USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1169 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 93 TYR OH : rot 180:sc= -1.46 USER MOD Set 1.2: A 97 TYR OH : rot -166:sc= -0.678 USER MOD Set 2.1: A 48 ASN : amide:sc= -1.72! C(o=-6.2!,f=-9.9!) USER MOD Set 2.2: A 50 GLN : amide:sc= -1.91! C(o=-6.2!,f=-10!) USER MOD Set 2.3: A 57 CYS SG : rot -124:sc= -2.58! USER MOD Set 3.1: A 37 CYS SG : rot 15:sc= 0.471 USER MOD Set 3.2: A 41 GLN :FLIP amide:sc= -1.05! C(o=-4.9!,f=-0.58!) USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0849 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -158:sc= -0.0689 (180deg=-0.384) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 HIS :FLIP no HD1:sc= -0.549 F(o=-2!,f=-0.55) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -71:sc= -0.188 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 1.1 K(o=1.1,f=-0.22) USER MOD Single : A 40 MET CE :methyl -166:sc= 0 (180deg=-0.0421) USER MOD Single : A 42 ASN : amide:sc= -2.31 X(o=-2.3,f=-2.6) USER MOD Single : A 43 LYS NZ :NH3+ -174:sc= 0.104 (180deg=0.0977) USER MOD Single : A 46 MET CE :methyl -172:sc= 0 (180deg=-0.124) USER MOD Single : A 51 ASN :FLIP amide:sc= -4.47! C(o=-6.8!,f=-4.5!) USER MOD Single : A 53 GLN : amide:sc= -1.08 K(o=-1.1,f=-5.7!) USER MOD Single : A 58 GLN :FLIP amide:sc= -0.26 F(o=-0.85,f=-0.26) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -3.39! C(o=-3.4!,f=-3.8!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -1.56! C(o=-1.6!,f=-5.3!) USER MOD Single : A 71 LYS NZ :NH3+ -178:sc= -0.297 (180deg=-0.324) USER MOD Single : A 72 ASN : amide:sc=-0.00399 K(o=-0.004,f=-1.1) USER MOD Single : A 77 HIS :FLIP no HD1:sc= -0.825 F(o=-2.9!,f=-0.83) USER MOD Single : A 82 GLN : amide:sc= -2.86 K(o=-2.9,f=-7.2!) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= -0.93 X(o=-0.93,f=-1.1) USER MOD Single : A 87 SER OG : rot -64:sc= 1.2 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 98 LYS NZ :NH3+ 135:sc=-0.00967 (180deg=-0.785) USER MOD Single : A 104 TYR OH : rot 144:sc= 0.742 USER MOD Single : A 106 SER OG : rot -102:sc= 0.0873 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.0331 K(o=-0.033,f=-1.2) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 HIS :FLIP no HE2:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 SER OG : rot 180:sc= -0.124 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -3.68! C(o=-3.7!,f=-5.8!) USER MOD Single : A 132 THR OG1 : rot 107:sc= 1.28 USER MOD Single : A 138 HIS : no HD1:sc= -3.45 X(o=-3.4,f=-3.5) USER MOD Single : A 140 GLN : amide:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 180:sc= -0.0969 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 152 SER OG : rot 21:sc= 0.286 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.020 -12.105 18.019 1.00 0.00 N ATOM 2 CA GLY A 1 21.112 -12.407 17.113 1.00 0.00 C ATOM 3 C GLY A 1 20.935 -13.740 16.414 1.00 0.00 C ATOM 4 O GLY A 1 20.001 -14.485 16.711 1.00 0.00 O ATOM 0 H1 GLY A 1 19.515 -11.260 17.684 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.363 -12.911 18.052 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.398 -11.928 18.971 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.190 -11.617 16.367 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.050 -12.414 17.669 1.00 0.00 H new ATOM 8 N SER A 2 21.833 -14.042 15.482 1.00 0.00 N ATOM 9 CA SER A 2 21.768 -15.293 14.735 1.00 0.00 C ATOM 10 C SER A 2 23.156 -15.718 14.266 1.00 0.00 C ATOM 11 O SER A 2 24.010 -14.880 13.976 1.00 0.00 O ATOM 12 CB SER A 2 20.834 -15.145 13.532 1.00 0.00 C ATOM 13 OG SER A 2 20.590 -16.399 12.919 1.00 0.00 O ATOM 0 H SER A 2 22.614 -13.438 15.226 1.00 0.00 H new ATOM 0 HA SER A 2 21.376 -16.064 15.398 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.890 -14.703 13.852 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.276 -14.462 12.807 1.00 0.00 H new ATOM 0 HG SER A 2 19.989 -16.278 12.154 1.00 0.00 H new ATOM 19 N SER A 3 23.375 -17.027 14.195 1.00 0.00 N ATOM 20 CA SER A 3 24.660 -17.566 13.765 1.00 0.00 C ATOM 21 C SER A 3 24.488 -18.489 12.563 1.00 0.00 C ATOM 22 O SER A 3 23.398 -19.001 12.310 1.00 0.00 O ATOM 23 CB SER A 3 25.328 -18.325 14.913 1.00 0.00 C ATOM 24 OG SER A 3 25.619 -17.458 15.996 1.00 0.00 O ATOM 0 H SER A 3 22.679 -17.734 14.430 1.00 0.00 H new ATOM 0 HA SER A 3 25.296 -16.731 13.471 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.674 -19.128 15.252 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.247 -18.791 14.559 1.00 0.00 H new ATOM 0 HG SER A 3 26.044 -17.967 16.718 1.00 0.00 H new ATOM 30 N GLY A 4 25.573 -18.696 11.823 1.00 0.00 N ATOM 31 CA GLY A 4 25.522 -19.557 10.656 1.00 0.00 C ATOM 32 C GLY A 4 26.496 -20.715 10.747 1.00 0.00 C ATOM 33 O GLY A 4 26.093 -21.878 10.722 1.00 0.00 O ATOM 0 H GLY A 4 26.486 -18.283 12.011 1.00 0.00 H new ATOM 0 HA2 GLY A 4 24.510 -19.946 10.539 1.00 0.00 H new ATOM 0 HA3 GLY A 4 25.743 -18.969 9.765 1.00 0.00 H new ATOM 37 N SER A 5 27.783 -20.397 10.850 1.00 0.00 N ATOM 38 CA SER A 5 28.818 -21.420 10.938 1.00 0.00 C ATOM 39 C SER A 5 28.715 -22.400 9.774 1.00 0.00 C ATOM 40 O SER A 5 28.852 -23.610 9.952 1.00 0.00 O ATOM 41 CB SER A 5 28.708 -22.174 12.265 1.00 0.00 C ATOM 42 OG SER A 5 29.205 -21.393 13.338 1.00 0.00 O ATOM 0 H SER A 5 28.133 -19.439 10.875 1.00 0.00 H new ATOM 0 HA SER A 5 29.788 -20.925 10.888 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.667 -22.435 12.453 1.00 0.00 H new ATOM 0 HB3 SER A 5 29.265 -23.109 12.203 1.00 0.00 H new ATOM 0 HG SER A 5 29.122 -21.896 14.175 1.00 0.00 H new ATOM 48 N SER A 6 28.472 -21.867 8.580 1.00 0.00 N ATOM 49 CA SER A 6 28.346 -22.694 7.386 1.00 0.00 C ATOM 50 C SER A 6 29.195 -22.137 6.247 1.00 0.00 C ATOM 51 O SER A 6 29.790 -21.067 6.368 1.00 0.00 O ATOM 52 CB SER A 6 26.881 -22.779 6.950 1.00 0.00 C ATOM 53 OG SER A 6 26.446 -21.554 6.385 1.00 0.00 O ATOM 0 H SER A 6 28.359 -20.867 8.415 1.00 0.00 H new ATOM 0 HA SER A 6 28.704 -23.694 7.628 1.00 0.00 H new ATOM 0 HB2 SER A 6 26.761 -23.582 6.223 1.00 0.00 H new ATOM 0 HB3 SER A 6 26.257 -23.030 7.808 1.00 0.00 H new ATOM 0 HG SER A 6 25.508 -21.634 6.113 1.00 0.00 H new ATOM 59 N GLY A 7 29.246 -22.872 5.141 1.00 0.00 N ATOM 60 CA GLY A 7 30.025 -22.436 3.996 1.00 0.00 C ATOM 61 C GLY A 7 29.366 -22.791 2.678 1.00 0.00 C ATOM 62 O GLY A 7 29.917 -23.560 1.889 1.00 0.00 O ATOM 0 H GLY A 7 28.762 -23.761 5.017 1.00 0.00 H new ATOM 0 HA2 GLY A 7 30.169 -21.357 4.048 1.00 0.00 H new ATOM 0 HA3 GLY A 7 31.014 -22.892 4.039 1.00 0.00 H new ATOM 66 N ILE A 8 28.185 -22.233 2.439 1.00 0.00 N ATOM 67 CA ILE A 8 27.451 -22.496 1.208 1.00 0.00 C ATOM 68 C ILE A 8 26.852 -21.213 0.640 1.00 0.00 C ATOM 69 O ILE A 8 25.893 -20.669 1.187 1.00 0.00 O ATOM 70 CB ILE A 8 26.322 -23.520 1.432 1.00 0.00 C ATOM 71 CG1 ILE A 8 26.900 -24.848 1.926 1.00 0.00 C ATOM 72 CG2 ILE A 8 25.530 -23.725 0.150 1.00 0.00 C ATOM 73 CD1 ILE A 8 27.062 -24.916 3.428 1.00 0.00 C ATOM 0 H ILE A 8 27.715 -21.595 3.082 1.00 0.00 H new ATOM 0 HA ILE A 8 28.167 -22.907 0.496 1.00 0.00 H new ATOM 0 HB ILE A 8 25.646 -23.133 2.195 1.00 0.00 H new ATOM 0 HG12 ILE A 8 26.250 -25.661 1.602 1.00 0.00 H new ATOM 0 HG13 ILE A 8 27.870 -25.009 1.457 1.00 0.00 H new ATOM 0 HG21 ILE A 8 24.736 -24.451 0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 8 25.092 -22.777 -0.163 1.00 0.00 H new ATOM 0 HG23 ILE A 8 26.193 -24.094 -0.632 1.00 0.00 H new ATOM 0 HD11 ILE A 8 27.476 -25.885 3.706 1.00 0.00 H new ATOM 0 HD12 ILE A 8 27.736 -24.125 3.757 1.00 0.00 H new ATOM 0 HD13 ILE A 8 26.090 -24.787 3.905 1.00 0.00 H new ATOM 85 N ASP A 9 27.424 -20.737 -0.461 1.00 0.00 N ATOM 86 CA ASP A 9 26.945 -19.520 -1.105 1.00 0.00 C ATOM 87 C ASP A 9 26.742 -19.741 -2.601 1.00 0.00 C ATOM 88 O ASP A 9 27.535 -20.421 -3.253 1.00 0.00 O ATOM 89 CB ASP A 9 27.932 -18.374 -0.876 1.00 0.00 C ATOM 90 CG ASP A 9 27.401 -17.044 -1.375 1.00 0.00 C ATOM 91 OD1 ASP A 9 26.499 -16.482 -0.719 1.00 0.00 O ATOM 92 OD2 ASP A 9 27.887 -16.566 -2.421 1.00 0.00 O ATOM 0 H ASP A 9 28.219 -21.175 -0.925 1.00 0.00 H new ATOM 0 HA ASP A 9 25.985 -19.257 -0.661 1.00 0.00 H new ATOM 0 HB2 ASP A 9 28.154 -18.297 0.188 1.00 0.00 H new ATOM 0 HB3 ASP A 9 28.871 -18.600 -1.382 1.00 0.00 H new ATOM 97 N LYS A 10 25.674 -19.162 -3.140 1.00 0.00 N ATOM 98 CA LYS A 10 25.365 -19.295 -4.559 1.00 0.00 C ATOM 99 C LYS A 10 24.818 -17.987 -5.121 1.00 0.00 C ATOM 100 O LYS A 10 24.129 -17.240 -4.425 1.00 0.00 O ATOM 101 CB LYS A 10 24.352 -20.421 -4.778 1.00 0.00 C ATOM 102 CG LYS A 10 24.890 -21.799 -4.434 1.00 0.00 C ATOM 103 CD LYS A 10 24.124 -22.893 -5.158 1.00 0.00 C ATOM 104 CE LYS A 10 24.950 -24.164 -5.282 1.00 0.00 C ATOM 105 NZ LYS A 10 26.102 -23.988 -6.209 1.00 0.00 N ATOM 0 H LYS A 10 25.008 -18.596 -2.615 1.00 0.00 H new ATOM 0 HA LYS A 10 26.288 -19.538 -5.086 1.00 0.00 H new ATOM 0 HB2 LYS A 10 23.467 -20.225 -4.173 1.00 0.00 H new ATOM 0 HB3 LYS A 10 24.034 -20.414 -5.820 1.00 0.00 H new ATOM 0 HG2 LYS A 10 25.946 -21.855 -4.700 1.00 0.00 H new ATOM 0 HG3 LYS A 10 24.824 -21.958 -3.358 1.00 0.00 H new ATOM 0 HD2 LYS A 10 23.201 -23.109 -4.620 1.00 0.00 H new ATOM 0 HD3 LYS A 10 23.840 -22.544 -6.151 1.00 0.00 H new ATOM 0 HE2 LYS A 10 25.317 -24.456 -4.298 1.00 0.00 H new ATOM 0 HE3 LYS A 10 24.316 -24.976 -5.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 26.411 -24.917 -6.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 25.814 -23.394 -7.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 26.887 -23.530 -5.704 1.00 0.00 H new ATOM 119 N LYS A 11 25.126 -17.716 -6.385 1.00 0.00 N ATOM 120 CA LYS A 11 24.663 -16.500 -7.042 1.00 0.00 C ATOM 121 C LYS A 11 24.266 -16.781 -8.488 1.00 0.00 C ATOM 122 O LYS A 11 24.824 -17.669 -9.134 1.00 0.00 O ATOM 123 CB LYS A 11 25.753 -15.427 -7.000 1.00 0.00 C ATOM 124 CG LYS A 11 26.929 -15.718 -7.916 1.00 0.00 C ATOM 125 CD LYS A 11 28.185 -14.997 -7.457 1.00 0.00 C ATOM 126 CE LYS A 11 28.183 -13.540 -7.893 1.00 0.00 C ATOM 127 NZ LYS A 11 28.699 -13.375 -9.280 1.00 0.00 N ATOM 0 H LYS A 11 25.695 -18.323 -6.975 1.00 0.00 H new ATOM 0 HA LYS A 11 23.785 -16.138 -6.506 1.00 0.00 H new ATOM 0 HB2 LYS A 11 25.317 -14.467 -7.276 1.00 0.00 H new ATOM 0 HB3 LYS A 11 26.116 -15.329 -5.977 1.00 0.00 H new ATOM 0 HG2 LYS A 11 27.114 -16.792 -7.942 1.00 0.00 H new ATOM 0 HG3 LYS A 11 26.684 -15.412 -8.933 1.00 0.00 H new ATOM 0 HD2 LYS A 11 28.261 -15.053 -6.371 1.00 0.00 H new ATOM 0 HD3 LYS A 11 29.063 -15.498 -7.864 1.00 0.00 H new ATOM 0 HE2 LYS A 11 27.169 -13.145 -7.833 1.00 0.00 H new ATOM 0 HE3 LYS A 11 28.794 -12.955 -7.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 28.681 -12.368 -9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 29.676 -13.729 -9.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 28.101 -13.913 -9.939 1.00 0.00 H new ATOM 141 N LEU A 12 23.301 -16.018 -8.990 1.00 0.00 N ATOM 142 CA LEU A 12 22.831 -16.184 -10.361 1.00 0.00 C ATOM 143 C LEU A 12 22.014 -14.975 -10.806 1.00 0.00 C ATOM 144 O LEU A 12 21.491 -14.227 -9.980 1.00 0.00 O ATOM 145 CB LEU A 12 21.989 -17.455 -10.482 1.00 0.00 C ATOM 146 CG LEU A 12 20.524 -17.333 -10.064 1.00 0.00 C ATOM 147 CD1 LEU A 12 19.672 -16.861 -11.233 1.00 0.00 C ATOM 148 CD2 LEU A 12 20.009 -18.661 -9.528 1.00 0.00 C ATOM 0 H LEU A 12 22.829 -15.279 -8.469 1.00 0.00 H new ATOM 0 HA LEU A 12 23.702 -16.270 -11.010 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.023 -17.792 -11.518 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.454 -18.234 -9.878 1.00 0.00 H new ATOM 0 HG LEU A 12 20.454 -16.592 -9.268 1.00 0.00 H new ATOM 0 HD11 LEU A 12 18.632 -16.780 -10.916 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.025 -15.887 -11.571 1.00 0.00 H new ATOM 0 HD13 LEU A 12 19.747 -17.578 -12.051 1.00 0.00 H new ATOM 0 HD21 LEU A 12 18.964 -18.555 -9.235 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.093 -19.423 -10.303 1.00 0.00 H new ATOM 0 HD23 LEU A 12 20.600 -18.957 -8.662 1.00 0.00 H new ATOM 160 N THR A 13 21.906 -14.791 -12.119 1.00 0.00 N ATOM 161 CA THR A 13 21.152 -13.674 -12.674 1.00 0.00 C ATOM 162 C THR A 13 19.651 -13.906 -12.544 1.00 0.00 C ATOM 163 O THR A 13 19.095 -14.809 -13.169 1.00 0.00 O ATOM 164 CB THR A 13 21.498 -13.445 -14.157 1.00 0.00 C ATOM 165 OG1 THR A 13 22.918 -13.347 -14.320 1.00 0.00 O ATOM 166 CG2 THR A 13 20.835 -12.179 -14.679 1.00 0.00 C ATOM 0 H THR A 13 22.331 -15.401 -12.817 1.00 0.00 H new ATOM 0 HA THR A 13 21.431 -12.789 -12.103 1.00 0.00 H new ATOM 0 HB THR A 13 21.124 -14.294 -14.729 1.00 0.00 H new ATOM 0 HG1 THR A 13 23.130 -13.203 -15.266 1.00 0.00 H new ATOM 0 HG21 THR A 13 21.094 -12.039 -15.728 1.00 0.00 H new ATOM 0 HG22 THR A 13 19.753 -12.268 -14.581 1.00 0.00 H new ATOM 0 HG23 THR A 13 21.182 -11.322 -14.102 1.00 0.00 H new ATOM 174 N THR A 14 18.998 -13.083 -11.729 1.00 0.00 N ATOM 175 CA THR A 14 17.561 -13.198 -11.517 1.00 0.00 C ATOM 176 C THR A 14 16.831 -11.956 -12.013 1.00 0.00 C ATOM 177 O THR A 14 15.730 -12.046 -12.559 1.00 0.00 O ATOM 178 CB THR A 14 17.229 -13.415 -10.029 1.00 0.00 C ATOM 179 OG1 THR A 14 17.871 -14.603 -9.551 1.00 0.00 O ATOM 180 CG2 THR A 14 15.726 -13.527 -9.820 1.00 0.00 C ATOM 0 H THR A 14 19.442 -12.329 -11.205 1.00 0.00 H new ATOM 0 HA THR A 14 17.226 -14.065 -12.087 1.00 0.00 H new ATOM 0 HB THR A 14 17.595 -12.554 -9.470 1.00 0.00 H new ATOM 0 HG1 THR A 14 17.656 -14.732 -8.604 1.00 0.00 H new ATOM 0 HG21 THR A 14 15.516 -13.680 -8.761 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.242 -12.610 -10.157 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.341 -14.371 -10.392 1.00 0.00 H new ATOM 188 N LEU A 15 17.449 -10.796 -11.821 1.00 0.00 N ATOM 189 CA LEU A 15 16.857 -9.533 -12.250 1.00 0.00 C ATOM 190 C LEU A 15 16.683 -9.501 -13.765 1.00 0.00 C ATOM 191 O LEU A 15 17.628 -9.748 -14.514 1.00 0.00 O ATOM 192 CB LEU A 15 17.729 -8.359 -11.800 1.00 0.00 C ATOM 193 CG LEU A 15 17.044 -6.993 -11.756 1.00 0.00 C ATOM 194 CD1 LEU A 15 16.415 -6.754 -10.393 1.00 0.00 C ATOM 195 CD2 LEU A 15 18.037 -5.888 -12.088 1.00 0.00 C ATOM 0 H LEU A 15 18.360 -10.703 -11.371 1.00 0.00 H new ATOM 0 HA LEU A 15 15.874 -9.445 -11.788 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.117 -8.581 -10.806 1.00 0.00 H new ATOM 0 HB3 LEU A 15 18.587 -8.292 -12.469 1.00 0.00 H new ATOM 0 HG LEU A 15 16.252 -6.981 -12.505 1.00 0.00 H new ATOM 0 HD11 LEU A 15 15.932 -5.777 -10.381 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.673 -7.527 -10.194 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.188 -6.786 -9.625 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.532 -4.923 -12.052 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.850 -5.900 -11.362 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.440 -6.050 -13.088 1.00 0.00 H new ATOM 207 N ALA A 16 15.469 -9.191 -14.210 1.00 0.00 N ATOM 208 CA ALA A 16 15.173 -9.122 -15.635 1.00 0.00 C ATOM 209 C ALA A 16 14.105 -8.072 -15.923 1.00 0.00 C ATOM 210 O ALA A 16 12.992 -8.145 -15.402 1.00 0.00 O ATOM 211 CB ALA A 16 14.729 -10.483 -16.149 1.00 0.00 C ATOM 0 H ALA A 16 14.675 -8.984 -13.604 1.00 0.00 H new ATOM 0 HA ALA A 16 16.084 -8.829 -16.156 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.511 -10.416 -17.215 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.524 -11.211 -15.986 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.833 -10.799 -15.615 1.00 0.00 H new ATOM 217 N ASP A 17 14.451 -7.095 -16.755 1.00 0.00 N ATOM 218 CA ASP A 17 13.522 -6.030 -17.112 