73.20 N ATOM 1553 NH2 ARG A 110 21.705 -27.985 10.585 1.00 34.41 N ATOM 0 H ARG A 110 21.400 -19.649 9.781 1.00 53.14 H new ATOM 0 HA ARG A 110 21.128 -20.822 12.377 1.00 41.42 H new ATOM 0 HB2 ARG A 110 20.500 -22.062 10.400 1.00 53.03 H new ATOM 0 HB3 ARG A 110 22.074 -21.820 9.669 1.00 53.03 H new ATOM 0 HG2 ARG A 110 23.005 -23.560 10.786 1.00 10.13 H new ATOM 0 HG3 ARG A 110 22.218 -23.146 12.297 1.00 10.13 H new ATOM 0 HD2 ARG A 110 20.360 -24.447 11.862 1.00 65.02 H new ATOM 0 HD3 ARG A 110 20.443 -24.190 10.130 1.00 65.02 H new ATOM 0 HE ARG A 110 22.719 -25.728 10.836 1.00 55.22 H new ATOM 0 HH11 ARG A 110 19.198 -25.984 10.854 1.00 73.20 H new ATOM 0 HH12 ARG A 110 19.208 -27.738 10.649 1.00 73.20 H new ATOM 0 HH21 ARG A 110 22.725 -27.980 10.571 1.00 34.41 H new ATOM 0 HH22 ARG A 110 21.198 -28.865 10.489 1.00 34.41 H new ATOM 1567 N ILE A 111 24.101 -20.048 11.287 1.00 14.43 N ATOM 1568 CA ILE A 111 25.508 -19.955 11.657 1.00 54.31 C ATOM 1569 C ILE A 111 25.666 -19.563 13.122 1.00 24.10 C ATOM 1570 O ILE A 111 26.596 -20.005 13.798 1.00 62.32 O ATOM 1571 CB ILE A 111 26.254 -18.932 10.780 1.00 54.21 C ATOM 1572 CG1 ILE A 111 26.042 -19.247 9.298 1.00 71.52 C ATOM 1573 CG2 ILE A 111 27.737 -18.925 11.119 1.00 33.31 C ATOM 1574 CD1 ILE A 111 26.473 -20.645 8.910 1.00 14.31 C ATOM 0 H ILE A 111 23.853 -19.539 10.439 1.00 14.43 H new ATOM 0 HA ILE A 111 25.942 -20.942 11.499 1.00 54.31 H new ATOM 0 HB ILE A 111 25.851 -17.940 10.982 1.00 54.21 H new ATOM 0 HG12 ILE A 111 24.987 -19.120 9.055 1.00 71.52 H new ATOM 0 HG13 ILE A 111 26.596 -18.525 8.698 1.00 71.52 H new ATOM 0 HG21 ILE A 111 28.250 -18.197 10.491 1.00 33.31 H new ATOM 0 HG22 ILE A 111 27.869 -18.657 12.167 1.00 33.31 H new ATOM 0 HG23 ILE A 111 28.155 -19.916 10.942 1.00 33.31 H new ATOM 0 HD11 ILE A 111 26.294 -20.799 7.846 1.00 14.31 H new ATOM 0 HD12 ILE A 111 27.535 -20.770 9.121 1.00 14.31 H new ATOM 0 HD13 ILE A 111 25.901 -21.374 9.483 1.00 14.31 H new ATOM 1586 N THR A 112 24.751 -18.731 13.609 1.00 1.02 N ATOM 1587 CA THR A 112 24.788 -18.280 14.995 1.00 44.25 C ATOM 1588 C THR A 112 23.961 -19.192 15.893 1.00 61.45 C ATOM 1589 O THR A 112 24.176 -19.248 17.103 1.00 53.10 O ATOM 1590 CB THR A 112 24.268 -16.836 15.129 1.00 33.45 C ATOM 1591 OG1 THR A 112 22.862 -16.796 14.861 1.00 13.32 O ATOM 1592 CG2 THR A 112 24.999 -15.906 14.173 1.00 13.25 C ATOM 0 H THR A 112 23.975 -18.356 13.064 1.00 1.02 H new ATOM 0 HA THR A 112 25.831 -18.314 15.311 1.00 44.25 H new ATOM 0 HB THR A 112 24.453 -16.499 16.149 1.00 33.45 H new ATOM 0 HG1 THR A 112 22.661 -17.357 14.083 1.00 13.32 H new ATOM 0 HG21 THR A 112 24.614 -14.892 14.286 1.00 13.25 H new ATOM 0 HG22 THR A 112 26.065 -15.917 14.399 1.00 13.25 H new ATOM 0 HG23 THR A 112 24.842 -16.241 13.148 1.00 13.25 H new ATOM 1600 N MET A 113 23.015 -19.907 15.292 1.00 64.14 N ATOM 1601 CA MET A 113 22.157 -20.819 16.038 1.00 30.42 C ATOM 1602 C MET A 113 22.970 -21.963 16.636 1.00 35.44 C ATOM 1603 O MET A 113 22.737 -22.373 17.773 1.00 11.22 O ATOM 1604 CB MET A 113 21.059 -21.378 15.131 1.00 20.10 C ATOM 1605 CG MET A 113 19.855 -20.459 14.997 1.00 25.30 C ATOM 1606 SD MET A 113 18.512 -21.208 14.056 1.00 13.30 S ATOM 1607 CE MET A 113 18.608 -20.277 12.529 1.00 43.30 C ATOM 0 H MET A 113 22.824 -19.872 14.291 1.00 64.14 H new ATOM 0 HA MET A 113 21.696 -20.260 16.852 1.00 30.42 H new ATOM 0 HB2 MET A 113 21.476 -21.564 14.141 1.00 20.10 H new ATOM 0 HB3 MET A 113 20.730 -22.340 15.524 1.00 20.10 H new ATOM 0 HG2 MET A 113 19.493 -20.193 15.990 1.00 25.30 H new ATOM 0 HG3 MET A 113 20.162 -19.533 14.511 1.00 25.30 H new ATOM 0 HE1 MET A 113 17.605 -20.130 12.129 1.00 43.30 H new ATOM 0 HE2 MET A 113 19.067 -19.307 12.722 1.00 