1.00 0.00 C ATOM 219 C ASP A 17 12.208 -6.606 -17.631 1.00 0.00 C ATOM 220 O ASP A 17 12.136 -7.097 -18.759 1.00 0.00 O ATOM 221 CB ASP A 17 14.144 -5.114 -18.168 1.00 0.00 C ATOM 222 CG ASP A 17 15.593 -4.785 -17.867 1.00 0.00 C ATOM 223 OD1 ASP A 17 16.458 -5.658 -18.084 1.00 0.00 O ATOM 224 OD2 ASP A 17 15.861 -3.652 -17.414 1.00 0.00 O ATOM 0 H ASP A 17 15.368 -7.019 -17.194 1.00 0.00 H new ATOM 0 HA ASP A 17 13.313 -5.448 -16.214 1.00 0.00 H new ATOM 0 HB2 ASP A 17 14.079 -5.593 -19.145 1.00 0.00 H new ATOM 0 HB3 ASP A 17 13.569 -4.190 -18.227 1.00 0.00 H new ATOM 229 N LEU A 18 11.173 -6.545 -16.801 1.00 0.00 N ATOM 230 CA LEU A 18 9.861 -7.061 -17.176 1.00 0.00 C ATOM 231 C LEU A 18 9.412 -6.488 -18.516 1.00 0.00 C ATOM 232 O LEU A 18 10.114 -5.679 -19.123 1.00 0.00 O ATOM 233 CB LEU A 18 8.832 -6.727 -16.094 1.00 0.00 C ATOM 234 CG LEU A 18 8.857 -5.293 -15.565 1.00 0.00 C ATOM 235 CD1 LEU A 18 8.347 -4.325 -16.621 1.00 0.00 C ATOM 236 CD2 LEU A 18 8.030 -5.180 -14.292 1.00 0.00 C ATOM 0 H LEU A 18 11.216 -6.144 -15.864 1.00 0.00 H new ATOM 0 HA LEU A 18 9.938 -8.144 -17.274 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.837 -6.929 -16.492 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.984 -7.406 -15.255 1.00 0.00 H new ATOM 0 HG LEU A 18 9.889 -5.031 -15.330 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.372 -3.309 -16.226 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.980 -4.386 -17.506 1.00 0.00 H new ATOM 0 HD13 LEU A 18 7.323 -4.585 -16.889 1.00 0.00 H new ATOM 0 HD21 LEU A 18 8.059 -4.153 -13.929 1.00 0.00 H new ATOM 0 HD22 LEU A 18 6.998 -5.462 -14.502 1.00 0.00 H new ATOM 0 HD23 LEU A 18 8.440 -5.845 -13.532 1.00 0.00 H new ATOM 248 N PHE A 19 8.237 -6.910 -18.970 1.00 0.00 N ATOM 249 CA PHE A 19 7.693 -6.437 -20.238 1.00 0.00 C ATOM 250 C PHE A 19 6.552 -5.450 -20.007 1.00 0.00 C ATOM 251 O PHE A 19 6.355 -4.520 -20.788 1.00 0.00 O ATOM 252 CB PHE A 19 7.198 -7.618 -21.077 1.00 0.00 C ATOM 253 CG PHE A 19 6.787 -8.806 -20.256 1.00 0.00 C ATOM 254 CD1 PHE A 19 7.723 -9.510 -19.515 1.00 0.00 C ATOM 255 CD2 PHE A 19 5.465 -9.219 -20.224 1.00 0.00 C ATOM 256 CE1 PHE A 19 7.348 -10.604 -18.758 1.00 0.00 C ATOM 257 CE2 PHE A 19 5.084 -10.312 -19.469 1.00 0.00 C ATOM 258 CZ PHE A 19 6.027 -11.006 -18.736 1.00 0.00 C ATOM 0 H PHE A 19 7.643 -7.578 -18.479 1.00 0.00 H new ATOM 0 HA PHE A 19 8.490 -5.925 -20.777 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.351 -7.294 -21.682 1.00 0.00 H new ATOM 0 HB3 PHE A 19 7.986 -7.919 -21.767 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.758 -9.200 -19.529 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.724 -8.681 -20.796 1.00 0.00 H new ATOM 0 HE1 PHE A 19 8.087 -11.144 -18.184 1.00 0.00 H new ATOM 0 HE2 PHE A 19 4.050 -10.623 -19.452 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.732 -11.862 -18.147 1.00 0.00 H new ATOM 268 N ARG A 20 5.805 -5.661 -18.928 1.00 0.00 N ATOM 269 CA ARG A 20 4.684 -4.792 -18.594 1.00 0.00 C ATOM 270 C ARG A 20 4.775 -4.318 -17.146 1.00 0.00 C ATOM 271 O ARG A 20 5.203 -5.050 -16.254 1.00 0.00 O ATOM 272 CB ARG A 20 3.359 -5.523 -18.820 1.00 0.00 C ATOM 273 CG ARG A 20 3.050 -6.566 -17.758 1.00 0.00 C ATOM 274 CD ARG A 20 3.716 -7.896 -18.074 1.00 0.00 C ATOM 275 NE ARG A 20 2.849 -8.769 -18.861 1.00 0.00 N ATOM 276 CZ ARG A 20 1.707 -9.272 -18.408 1.00 0.00 C ATOM 277 NH1 ARG A 20 1.295 -8.990 -17.180 1.00 0.00 N ATOM 278 NH2 ARG A 20 0.973 -10.059 -19.185 1.00 0.00 N ATOM 0 H ARG A 20 5.956 -6.426 -18.271 1.00 0.00 H new ATOM 0 HA ARG A 20 4.726 -3.920 -19.247 1.00 0.00 H new ATOM 0 HB2 ARG A 20 2.550 -4.792 -18.846 1.00 0.00 H new ATOM 0 HB3 ARG A 20 3.383 -6.007 -19.796 1.00 0.00 H new ATOM 0 HG2 ARG A 20 3.390 -6.209 -16.786 1.00 0.00 H new ATOM 0 HG3 ARG A 20 1.971 -6.706 -17.686 1.00 0.00 H new ATOM 0 HD2 ARG A 20 4.642 -7.717 -18.620 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.986 -8.396 -17.144 1.00 0.00 H new ATOM 0 HE ARG A 20 3.137 -9.005 -19.811 1.00 0.00 H new ATOM 0 HH11 ARG A 20 1.856 -8.385 -16.580 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.417 -9.378 -16.835 1.00 0.00 H new ATOM 0 HH21 ARG A 20 1.286 -10.278 -20.131 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.096 -10.445 -18.836 1.00 0.00 H new ATOM 292 N PRO A 21 4.364 -3.064 -16.906 1.00 0.00 N ATOM 293 CA PRO A 21 4.391 -2.465 -15.569 1.00 0.00 C ATOM 294 C PRO A 21 3.357 -3.086 -14.635 1.00 0.00 C ATOM 295 O PRO A 21 2.256 -3.453 -15.045 1.00 0.00 O ATOM 296 CB PRO A 21 4.057 -0.994 -15.832 1.00 0.00 C ATOM 297 CG PRO A 21 3.282 -1.004 -17.105 1.00 0.00 C ATOM 298 CD PRO A 21 3.843 -2.135 -17.922 1.00 0.00 C ATOM 0 HA PRO A 21 5.350 -2.617 -15.074 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.473 -0.569 -15.016 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.962 -0.393 -15.924 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.219 -1.151 -16.914 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.383 -0.055 -17.631 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.077 -2.603 -18.539 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.629 -1.793 -18.595 1.00 0.00 H new ATOM 306 N PRO A 22 3.718 -3.208 -13.349 1.00 0.00 N ATOM 307 CA PRO A 22 2.836 -3.784 -12.330 1.00 0.00 C ATOM 308 C PRO A 22 1.649 -2.881 -12.013 1.00 0.00 C ATOM 309 O PRO A 22 0.998 -3.035 -10.979 1.00 0.00 O ATOM 310 CB PRO A 22 3.746 -3.919 -11.107 1.00 0.00 C ATOM 311 CG PRO A 22 4.802 -2.887 -11.305 1.00 0.00 C ATOM 312 CD PRO A 22 5.016 -2.792 -12.790 1.00 0.00 C ATOM 0 HA PRO A 22 2.397 -4.726 -12.658 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.194 -3.749 -10.182 1.00 0.00 H new ATOM 0 HB3 PRO A 22 4.176 -4.918 -11.042 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.491 -1.927 -10.893 1.00 0.00 H new ATOM 0 HG3 PRO A 22 5.723 -3.169 -10.795 1.00 0.00 H new ATOM 0 HD2 PRO A 22 5.278 -1.779 -13.094 1.00 0.00 H new ATOM 0 HD3 PRO A 22 5.824 -3.444 -13.122 1.00 0.00 H new ATOM 320 N ILE A 23 1.373 -1.939 -12.909 1.00 0.00 N ATOM 321 CA ILE A 23 0.263 -1.012 -12.724 1.00 0.00 C ATOM 322 C ILE A 23 -0.899 -1.683 -11.999 1.00 0.00 C ATOM 323 O ILE A 23 -1.546 -1.075 -11.146 1.00 0.00 O ATOM 324 CB ILE A 23 -0.238 -0.458 -14.071 1.00 0.00 C ATOM 325 CG1 ILE A 23 -0.374 -1.589 -15.093 1.00 0.00 C ATOM 326 CG2 ILE A 23 0.706 0.618 -14.586 1.00 0.00 C ATOM 327 CD1 ILE A 23 -1.116 -1.184 -16.347 1.00 0.00 C ATOM 0 H ILE A 23 1.902 -1.798 -13.769 1.00 0.00 H new ATOM 0 HA ILE A 23 0.638 -0.187 -12.118 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.220 -0.010 -13.920 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.620 -1.942 -15.367 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.893 -2.427 -14.628 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.338 0.999 -15.539 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.757 1.433 -13.864 1.00 0.00 H new ATOM 0 HG23 ILE A 23 1.700 0.194 -14.725 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -1.174 -2.035 -17.026 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.123 -0.859 -16.085 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.586 -0.366 -16.835 1.00 0.00 H new ATOM 339 N ASP A 24 -1.156 -2.940 -12.343 1.00 0.00 N ATOM 340 CA ASP A 24 -2.239 -3.695 -11.723 1.00 0.00 C ATOM 341 C ASP A 24 -2.127 -3.656 -10.202 1.00 0.00 C ATOM 342 O ASP A 24 -3.098 -3.362 -9.504 1.00 0.00 O ATOM 343 CB ASP A 24 -2.222 -5.145 -12.211 1.00 0.00 C ATOM 344 CG ASP A 24 -1.117 -5.960 -11.568 1.00 0.00 C ATOM 345 OD1 ASP A 24 0.068 -5.659 -11.823 1.00 0.00 O ATOM 346 OD2 ASP A 24 -1.438 -6.898 -10.808 1.00 0.00 O ATOM 0 H ASP A 24 -0.630 -3.457 -13.047 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.183 -3.233 -12.012 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.184 -5.609 -11.995 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.097 -5.159 -13.294 1.00 0.00 H new ATOM 351 N LEU A 25 -0.936 -3.956 -9.694 1.00 0.00 N ATOM 352 CA LEU A 25 -0.697 -3.957 -8.255 1.00 0.00 C ATOM 353 C LEU A 25 -0.352 -2.556 -7.760 1.00 0.00 C ATOM 354 O LEU A 25 -0.683 -2.186 -6.633 1.00 0.00 O ATOM 355 CB LEU A 25 0.434 -4.926 -7.906 1.00 0.00 C ATOM 356 CG LEU A 25 1.039 -4.778 -6.510 1.00 0.00 C ATOM 357 CD1 LEU A 25 0.000 -5.087 -5.443 1.00 0.00 C ATOM 358 CD2 LEU A 25 2.251 -5.684 -6.355 1.00 0.00 C ATOM 0 H LEU A 25 -0.122 -4.201 -10.257 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.612 -4.283 -7.760 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.058 -5.944 -8.011 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.230 -4.803 -8.640 1.00 0.00 H new ATOM 0 HG LEU A 25 1.364 -3.745 -6.383 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.448 -4.977 -4.456 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.838 -4.397 -5.540 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.356 -6.110 -5.567 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.669 -5.565 -5.355 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.951 -6.722 -6.502 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.003 -5.415 -7.097 1.00 0.00 H new ATOM 370 N MET A 26 0.313 -1.781 -8.610 1.00 0.00 N ATOM 371 CA MET A 26 0.700 -0.419 -8.259 1.00 0.00 C ATOM 372 C MET A 26 -0.345 0.584 -8.740 1.00 0.00 C ATOM 373 O MET A 26 -0.561 0.742 -9.942 1.00 0.00 O ATOM 374 CB MET A 26 2.064 -0.081 -8.864 1.00 0.00 C ATOM 375 CG MET A 26 2.223 1.387 -9.223 1.00 0.00 C ATOM 376 SD MET A 26 3.777 1.730 -10.071 1.00 0.00 S ATOM 377 CE MET A 26 3.358 1.261 -11.748 1.00 0.00 C ATOM 0 H MET A 26 0.595 -2.072 -9.546 1.00 0.00 H new ATOM 0 HA MET A 26 0.767 -0.356 -7.173 1.00 0.00 H new ATOM 0 HB2 MET A 26 2.845 -0.360 -8.157 1.00 0.00 H new ATOM 0 HB3 MET A 26 2.214 -0.684 -9.760 1.00 0.00 H new ATOM 0 HG2 MET A 26 1.392 1.694 -9.858 1.00 0.00 H new ATOM 0 HG3 MET A 26 2.169 1.987 -8.315 1.00 0.00 H new ATOM 0 HE1 MET A 26 4.221 1.417 -12.396 1.00 0.00 H new ATOM 0 HE2 MET A 26 3.072 0.209 -11.771 1.00 0.00 H new ATOM 0 HE3 MET A 26 2.526 1.871 -12.099 1.00 0.00 H new ATOM 387 N HIS A 27 -0.990 1.259 -7.795 1.00 0.00 N ATOM 388 CA HIS A 27 -2.012 2.246 -8.123 1.00 0.00 C ATOM 389 C HIS A 27 -1.424 3.382 -8.955 1.00 0.00 C ATOM 390 O HIS A 27 -0.206 3.496 -9.095 1.00 0.00 O ATOM 391 CB HIS A 27 -2.639 2.806 -6.845 1.00 0.00 C ATOM 392 CG HIS A 27 -3.901 3.576 -7.085 1.00 0.00 C ATOM 393 ND1 HIS A 27 -4.900 3.382 -7.978 1.00 0.00 N flip ATOM 394 CD2 HIS A 27 -4.249 4.696 -6.360 1.00 0.00 C flip ATOM 395 CE1 HIS A 27 -5.825 4.377 -7.777 1.00 0.00 C flip ATOM 396 NE2 HIS A 27 -5.409 5.156 -6.794 1.00 0.00 N flip ATOM 0 H HIS A 27 -0.823 1.141 -6.796 1.00 0.00 H new ATOM 0 HA HIS A 27 -2.784 1.751 -8.711 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -2.850 1.983 -6.162 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -1.916 3.454 -6.349 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -3.665 5.130 -5.562 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -6.743 4.502 -8.332 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -5.900 5.973 -6.432 1.00 0.00 H new ATOM 405 N LYS A 28 -2.296 4.219 -9.505 1.00 0.00 N ATOM 406 CA LYS A 28 -1.864 5.347 -10.323 1.00 0.00 C ATOM 407 C LYS A 28 -0.876 6.225 -9.561 1.00 0.00 C ATOM 408 O LYS A 28 -1.167 6.691 -8.460 1.00 0.00 O ATOM 409 CB LYS A 28 -3.071 6.179 -10.759 1.00 0.00 C ATOM 410 CG LYS A 28 -3.818 5.592 -11.945 1.00 0.00 C ATOM 411 CD LYS A 28 -4.904 4.628 -11.498 1.00 0.00 C ATOM 412 CE LYS A 28 -5.678 4.073 -12.684 1.00 0.00 C ATOM 413 NZ LYS A 28 -6.850 4.925 -13.029 1.00 0.00 N ATOM 0 H LYS A 28 -3.307 4.138 -9.399 1.00 0.00 H new ATOM 0 HA LYS A 28 -1.364 4.952 -11.208 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.758 6.275 -9.919 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.736 7.185 -11.013 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.263 6.397 -12.530 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.116 5.073 -12.598 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.456 3.807 -10.938 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -5.589 5.138 -10.821 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.016 3.999 -13.547 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.018 3.063 -12.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.351 4.513 -13.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -7.494 4.975 -12.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.524 5.882 -13.272 1.00 0.00 H new ATOM 427 N GLY A 29 0.292 6.447 -10.155 1.00 0.00 N ATOM 428 CA GLY A 29 1.304 7.270 -9.518 1.00 0.00 C ATOM 429 C GLY A 29 0.746 8.585 -9.010 1.00 0.00 C ATOM 430 O GLY A 29 0.244 9.396 -9.788 1.00 0.00 O ATOM 0 H GLY A 29 0.556 6.072 -11.066 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.744 6.720 -8.686 1.00 0.00 H new ATOM 0 HA3 GLY A 29 2.106 7.469 -10.229 1.00 0.00 H new ATOM 434 N SER A 30 0.832 8.796 -7.701 1.00 0.00 N ATOM 435 CA SER A 30 0.327 10.019 -7.089 1.00 0.00 C ATOM 436 C SER A 30 0.822 10.152 -5.652 1.00 0.00 C ATOM 437 O SER A 30 1.134 9.158 -4.996 1.00 0.00 O ATOM 438 CB SER A 30 -1.203 10.034 -7.116 1.00 0.00 C ATOM 439 OG SER A 30 -1.735 8.863 -6.522 1.00 0.00 O ATOM 0 H SER A 30 1.247 8.136 -7.044 1.00 0.00 H new ATOM 0 HA SER A 30 0.702 10.865 -7.664 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.571 10.913 -6.587 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.551 10.113 -8.146 1.00 0.00 H new ATOM 0 HG SER A 30 -1.569 8.095 -7.107 1.00 0.00 H new ATOM 445 N PHE A 31 0.892 11.388 -5.169 1.00 0.00 N ATOM 446 CA PHE A 31 1.350 11.653 -3.810 1.00 0.00 C ATOM 447 C PHE A 31 0.195 12.118 -2.928 1.00 0.00 C ATOM 448 O PHE A 31 0.115 11.759 -1.753 1.00 0.00 O ATOM 449 CB PHE A 31 2.457 12.710 -3.819 1.00 0.00 C ATOM 450 CG PHE A 31 2.066 13.981 -4.518 1.00 0.00 C ATOM 451 CD1 PHE A 31 2.101 14.065 -5.901 1.00 0.00 C ATOM 452 CD2 PHE A 31 1.664 15.090 -3.793 1.00 0.00 C ATOM 453 CE1 PHE A 31 1.743 15.234 -6.546 1.00 0.00 C ATOM 454 CE2 PHE A 31 1.304 16.262 -4.433 1.00 0.00 C ATOM 455 CZ PHE A 31 1.343 16.333 -5.811 1.00 0.00 C ATOM 0 H PHE A 31 0.637 12.222 -5.698 1.00 0.00 H new ATOM 0 HA PHE A 31 1.747 10.725 -3.400 1.00 0.00 H new ATOM 0 HB2 PHE A 31 2.736 12.941 -2.791 1.00 0.00 H new ATOM 0 HB3 PHE A 31 3.341 12.295 -4.304 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.411 13.208 -6.481 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.631 15.039 -2.715 1.00 0.00 H new ATOM 0 HE1 PHE A 31 1.776 15.288 -7.624 1.00 0.00 H new ATOM 0 HE2 PHE A 31 0.993 17.120 -3.856 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.061 17.246 -6.314 1.00 0.00 H new ATOM 465 N GLU A 32 -0.697 12.918 -3.503 1.00 0.00 N ATOM 466 CA GLU A 32 -1.846 13.433 -2.768 1.00 0.00 C ATOM 467 C GLU A 32 -3.026 12.469 -2.858 1.00 0.00 C ATOM 468 O GLU A 32 -3.767 12.284 -1.892 1.00 0.00 O ATOM 469 CB GLU A 32 -2.253 14.805 -3.310 1.00 0.00 C ATOM 470 CG GLU A 32 -2.558 14.806 -4.799 1.00 0.00 C ATOM 471 CD GLU A 32 -3.433 15.972 -5.214 1.00 0.00 C ATOM 472 OE1 GLU A 32 -3.049 17.129 -4.940 1.00 0.00 O ATOM 473 OE2 GLU A 32 -4.501 15.729 -5.814 1.00 0.00 O ATOM 0 H GLU A 32 -0.646 13.223 -4.475 1.00 0.00 H new ATOM 0 HA GLU A 32 -1.560 13.534 -1.721 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -3.132 15.154 -2.768 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -1.452 15.517 -3.111 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -1.623 14.842 -5.358 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -3.053 13.872 -5.065 1.00 0.00 H new ATOM 480 N THR A 33 -3.193 11.855 -4.026 1.00 0.00 N ATOM 481 CA THR A 33 -4.282 10.911 -4.243 1.00 0.00 C ATOM 482 C THR A 33 -4.041 9.610 -3.488 1.00 0.00 C ATOM 483 O THR A 33 -4.968 9.024 -2.929 1.00 0.00 O ATOM 484 CB THR A 33 -4.462 10.597 -5.741 1.00 0.00 C ATOM 485 OG1 THR A 33 -4.718 11.804 -6.467 1.00 0.00 O ATOM 486 CG2 THR A 33 -5.607 9.618 -5.954 1.00 0.00 C ATOM 0 H THR A 33 -2.588 11.995 -4.835 1.00 0.00 H new ATOM 0 HA THR A 33 -5.189 11.383 -3.866 1.00 0.00 H new ATOM 0 HB THR A 33 -3.542 10.141 -6.108 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.829 11.596 -7.418 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.715 9.411 -7.019 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.395 8.690 -5.424 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.532 10.051 -5.572 1.00 0.00 H new ATOM 494 N ALA A 34 -2.790 9.162 -3.474 1.00 0.00 N ATOM 495 CA ALA A 34 -2.427 7.930 -2.784 1.00 0.00 C ATOM 496 C ALA A 34 -3.098 7.848 -1.417 1.00 0.00 C ATOM 497 O ALA A 34 -3.814 6.892 -1.122 1.00 0.00 O ATOM 498 CB ALA A 34 -0.915 7.833 -2.639 1.00 0.00 C ATOM 0 H ALA A 34 -2.011 9.634 -3.933 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.779 7.090 -3.383 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.658 6.909 -2.122 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.454 7.837 -3.627 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.549 8.684 -2.064 1.00 0.00 H new ATOM 504 N LYS A 35 -2.861 8.857 -0.586 1.00 0.00 N ATOM 505 CA LYS A 35 -3.443 8.900 0.751 1.00 0.00 C ATOM 506 C LYS A 35 -4.966 8.929 0.680 1.00 0.00 C ATOM 507 O LYS A 35 -5.643 8.201 1.405 1.00 0.00 O ATOM 508 CB LYS A 35 -2.933 10.127 1.511 1.00 0.00 C ATOM 509 CG LYS A 35 -1.675 9.861 2.320 1.00 0.00 C ATOM 510 CD LYS A 35 -1.071 11.151 2.851 1.00 0.00 C ATOM 511 CE LYS A 35 -0.502 12.003 1.727 1.00 0.00 C ATOM 512 NZ LYS A 35 0.582 12.904 2.209 1.00 0.00 N ATOM 0 H LYS A 35 -2.270 9.656 -0.814 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.139 7.998 1.283 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.735 10.928 0.799 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.717 10.482 2.180 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -1.910 9.198 3.153 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -0.944 9.345 1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.832 11.717 3.388 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.283 10.918 3.567 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.113 11.355 0.941 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.300 12.599 1.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.944 13.468 1.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 0.205 13.539 2.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 1.355 12.334 2.609 1.00 0.00 H new ATOM 526 N GLU A 36 -5.498 9.774 -0.198 1.00 0.00 N ATOM 527 CA GLU A 36 -6.941 9.896 -0.362 1.00 0.00 C ATOM 528 C GLU A 36 -7.587 8.524 -0.538 1.00 0.00 C ATOM 529 O GLU A 36 -8.486 8.149 0.214 1.00 0.00 O ATOM 530 CB GLU A 36 -7.267 10.783 -1.566 1.00 0.00 C ATOM 531 CG GLU A 36 -7.109 12.268 -1.288 1.00 0.00 C ATOM 532 CD GLU A 36 -7.936 12.732 -0.105 1.00 0.00 C ATOM 533 OE1 GLU A 36 -9.148 12.430 -0.073 1.00 0.00 O ATOM 534 OE2 GLU A 36 -7.372 13.397 0.788 1.00 0.00 O ATOM 0 H GLU A 36 -4.951 10.384 -0.806 1.00 0.00 H new ATOM 0 HA GLU A 36 -7.345 10.356 0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -6.618 10.506 -2.397 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.291 10.588 -1.883 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -6.058 12.489 -1.101 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.400 12.833 -2.174 1.00 0.00 H new ATOM 541 N CYS A 37 -7.121 7.782 -1.536 1.00 0.00 N ATOM 542 CA CYS A 37 -7.653 6.452 -1.813 1.00 0.00 C ATOM 543 C CYS A 37 -7.909 5.689 -0.517 1.00 0.00 C ATOM 544 O CYS A 37 -8.987 5.130 -0.317 1.00 0.00 O ATOM 545 CB CYS A 37 -6.685 5.667 -2.699 1.00 0.00 C ATOM 546 SG CYS A 37 -7.391 4.161 -3.410 1.00 0.00 S ATOM 0 H CYS A 37 -6.376 8.078 -2.167 1.00 0.00 H new ATOM 0 HA CYS A 37 -8.601 6.568 -2.338 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -6.345 6.313 -3.508 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -5.806 5.401 -2.112 1.00 0.00 H new ATOM 0 HG CYS A 37 -8.685 4.187 -3.285 1.00 0.00 H new ATOM 552 N GLY A 38 -6.910 5.668 0.359 1.00 0.00 N ATOM 553 CA GLY A 38 -7.046 4.969 1.624 1.00 0.00 C ATOM 554 C GLY A 38 -8.321 5.337 2.355 1.00 0.00 C ATOM 555 O GLY A 38 -8.962 4.483 2.966 1.00 0.00 O ATOM 0 H GLY A 38 -6.008 6.123 0.216 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.031 3.894 1.445 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.189 5.199 2.257 1.00 0.00 H new ATOM 559 N GLN A 39 -8.689 6.613 2.294 1.00 0.00 N ATOM 560 CA GLN A 39 -9.895 7.092 2.959 1.00 0.00 C ATOM 561 C GLN A 39 -11.140 6.447 2.359 1.00 0.00 C ATOM 562 O GLN A 39 -11.830 5.672 3.021 1.00 0.00 O ATOM 563 CB GLN A 39 -9.993 8.615 2.850 1.00 0.00 C ATOM 564 CG GLN A 39 -8.881 9.349 3.581 1.00 0.00 C ATOM 565 CD GLN A 39 -8.764 10.801 3.159 1.00 0.00 C ATOM 566 OE1 GLN A 39 -9.761 11.446 2.831 1.00 0.00 O ATOM 567 NE2 GLN A 39 -7.544 11.323 3.165 1.00 0.00 N ATOM 0 H GLN A 39 -8.170 7.333 1.791 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.834 6.813 4.011 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.973 8.898 1.798 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.954 8.939 3.249 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -9.063 9.300 4.655 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -7.934 8.843 3.395 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -6.746 10.752 3.444 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -7.404 12.295 2.891 1.00 0.00 H new ATOM 576 N MET A 40 -11.422 6.773 1.102 1.00 0.00 N ATOM 577 CA MET A 40 -12.584 6.224 0.413 1.00 0.00 C ATOM 578 C MET A 40 -12.616 4.703 0.527 1.00 0.00 C ATOM 579 O MET A 40 -13.551 4.134 1.089 1.00 0.00 O ATOM 580 CB MET A 40 -12.572 6.636 -1.061 1.00 0.00 C ATOM 581 CG MET A 40 -13.166 8.013 -1.311 1.00 0.00 C ATOM 582 SD MET A 40 -14.914 8.105 -0.877 1.00 0.00 S ATOM 583 CE MET A 40 -14.851 9.183 0.553 1.00 0.00 C ATOM 0 H MET A 40 -10.862 7.414 0.540 1.00 0.00 H new ATOM 0 HA MET A 40 -13.479 6.625 0.888 1.00 0.00 H new ATOM 0 HB2 MET A 40 -11.545 6.620 -1.426 1.00 0.00 H new ATOM 0 HB3 MET A 40 -13.128 5.899 -1.641 1.00 0.00 H new ATOM 0 HG2 MET A 40 -12.613 8.753 -0.733 1.00 0.00 H new ATOM 0 HG3 MET A 40 -13.043 8.272 -2.363 1.00 0.00 H new ATOM 0 HE1 MET A 40 -15.803 9.140 1.083 1.00 0.00 H new ATOM 0 HE2 MET A 40 -14.050 8.859 1.218 1.00 0.00 H new ATOM 0 HE3 MET A 40 -14.662 10.206 0.229 1.00 0.00 H new ATOM 593 N GLN A 41 -11.588 4.052 -0.010 1.00 0.00 N ATOM 594 CA GLN A 41 -11.501 2.597 0.032 1.00 0.00 C ATOM 595 C GLN A 41 -11.494 2.093 1.471 1.00 0.00 C ATOM 596 O GLN A 41 -11.839 0.943 1.737 1.00 0.00 O ATOM 597 CB GLN A 41 -10.241 2.121 -0.694 1.00 0.00 C ATOM 598 CG GLN A 41 -10.333 2.230 -2.208 1.00 0.00 C ATOM 599 CD GLN A 41 -11.006 3.511 -2.660 1.00 0.00 C ATOM 600 OE1 GLN A 41 -10.351 4.641 -2.422 1.00 0.00 O flip ATOM 601 NE2 GLN A 41 -12.104 3.486 -3.218 1.00 0.00 N flip ATOM 0 H GLN A 41 -10.805 4.509 -0.478 1.00 0.00 H new ATOM 0 HA GLN A 41 -12.378 2.190 -0.471 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.389 2.706 -0.347 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.046 1.083 -0.424 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.331 2.181 -2.634 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.887 1.376 -2.597 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -12.573 2.595 -3.381 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.544 4.356 -3.517 1.00 0.00 H new ATOM 610 N ASN A 42 -11.097 2.962 2.395 1.00 0.00 N ATOM 611 CA ASN A 42 -11.045 2.605 3.808 1.00 0.00 C ATOM 612 C ASN A 42 -10.021 1.500 4.052 1.00 0.00 C ATOM 613 O ASN A 42 -10.288 0.538 4.772 1.00 0.00 O ATOM 614 CB ASN A 42 -12.424 2.153 4.293 1.00 0.00 C ATOM 615 CG ASN A 42 -13.548 2.951 3.662 1.00 0.00 C ATOM 616 OD1 ASN A 42 -13.704 4.143 3.928 1.00 0.00 O ATOM 617 ND2 ASN A 42 -14.339 2.295 2.821 1.00 0.00 N ATOM 0 H ASN A 42 -10.807 3.918 2.191 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.742 3.489 4.369 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.559 1.096 4.063 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.476 2.252 5.377 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -15.113 2.779 2.366 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -14.173 1.307 2.630 1.00 0.00 H new ATOM 624 N LYS A 43 -8.847 1.645 3.446 1.00 0.00 N ATOM 625 CA LYS A 43 -7.780 0.663 3.598 1.00 0.00 C ATOM 626 C LYS A 43 -6.494 1.325 4.082 1.00 0.00 C ATOM 627 O LYS A 43 -6.353 2.546 4.020 1.00 0.00 O ATOM 628 CB LYS A 43 -7.528 -0.055 2.270 1.00 0.00 C ATOM 629 CG LYS A 43 -8.696 -0.911 1.810 1.00 0.00 C ATOM 630 CD LYS A 43 -8.724 -1.048 0.297 1.00 0.00 C ATOM 631 CE LYS A 43 -10.134 -1.304 -0.213 1.00 0.00 C ATOM 632 NZ LYS A 43 -10.445 -2.759 -0.280 1.00 0.00 N ATOM 0 H LYS A 43 -8.611 2.434 2.844 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.095 -0.066 4.345 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -7.307 0.686 1.502 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.644 -0.685 2.369 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.626 -1.899 2.265 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.631 -0.468 2.154 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.330 -0.140 -0.159 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.072 -1.866 -0.008 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -10.852 -0.809 0.441 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.248 -0.863 -1.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -11.374 -2.895 -0.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.717 -3.244 -0.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -10.462 -3.155 0.681 1.00 0.00 H new ATOM 646 N TRP A 44 -5.561 0.512 4.562 1.00 0.00 N ATOM 647 CA TRP A 44 -4.285 1.020 5.056 1.00 0.00 C ATOM 648 C TRP A 44 -3.386 1.447 3.901 1.00 0.00 C ATOM 649 O TRP A 44 -3.610 1.064 2.752 1.00 0.00 O ATOM 650 CB TRP A 44 -3.582 -0.043 5.900 1.00 0.00 C ATOM 651 CG TRP A 44 -4.324 -0.393 7.154 1.00 0.00 C ATOM 652 CD1 TRP A 44 -4.940 -1.579 7.438 1.00 0.00 C ATOM 653 CD2 TRP A 44 -4.530 0.451 8.292 1.00 0.00 C ATOM 654 NE1 TRP A 44 -5.517 -1.522 8.684 1.00 0.00 N ATOM 655 CE2 TRP A 44 -5.279 -0.288 9.229 1.00 0.00 C ATOM 656 CE3 TRP A 44 -4.154 1.758 8.612 1.00 0.00 C ATOM 657 CZ2 TRP A 44 -5.657 0.239 10.461 1.00 0.00 C ATOM 658 CZ3 TRP A 44 -4.530 2.280 9.835 1.00 0.00 C ATOM 659 CH2 TRP A 44 -5.275 1.521 10.748 1.00 0.00 C ATOM 0 H TRP A 44 -5.663 -0.501 4.620 1.00 0.00 H new ATOM 0 HA TRP A 44 -4.485 1.893 5.678 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -3.451 -0.944 5.301 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -2.586 0.313 6.163 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -4.969 -2.435 6.780 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -6.038 -2.276 9.131 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -3.579 2.350 7.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -6.232 -0.344 11.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -4.245 3.290 10.092 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -5.553 1.957 11.696 1.00 0.00 H new ATOM 670 N LEU A 45 -2.368 2.241 4.212 1.00 0.00 N ATOM 671 CA LEU A 45 -1.434 2.720 3.199 1.00 0.00 C ATOM 672 C LEU A 45 -0.025 2.199 3.468 1.00 0.00 C ATOM 673 O LEU A 45 0.680 2.710 4.337 1.00 0.00 O ATOM 674 CB LEU A 45 -1.426 4.250 3.166 1.00 0.00 C ATOM 675 CG LEU A 45 -0.272 4.899 2.403 1.00 0.00 C ATOM 676 CD1 LEU A 45 -0.372 4.588 0.917 1.00 0.00 C ATOM 677 CD2 LEU A 45 -0.258 6.403 2.635 1.00 0.00 C ATOM 0 H LEU A 45 -2.168 2.567 5.158 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.763 2.344 2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.363 4.589 2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.407 4.615 4.193 1.00 0.00 H new ATOM 0 HG LEU A 45 0.664 4.485 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.458 5.059 0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.332 3.509 0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.314 4.973 0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.570 6.848 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.198 6.833 2.288 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.137 6.606 3.699 1.00 0.00 H new ATOM 689 N MET A 46 0.377 1.181 2.714 1.00 0.00 N ATOM 690 CA MET A 46 1.703 0.594 2.869 1.00 0.00 C ATOM 691 C MET A 46 2.688 1.207 1.879 1.00 0.00 C ATOM 692 O MET A 46 2.471 1.168 0.668 1.00 0.00 O ATOM 693 CB MET A 46 1.639 -0.922 2.669 1.00 0.00 C ATOM 694 CG MET A 46 2.807 -1.667 3.295 1.00 0.00 C ATOM 695 SD MET A 46 2.935 -1.391 5.072 1.00 0.00 S ATOM 696 CE MET A 46 2.532 -3.020 5.697 1.00 0.00 C ATOM 0 H MET A 46 -0.196 0.746 1.991 1.00 0.00 H new ATOM 0 HA MET A 46 2.051 0.806 3.880 1.00 0.00 H new ATOM 0 HB2 MET A 46 0.709 -1.298 3.095 1.00 0.00 H new ATOM 0 HB3 MET A 46 1.611 -1.139 1.601 1.00 0.00 H new ATOM 0 HG2 MET A 46 2.696 -2.734 3.104 1.00 0.00 H new ATOM 0 HG3 MET A 46 3.733 -1.352 2.815 1.00 0.00 H new ATOM 0 HE1 MET A 46 2.429 -2.979 6.781 1.00 0.00 H new ATOM 0 HE2 MET A 46 1.594 -3.357 5.256 1.00 0.00 H new ATOM 0 HE3 MET A 46 3.327 -3.717 5.434 1.00 0.00 H new ATOM 706 N ILE A 47 3.770 1.774 2.402 1.00 0.00 N ATOM 707 CA ILE A 47 4.788 2.395 1.564 1.00 0.00 C ATOM 708 C ILE A 47 6.160 1.780 1.819 1.00 0.00 C ATOM 709 O ILE A 47 6.455 1.334 2.927 1.00 0.00 O ATOM 710 CB ILE A 47 4.866 3.914 1.805 1.00 0.00 C ATOM 711 CG1 ILE A 47 3.518 4.570 1.498 1.00 0.00 C ATOM 712 CG2 ILE A 47 5.967 4.529 0.954 1.00 0.00 C ATOM 713 CD1 ILE A 47 3.310 5.886 2.216 1.00 0.00 C ATOM 0 H ILE A 47 3.964 1.816 3.402 1.00 0.00 H new ATOM 0 HA ILE A 47 4.498 2.214 0.529 1.00 0.00 H new ATOM 0 HB ILE A 47 5.104 4.090 2.854 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.439 4.735 0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 47 2.718 3.884 1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 47 6.010 5.603 1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 47 6.924 4.078 1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 47 5.757 4.347 -0.100 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.334 6.294 1.952 1.00 0.00 H new ATOM 0 HD12 ILE A 47 3.356 5.724 3.293 1.00 0.00 H new ATOM 0 HD13 ILE A 47 4.089 6.589 1.921 1.00 0.00 H new ATOM 725 N ASN A 48 6.996 1.761 0.786 1.00 0.00 N ATOM 726 CA ASN A 48 8.338 1.202 0.898 1.00 0.00 C ATOM 727 C ASN A 48 9.335 2.012 0.075 1.00 0.00 C ATOM 728 O ASN A 48 9.221 2.096 -1.149 1.00 0.00 O ATOM 729 CB ASN A 48 8.345 -0.257 0.438 1.00 0.00 C ATOM 730 CG ASN A 48 9.720 -0.714 -0.011 1.00 0.00 C ATOM 731 OD1 ASN A 48 10.046 -0.663 -1.197 1.00 0.00 O ATOM 732 ND2 ASN A 48 10.533 -1.166 0.937 1.00 0.00 N ATOM 0 H ASN A 48 6.767 2.126 -0.138 1.00 0.00 H new ATOM 0 HA ASN A 48 8.638 1.247 1.945 1.00 0.00 H new ATOM 0 HB2 ASN A 48 8.001 -0.894 1.253 1.00 0.00 H new ATOM 0 HB3 ASN A 48 7.638 -0.380 -0.382 1.00 0.00 H new ATOM 0 HD21 ASN A 48 11.470 -1.489 0.694 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.221 -1.190 1.908 1.00 0.00 H new ATOM 739 N ILE A 49 10.311 2.605 0.753 1.00 0.00 N ATOM 740 CA ILE A 49 11.329 3.406 0.085 1.00 0.00 C ATOM 741 C ILE A 49 12.426 2.523 -0.500 1.00 0.00 C ATOM 742 O ILE A 49 13.073 1.762 0.220 1.00 0.00 O ATOM 743 CB ILE A 49 11.964 4.427 1.047 1.00 0.00 C ATOM 744 