43.30 H new ATOM 0 HE3 MET A 113 19.211 -20.826 11.805 1.00 43.30 H new ATOM 1617 N GLU A 114 23.922 -22.474 15.863 1.00 63.40 N ATOM 1618 CA GLU A 114 24.768 -23.572 16.318 1.00 73.12 C ATOM 1619 C GLU A 114 25.387 -23.255 17.676 1.00 42.02 C ATOM 1620 O GLU A 114 25.146 -23.938 18.671 1.00 24.51 O ATOM 1621 CB GLU A 114 25.870 -23.854 15.295 1.00 4.51 C ATOM 1622 CG GLU A 114 25.664 -25.142 14.517 1.00 25.42 C ATOM 1623 CD GLU A 114 26.968 -25.855 14.214 1.00 70.40 C ATOM 1624 OE1 GLU A 114 27.936 -25.176 13.813 1.00 52.44 O ATOM 1625 OE2 GLU A 114 27.020 -27.092 14.377 1.00 24.25 O ATOM 0 H GLU A 114 24.127 -22.146 14.919 1.00 63.40 H new ATOM 0 HA GLU A 114 24.144 -24.459 16.421 1.00 73.12 H new ATOM 0 HB2 GLU A 114 25.925 -23.021 14.594 1.00 4.51 H new ATOM 0 HB3 GLU A 114 26.829 -23.901 15.811 1.00 4.51 H new ATOM 0 HG2 GLU A 114 25.015 -25.807 15.087 1.00 25.42 H new ATOM 0 HG3 GLU A 114 25.150 -24.919 13.582 1.00 25.42 H new ATOM 1632 N PRO A 115 26.206 -22.193 17.719 1.00 73.21 N ATOM 1633 CA PRO A 115 26.877 -21.761 18.948 1.00 1.50 C ATOM 1634 C PRO A 115 25.904 -21.175 19.965 1.00 54.30 C ATOM 1635 O PRO A 115 25.916 -21.549 21.138 1.00 14.42 O ATOM 1636 CB PRO A 115 27.852 -20.686 18.460 1.00 10.13 C ATOM 1637 CG PRO A 115 27.244 -20.166 17.203 1.00 5.34 C ATOM 1638 CD PRO A 115 26.538 -21.333 16.571 1.00 41.20 C ATOM 0 HA PRO A 115 27.359 -22.592 19.463 1.00 1.50 H new ATOM 0 HB2 PRO A 115 27.971 -19.894 19.199 1.00 10.13 H new ATOM 0 HB3 PRO A 115 28.842 -21.103 18.278 1.00 10.13 H new ATOM 0 HG2 PRO A 115 26.546 -19.355 17.413 1.00 5.34 H new ATOM 0 HG3 PRO A 115 28.008 -19.765 16.537 1.00 5.34 H new ATOM 0 HD2 PRO A 115 25.644 -21.018 16.033 1.00 41.20 H new ATOM 0 HD3 PRO A 115 27.177 -21.849 15.854 1.00 41.20 H new ATOM 1646 N CYS A 116 25.061 -20.255 19.508 1.00 13.52 N ATOM 1647 CA CYS A 116 24.080 -19.616 20.378 1.00 72.43 C ATOM 1648 C CYS A 116 22.752 -20.368 20.343 1.00 1.24 C ATOM 1649 O CYS A 116 21.829 -19.984 19.625 1.00 34.43 O ATOM 1650 CB CYS A 116 23.866 -18.161 19.958 1.00 53.21 C ATOM 1651 SG CYS A 116 25.396 -17.288 19.494 1.00 52.03 S ATOM 0 H CYS A 116 25.037 -19.935 18.540 1.00 13.52 H new ATOM 0 HA CYS A 116 24.465 -19.640 21.398 1.00 72.43 H new ATOM 0 HB2 CYS A 116 23.176 -18.135 19.115 1.00 53.21 H new ATOM 0 HB3 CYS A 116 23.388 -17.624 20.777 1.00 53.21 H new ATOM 1656 N ARG A 117 22.665 -21.439 21.125 1.00 73.33 N ATOM 1657 CA ARG A 117 21.451 -22.245 21.183 1.00 21.13 C ATOM 1658 C ARG A 117 20.430 -21.622 22.131 1.00 23.42 C ATOM 1659 O ARG A 117 19.222 -21.748 21.928 1.00 44.15 O ATOM 1660 CB ARG A 117 21.780 -23.669 21.635 1.00 23.12 C ATOM 1661 CG ARG A 117 20.565 -24.458 22.095 1.00 64.42 C ATOM 1662 CD ARG A 117 20.891 -25.934 22.263 1.00 21.23 C ATOM 1663 NE ARG A 117 19.729 -26.705 22.699 1.00 44.24 N ATOM 1664 CZ ARG A 117 19.696 -28.033 22.724 1.00 54.52 C ATOM 1665 NH1 ARG A 117 20.754 -28.733 22.341 1.00 21.31 N ATOM 1666 NH2 ARG A 117 18.602 -28.662 23.133 1.00 15.00 N ATOM 0 H ARG A 117 23.420 -21.769 21.727 1.00 73.33 H new ATOM 0 HA ARG A 117 21.019 -22.279 20.183 1.00 21.13 H new ATOM 0 HB2 ARG A 117 22.258 -24.201 20.812 1.00 23.12 H new ATOM 0 HB3 ARG A 117 22.503 -23.625 22.449 1.00 23.12 H new ATOM 0 HG2 ARG A 117 20.204 -24.054 23.041 1.00 64.42 H new ATOM 0 HG3 ARG A 117 19.759 -24.342 21.371 1.00 64.42 H new ATOM 0 HD2 ARG A 117 21.258 -26.334 21.318 1.00 21.23 H new ATOM 0 HD3 ARG A 117 21.695 -26.047 22.990 1.00 21.23 H new ATOM 0 HE ARG A 117 18.898 -26.196 23.001 1.00 44.24 H new ATOM 0 HH11 ARG A 117 21.597 -28.252 22.026 1.00 21.31 H new ATOM 0 HH12 ARG A 117 20.726 -29.752 22.361 1.00 21.31 H new ATOM 0 HH21 ARG A 117 17.786 -28.126 23.428 1.00 15.00 H new ATOM 0 HH22 ARG