CG1 ILE A 49 10.891 5.351 1.626 1.00 0.00 C ATOM 745 CG2 ILE A 49 13.035 5.235 0.330 1.00 0.00 C ATOM 746 CD1 ILE A 49 10.170 6.170 0.579 1.00 0.00 C ATOM 0 H ILE A 49 10.419 2.546 1.766 1.00 0.00 H new ATOM 0 HA ILE A 49 10.829 3.943 -0.721 1.00 0.00 H new ATOM 0 HB ILE A 49 12.433 3.886 1.869 1.00 0.00 H new ATOM 0 HG12 ILE A 49 10.162 4.751 2.172 1.00 0.00 H new ATOM 0 HG13 ILE A 49 11.354 6.025 2.347 1.00 0.00 H new ATOM 0 HG21 ILE A 49 13.475 5.952 1.023 1.00 0.00 H new ATOM 0 HG22 ILE A 49 13.811 4.564 -0.039 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.588 5.768 -0.509 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.424 6.801 1.061 1.00 0.00 H new ATOM 0 HD12 ILE A 49 10.888 6.796 0.049 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.678 5.503 -0.129 1.00 0.00 H new ATOM 758 N GLN A 50 12.632 2.633 -1.808 1.00 0.00 N ATOM 759 CA GLN A 50 13.653 1.846 -2.489 1.00 0.00 C ATOM 760 C GLN A 50 14.994 2.573 -2.486 1.00 0.00 C ATOM 761 O GLN A 50 15.047 3.796 -2.609 1.00 0.00 O ATOM 762 CB GLN A 50 13.224 1.548 -3.927 1.00 0.00 C ATOM 763 CG GLN A 50 12.125 0.503 -4.030 1.00 0.00 C ATOM 764 CD GLN A 50 12.662 -0.914 -3.988 1.00 0.00 C ATOM 765 OE1 GLN A 50 13.710 -1.210 -4.563 1.00 0.00 O ATOM 766 NE2 GLN A 50 11.945 -1.800 -3.306 1.00 0.00 N ATOM 0 H GLN A 50 12.106 3.259 -2.417 1.00 0.00 H new ATOM 0 HA GLN A 50 13.769 0.906 -1.950 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.881 2.471 -4.394 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.091 1.208 -4.493 1.00 0.00 H new ATOM 0 HG2 GLN A 50 11.417 0.644 -3.213 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.574 0.651 -4.958 1.00 0.00 H new ATOM 0 HE21 GLN A 50 11.082 -1.511 -2.845 1.00 0.00 H new ATOM 0 HE22 GLN A 50 12.257 -2.769 -3.244 1.00 0.00 H new ATOM 775 N ASN A 51 16.074 1.812 -2.345 1.00 0.00 N ATOM 776 CA ASN A 51 17.415 2.385 -2.326 1.00 0.00 C ATOM 777 C ASN A 51 18.236 1.890 -3.513 1.00 0.00 C ATOM 778 O ASN A 51 18.492 0.693 -3.649 1.00 0.00 O ATOM 779 CB ASN A 51 18.125 2.030 -1.017 1.00 0.00 C ATOM 780 CG ASN A 51 17.627 2.855 0.153 1.00 0.00 C ATOM 781 OD1 ASN A 51 16.342 2.727 0.463 1.00 0.00 O flip ATOM 782 ND2 ASN A 51 18.389 3.599 0.771 1.00 0.00 N flip ATOM 0 H ASN A 51 16.047 0.798 -2.242 1.00 0.00 H new ATOM 0 HA ASN A 51 17.321 3.468 -2.399 1.00 0.00 H new ATOM 0 HB2 ASN A 51 17.976 0.972 -0.801 1.00 0.00 H new ATOM 0 HB3 ASN A 51 19.198 2.183 -1.136 1.00 0.00 H new ATOM 0 HD21 ASN A 51 19.369 3.666 0.498 1.00 0.00 H new ATOM 0 HD22 ASN A 51 18.040 4.148 1.556 1.00 0.00 H new ATOM 789 N VAL A 52 18.646 2.819 -4.370 1.00 0.00 N ATOM 790 CA VAL A 52 19.439 2.479 -5.545 1.00 0.00 C ATOM 791 C VAL A 52 20.865 2.104 -5.156 1.00 0.00 C ATOM 792 O VAL A 52 21.522 1.326 -5.847 1.00 0.00 O ATOM 793 CB VAL A 52 19.482 3.645 -6.550 1.00 0.00 C ATOM 794 CG1 VAL A 52 18.093 3.925 -7.104 1.00 0.00 C ATOM 795 CG2 VAL A 52 20.066 4.889 -5.898 1.00 0.00 C ATOM 0 H VAL A 52 18.442 3.814 -4.273 1.00 0.00 H new ATOM 0 HA VAL A 52 18.957 1.622 -6.015 1.00 0.00 H new ATOM 0 HB VAL A 52 20.128 3.361 -7.381 1.00 0.00 H new ATOM 0 HG11 VAL A 52 18.144 4.752 -7.812 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.717 3.036 -7.610 1.00 0.00 H new ATOM 0 HG13 VAL A 52 17.421 4.188 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 52 20.089 5.703 -6.623 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.449 5.178 -5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 52 21.080 4.679 -5.556 1.00 0.00 H new ATOM 805 N GLN A 53 21.336 2.663 -4.046 1.00 0.00 N ATOM 806 CA GLN A 53 22.684 2.388 -3.566 1.00 0.00 C ATOM 807 C GLN A 53 22.706 1.140 -2.689 1.00 0.00 C ATOM 808 O GLN A 53 23.492 0.221 -2.920 1.00 0.00 O ATOM 809 CB GLN A 53 23.224 3.586 -2.782 1.00 0.00 C ATOM 810 CG GLN A 53 23.221 4.883 -3.575 1.00 0.00 C ATOM 811 CD GLN A 53 21.938 5.671 -3.399 1.00 0.00 C ATOM 812 OE1 GLN A 53 20.988 5.201 -2.774 1.00 0.00 O ATOM 813 NE2 GLN A 53 21.904 6.878 -3.952 1.00 0.00 N ATOM 0 H GLN A 53 20.804 3.309 -3.463 1.00 0.00 H new ATOM 0 HA GLN A 53 23.322 2.212 -4.432 1.00 0.00 H new ATOM 0 HB2 GLN A 53 22.626 3.719 -1.881 1.00 0.00 H new ATOM 0 HB3 GLN A 53 24.242 3.369 -2.459 1.00 0.00 H new ATOM 0 HG2 GLN A 53 24.066 5.497 -3.263 1.00 0.00 H new ATOM 0 HG3 GLN A 53 23.363 4.659 -4.632 1.00 0.00 H new ATOM 0 HE21 GLN A 53 22.715 7.228 -4.462 1.00 0.00 H new ATOM 0 HE22 GLN A 53 21.067 7.455 -3.867 1.00 0.00 H new ATOM 822 N ASP A 54 21.838 1.115 -1.683 1.00 0.00 N ATOM 823 CA ASP A 54 21.757 -0.020 -0.772 1.00 0.00 C ATOM 824 C ASP A 54 21.363 -1.290 -1.520 1.00 0.00 C ATOM 825 O ASP A 54 20.545 -1.253 -2.439 1.00 0.00 O ATOM 826 CB ASP A 54 20.749 0.264 0.343 1.00 0.00 C ATOM 827 CG ASP A 54 20.728 -0.825 1.396 1.00 0.00 C ATOM 828 OD1 ASP A 54 20.153 -1.900 1.127 1.00 0.00 O ATOM 829 OD2 ASP A 54 21.286 -0.603 2.492 1.00 0.00 O ATOM 0 H ASP A 54 21.181 1.868 -1.478 1.00 0.00 H new ATOM 0 HA ASP A 54 22.742 -0.171 -0.330 1.00 0.00 H new ATOM 0 HB2 ASP A 54 20.992 1.216 0.814 1.00 0.00 H new ATOM 0 HB3 ASP A 54 19.754 0.367 -0.089 1.00 0.00 H new ATOM 834 N PHE A 55 21.950 -2.413 -1.119 1.00 0.00 N ATOM 835 CA PHE A 55 21.661 -3.694 -1.753 1.00 0.00 C ATOM 836 C PHE A 55 20.519 -4.409 -1.038 1.00 0.00 C ATOM 837 O PHE A 55 19.663 -5.025 -1.673 1.00 0.00 O ATOM 838 CB PHE A 55 22.910 -4.579 -1.755 1.00 0.00 C ATOM 839 CG PHE A 55 23.022 -5.460 -0.544 1.00 0.00 C ATOM 840 CD1 PHE A 55 23.334 -4.922 0.695 1.00 0.00 C ATOM 841 CD2 PHE A 55 22.816 -6.827 -0.644 1.00 0.00 C ATOM 842 CE1 PHE A 55 23.437 -5.731 1.811 1.00 0.00 C ATOM 843 CE2 PHE A 55 22.918 -7.640 0.469 1.00 0.00 C ATOM 844 CZ PHE A 55 23.230 -7.091 1.698 1.00 0.00 C ATOM 0 H PHE A 55 22.628 -2.462 -0.359 1.00 0.00 H new ATOM 0 HA PHE A 55 21.358 -3.502 -2.782 1.00 0.00 H new ATOM 0 HB2 PHE A 55 22.902 -5.203 -2.649 1.00 0.00 H new ATOM 0 HB3 PHE A 55 23.795 -3.945 -1.816 1.00 0.00 H new ATOM 0 HD1 PHE A 55 23.498 -3.859 0.789 1.00 0.00 H new ATOM 0 HD2 PHE A 55 22.573 -7.262 -1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 55 23.679 -5.299 2.771 1.00 0.00 H new ATOM 0 HE2 PHE A 55 22.754 -8.704 0.378 1.00 0.00 H new ATOM 0 HZ PHE A 55 23.312 -7.725 2.569 1.00 0.00 H new ATOM 854 N ALA A 56 20.513 -4.323 0.288 1.00 0.00 N ATOM 855 CA ALA A 56 19.475 -4.960 1.090 1.00 0.00 C ATOM 856 C ALA A 56 18.137 -4.955 0.360 1.00 0.00 C ATOM 857 O ALA A 56 17.525 -6.005 0.157 1.00 0.00 O ATOM 858 CB ALA A 56 19.347 -4.264 2.437 1.00 0.00 C ATOM 0 H ALA A 56 21.215 -3.819 0.830 1.00 0.00 H new ATOM 0 HA ALA A 56 19.764 -5.998 1.256 1.00 0.00 H new ATOM 0 HB1 ALA A 56 18.569 -4.750 3.025 1.00 0.00 H new ATOM 0 HB2 ALA A 56 20.296 -4.325 2.970 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.085 -3.217 2.282 1.00 0.00 H new ATOM 864 N CYS A 57 17.686 -3.769 -0.031 1.00 0.00 N ATOM 865 CA CYS A 57 16.418 -3.627 -0.737 1.00 0.00 C ATOM 866 C CYS A 57 16.196 -4.793 -1.695 1.00 0.00 C ATOM 867 O CYS A 57 15.162 -5.459 -1.649 1.00 0.00 O ATOM 868 CB CYS A 57 16.383 -2.306 -1.506 1.00 0.00 C ATOM 869 SG CYS A 57 14.720 -1.764 -1.967 1.00 0.00 S ATOM 0 H CYS A 57 18.180 -2.891 0.129 1.00 0.00 H new ATOM 0 HA CYS A 57 15.617 -3.630 0.002 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.850 -1.531 -0.898 1.00 0.00 H new ATOM 0 HB3 CYS A 57 16.984 -2.408 -2.410 1.00 0.00 H new ATOM 0 HG CYS A 57 14.665 -1.577 -3.252 1.00 0.00 H new ATOM 875 N GLN A 58 17.173 -5.032 -2.564 1.00 0.00 N ATOM 876 CA GLN A 58 17.083 -6.116 -3.535 1.00 0.00 C ATOM 877 C GLN A 58 16.691 -7.424 -2.856 1.00 0.00 C ATOM 878 O GLN A 58 15.601 -7.950 -3.082 1.00 0.00 O ATOM 879 CB GLN A 58 18.416 -6.287 -4.266 1.00 0.00 C ATOM 880 CG GLN A 58 18.508 -5.490 -5.557 1.00 0.00 C ATOM 881 CD GLN A 58 17.500 -5.943 -6.595 1.00 0.00 C ATOM 882 OE1 GLN A 58 17.339 -7.254 -6.732 1.00 0.00 O flip ATOM 883 NE2 GLN A 58 16.873 -5.124 -7.267 1.00 0.00 N flip ATOM 0 H GLN A 58 18.035 -4.490 -2.615 1.00 0.00 H new ATOM 0 HA GLN A 58 16.310 -5.858 -4.259 1.00 0.00 H new ATOM 0 HB2 GLN A 58 19.226 -5.984 -3.603 1.00 0.00 H new ATOM 0 HB3 GLN A 58 18.566 -7.343 -4.489 1.00 0.00 H new ATOM 0 HG2 GLN A 58 18.350 -4.434 -5.340 1.00 0.00 H new ATOM 0 HG3 GLN A 58 19.514 -5.584 -5.967 1.00 0.00 H new ATOM 0 HE21 GLN A 58 17.028 -4.125 -7.129 1.00 0.00 H new ATOM 0 HE22 GLN A 58 16.198 -5.444 -7.962 1.00 0.00 H new ATOM 892 N CYS A 59 17.587 -7.944 -2.023 1.00 0.00 N ATOM 893 CA CYS A 59 17.335 -9.192 -1.312 1.00 0.00 C ATOM 894 C CYS A 59 15.936 -9.199 -0.704 1.00 0.00 C ATOM 895 O CYS A 59 15.228 -10.205 -0.760 1.00 0.00 O ATOM 896 CB CYS A 59 18.381 -9.399 -0.216 1.00 0.00 C ATOM 897 SG CYS A 59 18.488 -11.098 0.393 1.00 0.00 S ATOM 0 H CYS A 59 18.493 -7.521 -1.824 1.00 0.00 H new ATOM 0 HA CYS A 59 17.404 -10.010 -2.029 1.00 0.00 H new ATOM 0 HB2 CYS A 59 19.357 -9.100 -0.599 1.00 0.00 H new ATOM 0 HB3 CYS A 59 18.151 -8.739 0.620 1.00 0.00 H new ATOM 0 HG CYS A 59 19.401 -11.172 1.315 1.00 0.00 H new ATOM 903 N LEU A 60 15.544 -8.071 -0.122 1.00 0.00 N ATOM 904 CA LEU A 60 14.230 -7.946 0.498 1.00 0.00 C ATOM 905 C LEU A 60 13.122 -8.234 -0.510 1.00 0.00 C ATOM 906 O LEU A 60 12.408 -9.229 -0.396 1.00 0.00 O ATOM 907 CB LEU A 60 14.051 -6.544 1.083 1.00 0.00 C ATOM 908 CG LEU A 60 14.615 -6.326 2.488 1.00 0.00 C ATOM 909 CD1 LEU A 60 15.055 -4.882 2.669 1.00 0.00 C ATOM 910 CD2 LEU A 60 13.584 -6.707 3.541 1.00 0.00 C ATOM 0 H LEU A 60 16.118 -7.230 -0.067 1.00 0.00 H new ATOM 0 HA LEU A 60 14.164 -8.679 1.302 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.522 -5.828 0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 60 12.986 -6.313 1.101 1.00 0.00 H new ATOM 0 HG LEU A 60 15.487 -6.968 2.612 1.00 0.00 H new ATOM 0 HD11 LEU A 60 15.453 -4.746 3.674 1.00 0.00 H new ATOM 0 HD12 LEU A 60 15.827 -4.642 1.938 1.00 0.00 H new ATOM 0 HD13 LEU A 60 14.201 -4.221 2.525 1.00 0.00 H new ATOM 0 HD21 LEU A 60 14.002 -6.546 4.535 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.693 -6.091 3.418 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.317 -7.758 3.426 1.00 0.00 H new ATOM 922 N ASN A 61 12.987 -7.356 -1.499 1.00 0.00 N ATOM 923 CA ASN A 61 11.967 -7.516 -2.529 1.00 0.00 C ATOM 924 C ASN A 61 12.047 -8.902 -3.163 1.00 0.00 C ATOM 925 O ASN A 61 11.086 -9.374 -3.769 1.00 0.00 O ATOM 926 CB ASN A 61 12.126 -6.441 -3.606 1.00 0.00 C ATOM 927 CG ASN A 61 11.002 -6.470 -4.623 1.00 0.00 C ATOM 928 OD1 ASN A 61 10.727 -7.504 -5.232 1.00 0.00 O ATOM 929 ND2 ASN A 61 10.346 -5.331 -4.812 1.00 0.00 N ATOM 0 H ASN A 61 13.571 -6.527 -1.609 1.00 0.00 H new ATOM 0 HA ASN A 61 10.990 -7.407 -2.058 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.159 -5.459 -3.133 1.00 0.00 H new ATOM 0 HB3 ASN A 61 13.078 -6.581 -4.117 1.00 0.00 H new ATOM 0 HD21 ASN A 61 9.580 -5.289 -5.484 1.00 0.00 H new ATOM 0 HD22 ASN A 61 10.608 -4.498 -4.285 1.00 0.00 H new ATOM 936 N ARG A 62 13.199 -9.548 -3.016 1.00 0.00 N ATOM 937 CA ARG A 62 13.405 -10.879 -3.574 1.00 0.00 C ATOM 938 C ARG A 62 12.192 -11.769 -3.319 1.00 0.00 C ATOM 939 O ARG A 62 11.544 -12.235 -4.257 1.00 0.00 O ATOM 940 CB ARG A 62 14.657 -11.520 -2.972 1.00 0.00 C ATOM 941 CG ARG A 62 15.217 -12.661 -3.804 1.00 0.00 C ATOM 942 CD ARG A 62 16.637 -13.010 -3.386 1.00 0.00 C ATOM 943 NE ARG A 62 17.401 -13.599 -4.483 1.00 0.00 N ATOM 944 CZ ARG A 62 17.168 -14.811 -4.973 1.00 0.00 C ATOM 945 NH1 ARG A 62 16.197 -15.559 -4.467 1.00 0.00 N ATOM 946 NH2 ARG A 62 17.906 -15.277 -5.972 1.00 0.00 N ATOM 0 H ARG A 62 14.004 -9.171 -2.515 1.00 0.00 H new ATOM 0 HA ARG A 62 13.540 -10.777 -4.651 1.00 0.00 H new ATOM 0 HB2 ARG A 62 15.425 -10.756 -2.855 1.00 0.00 H new ATOM 0 HB3 ARG A 62 14.421 -11.891 -1.974 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.579 -13.538 -3.697 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.204 -12.384 -4.858 1.00 0.00 H new ATOM 0 HD2 ARG A 62 17.143 -12.111 -3.034 1.00 0.00 H new ATOM 0 HD3 ARG A 62 16.608 -13.708 -2.549 1.00 0.00 H new ATOM 0 HE ARG A 62 18.155 -13.049 -4.895 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.627 -15.204 -3.699 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.020 -16.490 -4.845 1.00 0.00 H new ATOM 0 HH21 ARG A 62 18.653 -14.704 -6.364 1.00 0.00 H new ATOM 0 HH22 ARG A 62 17.726 -16.208 -6.348 1.00 0.00 H new ATOM 960 N ASP A 63 11.892 -12.000 -2.046 1.00 0.00 N ATOM 961 CA ASP A 63 10.756 -12.833 -1.668 1.00 0.00 C ATOM 962 C ASP A 63 9.733 -12.029 -0.871 1.00 0.00 C ATOM 963 O ASP A 63 8.528 -12.251 -0.986 1.00 0.00 O ATOM 964 CB ASP A 63 11.229 -14.035 -0.848 1.00 0.00 C ATOM 965 CG ASP A 63 12.068 -14.999 -1.664 1.00 0.00 C ATOM 966 OD1 ASP A 63 11.667 -15.317 -2.803 1.00 0.00 O ATOM 967 OD2 ASP A 63 13.127 -15.433 -1.164 1.00 0.00 O ATOM 0 H ASP A 63 12.419 -11.623 -1.259 1.00 0.00 H new ATOM 0 HA ASP A 63 10.279 -13.190 -2.581 1.00 0.00 H new ATOM 0 HB2 ASP A 63 11.811 -13.683 0.004 1.00 0.00 H new ATOM 0 HB3 ASP A 63 10.363 -14.561 -0.447 1.00 0.00 H new ATOM 972 N VAL A 64 10.223 -11.095 -0.063 1.00 0.00 N ATOM 973 CA VAL A 64 9.352 -10.257 0.753 1.00 0.00 C ATOM 974 C VAL A 64 8.320 -9.536 -0.107 1.00 0.00 C ATOM 975 O VAL A 64 7.127 -9.833 -0.043 1.00 0.00 O ATOM 976 CB VAL A 64 10.159 -9.215 1.549 1.00 0.00 C ATOM 977 CG1 VAL A 64 9.230 -8.323 2.358 1.00 0.00 C ATOM 978 CG2 VAL A 64 11.172 -9.903 2.453 1.00 0.00 C ATOM 0 H VAL A 64 11.218 -10.899 0.044 1.00 0.00 H new ATOM 0 HA VAL A 64 8.840 -10.919 1.451 1.00 0.00 H new ATOM 0 HB VAL A 64 10.703 -8.587 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.819 -7.593 2.914 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.548 -7.803 1.685 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.656 -8.933 3.056 1.00 0.00 H new ATOM 0 HG21 VAL A 64 11.734 -9.152 3.008 1.00 0.00 H new ATOM 0 HG22 VAL A 64 10.651 -10.557 3.152 1.00 0.00 H new ATOM 0 HG23 VAL A 64 11.858 -10.494 1.847 1.00 0.00 H new ATOM 988 N TRP A 65 8.787 -8.587 -0.910 1.00 0.00 N ATOM 989 CA TRP A 65 7.905 -7.823 -1.784 1.00 0.00 C ATOM 990 C TRP A 65 7.620 -8.586 -3.073 1.00 0.00 C ATOM 991 O TRP A 65 7.162 -8.009 -4.058 1.00 0.00 O ATOM 992 CB TRP A 65 8.527 -6.464 -2.108 1.00 0.00 C ATOM 993 CG TRP A 65 9.073 -5.758 -0.904 1.00 0.00 C ATOM 994 CD1 TRP A 65 10.365 -5.367 -0.699 1.00 0.00 C ATOM 995 CD2 TRP A 65 8.342 -5.360 0.261 1.00 0.00 C ATOM 996 NE1 TRP A 65 10.482 -4.751 0.523 1.00 0.00 N ATOM 997 CE2 TRP A 65 9.255 -4.733 1.132 1.00 0.00 C ATOM 998 CE3 TRP A 65 7.005 -5.472 0.653 1.00 0.00 C ATOM 999 CZ2 TRP A 65 8.872 -4.222 2.369 1.00 0.00 C ATOM 1000 CZ3 TRP A 65 6.627 -4.964 1.881 1.00 0.00 C ATOM 1001 CH2 TRP A 65 7.557 -4.345 2.727 1.00 0.00 C ATOM 0 H TRP A 65 9.772 -8.328 -0.974 1.00 0.00 H new ATOM 0 HA TRP A 65 6.962 -7.668 -1.260 1.00 0.00 H new ATOM 0 HB2 TRP A 65 9.329 -6.603 -2.833 1.00 0.00 H new ATOM 0 HB3 TRP A 65 7.775 -5.832 -2.581 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.176 -5.520 -1.396 1.00 0.00 H new ATOM 0 HE1 TRP A 65 11.343 -4.369 0.914 1.00 0.00 H new ATOM 0 HE3 TRP A 65 6.281 -5.947 0.008 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 9.587 -3.745 3.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 5.597 -5.045 2.194 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.229 -3.957 3.680 1.00 0.00 H new ATOM 1012 N SER A 66 7.895 -9.886 -3.058 1.00 0.00 N ATOM 1013 CA SER A 66 7.672 -10.728 -4.228 1.00 0.00 C ATOM 1014 C SER A 66 6.635 -11.807 -3.931 1.00 0.00 C ATOM 1015 O SER A 66 5.938 -12.277 -4.829 1.00 0.00 O ATOM 1016 CB SER A 66 8.984 -11.375 -4.675 1.00 0.00 C ATOM 1017 OG SER A 66 8.768 -12.282 -5.743 1.00 0.00 O ATOM 0 H SER A 66 8.272 -10.379 -2.249 1.00 0.00 H new ATOM 0 HA SER A 66 7.294 -10.097 -5.032 1.00 0.00 H new ATOM 0 HB2 SER A 66 9.687 -10.602 -4.987 1.00 0.00 H new ATOM 0 HB3 SER A 66 9.439 -11.899 -3.835 1.00 0.00 H new ATOM 0 HG SER A 66 9.622 -12.681 -6.011 1.00 0.00 H new ATOM 1023 N ASN A 67 6.539 -12.194 -2.663 1.00 0.00 N ATOM 1024 CA ASN A 67 5.588 -13.218 -2.246 1.00 0.00 C ATOM 1025 C ASN A 67 4.161 -12.808 -2.595 1.00 0.00 C ATOM 1026 O ASN A 67 3.636 -11.833 -2.058 1.00 0.00 O ATOM 1027 CB ASN A 67 5.705 -13.470 -0.742 1.00 0.00 C ATOM 1028 CG ASN A 67 4.971 -14.723 -0.307 1.00 0.00 C ATOM 1029 OD1 ASN A 67 3.742 -14.782 -0.350 1.00 0.00 O ATOM 1030 ND2 ASN A 67 5.723 -15.733 0.117 1.00 0.00 N ATOM 0 H ASN A 67 7.108 -11.814 -1.907 1.00 0.00 H new ATOM 0 HA ASN A 67 5.824 -14.138 -2.781 1.00 0.00 H new ATOM 0 HB2 ASN A 67 6.757 -13.556 -0.472 1.00 0.00 H new ATOM 0 HB3 ASN A 67 5.306 -12.612 -0.201 1.00 0.00 H new ATOM 0 HD21 ASN A 67 5.285 -16.601 0.424 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.739 -15.640 0.136 1.00 0.00 H new ATOM 1037 N GLU A 68 3.538 -13.561 -3.497 1.00 0.00 N ATOM 1038 CA GLU A 68 2.171 -13.276 -3.917 1.00 0.00 C ATOM 1039 C GLU A 68 1.279 -12.997 -2.711 1.00 0.00 C ATOM 1040 O GLU A 68 0.617 -11.962 -2.642 1.00 0.00 O ATOM 1041 CB GLU A 68 1.607 -14.447 -4.724 1.00 0.00 C ATOM 1042 CG GLU A 68 0.572 -14.033 -5.756 1.00 0.00 C ATOM 1043 CD GLU A 68 1.187 -13.330 -6.950 1.00 0.00 C ATOM 1044 OE1 GLU A 68 2.168 -12.582 -6.759 1.00 0.00 O ATOM 1045 OE2 GLU A 68 0.687 -13.529 -8.077 1.00 0.00 O ATOM 0 H GLU A 68 3.958 -14.372 -3.950 1.00 0.00 H new ATOM 0 HA GLU A 68 2.189 -12.387 -4.547 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.427 -14.958 -5.229 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.157 -15.166 -4.039 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.032 -14.916 -6.098 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.159 -13.374 -5.288 1.00 0.00 H new ATOM 1052 N ALA A 69 1.266 -13.929 -1.764 1.00 0.00 N ATOM 1053 CA ALA A 69 0.456 -13.784 -0.561 1.00 0.00 C ATOM 1054 C ALA A 69 0.621 -12.396 0.048 1.00 0.00 C ATOM 1055 O ALA A 69 -0.340 -11.803 0.537 1.00 0.00 O ATOM 1056 CB ALA A 69 0.824 -14.855 0.455 1.00 0.00 C ATOM 0 H ALA A 69 1.807 -14.793 -1.807 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.590 -13.908 -0.840 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.211 -14.735 1.348 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.648 -15.841 0.024 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.877 -14.758 0.721 1.00 0.00 H new ATOM 1062 N VAL A 70 1.847 -11.882 0.015 1.00 0.00 N ATOM 1063 CA VAL A 70 2.138 -10.563 0.564 1.00 0.00 C ATOM 1064 C VAL A 70 1.564 -9.462 -0.320 1.00 0.00 C ATOM 1065 O VAL A 70 0.858 -8.573 0.156 1.00 0.00 O ATOM 1066 CB VAL A 70 3.654 -10.343 0.721 1.00 0.00 C ATOM 1067 CG1 VAL A 70 3.941 -8.929 1.204 1.00 0.00 C ATOM 1068 CG2 VAL A 70 4.246 -11.371 1.673 1.00 0.00 C ATOM 0 H VAL A 70 2.654 -12.359 -0.386 1.00 0.00 H new ATOM 0 HA VAL A 70 1.669 -10.518 1.547 1.00 0.00 H new ATOM 0 HB VAL A 70 4.125 -10.471 -0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 70 5.017 -8.792 1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.553 -8.212 0.481 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.459 -8.769 2.168 1.00 0.00 H new ATOM 0 HG21 VAL A 70 5.318 -11.200 1.772 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.772 -11.278 2.650 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.073 -12.373 1.280 1.00 0.00 H new ATOM 1078 N LYS A 71 1.872 -9.526 -1.611 1.00 0.00 N ATOM 1079 CA LYS A 71 1.386 -8.536 -2.564 1.00 0.00 C ATOM 1080 C LYS A 71 -0.136 -8.443 -2.525 1.00 0.00 C ATOM 1081 O LYS A 71 -0.699 -7.351 -2.469 1.00 0.00 O ATOM 1082 CB LYS A 71 1.849 -8.890 -3.979 1.00 0.00 C ATOM 1083 CG LYS A 71 3.349 -8.753 -4.181 1.00 0.00 C ATOM 1084 CD LYS A 71 3.868 -9.753 -5.200 1.00 0.00 C ATOM 1085 CE LYS A 71 3.756 -9.213 -6.618 1.00 0.00 C ATOM 1086 NZ LYS A 71 2.373 -9.347 -7.155 1.00 0.00 N ATOM 0 H LYS A 71 2.457 -10.254 -2.021 1.00 0.00 H new ATOM 0 HA LYS A 71 1.799 -7.567 -2.284 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.553 -9.915 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.335 -8.246 -4.692 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.581 -7.741 -4.512 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.860 -8.903 -3.230 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.909 -9.990 -4.981 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.305 -10.683 -5.118 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.051 -8.164 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.451 -9.747 -7.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.346 -8.999 -8.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.088 -10.347 -7.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.718 -8.788 -6.571 1.00 0.00 H new ATOM 1100 N ASN A 72 -0.795 -9.597 -2.553 1.00 0.00 N ATOM 1101 CA ASN A 72 -2.253 -9.645 -2.519 1.00 0.00 C ATOM 1102 C ASN A 72 -2.792 -8.932 -1.283 1.00 0.00 C ATOM 1103 O ASN A 72 -3.879 -8.354 -1.313 1.00 0.00 O ATOM 1104 CB ASN A 72 -2.736 -11.097 -2.535 1.00 0.00 C ATOM 1105 CG ASN A 72 -2.326 -11.828 -3.799 1.00 0.00 C ATOM 1106 OD1 ASN A 72 -1.922 -11.210 -4.784 1.00 0.00 O ATOM 1107 ND2 ASN A 72 -2.428 -13.152 -3.775 1.00 0.00 N ATOM 0 H ASN A 72 -0.344 -10.510 -2.599 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.630 -9.133 -3.405 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.333 -11.621 -1.668 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.822 -11.117 -2.443 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.166 -13.699 -4.595 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -2.768 -13.622 -2.936 1.00 0.00 H new ATOM 1114 N ILE A 73 -2.025 -8.977 -0.199 1.00 0.00 N ATOM 1115 CA ILE A 73 -2.425 -8.333 1.046 1.00 0.00 C ATOM 1116 C ILE A 73 -2.113 -6.841 1.019 1.00 0.00 C ATOM 1117 O ILE A 73 -2.920 -6.020 1.457 1.00 0.00 O ATOM 1118 CB ILE A 73 -1.723 -8.971 2.260 1.00 0.00 C ATOM 1119 CG1 ILE A 73 -2.218 -10.403 2.469 1.00 0.00 C ATOM 1120 CG2 ILE A 73 -1.961 -8.134 3.509 1.00 0.00 C ATOM 1121 CD1 ILE A 73 -1.370 -11.201 3.433 1.00 0.00 C ATOM 0 H ILE A 73 -1.124 -9.452 -0.158 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.501 -8.474 1.143 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.651 -9.003 2.066 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.243 -10.374 2.838 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.240 -10.915 1.507 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.459 -8.597 4.358 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.564 -7.131 3.356 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.031 -8.074 3.708 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.780 -12.206 3.532 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.349 -11.261 3.056 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.368 -10.712 4.407 1.00 0.00 H new ATOM 1133 N ILE A 74 -0.939 -6.497 0.500 1.00 0.00 N ATOM 1134 CA ILE A 74 -0.523 -5.103 0.412 1.00 0.00 C ATOM 1135 C ILE A 74 -1.348 -4.346 -0.623 1.00 0.00 C ATOM 1136 O ILE A 74 -1.328 -3.116 -0.670 1.00 0.00 O ATOM 1137 CB ILE A 74 0.970 -4.983 0.051 1.00 0.00 C ATOM 1138 CG1 ILE A 74 1.834 -5.607 1.148 1.00 0.00 C ATOM 1139 CG2 ILE A 74 1.347 -3.525 -0.164 1.00 0.00 C ATOM 1140 CD1 ILE A 74 3.276 -5.813 0.737 1.00 0.00 C ATOM 0 H ILE A 74 -0.260 -7.164 0.134 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.687 -4.662 1.395 1.00 0.00 H new ATOM 0 HB ILE A 74 1.149 -5.525 -0.878 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.804 -4.968 2.031 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.405 -6.567 1.435 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.405 -3.456 -0.418 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.751 -3.111 -0.977 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.156 -2.961 0.749 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.830 -6.259 1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.317 -6.476 -0.127 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.721 -4.852 0.478 1.00 0.00 H new ATOM 1152 N ARG A 75 -2.073 -5.090 -1.452 1.00 0.00 N ATOM 1153 CA ARG A 75 -2.906 -4.490 -2.487 1.00 0.00 C ATOM 1154 C ARG A 75 -4.354 -4.371 -2.019 1.00 0.00 C ATOM 1155 O ARG A 75 -5.048 -3.411 -2.353 1.00 0.00 O ATOM 1156 CB ARG A 75 -2.840 -5.320 -3.770 1.00 0.00 C ATOM 1157 CG ARG A 75 -3.757 -6.532 -3.759 1.00 0.00 C ATOM 1158 CD ARG A 75 -3.963 -7.087 -5.160 1.00 0.00 C ATOM 1159 NE ARG A 75 -4.655 -8.373 -5.143 1.00 0.00 N ATOM 1160 CZ ARG A 75 -5.272 -8.890 -6.200 1.00 0.00 C ATOM 1161 NH1 ARG A 75 -5.283 -8.233 -7.352 1.00 0.00 N ATOM 1162 NH2 ARG A 75 -5.879 -10.065 -6.105 1.00 0.00 N ATOM 0 H ARG A 75 -2.100 -6.109 -1.427 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.525 -3.489 -2.690 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -3.101 -4.685 -4.617 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.814 -5.653 -3.925 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -3.332 -7.305 -3.119 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -4.721 -6.257 -3.330 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -4.537 -6.374 -5.751 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -2.996 -7.202 -5.650 1.00 0.00 H new ATOM 0 HE ARG A 75 -4.665 -8.903 -4.272 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -4.817 -7.329 -7.428 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -5.757 -8.632 -8.162 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -5.872 -10.572 -5.220 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -6.353 -10.461 -6.917 1.00 0.00 H new ATOM 1176 N GLU A 76 -4.803 -5.354 -1.244 1.00 0.00 N ATOM 1177 CA GLU A 76 -6.168 -5.360 -0.732 1.00 0.00 C ATOM 1178 C GLU A 76 -6.251 -4.630 0.605 1.00 0.00 C ATOM 1179 O GLU A 76 -6.878 -3.576 0.712 1.00 0.00 O ATOM 1180 CB GLU A 76 -6.671 -6.797 -0.574 1.00 0.00 C ATOM 1181 CG GLU A 76 -8.113 -6.889 -0.105 1.00 0.00 C ATOM 1182 CD GLU A 76 -9.105 -6.545 -1.199 1.00 0.00 C ATOM 1183 OE1 GLU A 76 -9.305 -5.340 -1.463 1.00 0.00 O ATOM 1184 OE2 GLU A 76 -9.681 -7.481 -1.792 1.00 0.00 O ATOM 0 H GLU A 76 -4.241 -6.156 -0.957 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.800 -4.839 -1.450 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.575 -7.314 -1.529 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.032 -7.320 0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.310 -7.899 0.255 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.260 -6.215 0.739 1.00 0.00 H new ATOM 1191 N HIS A 77 -5.613 -5.200 1.624 1.00 0.00 N ATOM 1192 CA HIS A 77 -5.614 -4.604 2.955 1.00 0.00 C ATOM 1193 C HIS A 77 -4.920 -3.245 2.943 1.00 0.00 C ATOM 1194 O HIS A 77 -5.334 -2.319 3.640 1.00 0.00 O ATOM 1195 CB HIS A 77 -4.924 -5.534 3.953 1.00 0.00 C ATOM 1196 CG HIS A 77 -5.706 -6.774 4.256 1.00 0.00 C ATOM 1197 ND1 HIS A 77 -5.432 -8.077 4.009 1.00 0.00 N flip ATOM 1198 CD2 HIS A 77 -6.932 -6.756 4.888 1.00 0.00 C flip ATOM 1199 CE1 HIS A 77 -6.485 -8.813 4.492 1.00 0.00 C flip ATOM 1200 NE2 HIS A 77 -7.377 -7.993 5.018 1.00 0.00 N flip ATOM 0 H HIS A 77 -5.090 -6.073 1.553 1.00 0.00 H new ATOM 0 HA HIS A 77 -6.650 -4.459 3.261 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -3.948 -5.817 3.558 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -4.747 -4.990 4.881 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -7.448 -5.869 5.224 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -6.570 -9.889 4.449 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -8.259 -8.268 5.451 1.00 0.00 H new ATOM 1209 N PHE A 78 -3.862 -3.134 2.147 1.00 0.00 N ATOM 1210 CA PHE A 78 -3.109 -1.890 2.046 1.00 0.00 C ATOM 1211 C PHE A 78 -3.021 -1.424 0.595 1.00 0.00 C ATOM 1212 O PHE A 78 -3.510 -2.095 -0.314 1.00 0.00 O ATOM 1213 CB PHE A 78 -1.702 -2.071 2.620 1.00 0.00 C ATOM 1214 CG PHE A 78 -1.692 -2.627 4.016 1.00 0.00 C ATOM 1215 CD1 PHE A 78 -2.115 -3.923 4.263 1.00 0.00 C ATOM 1216 CD2 PHE A 78 -1.260 -1.853 5.081 1.00 0.00 C ATOM 1217 CE1 PHE A 78 -2.106 -4.438 5.546 1.00 0.00 C ATOM 1218 CE2 PHE A 78 -1.249 -2.362 6.365 1.00 0.00 C ATOM 1219 CZ PHE A 78 -1.674 -3.655 6.599 1.00 0.00 C ATOM 0 H PHE A 78 -3.507 -3.891 1.562 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.634 -1.129 2.624 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.135 -2.736 1.968 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.190 -1.109 2.617 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.456 -4.538 3.443 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -0.928 -0.840 4.905 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -2.436 -5.451 5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.908 -1.749 7.186 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.669 -4.053 7.603 1.00 0.00 H new ATOM 1229 N ILE A 79 -2.396 -0.269 0.388 1.00 0.00 N ATOM 1230 CA ILE A 79 -2.244 0.287 -0.951 1.00 0.00 C ATOM 1231 C ILE A 79 -0.790 0.234 -1.406 1.00 0.00 C ATOM 1232 O ILE A 79 0.033 1.048 -0.988 1.00 0.00 O ATOM 1233 CB ILE A 79 -2.738 1.744 -1.015 1.00 0.00 C ATOM 1234 CG1 ILE A 79 -4.179 1.840 -0.510 1.00 0.00 C ATOM 1235 CG2 ILE A 79 -2.632 2.277 -2.436 1.00 0.00 C ATOM 1236 CD1 ILE A 79 -5.198 1.288 -1.482 1.00 0.00 C ATOM 0 H ILE A 79 -1.987 0.299 1.130 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.853 -0.324 -1.617 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.106 2.355 -0.370 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.261 1.302 0.434 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.414 2.884 -0.303 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.985 3.308 -2.465 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.593 2.240 -2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.243 1.666 -3.100 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -6.197 1.389 -1.058 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.144 1.842 -2.419 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.988 0.235 -1.670 1.00 0.00 H new ATOM 1248 N PHE A 80 -0.480 -0.730 -2.268 1.00 0.00 N ATOM 1249 CA PHE A 80 0.875 -0.889 -2.782 1.00 0.00 C ATOM 1250 C PHE A 80 1.359 0.397 -3.447 1.00 0.00 C ATOM 1251 O PHE A 80 0.921 0.743 -4.544 1.00 0.00 O ATOM 1252 CB PHE A 80 0.932 -2.046 -3.781 1.00 0.00 C ATOM 1253 CG PHE A 80 2.324 -2.377 -4.237 1.00 0.00 C ATOM 1254 CD1 PHE A 80 3.147 -3.183 -3.467 1.00 0.00 C ATOM 1255 CD2 PHE A 80 2.811 -1.881 -5.436 1.00 0.00 C ATOM 1256 CE1 PHE A 80 4.429 -3.488 -3.884 1.00 0.00 C ATOM 1257 CE2 PHE A 80 4.092 -2.183 -5.858 1.00 0.00 C ATOM 1258 CZ PHE A 80 4.901 -2.988 -5.082 1.00 0.00 C ATOM 0 H PHE A 80 -1.149 -1.412 -2.625 1.00 0.00 H new ATOM 0 HA PHE A 80 1.532 -1.112 -1.941 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.488 -2.931 -3.325 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.324 -1.795 -4.650 1.00 0.00 H new ATOM 0 HD1 PHE A 80 2.783 -3.578 -2.530 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.182 -1.251 -6.048 1.00 0.00 H new ATOM 0 HE1 PHE A 80 5.061 -4.116 -3.274 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.460 -1.789 -6.794 1.00 0.00 H new ATOM 0 HZ PHE A 80 5.902 -3.227 -5.411 1.00 0.00 H new ATOM 1268 N TRP A 81 2.264 1.099 -2.774 1.00 0.00 N ATOM 1269 CA TRP A 81 2.807 2.346 -3.300 1.00 0.00 C ATOM 1270 C TRP A 81 4.292 2.471 -2.979 1.00 0.00 C ATOM 1271 O TRP A 81 4.668 2.799 -1.854 1.00 0.00 O ATOM 1272 CB TRP A 81 2.046 3.541 -2.722 1.00 0.00 C ATOM 1273 CG TRP A 81 2.190 4.789 -3.540 1.00 0.00 C ATOM 1274 CD1 TRP A 81 1.554 5.078 -4.713 1.00 0.00 C ATOM 1275 CD2 TRP A 81 3.025 5.914 -3.246 1.00 0.00 C ATOM 1276 NE1 TRP A 81 1.943 6.315 -5.166 1.00 0.00 N ATOM 1277 CE2 TRP A 81 2.844 6.849 -4.284 1.00 0.00 C ATOM 1278 CE3 TRP A 81 3.906 6.224 -2.206 1.00 0.00 C ATOM 1279 CZ2 TRP A 81 3.513 8.070 -4.310 1.00 0.00 C ATOM 1280 CZ3 TRP A 81 4.569 7.436 -2.234 1.00 0.00 C ATOM 1281 CH2 TRP A 81 4.369 8.348 -3.280 1.00 0.00 C ATOM 0 H TRP A 81 2.637 0.826 -1.864 1.00 0.00 H new ATOM 0 HA TRP A 81 2.688 2.337 -4.383 1.00 0.00 H new ATOM 0 HB2 TRP A 81 0.989 3.286 -2.644 1.00 0.00 H new ATOM 0 HB3 TRP A 81 2.403 3.735 -1.710 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.849 4.429 -5.211 1.00 0.00 H new ATOM 0 HE1 TRP A 81 1.614 6.763 -6.021 1.00 0.00 H new ATOM 0 HE3 TRP A 81 4.066 5.529 -1.