A 117 18.577 -29.682 23.152 1.00 15.00 H new ATOM 1680 N ILE A 118 20.924 -20.952 23.167 1.00 61.22 N ATOM 1681 CA ILE A 118 20.055 -20.310 24.145 1.00 1.00 C ATOM 1682 C ILE A 118 19.115 -19.314 23.475 1.00 74.21 C ATOM 1683 O ILE A 118 18.076 -18.954 24.030 1.00 11.24 O ATOM 1684 CB ILE A 118 20.870 -19.580 25.229 1.00 43.23 C ATOM 1685 CG1 ILE A 118 21.821 -20.555 25.926 1.00 12.14 C ATOM 1686 CG2 ILE A 118 19.941 -18.924 26.239 1.00 53.34 C ATOM 1687 CD1 ILE A 118 21.119 -21.743 26.547 1.00 4.53 C ATOM 0 H ILE A 118 21.921 -20.840 23.350 1.00 61.22 H new ATOM 0 HA ILE A 118 19.469 -21.101 24.613 1.00 1.00 H new ATOM 0 HB ILE A 118 21.464 -18.800 24.752 1.00 43.23 H new ATOM 0 HG12 ILE A 118 22.555 -20.913 25.204 1.00 12.14 H new ATOM 0 HG13 ILE A 118 22.371 -20.022 26.701 1.00 12.14 H new ATOM 0 HG21 ILE A 118 20.532 -18.412 26.998 1.00 53.34 H new ATOM 0 HG22 ILE A 118 19.301 -18.203 25.730 1.00 53.34 H new ATOM 0 HG23 ILE A 118 19.323 -19.686 26.713 1.00 53.34 H new ATOM 0 HD11 ILE A 118 21.854 -22.392 27.023 1.00 4.53 H new ATOM 0 HD12 ILE A 118 20.405 -21.394 27.293 1.00 4.53 H new ATOM 0 HD13 ILE A 118 20.592 -22.300 25.772 1.00 4.53 H new ATOM 1699 N LEU A 119 19.484 -18.874 22.277 1.00 0.13 N ATOM 1700 CA LEU A 119 18.672 -17.920 21.529 1.00 64.42 C ATOM 1701 C LEU A 119 17.739 -18.641 20.562 1.00 75.21 C ATOM 1702 O LEU A 119 17.409 -18.120 19.496 1.00 64.00 O ATOM 1703 CB LEU A 119 19.570 -16.949 20.760 1.00 21.22 C ATOM 1704 CG LEU A 119 20.010 -15.697 21.520 1.00 22.42 C ATOM 1705 CD1 LEU A 119 21.504 -15.467 21.349 1.00 14.33 C ATOM 1706 CD2 LEU A 119 19.224 -14.483 21.049 1.00 74.15 C ATOM 0 H LEU A 119 20.340 -19.162 21.803 1.00 0.13 H new ATOM 0 HA LEU A 119 18.066 -17.359 22.241 1.00 64.42 H new ATOM 0 HB2 LEU A 119 20.462 -17.487 20.439 1.00 21.22 H new ATOM 0 HB3 LEU A 119 19.044 -16.636 19.858 1.00 21.22 H new ATOM 0 HG LEU A 119 19.805 -15.848 22.580 1.00 22.42 H new ATOM 0 HD11 LEU A 119 21.799 -14.572 21.897 1.00 14.33 H new ATOM 0 HD12 LEU A 119 22.051 -16.326 21.736 1.00 14.33 H new ATOM 0 HD13 LEU A 119 21.733 -15.338 20.291 1.00 14.33 H new ATOM 0 HD21 LEU A 119 19.551 -13.602 21.601 1.00 74.15 H new ATOM 0 HD22 LEU A 119 19.396 -14.329 19.984 1.00 74.15 H new ATOM 0 HD23 LEU A 119 18.161 -14.647 21.224 1.00 74.15 H new ATOM 1718 N TYR A 120 17.314 -19.841 20.942 1.00 55.12 N ATOM 1719 CA TYR A 120 16.417 -20.634 20.108 1.00 4.44 C ATOM 1720 C TYR A 120 15.279 -19.776 19.564 1.00 31.31 C ATOM 1721 O TYR A 120 14.844 -19.952 18.427 1.00 52.01 O ATOM 1722 CB TYR A 120 15.849 -21.808 20.907 1.00 4.12 C ATOM 1723 CG TYR A 120 15.857 -21.583 22.402 1.00 24.35 C ATOM 1724 CD1 TYR A 120 14.993 -20.670 22.992 1.00 12.34 C ATOM 1725 CD2 TYR A 120 16.729 -22.286 23.225 1.00 1.15 C ATOM 1726 CE1 TYR A 120 14.997 -20.461 24.358 1.00 43.11 C ATOM 1727 CE2 TYR A 120 16.740 -22.085 24.592 1.00 14.32 C ATOM 1728 CZ TYR A 120 15.872 -21.171 25.154 1.00 42.25 C ATOM 1729 OH TYR A 120 15.879 -20.967 26.514 1.00 12.24 O ATOM 0 H TYR A 120 17.576 -20.286 21.822 1.00 55.12 H new ATOM 0 HA TYR A 120 16.991 -21.020 19.266 1.00 4.44 H new ATOM 0 HB2 TYR A 120 14.826 -21.997 20.582 1.00 4.12 H new ATOM 0 HB3 TYR A 120 16.426 -22.704 20.680 1.00 4.12 H new ATOM 0 HD1 TYR A 120 14.306 -20.113 22.372 1.00 12.34 H new ATOM 0 HD2 TYR A 120 17.410 -23.002 22.788 1.00 1.15 H new ATOM 0 HE1 TYR A 120 14.319 -19.746 24.800 1.00 43.11 H new ATOM 0 HE2 TYR A 120 17.424 -22.640 25.217 1.00 14.32 H new ATOM 0 HH TYR A 120 16.553 -21.546 26.928 1.00 12.24 H new ATOM 1739 N ASN A 121 14.802 -18.847 20.386 1.00 75.12 N ATOM 1740 CA ASN A 121 13.713 -17.961 19.988 1.00 25.12 C ATOM 1741 C ASN A 121 13.430 -16.927 21.073 1.00 33.05 C ATOM 1742 O ASN A 121 13.077 -15.784 20.781 1.00 1.23 O ATOM 1743 CB ASN A 121 12.449 -18.771 19.697 1.00 73.41 C ATOM 1744 CG ASN A 121 11.609 -18.999 20.939 1.00 52.41 C ATOM 1745 OD1 ASN A 121 10.661 -18.259 21.205 1.00 70.24 O ATOM 1746 ND2 ASN A 121 11.954 -20.026 21.707 1.00 42.52 N ATOM 0 H ASN A 121 15.152 -18.688 21.331 1.00 75.12 H new ATOM 0 HA ASN A 121 14.017 -17.437 19.082 1.00 25.12 H new ATOM 0 HB2 ASN A 121 11.852 -18.251 18.948 1.00 73.41 H new ATOM 0 HB3 ASN A 121 12.728 -19.734 19.269 1.00 73.41 H new ATOM 0 HD21 ASN A 121 11.426 -20.228 22.556 1.00 42.52 H new ATOM 0 HD22 ASN A 121 12.747 -20.613 21.448 1.00 42.52 H new ATOM 1753 N THR A 122 13.587 -17.336 22.329 1.00 75.23 N ATOM 1754 CA THR A 122 13.347 -16.447 23.458 1.00 0.31 C ATOM 1755 C THR A 122 14.051 -15.109 23.263 1.00 55.52 C ATOM 1756 O THR A 122 14.932 -14.976 22.413 1.00 74.14 O ATOM 1757 CB THR A 122 13.824 -17.077 24.780 1.00 2.43 C ATOM 1758 OG1 THR A 122 13.488 -16.223 25.879 1.00 14.53 O ATOM 1759 CG2 THR A 122 15.327 -17.312 24.756 1.00 31.12 C ATOM 0 H THR A 122 13.880 -18.278 22.589 1.00 75.23 H new ATOM 0 HA THR A 122 12.270 -16.284 23.509 1.00 0.31 H new ATOM 0 HB THR A 122 13.323 -18.038 24.900 1.00 2.43 H new ATOM 0 HG1 THR A 122 13.793 -16.632 26.716 1.00 14.53 H new ATOM 0 HG21 THR A 122 15.641 -17.757 25.700 1.00 31.12 H new ATOM 0 HG22 THR A 122 15.577 -17.985 23.936 1.00 31.12 H new ATOM 0 HG23 THR A 122 15.842 -16.362 24.615 1.00 31.12 H new ATOM 1767 N THR A 123 13.657 -14.117 24.056 1.00 0.11 N ATOM 1768 CA THR A 123 14.250 -12.788 23.970 1.00 33.21 C ATOM 1769 C THR A 123 15.471 -12.671 24.875 1.00 62.44 C ATOM 1770 O THR A 123 15.360 -12.281 26.037 1.00 23.21 O ATOM 1771 CB THR A 123 13.235 -11.695 24.353 1.00 11.52 C ATOM 1772 OG1 THR A 123 12.340 -12.186 25.357 1.00 70.51 O ATOM 1773 CG2 THR A 123 12.441 -11.243 23.137 1.00 44.55 C ATOM 0 H THR A 123 12.930 -14.209 24.765 1.00 0.11 H new ATOM 0 HA THR A 123 14.555 -12.644 22.933 1.00 33.21 H new ATOM 0 HB THR A 123 13.787 -10.841 24.745 1.00 11.52 H new ATOM 0 HG1 THR A 123 11.699 -11.484 25.596 1.00 70.51 H new ATOM 0 HG21 THR A 123 11.731 -10.471 23.433 1.00 44.55 H new ATOM 0 HG22 THR A 123 13.122 -10.842 22.387 1.00 44.55 H new ATOM 0 HG23 THR A 123 11.900 -12.092 22.719 1.00 44.55 H new ATOM 1781 N PHE A 124 16.637 -13.011 24.334 1.00 34.31 N ATOM 1782 CA PHE A 124 17.880 -12.945 25.093 1.00 11.43 C ATOM 1783 C PHE A 124 18.834 -11.920 24.486 1.00 71.44 C ATOM 1784 O PHE A 124 19.419 -11.102 25.196 1.00 75.02 O ATOM 1785 CB PHE A 124 18.550 -14.319 25.137 1.00 70.52 C ATOM 1786 CG PHE A 124 18.796 -14.823 26.531 1.00 52.45 C ATOM 1787 CD1 PHE A 124 17.777 -14.826 27.470 1.00 42.02 C ATOM 1788 CD2 PHE A 124 20.046 -15.292 26.902 1.00 54.35 C ATOM 1789 CE1 PHE A 124 18.000 -15.289 28.753 1.00 11.31 C ATOM 1790 CE2 PHE A 124 20.274 -15.756 28.183 1.00 21.01 C ATOM 1791 CZ PHE A 124 19.250 -15.753 29.110 1.00 24.34 C ATOM 0 H PHE A 124 16.746 -13.335 23.373 1.00 34.31 H new ATOM 0 HA PHE A 124 17.639 -12.634 26.110 1.00 11.43 H new ATOM 0 HB2 PHE A 124 17.925 -15.036 24.605 1.00 70.52 H new ATOM 0 HB3 PHE A 124 19.500 -14.268 24.605 1.00 70.52 H new ATOM 0 HD1 PHE A 124 16.798 -14.462 27.196 1.00 42.02 H new ATOM 0 HD2 PHE A 124 20.851 -15.295 26.182 1.00 54.35 H new ATOM 0 HE1 PHE A 124 17.197 -15.288 29.475 1.00 11.31 H new ATOM 0 HE2 PHE A 124 21.252 -16.121 28.459 1.00 21.01 H new ATOM 0 HZ PHE A 124 19.427 -16.113 30.113 1.00 24.34 H new ATOM 1801 N PHE A 125 18.987 -11.973 23.167 1.00 54.34 N ATOM 1802 CA PHE A 125 19.871 -11.051 22.462 1.00 34.22 C ATOM 1803 C PHE A 125 19.387 -10.818 21.034 1.00 14.11 C ATOM 1804 O PHE A 125 20.050 -11.176 20.061 1.00 74.24 O ATOM 1805 CB PHE A 125 21.301 -11.595 22.446 1.00 74.34 C ATOM 1806 CG PHE A 125 21.858 -11.858 23.815 1.00 2.43 C ATOM 1807 CD1 PHE A 125 22.241 -10.808 24.635 1.00 42.25 C ATOM 1808 CD2 PHE A 125 21.999 -13.154 24.284 1.00 52.20 C ATOM 1809 CE1 PHE A 125 22.755 -11.047 25.895 1.00 2.40 C ATOM 1810 CE2 PHE A 125 22.512 -13.399 25.544 1.00 52.21 C ATOM 1811 CZ PHE A 125 22.890 -12.344 26.351 1.00 54.52 C ATOM 0 H PHE A 125 18.511 -12.644 22.565 1.00 54.34 H new ATOM 0 HA PHE A 125 19.858 -10.098 22.991 1.00 34.22 H new ATOM 0 HB2 PHE A 125 21.323 -12.520 21.870 1.00 74.34 H new ATOM 0 HB3 PHE A 125 21.946 -10.883 21.931 1.00 74.34 H new ATOM 0 HD1 PHE A 125 22.136 -9.792 24.285 1.00 42.25 H new ATOM 0 HD2 PHE A 125 21.705 -13.983 23.658 1.00 52.20 H new ATOM 0 HE1 PHE A 125 23.051 -10.220 26.523 1.00 2.40 H new ATOM 0 HE2 PHE A 125 22.617 -14.414 25.897 1.00 52.21 H new ATOM 0 HZ PHE A 125 23.290 -12.532 27.336 1.00 54.52 H new ATOM 1821 N PRO A 126 18.202 -10.203 20.905 1.00 54.24 N ATOM 1822 CA PRO A 126 17.601 -9.907 19.600 1.00 24.52 C ATOM 1823 C PRO A 126 18.359 -8.820 18.847 1.00 51.45 C ATOM 1824 O PRO A 126 18.715 -8.990 17.680 1.00 32.43 O ATOM 1825 CB PRO A 126 16.193 -9.428 19.958 1.00 14.25 C ATOM 1826 CG PRO A 126 16.313 -8.901 21.347 1.00 64.22 C ATOM 1827 CD PRO A 126 17.357 -9.748 22.022 1.00 52.14 C ATOM 0 HA PRO A 126 17.615 -10.773 18.939 1.00 24.52 H new ATOM 0 HB2 PRO A 126 15.851 -8.655 19.270 1.00 14.25 H new ATOM 0 HB3 PRO A 126 15.472 -10.244 19.905 1.00 14.25 H new ATOM 0 HG2 PRO A 126 16.606 -7.851 21.342 1.00 64.22 H new ATOM 0 HG3 PRO A 126 15.360 -8.964 21.872 1.00 64.22 H new ATOM 0 HD2 PRO A 126 17.929 -9.175 22.751 1.00 52.14 H new ATOM 0 HD3 PRO A 126 16.910 -10.587 22.556 1.00 52.14 H new ATOM 1835 N LYS A 127 18.603 -7.700 19.520 1.00 61.43 N ATOM 1836 CA LYS A 127 19.320 -6.584 18.915 1.00 62.21 C ATOM 1837 C LYS A 127 20.694 -7.025 18.418 1.00 14.25 C ATOM 1838 O LYS A 127 21.156 -6.582 17.367 1.00 40.11 O ATOM 1839 CB LYS A 127 19.473 -5.443 19.923 1.00 55.10 C ATOM 1840 CG LYS A 127 19.981 -5.895 21.281 1.00 15.32 C ATOM 1841 CD LYS A 127 21.310 -5.244 21.624 1.00 10.31 C ATOM 1842 CE LYS A 127 22.413 -6.279 21.784 1.00 34.14 C ATOM 1843 NZ LYS A 127 23.341 -5.933 22.896 1.00 32.34 N ATOM 0 H LYS A 127 18.314 -7.541 20.485 1.00 61.43 H new ATOM 0 HA LYS A 127 18.740 -6.232 18.062 1.00 62.21 H new ATOM 0 HB2 LYS A 127 20.159 -4.700 19.517 1.00 55.10 H new ATOM 0 HB3 LYS A 127 18.509 -4.950 20.051 1.00 55.10 H new ATOM 0 HG2 LYS A 127 19.245 -5.648 22.046 1.00 15.32 H new ATOM 0 HG3 LYS A 127 20.094 -6.979 21.286 1.00 15.32 H new ATOM 0 HD2 LYS A 127 21.583 -4.538 20.840 1.00 10.31 H new ATOM 0 HD3 LYS A 127 21.209 -4.673 22.547 1.00 10.31 H new ATOM 0 HE2 LYS A 127 21.969 -7.257 21.972 1.00 34.14 H new ATOM 0 HE3 LYS A 127 22.975 -6.358 20.853 1.00 34.14 H new ATOM 0 HZ1 LYS A 127 24.324 -6.004 22.563 1.00 32.34 H new ATOM 0 HZ2 LYS A 127 23.153 -4.961 23.215 1.00 32.34 H new ATOM 0 HZ3 LYS A 127 23.195 -6.592 23.688 1.00 32.34 H new ATOM 1857 N PHE A 128 21.341 -7.900 19.181 1.00 75.11 N ATOM 1858 CA PHE A 128 22.661 -8.401 18.818 1.00 41.02 C ATOM 1859 C PHE A 128 22.617 -9.131 17.479 1.00 54.25 C ATOM 1860 O PHE A 128 23.518 -8.989 16.651 1.00 54.33 O ATOM 1861 CB PHE A 128 23.191 -9.338 19.905 1.00 71.41 C ATOM 1862 CG PHE A 128 24.023 -10.468 19.369 1.00 61.01 C ATOM 1863 CD1 PHE A 128 25.171 -10.213 18.635 1.00 33.14 C ATOM 1864 CD2 PHE A 128 23.658 -11.785 19.599 1.00 3.30 C ATOM 1865 CE1 PHE A 128 25.938 -11.251 18.140 1.00 13.24 C ATOM 1866 CE2 PHE A 128 24.422 -12.827 19.107 1.00 53.41 C ATOM 1867 CZ PHE A 128 25.564 -12.559 18.377 1.00 35.15 C ATOM 0 H PHE A 128 20.972 -8.277 20.054 1.00 75.11 H new ATOM 0 HA PHE A 128 23.332 -7.547 18.724 1.00 