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 3.361 8.773 -5.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 5.253 7.685 -1.436 1.00 0.00 H new ATOM 0 HH2 TRP A 81 4.901 9.288 -3.272 1.00 0.00 H new ATOM 1292 N GLN A 82 5.132 2.206 -3.975 1.00 0.00 N ATOM 1293 CA GLN A 82 6.577 2.289 -3.797 1.00 0.00 C ATOM 1294 C GLN A 82 7.160 3.445 -4.603 1.00 0.00 C ATOM 1295 O GLN A 82 6.720 3.721 -5.719 1.00 0.00 O ATOM 1296 CB GLN A 82 7.239 0.975 -4.215 1.00 0.00 C ATOM 1297 CG GLN A 82 8.758 1.040 -4.239 1.00 0.00 C ATOM 1298 CD GLN A 82 9.300 1.523 -5.569 1.00 0.00 C ATOM 1299 OE1 GLN A 82 9.816 2.637 -5.675 1.00 0.00 O ATOM 1300 NE2 GLN A 82 9.187 0.687 -6.595 1.00 0.00 N ATOM 0 H GLN A 82 4.837 1.932 -4.912 1.00 0.00 H new ATOM 0 HA GLN A 82 6.778 2.470 -2.741 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.928 0.187 -3.529 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.880 0.696 -5.205 1.00 0.00 H new ATOM 0 HG2 GLN A 82 9.102 1.706 -3.447 1.00 0.00 H new ATOM 0 HG3 GLN A 82 9.164 0.052 -4.023 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.753 -0.226 -6.463 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.535 0.958 -7.515 1.00 0.00 H new ATOM 1309 N VAL A 83 8.152 4.118 -4.030 1.00 0.00 N ATOM 1310 CA VAL A 83 8.796 5.244 -4.696 1.00 0.00 C ATOM 1311 C VAL A 83 10.247 5.390 -4.251 1.00 0.00 C ATOM 1312 O VAL A 83 10.616 4.966 -3.155 1.00 0.00 O ATOM 1313 CB VAL A 83 8.050 6.563 -4.417 1.00 0.00 C ATOM 1314 CG1 VAL A 83 6.628 6.495 -4.951 1.00 0.00 C ATOM 1315 CG2 VAL A 83 8.055 6.872 -2.928 1.00 0.00 C ATOM 0 H VAL A 83 8.527 3.903 -3.106 1.00 0.00 H new ATOM 0 HA VAL A 83 8.766 5.037 -5.766 1.00 0.00 H new ATOM 0 HB VAL A 83 8.568 7.370 -4.934 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.117 7.435 -4.745 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.651 6.323 -6.027 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.095 5.678 -4.464 1.00 0.00 H new ATOM 0 HG21 VAL A 83 7.524 7.807 -2.749 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.561 6.065 -2.387 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.083 6.966 -2.579 1.00 0.00 H new ATOM 1325 N TYR A 84 11.065 5.992 -5.106 1.00 0.00 N ATOM 1326 CA TYR A 84 12.477 6.192 -4.802 1.00 0.00 C ATOM 1327 C TYR A 84 12.698 7.526 -4.094 1.00 0.00 C ATOM 1328 O TYR A 84 11.888 8.446 -4.211 1.00 0.00 O ATOM 1329 CB TYR A 84 13.309 6.138 -6.084 1.00 0.00 C ATOM 1330 CG TYR A 84 13.543 4.735 -6.596 1.00 0.00 C ATOM 1331 CD1 TYR A 84 12.476 3.895 -6.890 1.00 0.00 C ATOM 1332 CD2 TYR A 84 14.831 4.249 -6.786 1.00 0.00 C ATOM 1333 CE1 TYR A 84 12.685 2.612 -7.357 1.00 0.00 C ATOM 1334 CE2 TYR A 84 15.050 2.968 -7.254 1.00 0.00 C ATOM 1335 CZ TYR A 84 13.974 2.153 -7.538 1.00 0.00 C ATOM 1336 OH TYR A 84 14.186 0.876 -8.004 1.00 0.00 O ATOM 0 H TYR A 84 10.775 6.350 -6.016 1.00 0.00 H new ATOM 0 HA TYR A 84 12.796 5.390 -4.136 1.00 0.00 H new ATOM 0 HB2 TYR A 84 12.807 6.719 -6.858 1.00 0.00 H new ATOM 0 HB3 TYR A 84 14.272 6.615 -5.902 1.00 0.00 H new ATOM 0 HD1 TYR A 84 11.466 4.251 -6.751 1.00 0.00 H new ATOM 0 HD2 TYR A 84 15.676 4.884 -6.564 1.00 0.00 H new ATOM 0 HE1 TYR A 84 11.844 1.971 -7.579 1.00 0.00 H new ATOM 0 HE2 TYR A 84 16.058 2.607 -7.397 1.00 0.00 H new ATOM 0 HH TYR A 84 15.149 0.710 -8.076 1.00 0.00 H new ATOM 1346 N HIS A 85 13.802 7.623 -3.360 1.00 0.00 N ATOM 1347 CA HIS A 85 14.132 8.844 -2.634 1.00 0.00 C ATOM 1348 C HIS A 85 14.513 9.964 -3.598 1.00 0.00 C ATOM 1349 O HIS A 85 14.118 11.115 -3.414 1.00 0.00 O ATOM 1350 CB HIS A 85 15.278 8.586 -1.655 1.00 0.00 C ATOM 1351 CG HIS A 85 16.565 8.214 -2.325 1.00 0.00 C ATOM 1352 ND1 HIS A 85 17.676 9.031 -2.328 1.00 0.00 N ATOM 1353 CD2 HIS A 85 16.915 7.103 -3.014 1.00 0.00 C ATOM 1354 CE1 HIS A 85 18.653 8.440 -2.992 1.00 0.00 C ATOM 1355 NE2 HIS A 85 18.217 7.268 -3.418 1.00 0.00 N ATOM 0 H HIS A 85 14.483 6.871 -3.252 1.00 0.00 H new ATOM 0 HA HIS A 85 13.249 9.155 -2.075 1.00 0.00 H new ATOM 0 HB2 HIS A 85 15.437 9.479 -1.051 1.00 0.00 H new ATOM 0 HB3 HIS A 85 14.989 7.787 -0.972 1.00 0.00 H new ATOM 0 HD1 HIS A 85 17.734 9.949 -1.886 1.00 0.00 H new ATOM 0 HD2 HIS A 85 16.287 6.246 -3.210 1.00 0.00 H new ATOM 0 HE1 HIS A 85 19.640 8.846 -3.158 1.00 0.00 H new ATOM 1364 N ASP A 86 15.282 9.618 -4.624 1.00 0.00 N ATOM 1365 CA ASP A 86 15.716 10.593 -5.618 1.00 0.00 C ATOM 1366 C ASP A 86 14.522 11.348 -6.196 1.00 0.00 C ATOM 1367 O ASP A 86 14.557 12.570 -6.336 1.00 0.00 O ATOM 1368 CB ASP A 86 16.489 9.900 -6.740 1.00 0.00 C ATOM 1369 CG ASP A 86 16.514 10.718 -8.017 1.00 0.00 C ATOM 1370 OD1 ASP A 86 17.376 11.615 -8.131 1.00 0.00 O ATOM 1371 OD2 ASP A 86 15.672 10.462 -8.902 1.00 0.00 O ATOM 0 H ASP A 86 15.618 8.669 -4.789 1.00 0.00 H new ATOM 0 HA ASP A 86 16.372 11.310 -5.125 1.00 0.00 H new ATOM 0 HB2 ASP A 86 17.511 9.713 -6.411 1.00 0.00 H new ATOM 0 HB3 ASP A 86 16.037 8.929 -6.943 1.00 0.00 H new ATOM 1376 N SER A 87 13.468 10.610 -6.531 1.00 0.00 N ATOM 1377 CA SER A 87 12.266 11.209 -7.098 1.00 0.00 C ATOM 1378 C SER A 87 11.663 12.231 -6.139 1.00 0.00 C ATOM 1379 O SER A 87 11.971 12.236 -4.948 1.00 0.00 O ATOM 1380 CB SER A 87 11.235 10.125 -7.421 1.00 0.00 C ATOM 1381 OG SER A 87 10.561 9.698 -6.250 1.00 0.00 O ATOM 0 H SER A 87 13.423 9.597 -6.419 1.00 0.00 H new ATOM 0 HA SER A 87 12.545 11.722 -8.018 1.00 0.00 H new ATOM 0 HB2 SER A 87 10.512 10.509 -8.141 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.731 9.275 -7.890 1.00 0.00 H new ATOM 0 HG SER A 87 11.200 9.273 -5.641 1.00 0.00 H new ATOM 1387 N GLU A 88 10.802 13.094 -6.669 1.00 0.00 N ATOM 1388 CA GLU A 88 10.157 14.122 -5.860 1.00 0.00 C ATOM 1389 C GLU A 88 9.394 13.498 -4.695 1.00 0.00 C ATOM 1390 O GLU A 88 9.648 13.815 -3.534 1.00 0.00 O ATOM 1391 CB GLU A 88 9.203 14.955 -6.720 1.00 0.00 C ATOM 1392 CG GLU A 88 8.680 16.197 -6.020 1.00 0.00 C ATOM 1393 CD GLU A 88 8.123 17.222 -6.988 1.00 0.00 C ATOM 1394 OE1 GLU A 88 8.537 17.210 -8.167 1.00 0.00 O ATOM 1395 OE2 GLU A 88 7.274 18.036 -6.569 1.00 0.00 O ATOM 0 H GLU A 88 10.535 13.102 -7.653 1.00 0.00 H new ATOM 0 HA GLU A 88 10.934 14.772 -5.457 1.00 0.00 H new ATOM 0 HB2 GLU A 88 9.717 15.253 -7.634 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.359 14.333 -7.017 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.902 15.910 -5.313 1.00 0.00 H new ATOM 0 HG3 GLU A 88 9.485 16.649 -5.441 1.00 0.00 H new ATOM 1402 N GLU A 89 8.459 12.609 -5.015 1.00 0.00 N ATOM 1403 CA GLU A 89 7.659 11.942 -3.995 1.00 0.00 C ATOM 1404 C GLU A 89 8.502 11.628 -2.762 1.00 0.00 C ATOM 1405 O GLU A 89 8.145 11.995 -1.643 1.00 0.00 O ATOM 1406 CB GLU A 89 7.053 10.652 -4.553 1.00 0.00 C ATOM 1407 CG GLU A 89 5.692 10.850 -5.201 1.00 0.00 C ATOM 1408 CD GLU A 89 5.739 11.808 -6.375 1.00 0.00 C ATOM 1409 OE1 GLU A 89 5.578 13.027 -6.154 1.00 0.00 O ATOM 1410 OE2 GLU A 89 5.937 11.339 -7.515 1.00 0.00 O ATOM 0 H GLU A 89 8.237 12.334 -5.972 1.00 0.00 H new ATOM 0 HA GLU A 89 6.854 12.616 -3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.737 10.227 -5.287 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.960 9.925 -3.746 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.311 9.886 -5.538 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.991 11.227 -4.457 1.00 0.00 H new ATOM 1417 N GLY A 90 9.623 10.946 -2.976 1.00 0.00 N ATOM 1418 CA GLY A 90 10.498 10.593 -1.874 1.00 0.00 C ATOM 1419 C GLY A 90 11.026 11.810 -1.141 1.00 0.00 C ATOM 1420 O GLY A 90 10.770 11.984 0.050 1.00 0.00 O ATOM 0 H GLY A 90 9.941 10.632 -3.893 1.00 0.00 H new ATOM 0 HA2 GLY A 90 9.957 9.957 -1.173 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.336 10.008 -2.253 1.00 0.00 H new ATOM 1424 N GLN A 91 11.767 12.653 -1.853 1.00 0.00 N ATOM 1425 CA GLN A 91 12.335 13.859 -1.261 1.00 0.00 C ATOM 1426 C GLN A 91 11.396 14.443 -0.210 1.00 0.00 C ATOM 1427 O GLN A 91 11.833 14.866 0.860 1.00 0.00 O ATOM 1428 CB GLN A 91 12.617 14.900 -2.345 1.00 0.00 C ATOM 1429 CG GLN A 91 13.809 14.556 -3.224 1.00 0.00 C ATOM 1430 CD GLN A 91 15.119 15.062 -2.654 1.00 0.00 C ATOM 1431 OE1 GLN A 91 15.389 16.264 -2.658 1.00 0.00 O ATOM 1432 NE2 GLN A 91 15.943 14.146 -2.159 1.00 0.00 N ATOM 0 H GLN A 91 11.988 12.523 -2.840 1.00 0.00 H new ATOM 0 HA GLN A 91 13.272 13.589 -0.775 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.732 15.007 -2.973 1.00 0.00 H new ATOM 0 HB3 GLN A 91 12.792 15.866 -1.872 1.00 0.00 H new ATOM 0 HG2 GLN A 91 13.864 13.474 -3.348 1.00 0.00 H new ATOM 0 HG3 GLN A 91 13.660 14.983 -4.216 1.00 0.00 H new ATOM 0 HE21 GLN A 91 15.680 13.161 -2.176 1.00 0.00 H new ATOM 0 HE22 GLN A 91 16.839 14.428 -1.762 1.00 0.00 H new ATOM 1441 N ARG A 92 10.105 14.463 -0.523 1.00 0.00 N ATOM 1442 CA ARG A 92 9.105 14.996 0.394 1.00 0.00 C ATOM 1443 C ARG A 92 8.805 14.001 1.511 1.00 0.00 C ATOM 1444 O ARG A 92 8.840 14.348 2.692 1.00 0.00 O ATOM 1445 CB ARG A 92 7.818 15.334 -0.361 1.00 0.00 C ATOM 1446 CG ARG A 92 7.846 16.698 -1.032 1.00 0.00 C ATOM 1447 CD ARG A 92 8.686 16.678 -2.300 1.00 0.00 C ATOM 1448 NE ARG A 92 10.084 17.006 -2.035 1.00 0.00 N ATOM 1449 CZ ARG A 92 10.545 18.250 -1.956 1.00 0.00 C ATOM 1450 NH1 ARG A 92 9.722 19.277 -2.120 1.00 0.00 N ATOM 1451 NH2 ARG A 92 11.831 18.468 -1.712 1.00 0.00 N ATOM 0 H ARG A 92 9.727 14.116 -1.405 1.00 0.00 H new ATOM 0 HA ARG A 92 9.507 15.906 0.840 1.00 0.00 H new ATOM 0 HB2 ARG A 92 7.639 14.570 -1.117 1.00 0.00 H new ATOM 0 HB3 ARG A 92 6.979 15.297 0.334 1.00 0.00 H new ATOM 0 HG2 ARG A 92 6.829 17.007 -1.273 1.00 0.00 H new ATOM 0 HG3 ARG A 92 8.248 17.437 -0.339 1.00 0.00 H new ATOM 0 HD2 ARG A 92 8.626 15.691 -2.759 1.00 0.00 H new ATOM 0 HD3 ARG A 92 8.276 17.389 -3.017 1.00 0.00 H new ATOM 0 HE ARG A 92 10.743 16.238 -1.903 1.00 0.00 H new ATOM 0 HH11 ARG A 92 8.733 19.113 -2.307 1.00 0.00 H new ATOM 0 HH12 ARG A 92 10.078 20.231 -2.059 1.00 0.00 H new ATOM 0 HH21 ARG A 92 12.467 17.680 -1.585 1.00 0.00 H new ATOM 0 HH22 ARG A 92 12.184 19.423 -1.652 1.00 0.00 H new ATOM 1465 N TYR A 93 8.509 12.763 1.129 1.00 0.00 N ATOM 1466 CA TYR A 93 8.200 11.718 2.098 1.00 0.00 C ATOM 1467 C TYR A 93 9.268 11.649 3.185 1.00 0.00 C ATOM 1468 O TYR A 93 8.964 11.418 4.356 1.00 0.00 O ATOM 1469 CB TYR A 93 8.082 10.363 1.397 1.00 0.00 C ATOM 1470 CG TYR A 93 7.291 9.342 2.183 1.00 0.00 C ATOM 1471 CD1 TYR A 93 5.901 9.363 2.185 1.00 0.00 C ATOM 1472 CD2 TYR A 93 7.932 8.356 2.923 1.00 0.00 C ATOM 1473 CE1 TYR A 93 5.174 8.433 2.902 1.00 0.00 C ATOM 1474 CE2 TYR A 93 7.213 7.421 3.642 1.00 0.00 C ATOM 1475 CZ TYR A 93 5.835 7.464 3.629 1.00 0.00 C ATOM 1476 OH TYR A 93 5.114 6.534 4.343 1.00 0.00 O ATOM 0 H TYR A 93 8.477 12.459 0.156 1.00 0.00 H new ATOM 0 HA TYR A 93 7.247 11.963 2.566 1.00 0.00 H new ATOM 0 HB2 TYR A 93 7.610 10.506 0.425 1.00 0.00 H new ATOM 0 HB3 TYR A 93 9.082 9.971 1.211 1.00 0.00 H new ATOM 0 HD1 TYR A 93 5.381 10.119 1.616 1.00 0.00 H new ATOM 0 HD2 TYR A 93 9.011 8.320 2.936 1.00 0.00 H new ATOM 0 HE1 TYR A 93 4.094 8.464 2.894 1.00 0.00 H new ATOM 0 HE2 TYR A 93 7.727 6.661 4.211 1.00 0.00 H new ATOM 0 HH TYR A 93 5.729 5.922 4.798 1.00 0.00 H new ATOM 1486 N ILE A 94 10.520 11.853 2.789 1.00 0.00 N ATOM 1487 CA ILE A 94 11.634 11.816 3.729 1.00 0.00 C ATOM 1488 C ILE A 94 11.528 12.943 4.751 1.00 0.00 C ATOM 1489 O ILE A 94 11.321 12.698 5.939 1.00 0.00 O ATOM 1490 CB ILE A 94 12.988 11.924 3.002 1.00 0.00 C ATOM 1491 CG1 ILE A 94 13.218 10.694 2.122 1.00 0.00 C ATOM 1492 CG2 ILE A 94 14.118 12.081 4.008 1.00 0.00 C ATOM 1493 CD1 ILE A 94 14.162 10.945 0.967 1.00 0.00 C ATOM 0 H ILE A 94 10.788 12.046 1.824 1.00 0.00 H new ATOM 0 HA ILE A 94 11.582 10.856 4.243 1.00 0.00 H new ATOM 0 HB ILE A 94 12.972 12.807 2.363 1.00 0.00 H new ATOM 0 HG12 ILE A 94 13.616 9.887 2.737 1.00 0.00 H new ATOM 0 HG13 ILE A 94 12.260 10.353 1.730 1.00 0.00 H new ATOM 0 HG21 ILE A 94 15.068 12.156 3.479 1.00 0.00 H new ATOM 0 HG22 ILE A 94 13.958 12.984 4.597 1.00 0.00 H new ATOM 0 HG23 ILE A 94 14.139 11.215 4.670 1.00 0.00 H new ATOM 0 HD11 ILE A 94 14.278 10.030 0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 94 13.756 11.730 0.329 1.00 0.00 H new ATOM 0 HD13 ILE A 94 15.133 11.256 1.352 1.00 0.00 H new ATOM 1505 N GLN A 95 11.669 14.178 4.280 1.00 0.00 N ATOM 1506 CA GLN A 95 11.588 15.342 5.153 1.00 0.00 C ATOM 1507 C GLN A 95 10.339 15.281 6.028 1.00 0.00 C ATOM 1508 O GLN A 95 10.343 15.747 7.167 1.00 0.00 O ATOM 1509 CB GLN A 95 11.582 16.628 4.325 1.00 0.00 C ATOM 1510 CG GLN A 95 10.211 16.993 3.778 1.00 0.00 C ATOM 1511 CD GLN A 95 10.205 18.330 3.063 1.00 0.00 C ATOM 1512 OE1 GLN A 95 11.135 19.125 3.202 1.00 0.00 O ATOM 1513 NE2 GLN A 95 9.154 18.585 2.292 1.00 0.00 N ATOM 0 H GLN A 95 11.840 14.398 3.299 1.00 0.00 H new ATOM 0 HA GLN A 95 12.464 15.340 5.801 1.00 0.00 H new ATOM 0 HB2 GLN A 95 11.948 17.449 4.941 1.00 0.00 H new ATOM 0 HB3 GLN A 95 12.278 16.518 3.494 1.00 0.00 H new ATOM 0 HG2 GLN A 95 9.880 16.216 3.089 1.00 0.00 H new ATOM 0 HG3 GLN A 95 9.493 17.020 4.597 1.00 0.00 H new ATOM 0 HE21 GLN A 95 8.406 17.897 2.206 1.00 0.00 H new ATOM 0 HE22 GLN A 95 9.095 19.469 1.786 1.00 0.00 H new ATOM 1522 N PHE A 96 9.272 14.703 5.486 1.00 0.00 N ATOM 1523 CA PHE A 96 8.015 14.582 6.217 1.00 0.00 C ATOM 1524 C PHE A 96 8.231 13.891 7.560 1.00 0.00 C ATOM 1525 O PHE A 96 7.885 14.431 8.611 1.00 0.00 O ATOM 1526 CB PHE A 96 6.992 13.802 5.388 1.00 0.00 C ATOM 1527 CG PHE A 96 5.656 13.664 6.060 1.00 0.00 C ATOM 1528 CD1 PHE A 96 5.228 14.608 6.979 1.00 0.00 C ATOM 1529 CD2 PHE A 96 4.829 12.591 5.772 1.00 0.00 C ATOM 1530 CE1 PHE A 96 3.999 14.483 7.600 1.00 0.00 C ATOM 1531 CE2 PHE A 96 3.599 12.461 6.389 1.00 0.00 C ATOM 1532 CZ PHE A 96 3.183 13.409 7.304 1.00 0.00 C ATOM 0 H PHE A 96 9.252 14.311 4.544 1.00 0.00 H new ATOM 0 HA PHE A 96 7.633 15.586 6.402 1.00 0.00 H new ATOM 0 HB2 PHE A 96 6.857 14.301 4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 96 7.388 12.809 5.178 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.861 15.451 7.213 1.00 0.00 H new ATOM 0 HD2 PHE A 96 5.149 11.847 5.057 1.00 0.00 H new ATOM 0 HE1 PHE A 96 3.677 15.225 8.316 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.964 11.619 6.156 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.222 13.310 7.787 1.00 0.00 H new ATOM 1542 N TYR A 97 8.806 12.694 7.517 1.00 0.00 N ATOM 1543 CA TYR A 97 9.066 11.927 8.729 1.00 0.00 C ATOM 1544 C TYR A 97 10.522 12.067 9.160 1.00 0.00 C ATOM 1545 O TYR A 97 10.968 11.417 10.107 1.00 0.00 O ATOM 1546 CB TYR A 97 8.727 10.452 8.507 1.00 0.00 C ATOM 1547 CG TYR A 97 7.436 10.234 7.751 1.00 0.00 C ATOM 1548 CD1 TYR A 97 6.210 10.282 8.402 1.00 0.00 C ATOM 1549 CD2 TYR A 97 7.443 9.982 6.384 1.00 0.00 C ATOM 1550 CE1 TYR A 97 5.028 10.082 7.714 1.00 0.00 C ATOM 1551 CE2 TYR A 97 6.266 9.783 5.689 1.00 0.00 C ATOM 1552 CZ TYR A 97 5.061 9.834 6.358 1.00 0.00 C ATOM 1553 OH TYR A 97 3.886 9.636 5.670 1.00 0.00 O ATOM 0 H TYR A 97 9.101 12.234 6.656 1.00 0.00 H new ATOM 0 HA TYR A 97 8.432 12.323 9.522 1.00 0.00 H new ATOM 0 HB2 TYR A 97 9.543 9.979 7.960 1.00 0.00 H new ATOM 0 HB3 TYR A 97 8.660 9.954 9.474 1.00 0.00 H new ATOM 0 HD1 TYR A 97 6.180 10.479 9.463 1.00 0.00 H new ATOM 0 HD2 TYR A 97 8.385 9.941 5.856 1.00 0.00 H new ATOM 0 HE1 TYR A 97 4.083 10.120 8.236 1.00 0.00 H new ATOM 0 HE2 TYR A 97 6.289 9.588 4.627 1.00 0.00 H new ATOM 0 HH TYR A 97 4.083 9.258 4.788 1.00 0.00 H new ATOM 1563 N LYS A 98 11.261 12.921 8.460 1.00 0.00 N ATOM 1564 CA LYS A 98 12.667 13.150 8.769 1.00 0.00 C ATOM 1565 C LYS A 98 13.470 11.860 8.639 1.00 0.00 C ATOM 1566 O LYS A 98 14.422 11.631 9.386 1.00 0.00 O ATOM 1567 CB LYS A 98 12.814 13.714 10.183 1.00 0.00 C ATOM 1568 CG LYS A 98 12.233 15.108 10.346 1.00 0.00 C ATOM 1569 CD LYS A 98 13.076 16.151 9.630 1.00 0.00 C ATOM 1570 CE LYS A 98 14.158 16.713 10.540 1.00 0.00 C ATOM 1571 NZ LYS A 98 15.423 15.933 10.444 1.00 0.00 N ATOM 0 H LYS A 98 10.909 13.467 7.674 1.00 0.00 H new ATOM 0 HA LYS A 98 13.057 13.874 8.053 1.00 0.00 H new ATOM 0 HB2 LYS A 98 12.324 13.041 10.886 1.00 0.00 H new ATOM 0 HB3 LYS A 98 13.871 13.737 10.448 1.00 0.00 H new ATOM 0 HG2 LYS A 98 11.217 15.128 9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 98 12.170 15.355 11.406 1.00 0.00 H new ATOM 0 HD2 LYS A 98 13.536 15.706 8.748 1.00 0.00 H new ATOM 0 HD3 LYS A 98 12.436 16.961 9.281 1.00 0.00 H new ATOM 0 HE2 LYS A 98 14.351 17.753 10.275 1.00 0.00 H new ATOM 0 HE3 LYS A 98 13.805 16.707 11.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 16.229 16.586 10.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 15.531 15.340 11.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 15.394 15.327 9.599 1.00 0.00 H new ATOM 1585 N LEU A 99 13.081 11.020 7.686 1.00 0.00 N ATOM 1586 CA LEU A 99 13.766 9.752 7.457 1.00 0.00 C ATOM 1587 C LEU A 99 15.258 9.973 7.228 1.00 0.00 C ATOM 1588 O LEU A 99 15.680 11.054 6.820 1.00 0.00 O ATOM 1589 CB LEU A 99 13.156 9.030 6.254 1.00 0.00 C ATOM 1590 CG LEU A 99 13.957 7.851 5.702 1.00 0.00 C ATOM 1591 CD1 LEU A 99 13.028 6.819 5.080 1.00 0.00 C ATOM 1592 CD2 LEU A 99 14.981 8.331 4.685 1.00 0.00 C ATOM 0 H LEU A 99 12.295 11.194 7.059 1.00 0.00 H new ATOM 0 HA LEU A 99 13.641 9.134 8.346 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.166 8.671 6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 99 13.016 9.756 5.453 1.00 0.00 H new ATOM 0 HG LEU A 99 14.489 7.380 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 99 13.616 5.987 4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 99 12.334 6.452 5.836 1.00 0.00 H new ATOM 0 HD13 LEU A 99 12.468 7.278 4.265 1.00 0.00 H new ATOM 0 HD21 LEU A 99 15.542 7.478 4.303 1.00 0.00 H new ATOM 0 HD22 LEU A 99 14.470 8.828 3.861 1.00 0.00 H new ATOM 0 HD23 LEU A 99 15.666 9.032 5.162 1.00 0.00 H new ATOM 1604 N GLY A 100 16.051 8.939 7.493 1.00 0.00 N ATOM 1605 CA GLY A 100 17.487 9.040 7.308 1.00 0.00 C ATOM 1606 C GLY A 100 18.175 7.691 7.365 1.00 0.00 C ATOM 1607 O GLY A 100 19.324 7.590 7.796 1.00 0.00 O ATOM 0 H GLY A 100 15.725 8.034 7.832 1.00 0.00 H new ATOM 0 HA2 GLY A 100 17.694 9.510 6.346 1.00 0.00 H new ATOM 0 HA3 GLY A 100 17.904 9.690 8.077 1.00 0.00 H new ATOM 1611 N ASP A 101 17.471 6.651 6.932 1.00 0.00 N ATOM 1612 CA ASP A 101 18.021 5.300 6.937 1.00 0.00 C ATOM 1613 C ASP A 101 17.254 4.398 5.975 1.00 0.00 C ATOM 1614 O ASP A 101 16.166 4.745 5.517 1.00 0.00 O ATOM 1615 CB ASP A 101 17.978 4.714 8.349 1.00 0.00 C ATOM 1616 CG ASP A 101 16.604 4.824 8.980 1.00 0.00 C ATOM 1617 OD1 ASP A 101 15.612 4.922 8.228 1.00 0.00 O ATOM 1618 OD2 ASP A 101 16.521 4.814 10.226 1.00 0.00 O ATOM 0 H ASP A 101 16.519 6.717 6.573 1.00 0.00 H new ATOM 0 HA ASP A 101 19.058 5.355 6.607 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.275 3.666 8.313 1.00 0.00 H new ATOM 0 HB3 ASP A 101 18.705 5.231 8.976 1.00 0.00 H new ATOM 1623 N PHE A 102 17.831 3.239 5.672 1.00 0.00 N ATOM 1624 CA PHE A 102 17.203 2.288 4.762 1.00 0.00 C ATOM 1625 C PHE A 102 17.757 0.883 4.977 1.00 0.00 C ATOM 1626 O PHE A 102 18.899 0.696 5.399 1.00 0.00 O ATOM 1627 CB PHE A 102 17.421 2.718 3.310 1.00 0.00 C ATOM 1628 CG PHE A 102 17.273 4.197 3.094 1.00 0.00 C ATOM 1629 CD1 PHE A 102 16.018 4.768 2.959 1.00 0.00 C ATOM 1630 CD2 PHE A 102 18.388 5.016 3.026 1.00 0.00 C ATOM 1631 CE1 PHE A 102 15.877 6.129 2.760 1.00 0.00 C ATOM 1632 CE2 PHE A 102 18.254 6.377 2.828 1.00 0.00 C ATOM 1633 CZ PHE A 102 16.997 6.934 2.694 1.00 0.00 C ATOM 0 H PHE A 102 18.732 2.936 6.043 1.00 0.00 H new ATOM 0 HA PHE A 102 16.134 2.274 4.972 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.418 2.411 2.994 1.00 0.00 H new ATOM 0 HB3 PHE A 102 16.709 2.193 2.673 1.00 0.00 H new ATOM 0 HD1 PHE A 102 15.139 4.142 3.010 1.00 0.00 H new ATOM 0 HD2 PHE A 102 19.373 4.586 3.129 1.00 0.00 H new ATOM 0 HE1 PHE A 102 14.893 6.562 2.656 1.00 0.00 H new ATOM 0 HE2 PHE A 102 19.131 7.005 2.778 1.00 0.00 H new ATOM 0 HZ PHE A 102 16.890 7.997 2.538 1.00 0.00 H new ATOM 1643 N PRO A 103 16.930 -0.131 4.680 1.00 0.00 N ATOM 1644 CA PRO A 103 15.570 0.079 4.178 1.00 0.00 C ATOM 1645 C PRO A 103 14.641 0.655 5.241 1.00 0.00 C ATOM 1646 O PRO A 103 14.903 0.535 6.439 1.00 0.00 O ATOM 1647 CB PRO A 103 15.118 -1.328 3.778 1.00 0.00 C ATOM 1648 CG PRO A 103 15.934 -2.242 4.626 1.00 0.00 C ATOM 1649 CD PRO A 103 17.260 -1.560 4.814 1.00 0.00 C ATOM 0 HA PRO A 103 15.545 0.799 3.360 1.00 0.00 H new ATOM 0 HB2 PRO A 103 14.052 -1.468 3.957 1.00 0.00 H new ATOM 0 HB3 PRO A 103 15.290 -1.513 2.718 1.00 0.00 H new ATOM 0 HG2 PRO A 103 15.448 -2.422 5.585 1.00 0.00 H new ATOM 0 HG3 PRO A 103 16.059 -3.212 4.145 1.00 0.00 H new ATOM 0 HD2 PRO A 103 17.692 -1.783 5.790 1.00 0.00 H new ATOM 0 HD3 PRO A 103 17.985 -1.877 4.064 1.00 0.00 H new ATOM 1657 N TYR A 104 13.555 1.278 4.798 1.00 0.00 N ATOM 1658 CA TYR A 104 12.589 1.874 5.712 1.00 0.00 C ATOM 1659 C TYR A 104 11.161 1.545 5.286 1.00 0.00 C ATOM 1660 O TYR A 104 10.756 1.831 4.159 1.00 0.00 O ATOM 1661 CB TYR A 104 12.779 3.391 5.771 1.00 0.00 C ATOM 1662 CG TYR A 104 11.929 4.067 6.824 1.00 0.00 C ATOM 1663 CD1 TYR A 104 10.586 4.338 6.591 1.00 0.00 C ATOM 1664 CD2 TYR A 104 12.469 4.435 8.050 1.00 0.00 C ATOM 1665 CE1 TYR A 104 9.806 4.956 7.549 1.00 0.00 C ATOM 1666 CE2 TYR A 104 11.696 5.052 9.014 1.00 0.00 C ATOM 1667 CZ TYR A 104 10.366 5.311 8.759 1.00 0.00 C ATOM 1668 OH TYR A 104 9.593 5.926 9.717 1.00 0.00 O ATOM 0 H TYR A 104 13.322 1.383 3.811 1.00 0.00 H new ATOM 0 HA TYR A 104 12.759 1.455 6.704 1.00 0.00 H new ATOM 0 HB2 TYR A 104 13.829 3.610 5.968 1.00 0.00 H new ATOM 0 HB3 TYR A 104 12.542 3.817 4.796 1.00 0.00 H new ATOM 0 HD1 TYR A 104 10.145 4.061 5.645 1.00 0.00 H new ATOM 0 HD2 TYR A 104 13.511 4.235 8.253 1.00 0.00 H new ATOM 0 HE1 TYR A 104 8.764 5.160 7.352 1.00 0.00 H new ATOM 0 HE2 TYR A 104 12.131 5.330 9.963 1.00 0.00 H new ATOM 0 HH TYR A 104 9.870 5.621 10.606 1.00 0.00 H new ATOM 1678 N VAL A 105 10.402 0.943 6.196 1.00 0.00 N ATOM 1679 CA VAL A 105 9.019 0.576 5.916 1.00 0.00 C ATOM 1680 C VAL A 105 8.154 0.704 7.165 1.00 0.00 C ATOM 1681 O VAL A 105 8.549 0.283 8.252 1.00 0.00 O ATOM 1682 CB VAL A 105 8.918 -0.864 5.380 1.00 0.00 C ATOM 1683 CG1 VAL A 105 7.466 -1.238 5.123 1.00 0.00 C ATOM 1684 CG2 VAL A 105 9.749 -1.021 4.116 1.00 0.00 C ATOM 0 H VAL A 105 10.722 0.699 7.133 1.00 0.00 H new ATOM 0 HA VAL A 105 8.656 1.265 5.154 1.00 0.00 H new ATOM 0 HB VAL A 105 9.315 -1.543 6.135 1.00 0.00 H new ATOM 0 HG11 VAL A 105 7.415 -2.259 4.745 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.902 -1.167 6.053 1.00 0.00 H new ATOM 0 HG13 VAL A 105 7.040 -0.556 4.387 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.666 -2.045 3.751 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.385 -0.333 3.353 1.00 0.00 H new ATOM 0 HG23 VAL A 105 10.793 -0.798 4.337 1.00 0.00 H new ATOM 1694 N SER A 106 6.971 1.287 7.002 1.00 0.00 N ATOM 1695 CA SER A 106 6.050 1.473 8.117 1.00 0.00 C ATOM 1696 C SER A 106 4.623 1.675 7.615 1.00 0.00 C ATOM 1697 O SER A 106 4.400 1.916 6.428 1.00 0.00 O ATOM 1698 CB SER A 106 6.479 2.672 8.965 1.00 0.00 C ATOM 1699 OG SER A 106 6.646 3.829 8.165 1.00 0.00 O ATOM 0 H SER A 106 6.628 1.639 6.108 1.00 0.00 H new ATOM 0 HA SER A 106 6.076 0.574 8.732 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.731 2.863 9.735 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.413 2.443 9.478 1.00 0.00 H new ATOM 0 HG SER A 106 7.601 3.985 8.011 1.00 0.00 H new ATOM 1705 N ILE A 107 3.662 1.576 8.527 1.00 0.00 N ATOM 1706 CA ILE A 107 2.258 1.748 8.178 1.00 0.00 C ATOM 1707 C ILE A 107 1.797 3.178 8.443 1.00 0.00 C ATOM 1708 O ILE A 107 1.906 3.680 9.563 1.00 0.00 O ATOM 1709 CB ILE A 107 1.359 0.777 8.966 1.00 0.00 C ATOM 1710 CG1 ILE A 107 1.736 -0.671 8.650 1.00 0.00 C ATOM 1711 CG2 ILE A 107 -0.106 1.031 8.642 1.00 0.00 C ATOM 1712 CD1 ILE A 107 0.953 -1.688 9.451 1.00 0.00 C ATOM 0 H ILE A 107 3.830 1.378 9.513 1.00 0.00 H new ATOM 0 HA ILE A 107 2.168 1.531 7.114 1.00 0.00 H new ATOM 0 HB ILE A 107 1.511 0.948 10.032 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.576 -0.856 7.588 1.00 0.00 H new ATOM 0 HG13 ILE A 107 2.800 -0.811 8.841 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.729 0.337 9.206 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.366 2.054 8.912 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -0.274 0.884 7.575 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.273 -2.693 9.175 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.132 -1.530 10.514 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.111 -1.575 9.241 1.00 0.00 H new ATOM 1724 N LEU A 108 1.282 3.829 7.406 1.00 0.00 N ATOM 1725 CA LEU A 108 0.802 5.201 7.526 1.00 0.00 C ATOM 1726 C LEU A 108 -0.713 5.265 7.364 1.00 0.00 C ATOM 1727 O LEU A 108 -1.300 4.485 6.613 1.00 0.00 O ATOM 1728 CB LEU A 108 1.476 6.091 6.481 1.00 0.00 C ATOM 1729 CG LEU A 108 1.704 7.548 6.886 1.00 0.00 C ATOM 1730 CD1 LEU A 108 0.432 8.360 6.699 1.00 0.00 C ATOM 1731 CD2 LEU A 108 2.185 7.632 8.327 1.00 0.00 C ATOM 0 H LEU A 108 1.186 3.429 6.473 1.00 0.00 H new ATOM 0 HA LEU A 108 1.057 5.563 8.522 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.440 5.651 6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.869 6.077 5.576 1.00 0.00 H new ATOM 0 HG LEU A 108 2.476 7.967 6.241 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.614 9.394 6.992 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.130 8.328 5.652 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.361 7.941 7.318 1.00 0.00 H new ATOM 0 HD21 LEU A 108 2.342 8.676 8.598 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.436 7.195 8.987 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.122 7.085 8.430 1.00 0.00 H new ATOM 1743 N ASP A 109 -1.340 6.199 8.070 1.00 0.00 N ATOM 1744 CA ASP A 109 -2.787 6.367 8.002 1.00 0.00 C ATOM 1745 C ASP A 109 -3.164 7.421 6.966 1.00 0.00 C ATOM 1746 O ASP A 109 -2.745 8.577 7.040 1.00 0.00 O ATOM 1747 CB ASP A 109 -3.342 6.759 9.372 1.00 0.00 C ATOM 1748 CG ASP A 109 -4.771 6.294 9.573 1.00 0.00 C ATOM 1749 OD1 ASP A 109 -5.667 6.814 8.877 1.00 0.00 O ATOM 1750 OD2 ASP A 109 -4.993 5.410 10.427 1.00 0.00 O ATOM 0 H ASP A 109 -0.869 6.852 8.696 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.224 5.415 7.701 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.711 6.332 10.152 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.297 7.842 9.483 1.00 0.00 H new ATOM 1755 N PRO A 110 -3.973 7.016 5.976 1.00 0.00 N ATOM 1756 CA PRO A 110 -4.423 7.911 4.905 1.00 0.00 C ATOM 1757 C PRO A 110 -5.403 8.967 5.406 1.00 0.00 C ATOM 1758 O PRO A 110 -5.725 9.917 4.692 1.00 0.00 O ATOM 1759 CB PRO A 110 -5.114 6.966 3.919 1.00 0.00 C ATOM 1760 CG PRO A 110 -5.550 5.807 4.748 1.00 0.00 C ATOM 1761 CD PRO A 110 -4.511 5.654 5.825 1.00 0.00 C ATOM 0 HA PRO A 110 -3.597 8.473 4.470 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -5.963 7.449 3.436 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -4.433 6.653 3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -6.535 5.984 5.179 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -5.624 4.902 4.145 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.947 5.289 6.755 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.735 4.945 5.537 1.00 0.00 H new ATOM 1769 N ARG A 111 -5.873 8.795 6.637 1.00 0.00 N ATOM 1770 CA ARG A 111 -6.816 9.733 7.233 1.00 0.00 C ATOM 1771 C ARG A 111 -6.085 10.795 8.050 1.00 0.00 C ATOM 1772 O ARG A 111 -5.931 11.935 7.611 1.00 0.00 O ATOM 1773 CB ARG A 111 -7.816 8.990 8.121 1.00 0.00 C ATOM 1774 CG ARG A 111 -8.884 8.240 7.341 1.00 0.00 C ATOM 1775 CD ARG A 111 -9.385 7.027 8.108 1.00 0.00 C ATOM 1776 NE ARG A 111 -10.257 7.403 9.217 1.00 0.00 N ATOM 1777 CZ ARG A 111 -11.560 7.628 9.085 1.00 0.00 C ATOM 1778 NH1 ARG A 111 -12.138 7.515 7.897 1.00 0.00 N ATOM 1779 NH2 ARG A 111 -12.287 7.967 10.142 1.00 0.00 N ATOM 0 H ARG A 111 -5.616 8.014 7.241 1.00 0.00 H new ATOM 0 HA ARG A 111 -7.356 10.228 6.426 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.275 8.284 8.751 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -8.299 9.705 8.787 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.719 8.908 7.130 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -8.479 7.922 6.380 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -9.925 6.367 7.430 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.534 6.463 8.491 1.00 0.00 H new ATOM 0 HE ARG A 111 -9.843 7.498 10.144 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -11.582 7.255 7.082 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -13.138 7.688 7.798 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -11.846 8.055 11.057 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -13.287 8.139 10.039 1.00 0.00 H new ATOM 1793 N THR A 112 -5.637 10.412 9.242 1.00 0.00 N ATOM 1794 CA THR A 112 -4.924 11.330 10.121 1.00 0.00 C ATOM 1795 C THR A 112 -3.541 11.657 9.570 1.00 0.00 C ATOM 1796 O THR A 112 -3.039 12.767 9.742 1.00 0.00 O ATOM 1797 CB THR A 112 -4.775 10.748 11.539 1.00 0.00 C ATOM 1798 OG1 THR A 112 -3.677 11.374 12.212 1.00 0.00 O ATOM 1799 CG2 THR A 112 -4.553 9.244 11.486 1.00 0.00 C ATOM 0 H THR A 112 -5.756 9.472 9.620 1.00 0.00 H new ATOM 0 HA THR A 112 -5.517 12.243 10.172 1.00 0.00 H new ATOM 0 HB THR A 112 -5.696 10.944 12.087 1.00 0.00 H new ATOM 0 HG1 THR A 112 -3.590 11.000 13.114 1.00 0.00 H new ATOM 0 HG21 THR A 112 -4.451 8.855 12.499 1.00 0.00 H new ATOM 0 HG22 THR A 112 -5.404 8.768 10.999 1.00 0.00 H new ATOM 0 HG23 THR A 112 -3.645 9.030 10.922 1.00 0.00 H new ATOM 1807 N GLY A 113 -2.929 10.682 8.904 1.00 0.00 N ATOM 1808 CA GLY A 113 -1.608 10.886 8.337 1.00 0.00 C ATOM 1809 C GLY A 113 -0.504 10.701 9.358 1.00 0.00 C ATOM 1810 O GLY A 113 0.642 11.079 9.117 1.00 0.00 O ATOM 0 H GLY A 113 -3.324 9.755 8.747 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.458 10.188 7.514 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -1.547 11.891 7.918 1.00 0.00 H new ATOM 1814 N GLN A 114 -0.849 10.119 10.502 1.00 0.00 N ATOM 1815 CA GLN A 114 0.122 9.887 11.565 1.00 0.00 C ATOM 1816 C GLN A 114 0.685 8.471 11.488 1.00 0.00 C ATOM 1817 O GLN A 114 -0.021 7.531 11.123 1.00 0.00 O ATOM 1818 CB GLN A 114 -0.521 10.120 12.933 1.00 0.00 C ATOM 1819 CG GLN A 114 0.366 9.715 14.099 1.00 0.00 C ATOM 1820 CD GLN A 114 1.205 10.864 14.621 1.00 0.00 C ATOM 1821 OE1 GLN A 114 1.334 11.901 13.969 1.00 0.00 O ATOM 1822 NE2 GLN A 114 1.782 10.687 15.804 1.00 0.00 N ATOM 0 H GLN A 114 -1.794 9.799 10.717 1.00 0.00 H new ATOM 0 HA GLN A 114 0.943 10.592 11.433 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -0.776 11.175 13.030 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -1.455 9.560 12.986 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -0.256 9.328 14.906 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.023 8.903 13.786 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.649 9.812 16.311 1.00 0.00 H new ATOM 0 HE22 GLN A 114 2.358 11.426 16.206 1.00 0.00 H new ATOM 1831 N LYS A 115 1.959 8.327 11.835 1.00 0.00 N ATOM 1832 CA LYS A 115 2.617 7.026 11.808 1.00 0.00 C ATOM 1833 C LYS A 115 2.126 6.143 12.951 1.00 0.00 C ATOM 1834 O LYS A 115 2.083 6.572 14.105 1.00 0.00 O ATOM 1835 CB LYS A 115 4.135 7.197 11.897 1.00 0.00 C ATOM 1836 CG LYS A 115 4.883 5.893 12.112 1.00 0.00 C ATOM 1837 CD LYS A 115 5.070 5.594 13.590 1.00 0.00 C ATOM 1838 CE LYS A 115 6.126 6.495 14.212 1.00 0.00 C ATOM 1839 NZ LYS A 115 6.105 6.430 15.699 1.00 0.00 N ATOM 0 H LYS A 115 2.557 9.096 12.138 1.00 0.00 H new ATOM 0 HA LYS A 115 2.367 6.540 10.865 1.00 0.00 H new ATOM 0 HB2 LYS A 115 4.494 7.665 10.980 1.00 0.00 H new ATOM 0 HB3 LYS A 115 4.368 7.879 12.715 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.335 5.077 11.641 1.00 0.00 H new ATOM 0 HG3 LYS A 115 5.857 5.946 11.625 1.00 0.00 H new ATOM 0 HD2 LYS A 115 4.123 5.728 14.112 1.00 0.00 H new ATOM 0 HD3 LYS A 115 5.359 4.551 13.717 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.112 6.203 13.850 1.00 0.00 H new ATOM 0 HE3 LYS A 115 5.960 7.523 13.