41.02 H new ATOM 0 HB2 PHE A 128 23.788 -8.761 20.611 1.00 71.41 H new ATOM 0 HB3 PHE A 128 22.349 -9.750 20.461 1.00 71.41 H new ATOM 0 HD1 PHE A 128 25.469 -9.192 18.448 1.00 33.14 H new ATOM 0 HD2 PHE A 128 22.766 -12.000 20.169 1.00 3.30 H new ATOM 0 HE1 PHE A 128 26.829 -11.039 17.568 1.00 13.24 H new ATOM 0 HE2 PHE A 128 24.127 -13.849 19.293 1.00 53.41 H new ATOM 0 HZ PHE A 128 26.163 -13.371 17.992 1.00 35.15 H new ATOM 1877 N LEU A 129 21.563 -9.913 17.273 1.00 53.34 N ATOM 1878 CA LEU A 129 21.399 -10.666 16.034 1.00 24.32 C ATOM 1879 C LEU A 129 20.050 -10.368 15.389 1.00 34.44 C ATOM 1880 O LEU A 129 19.107 -11.152 15.508 1.00 3.34 O ATOM 1881 CB LEU A 129 21.528 -12.166 16.306 1.00 34.21 C ATOM 1882 CG LEU A 129 21.069 -12.640 17.686 1.00 52.13 C ATOM 1883 CD1 LEU A 129 19.552 -12.739 17.739 1.00 62.53 C ATOM 1884 CD2 LEU A 129 21.705 -13.979 18.029 1.00 43.22 C ATOM 0 H LEU A 129 20.809 -10.042 17.948 1.00 53.34 H new ATOM 0 HA LEU A 129 22.185 -10.359 15.344 1.00 24.32 H new ATOM 0 HB2 LEU A 129 20.954 -12.703 15.550 1.00 34.21 H new ATOM 0 HB3 LEU A 129 22.572 -12.450 16.175 1.00 34.21 H new ATOM 0 HG LEU A 129 21.391 -11.907 18.426 1.00 52.13 H new ATOM 0 HD11 LEU A 129 19.244 -13.078 18.728 1.00 62.53 H new ATOM 0 HD12 LEU A 129 19.116 -11.760 17.538 1.00 62.53 H new ATOM 0 HD13 LEU A 129 19.207 -13.450 16.988 1.00 62.53 H new ATOM 0 HD21 LEU A 129 21.367 -14.301 19.014 1.00 43.22 H new ATOM 0 HD22 LEU A 129 21.414 -14.721 17.285 1.00 43.22 H new ATOM 0 HD23 LEU A 129 22.790 -13.876 18.033 1.00 43.22 H new ATOM 1896 N ARG A 130 19.964 -9.232 14.705 1.00 65.52 N ATOM 1897 CA ARG A 130 18.730 -8.832 14.040 1.00 4.30 C ATOM 1898 C ARG A 130 18.392 -9.788 12.900 1.00 50.53 C ATOM 1899 O ARG A 130 18.749 -9.546 11.746 1.00 31.02 O ATOM 1900 CB ARG A 130 18.855 -7.405 13.503 1.00 4.44 C ATOM 1901 CG ARG A 130 17.617 -6.555 13.739 1.00 43.22 C ATOM 1902 CD ARG A 130 17.814 -5.594 14.901 1.00 51.11 C ATOM 1903 NE ARG A 130 16.804 -5.778 15.940 1.00 5.01 N ATOM 1904 CZ ARG A 130 15.523 -5.463 15.784 1.00 24.52 C ATOM 1905 NH1 ARG A 130 15.098 -4.952 14.637 1.00 34.43 N ATOM 1906 NH2 ARG A 130 14.665 -5.661 16.777 1.00 40.53 N ATOM 0 H ARG A 130 20.734 -8.572 14.597 1.00 65.52 H new ATOM 0 HA ARG A 130 17.924 -8.868 14.773 1.00 4.30 H new ATOM 0 HB2 ARG A 130 19.712 -6.923 13.973 1.00 4.44 H new ATOM 0 HB3 ARG A 130 19.059 -7.445 12.433 1.00 4.44 H new ATOM 0 HG2 ARG A 130 17.383 -5.992 12.835 1.00 43.22 H new ATOM 0 HG3 ARG A 130 16.763 -7.202 13.941 1.00 43.22 H new ATOM 0 HD2 ARG A 130 18.806 -5.741 15.329 1.00 51.11 H new ATOM 0 HD3 ARG A 130 17.774 -4.568 14.534 1.00 51.11 H new ATOM 0 HE ARG A 130 17.099 -6.170 16.834 1.00 5.01 H new ATOM 0 HH11 ARG A 130 15.755 -4.800 13.872 1.00 34.43 H new ATOM 0 HH12 ARG A 130 14.114 -4.711 14.520 1.00 34.43 H new ATOM 0 HH21 ARG A 130 14.989 -6.055 17.660 1.00 40.53 H new ATOM 0 HH22 ARG A 130 13.681 -5.419 16.657 1.00 40.53 H new ATOM 1920 N CYS A 131 17.702 -10.874 13.230 1.00 12.23 N ATOM 1921 CA CYS A 131 17.316 -11.867 12.236 1.00 75.14 C ATOM 1922 C CYS A 131 16.068 -12.625 12.680 1.00 71.22 C ATOM 1923 O CYS A 131 15.910 -12.946 13.857 1.00 4.20 O ATOM 1924 CB CYS A 131 18.463 -12.849 11.993 1.00 61.42 C ATOM 1925 SG CYS A 131 18.019 -14.265 10.936 1.00 31.32 S ATOM 0 H CYS A 131 17.398 -11.089 14.180 1.00 12.23 H new ATOM 0 HA CYS A 131 17.091 -11.345 11.306 1.00 75.14 H new ATOM 0 HB2 CYS A 131 19.294 -12.314 11.534 1.00 61.42 H new ATOM 0 HB3 CYS A 131 18.816 -13.223 12.954 1.00 61.42 H new ATOM 1930 N ASN A 132 15.184 -12.909 11.728 1.00 2.53 N ATOM 1931 CA ASN A 132 13.950 -13.629 12.021 1.00 3.31 C ATOM 1932 C ASN A 132 14.185 -15.136 12.013 1.00 61.12 C ATOM 1933 O ASN A 132 14.740 -15.682 11.060 1.00 61.01 O ATOM 1934 CB ASN A 132 12.869 -13.264 11.002 1.00 35.24 C ATOM 1935 CG ASN A 132 13.181 -13.789 9.614 1.00 2.13 C ATOM 1936 OD1 ASN A 132 12.956 -14.962 9.317 1.00 60.12 O ATOM 1937 ND2 ASN A 132 13.703 -12.919 8.757 1.00 24.41 N ATOM 0 H ASN A 132 15.300 -12.652 10.748 1.00 2.53 H new ATOM 0 HA ASN A 132 13.615 -13.337 13.016 1.00 3.31 H new ATOM 0 HB2 ASN A 132 11.911 -13.666 11.333 1.00 35.24 H new ATOM 0 HB3 ASN A 132 12.763 -12.180 10.962 1.00 35.24 H new ATOM 0 HD21 ASN A 132 13.935 -13.214 7.808 1.00 24.41 H new ATOM 0 HD22 ASN A 132 13.872 -11.956 9.047 1.00 24.41 H new ATOM 1944 N GLU A 133 13.758 -15.802 13.081 1.00 30.12 N ATOM 1945 CA GLU A 133 13.922 -17.246 13.196 1.00 23.43 C ATOM 1946 C GLU A 133 12.598 -17.918 13.546 1.00 33.51 C ATOM 1947 O GLU A 133 12.291 -19.006 13.057 1.00 61.24 O ATOM 1948 CB GLU A 133 14.972 -17.580 14.258 1.00 0.45 C ATOM 1949 CG GLU A 133 15.028 -19.055 14.618 1.00 54.14 C ATOM 1950 CD GLU A 133 14.915 -19.956 13.403 1.00 53.41 C ATOM 1951 OE1 GLU A 133 15.451 -19.584 12.338 1.00 61.31 O ATOM 1952 OE2 GLU A 133 14.290 -21.031 13.517 1.00 43.11 O ATOM 0 H GLU A 133 13.296 -15.365 13.878 1.00 30.12 H new ATOM 0 HA GLU A 133 14.258 -17.625 12.231 1.00 23.43 H new ATOM 0 HB2 GLU A 133 15.952 -17.265 13.899 1.00 0.45 H new ATOM 0 HB3 GLU A 133 14.762 -17.003 15.158 1.00 0.45 H new ATOM 0 HG2 GLU A 133 15.965 -19.264 15.135 1.00 54.14 H new ATOM 0 HG3 GLU A 133 14.221 -19.286 15.314 1.00 54.14 H new ATOM 1959 N THR A 134 11.815 -17.263 14.398 1.00 60.21 N ATOM 1960 CA THR A 134 10.525 -17.797 14.816 1.00 54.55 C ATOM 1961 C THR A 134 9.677 -18.191 13.611 1.00 10.15 C ATOM 1962 O THR A 134 9.101 -19.279 13.574 1.00 22.23 O ATOM 1963 CB THR A 134 9.744 -16.777 15.667 1.00 62.14 C ATOM 1964 OG1 THR A 134 10.180 -15.448 15.361 1.00 41.22 O ATOM 1965 CG2 THR A 134 9.937 -17.051 17.151 1.00 41.34 C ATOM 0 H THR A 134 12.052 -16.361 14.812 1.00 60.21 H new ATOM 0 HA THR A 134 10.729 -18.682 15.419 1.00 54.55 H new ATOM 0 HB THR A 134 8.684 -16.874 15.430 1.00 62.14 H new ATOM 0 HG1 THR A 134 9.678 -14.806 15.905 1.00 41.22 H new ATOM 0 HG21 THR A 134 9.377 -16.319 17.732 1.00 41.34 H new ATOM 0 HG22 THR A 134 9.577 -18.053 17.386 1.00 41.34 H new ATOM 0 HG23 THR A 134 10.996 -16.978 17.400 1.00 41.34 H new ATOM 1973 N LEU A 135 9.605 -17.301 12.628 1.00 55.10 N ATOM 1974 CA LEU A 135 8.827 -17.557 11.420 1.00 0.44 C ATOM 1975 C LEU A 135 9.498 -18.619 10.556 1.00 74.41 C ATOM 1976 O LEU A 135 10.469 -19.251 10.972 1.00 30.11 O ATOM 1977 CB LEU A 135 8.654 -16.265 10.619 1.00 71.44 C ATOM 1978 CG LEU A 135 9.942 -15.596 10.138 1.00 71.11 C ATOM 1979 CD1 LEU A 135 10.376 -16.173 8.800 1.00 61.44 C ATOM 1980 CD2 LEU A 135 9.754 -14.090 10.035 1.00 13.51 C ATOM 0 H LEU A 135 10.075 -16.396 12.643 1.00 55.10 H new ATOM 0 HA LEU A 135 7.846 -17.926 11.719 1.00 0.44 H new ATOM 0 HB2 LEU A 135 8.034 -16.481 9.749 1.00 71.44 H new ATOM 0 HB3 LEU A 135 8.105 -15.551 11.233 1.00 71.44 H new ATOM 0 HG LEU A 135 10.727 -15.795 10.868 1.00 71.11 H new ATOM 0 HD11 LEU A 135 11.294 -15.685 8.474 1.00 61.44 H new ATOM 0 HD12 LEU A 135 10.552 -17.244 8.905 1.00 61.44 H new ATOM 0 HD13 LEU A 135 9.593 -16.005 8.060 1.00 61.44 H new ATOM 0 HD21 LEU A 135 10.681 -13.630 9.691 1.00 13.51 H new ATOM 0 HD22 LEU A 135 8.955 -13.871 9.326 1.00 13.51 H new ATOM 0 HD23 LEU A 135 9.491 -13.688 11.014 1.00 13.51 H new ATOM 1992 N PHE A 136 8.974 -18.810 9.350 1.00 71.35 N ATOM 1993 CA PHE A 136 9.523 -19.796 8.425 1.00 15.22 C ATOM 1994 C PHE A 136 10.259 -19.113 7.276 1.00 30.03 C ATOM 1995 O PHE A 136 9.681 -18.796 6.236 1.00 23.42 O ATOM 1996 CB PHE A 136 8.407 -20.685 7.873 1.00 34.44 C ATOM 1997 CG PHE A 136 8.377 -22.057 8.484 1.00 72.51 C ATOM 1998 CD1 PHE A 136 8.231 -22.218 9.852 1.00 21.33 C ATOM 1999 CD2 PHE A 136 8.495 -23.186 7.689 1.00 31.31 C ATOM 2000 CE1 PHE A 136 8.203 -23.480 10.417 1.00 12.52 C ATOM 2001 CE2 PHE A 136 8.467 -24.450 8.248 1.00 11.13 C ATOM 2002 CZ PHE A 136 8.322 -24.597 9.614 1.00 10.31 C ATOM 0 H PHE A 136 8.170 -18.296 8.990 1.00 71.35 H new ATOM 0 HA PHE A 136 10.234 -20.415 8.972 1.00 15.22 H new ATOM 0 HB2 PHE A 136 7.447 -20.198 8.045 1.00 34.44 H new ATOM 0 HB3 PHE A 136 8.528 -20.779 6.794 1.00 34.44 H new ATOM 0 HD1 PHE A 136 8.138 -21.348 10.485 1.00 21.33 H new ATOM 0 HD2 PHE A 136 8.610 -23.077 6.621 1.00 31.31 H new ATOM 0 HE1 PHE A 136 8.088 -23.592 11.485 1.00 12.52 H new ATOM 0 HE2 PHE A 136 8.558 -25.322 7.617 1.00 11.13 H new ATOM 0 HZ PHE A 136 8.302 -25.584 10.053 1.00 10.31 H new ATOM 2012 N PRO A 137 11.566 -18.880 7.468 1.00 51.44 N ATOM 2013 CA PRO A 137 12.410 -18.232 6.459 1.00 23.23 C ATOM 2014 C PRO A 137 12.647 -19.122 5.244 1.00 51.35 C ATOM 2015 O PRO A 137 12.498 -18.684 4.102 1.00 20.20 O ATOM 2016 CB PRO A 137 13.724 -17.983 7.204 1.00 64.52 C ATOM 2017 CG PRO A 137 13.752 -19.015 8.278 1.00 22.12 C ATOM 2018 CD PRO A 137 12.320 -19.230 8.683 1.00 60.32 C ATOM 0 HA PRO A 137 11.950 -17.327 6.063 1.00 23.23 H new ATOM 0 HB2 PRO A 137 14.581 -18.081 6.538 1.00 64.52 H new ATOM 0 HB3 PRO A 137 13.758 -16.977 7.621 1.00 64.52 H new ATOM 0 HG2 PRO A 137 14.199 -19.941 7.917 1.00 22.12 H new ATOM 0 HG3 PRO A 137 14.351 -18.681 9.125 1.00 22.12 H new ATOM 0 HD2 PRO A 137 12.138 -20.261 8.986 1.00 60.32 H new ATOM 0 HD3 PRO A 137 12.041 -18.597 9.525 1.00 60.32 H new ATOM 2026 N THR A 138 13.016 -20.374 5.495 1.00 42.11 N ATOM 2027 CA THR A 138 13.274 -21.325 4.421 1.00 1.11 C ATOM 2028 C THR A 138 12.126 -21.347 3.419 1.00 50.24 C ATOM 2029 O THR A 138 12.284 -20.936 2.269 1.00 71.44 O ATOM 2030 CB THR A 138 13.488 -22.748 4.970 1.00 2.03 C ATOM 2031 OG1 THR A 138 13.395 -22.741 6.399 1.00 1.22 O ATOM 2032 CG2 THR A 138 14.844 -23.293 4.548 1.00 4.42 C ATOM 0 H THR A 138 13.143 -20.753 6.433 1.00 42.11 H new ATOM 0 HA THR A 138 14.184 -20.996 3.920 1.00 1.11 H new ATOM 0 HB THR A 138 12.711 -23.393 4.559 1.00 2.03 H new ATOM 0 HG1 THR A 138 14.204 -22.337 6.777 1.00 1.22 H new ATOM 0 HG21 THR A 138 14.972 -24.299 4.948 1.00 4.42 H new ATOM 0 HG22 THR A 138 14.901 -23.325 3.460 1.00 4.42 H new ATOM 0 HG23 THR A 138 15.632 -22.646 4.934 1.00 4.42 H new ATOM 2040 N LYS A 139 10.969 -21.828 3.861 1.00 2.23 N ATOM 2041 CA LYS A 139 9.792 -21.902 3.004 1.00 43.32 C ATOM 2042 C LYS A 139 8.576 -22.383 3.789 1.00 63.01 C ATOM 2043 O LYS A 139 7.542 -21.716 3.821 1.00 2.43 O ATOM 2044 CB LYS A 139 10.054 -22.840 1.823 1.00 2.51 C ATOM 2045 CG LYS A 139 10.404 -24.258 2.239 1.00 53.10 C ATOM 2046 CD LYS A 139 10.022 -25.264 1.166 1.00 43.33 C ATOM 2047 CE LYS A 139 10.166 -26.693 1.665 1.00 31.21 C ATOM 2048 NZ LYS A 139 8.930 -27.490 1.430 1.00 50.25 N ATOM 0 H LYS A 139 10.821 -22.173 4.809 1.00 2.23 H new ATOM 0 HA LYS A 139 9.585 -20.901 2.626 1.00 43.32 H new ATOM 0 HB2 LYS A 139 9.170 -22.865 1.186 1.00 2.51 H new ATOM 0 HB3 LYS A 139 10.868 -22.435 1.222 1.00 2.51 H new ATOM 0 HG2 LYS A 139 11.473 -24.326 2.439 1.00 53.10 H new ATOM 0 HG3 LYS A 139 9.890 -24.503 3.168 1.00 53.10 H new ATOM 0 HD2 LYS A 139 8.993 -25.089 0.852 1.00 43.33 H new ATOM 0 HD3 LYS A 139 10.652 -25.119 0.289 1.00 43.33 H new ATOM 0 HE2 LYS A 139 11.007 -27.170 1.162 1.00 31.21 H new ATOM 0 HE3 LYS A 139 10.395 -26.684 2.731 1.00 31.21 H new ATOM 0 HZ1 LYS A 139 9.069 -28.458 1.784 1.00 50.25 H new ATOM 0 HZ2 LYS A 139 8.132 -27.049 1.931 1.00 50.25 H new ATOM 0 HZ3 LYS A 139 8.725 -27.520 0.411 1.00 50.25 H new TER 2062 LYS A 139