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.839 7.058 16.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 5.173 6.733 16.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 6.288 5.454 16.006 1.00 0.00 H new ATOM 1853 N LEU A 116 1.759 4.909 12.623 1.00 0.00 N ATOM 1854 CA LEU A 116 1.272 3.965 13.623 1.00 0.00 C ATOM 1855 C LEU A 116 2.399 3.059 14.110 1.00 0.00 C ATOM 1856 O LEU A 116 2.676 2.984 15.307 1.00 0.00 O ATOM 1857 CB LEU A 116 0.136 3.120 13.045 1.00 0.00 C ATOM 1858 CG LEU A 116 -0.987 3.890 12.351 1.00 0.00 C ATOM 1859 CD1 LEU A 116 -1.950 2.931 11.669 1.00 0.00 C ATOM 1860 CD2 LEU A 116 -1.725 4.771 13.348 1.00 0.00 C ATOM 0 H LEU A 116 1.789 4.539 11.673 1.00 0.00 H new ATOM 0 HA LEU A 116 0.896 4.535 14.473 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.562 2.415 12.331 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.299 2.531 13.853 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.544 4.531 11.588 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.743 3.498 11.180 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.412 2.343 10.925 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -2.386 2.264 12.412 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.521 5.312 12.836 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -2.155 4.150 14.134 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -1.028 5.483 13.789 1.00 0.00 H new ATOM 1872 N VAL A 117 3.047 2.374 13.174 1.00 0.00 N ATOM 1873 CA VAL A 117 4.146 1.476 13.506 1.00 0.00 C ATOM 1874 C VAL A 117 5.402 1.826 12.716 1.00 0.00 C ATOM 1875 O VAL A 117 5.392 2.739 11.891 1.00 0.00 O ATOM 1876 CB VAL A 117 3.773 0.007 13.231 1.00 0.00 C ATOM 1877 CG1 VAL A 117 2.500 -0.369 13.974 1.00 0.00 C ATOM 1878 CG2 VAL A 117 3.618 -0.232 11.737 1.00 0.00 C ATOM 0 H VAL A 117 2.830 2.424 12.179 1.00 0.00 H new ATOM 0 HA VAL A 117 4.344 1.600 14.571 1.00 0.00 H new ATOM 0 HB VAL A 117 4.579 -0.629 13.596 1.00 0.00 H new ATOM 0 HG11 VAL A 117 2.252 -1.410 13.768 1.00 0.00 H new ATOM 0 HG12 VAL A 117 2.652 -0.238 15.045 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.683 0.271 13.642 1.00 0.00 H new ATOM 0 HG21 VAL A 117 3.354 -1.275 11.561 1.00 0.00 H new ATOM 0 HG22 VAL A 117 2.831 0.412 11.345 1.00 0.00 H new ATOM 0 HG23 VAL A 117 4.557 -0.005 11.233 1.00 0.00 H new ATOM 1888 N GLU A 118 6.481 1.094 12.974 1.00 0.00 N ATOM 1889 CA GLU A 118 7.745 1.329 12.285 1.00 0.00 C ATOM 1890 C GLU A 118 8.579 0.053 12.229 1.00 0.00 C ATOM 1891 O GLU A 118 8.809 -0.596 13.250 1.00 0.00 O ATOM 1892 CB GLU A 118 8.534 2.437 12.986 1.00 0.00 C ATOM 1893 CG GLU A 118 8.160 3.836 12.525 1.00 0.00 C ATOM 1894 CD GLU A 118 8.967 4.915 13.221 1.00 0.00 C ATOM 1895 OE1 GLU A 118 8.928 4.973 14.468 1.00 0.00 O ATOM 1896 OE2 GLU A 118 9.637 5.700 12.519 1.00 0.00 O ATOM 0 H GLU A 118 6.506 0.334 13.654 1.00 0.00 H new ATOM 0 HA GLU A 118 7.522 1.641 11.265 1.00 0.00 H new ATOM 0 HB2 GLU A 118 8.372 2.362 14.061 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.598 2.279 12.813 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.311 3.912 11.448 1.00 0.00 H new ATOM 0 HG3 GLU A 118 7.099 4.004 12.711 1.00 0.00 H new ATOM 1903 N TRP A 119 9.029 -0.301 11.031 1.00 0.00 N ATOM 1904 CA TRP A 119 9.837 -1.500 10.841 1.00 0.00 C ATOM 1905 C TRP A 119 11.052 -1.205 9.968 1.00 0.00 C ATOM 1906 O TRP A 119 10.942 -0.534 8.941 1.00 0.00 O ATOM 1907 CB TRP A 119 8.997 -2.611 10.209 1.00 0.00 C ATOM 1908 CG TRP A 119 7.705 -2.860 10.926 1.00 0.00 C ATOM 1909 CD1 TRP A 119 7.511 -2.892 12.278 1.00 0.00 C ATOM 1910 CD2 TRP A 119 6.429 -3.114 10.330 1.00 0.00 C ATOM 1911 NE1 TRP A 119 6.190 -3.150 12.557 1.00 0.00 N ATOM 1912 CE2 TRP A 119 5.505 -3.289 11.379 1.00 0.00 C ATOM 1913 CE3 TRP A 119 5.975 -3.207 9.011 1.00 0.00 C ATOM 1914 CZ2 TRP A 119 4.158 -3.554 11.148 1.00 0.00 C ATOM 1915 CZ3 TRP A 119 4.638 -3.471 8.784 1.00 0.00 C ATOM 1916 CH2 TRP A 119 3.742 -3.641 9.848 1.00 0.00 C ATOM 0 H TRP A 119 8.848 0.225 10.176 1.00 0.00 H new ATOM 0 HA TRP A 119 10.187 -1.831 11.819 1.00 0.00 H new ATOM 0 HB2 TRP A 119 8.784 -2.351 9.172 1.00 0.00 H new ATOM 0 HB3 TRP A 119 9.579 -3.532 10.193 1.00 0.00 H new ATOM 0 HD1 TRP A 119 8.282 -2.737 13.018 1.00 0.00 H new ATOM 0 HE1 TRP A 119 5.785 -3.226 13.490 1.00 0.00 H new ATOM 0 HE3 TRP A 119 6.657 -3.075 8.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 3.466 -3.686 11.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 4.277 -3.548 7.769 1.00 0.00 H new ATOM 0 HH2 TRP A 119 2.703 -3.845 9.637 1.00 0.00 H new ATOM 1927 N HIS A 120 12.210 -1.709 10.382 1.00 0.00 N ATOM 1928 CA HIS A 120 13.446 -1.500 9.637 1.00 0.00 C ATOM 1929 C HIS A 120 13.738 -2.688 8.725 1.00 0.00 C ATOM 1930 O HIS A 120 13.931 -2.525 7.521 1.00 0.00 O ATOM 1931 CB HIS A 120 14.615 -1.279 10.597 1.00 0.00 C ATOM 1932 CG HIS A 120 15.694 -0.406 10.036 1.00 0.00 C ATOM 1933 ND1 HIS A 120 16.918 -0.715 9.546 1.00 0.00 N flip ATOM 1934 CD2 HIS A 120 15.577 0.964 9.933 1.00 0.00 C flip ATOM 1935 CE1 HIS A 120 17.511 0.462 9.160 1.00 0.00 C flip ATOM 1936 NE2 HIS A 120 16.681 1.460 9.404 1.00 0.00 N flip ATOM 0 H HIS A 120 12.318 -2.265 11.230 1.00 0.00 H new ATOM 0 HA HIS A 120 13.322 -0.611 9.018 1.00 0.00 H new ATOM 0 HB2 HIS A 120 14.239 -0.832 11.517 1.00 0.00 H new ATOM 0 HB3 HIS A 120 15.043 -2.245 10.864 1.00 0.00 H new ATOM 0 HD1 HIS A 120 17.324 -1.648 9.477 1.00 0.00 H new ATOM 0 HD2 HIS A 120 14.717 1.542 10.237 1.00 0.00 H new ATOM 0 HE1 HIS A 120 18.496 0.556 8.727 1.00 0.00 H new ATOM 1945 N GLN A 121 13.769 -3.882 9.309 1.00 0.00 N ATOM 1946 CA GLN A 121 14.040 -5.096 8.549 1.00 0.00 C ATOM 1947 C GLN A 121 12.867 -6.066 8.637 1.00 0.00 C ATOM 1948 O GLN A 121 12.622 -6.668 9.684 1.00 0.00 O ATOM 1949 CB GLN A 121 15.314 -5.770 9.061 1.00 0.00 C ATOM 1950 CG GLN A 121 15.239 -6.182 10.522 1.00 0.00 C ATOM 1951 CD GLN A 121 16.607 -6.317 11.161 1.00 0.00 C ATOM 1952 OE1 GLN A 121 17.294 -7.323 10.978 1.00 0.00 O ATOM 1953 NE2 GLN A 121 17.011 -5.302 11.916 1.00 0.00 N ATOM 0 H GLN A 121 13.610 -4.034 10.305 1.00 0.00 H new ATOM 0 HA GLN A 121 14.180 -4.817 7.505 1.00 0.00 H new ATOM 0 HB2 GLN A 121 15.518 -6.652 8.453 1.00 0.00 H new ATOM 0 HB3 GLN A 121 16.154 -5.089 8.927 1.00 0.00 H new ATOM 0 HG2 GLN A 121 14.656 -5.445 11.074 1.00 0.00 H new ATOM 0 HG3 GLN A 121 14.710 -7.132 10.601 1.00 0.00 H new ATOM 0 HE21 GLN A 121 16.409 -4.488 12.040 1.00 0.00 H new ATOM 0 HE22 GLN A 121 17.923 -5.337 12.372 1.00 0.00 H new ATOM 1962 N LEU A 122 12.143 -6.214 7.533 1.00 0.00 N ATOM 1963 CA LEU A 122 10.994 -7.111 7.485 1.00 0.00 C ATOM 1964 C LEU A 122 11.366 -8.438 6.831 1.00 0.00 C ATOM 1965 O LEU A 122 12.316 -8.512 6.052 1.00 0.00 O ATOM 1966 CB LEU A 122 9.842 -6.457 6.719 1.00 0.00 C ATOM 1967 CG LEU A 122 9.302 -5.152 7.306 1.00 0.00 C ATOM 1968 CD1 LEU A 122 8.641 -4.314 6.223 1.00 0.00 C ATOM 1969 CD2 LEU A 122 8.321 -5.440 8.433 1.00 0.00 C ATOM 0 H LEU A 122 12.332 -5.724 6.659 1.00 0.00 H new ATOM 0 HA LEU A 122 10.676 -7.308 8.509 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.174 -6.264 5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.021 -7.171 6.657 1.00 0.00 H new ATOM 0 HG LEU A 122 10.139 -4.586 7.715 1.00 0.00 H new ATOM 0 HD11 LEU A 122 8.263 -3.389 6.659 1.00 0.00 H new ATOM 0 HD12 LEU A 122 9.371 -4.078 5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 122 7.815 -4.873 5.784 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.947 -4.500 8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.487 -6.027 8.048 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.826 -6.000 9.220 1.00 0.00 H new ATOM 1981 N ASP A 123 10.610 -9.482 7.152 1.00 0.00 N ATOM 1982 CA ASP A 123 10.858 -10.806 6.593 1.00 0.00 C ATOM 1983 C ASP A 123 9.574 -11.408 6.031 1.00 0.00 C ATOM 1984 O ASP A 123 8.475 -10.929 6.315 1.00 0.00 O ATOM 1985 CB ASP A 123 11.446 -11.732 7.660 1.00 0.00 C ATOM 1986 CG ASP A 123 12.941 -11.548 7.825 1.00 0.00 C ATOM 1987 OD1 ASP A 123 13.622 -11.287 6.811 1.00 0.00 O ATOM 1988 OD2 ASP A 123 13.432 -11.667 8.967 1.00 0.00 O ATOM 0 H ASP A 123 9.820 -9.437 7.796 1.00 0.00 H new ATOM 0 HA ASP A 123 11.575 -10.701 5.779 1.00 0.00 H new ATOM 0 HB2 ASP A 123 10.952 -11.543 8.613 1.00 0.00 H new ATOM 0 HB3 ASP A 123 11.238 -12.768 7.393 1.00 0.00 H new ATOM 1993 N VAL A 124 9.719 -12.460 5.232 1.00 0.00 N ATOM 1994 CA VAL A 124 8.572 -13.128 4.630 1.00 0.00 C ATOM 1995 C VAL A 124 7.563 -13.552 5.692 1.00 0.00 C ATOM 1996 O VAL A 124 6.355 -13.397 5.512 1.00 0.00 O ATOM 1997 CB VAL A 124 9.002 -14.367 3.823 1.00 0.00 C ATOM 1998 CG1 VAL A 124 7.786 -15.093 3.269 1.00 0.00 C ATOM 1999 CG2 VAL A 124 9.952 -13.969 2.703 1.00 0.00 C ATOM 0 H VAL A 124 10.621 -12.868 4.986 1.00 0.00 H new ATOM 0 HA VAL A 124 8.106 -12.409 3.956 1.00 0.00 H new ATOM 0 HB VAL A 124 9.529 -15.049 4.491 1.00 0.00 H new ATOM 0 HG11 VAL A 124 8.110 -15.966 2.702 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.147 -15.412 4.092 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.228 -14.422 2.615 1.00 0.00 H new ATOM 0 HG21 VAL A 124 10.246 -14.857 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.453 -13.267 2.035 1.00 0.00 H new ATOM 0 HG23 VAL A 124 10.838 -13.498 3.128 1.00 0.00 H new ATOM 2009 N SER A 125 8.068 -14.087 6.799 1.00 0.00 N ATOM 2010 CA SER A 125 7.211 -14.537 7.890 1.00 0.00 C ATOM 2011 C SER A 125 6.888 -13.385 8.837 1.00 0.00 C ATOM 2012 O SER A 125 5.722 -13.104 9.116 1.00 0.00 O ATOM 2013 CB SER A 125 7.885 -15.673 8.661 1.00 0.00 C ATOM 2014 OG SER A 125 9.144 -15.267 9.169 1.00 0.00 O ATOM 0 H SER A 125 9.066 -14.219 6.964 1.00 0.00 H new ATOM 0 HA SER A 125 6.279 -14.903 7.460 1.00 0.00 H new ATOM 0 HB2 SER A 125 7.243 -15.990 9.483 1.00 0.00 H new ATOM 0 HB3 SER A 125 8.014 -16.535 8.006 1.00 0.00 H new ATOM 0 HG SER A 125 9.554 -16.010 9.659 1.00 0.00 H new ATOM 2020 N SER A 126 7.929 -12.722 9.329 1.00 0.00 N ATOM 2021 CA SER A 126 7.758 -11.603 10.248 1.00 0.00 C ATOM 2022 C SER A 126 6.776 -10.581 9.684 1.00 0.00 C ATOM 2023 O SER A 126 5.870 -10.124 10.380 1.00 0.00 O ATOM 2024 CB SER A 126 9.105 -10.933 10.526 1.00 0.00 C ATOM 2025 OG SER A 126 8.972 -9.898 11.484 1.00 0.00 O ATOM 0 H SER A 126 8.900 -12.940 9.107 1.00 0.00 H new ATOM 0 HA SER A 126 7.354 -11.992 11.183 1.00 0.00 H new ATOM 0 HB2 SER A 126 9.817 -11.676 10.885 1.00 0.00 H new ATOM 0 HB3 SER A 126 9.510 -10.525 9.600 1.00 0.00 H new ATOM 0 HG SER A 126 9.847 -9.487 11.645 1.00 0.00 H new ATOM 2031 N PHE A 127 6.963 -10.228 8.416 1.00 0.00 N ATOM 2032 CA PHE A 127 6.095 -9.259 7.757 1.00 0.00 C ATOM 2033 C PHE A 127 4.645 -9.734 7.765 1.00 0.00 C ATOM 2034 O PHE A 127 3.745 -9.009 8.190 1.00 0.00 O ATOM 2035 CB PHE A 127 6.559 -9.025 6.317 1.00 0.00 C ATOM 2036 CG PHE A 127 5.677 -8.081 5.550 1.00 0.00 C ATOM 2037 CD1 PHE A 127 4.512 -8.531 4.952 1.00 0.00 C ATOM 2038 CD2 PHE A 127 6.015 -6.742 5.428 1.00 0.00 C ATOM 2039 CE1 PHE A 127 3.700 -7.665 4.245 1.00 0.00 C ATOM 2040 CE2 PHE A 127 5.206 -5.871 4.722 1.00 0.00 C ATOM 2041 CZ PHE A 127 4.047 -6.333 4.131 1.00 0.00 C ATOM 0 H PHE A 127 7.707 -10.598 7.825 1.00 0.00 H new ATOM 0 HA PHE A 127 6.154 -8.321 8.308 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.575 -8.631 6.330 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.595 -9.981 5.795 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.235 -9.571 5.039 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.920 -6.375 5.889 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.795 -8.029 3.782 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.480 -4.830 4.633 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.413 -5.654 3.580 1.00 0.00 H new ATOM 2051 N LEU A 128 4.427 -10.956 7.293 1.00 0.00 N ATOM 2052 CA LEU A 128 3.086 -11.529 7.245 1.00 0.00 C ATOM 2053 C LEU A 128 2.478 -11.609 8.642 1.00 0.00 C ATOM 2054 O LEU A 128 1.277 -11.404 8.819 1.00 0.00 O ATOM 2055 CB LEU A 128 3.128 -12.922 6.615 1.00 0.00 C ATOM 2056 CG LEU A 128 3.276 -12.966 5.093 1.00 0.00 C ATOM 2057 CD1 LEU A 128 3.657 -14.365 4.634 1.00 0.00 C ATOM 2058 CD2 LEU A 128 1.989 -12.514 4.419 1.00 0.00 C ATOM 0 H LEU A 128 5.161 -11.569 6.938 1.00 0.00 H new ATOM 0 HA LEU A 128 2.461 -10.878 6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 128 3.958 -13.474 7.057 1.00 0.00 H new ATOM 0 HB3 LEU A 128 2.214 -13.450 6.887 1.00 0.00 H new ATOM 0 HG LEU A 128 4.074 -12.281 4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 128 3.758 -14.377 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 128 4.605 -14.652 5.090 1.00 0.00 H new ATOM 0 HD13 LEU A 128 2.882 -15.070 4.934 1.00 0.00 H new ATOM 0 HD21 LEU A 128 2.112 -12.552 3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 128 1.173 -13.173 4.714 1.00 0.00 H new ATOM 0 HD23 LEU A 128 1.759 -11.493 4.723 1.00 0.00 H new ATOM 2070 N ASP A 129 3.315 -11.905 9.630 1.00 0.00 N ATOM 2071 CA ASP A 129 2.860 -12.008 11.012 1.00 0.00 C ATOM 2072 C ASP A 129 2.522 -10.632 11.577 1.00 0.00 C ATOM 2073 O ASP A 129 1.541 -10.474 12.302 1.00 0.00 O ATOM 2074 CB ASP A 129 3.931 -12.679 11.874 1.00 0.00 C ATOM 2075 CG ASP A 129 3.734 -14.178 11.980 1.00 0.00 C ATOM 2076 OD1 ASP A 129 2.869 -14.608 12.771 1.00 0.00 O ATOM 2077 OD2 ASP A 129 4.445 -14.922 11.272 1.00 0.00 O ATOM 0 H ASP A 129 4.312 -12.078 9.500 1.00 0.00 H new ATOM 0 HA ASP A 129 1.957 -12.618 11.028 1.00 0.00 H new ATOM 0 HB2 ASP A 129 4.914 -12.474 11.451 1.00 0.00 H new ATOM 0 HB3 ASP A 129 3.916 -12.242 12.872 1.00 0.00 H new ATOM 2082 N GLN A 130 3.342 -9.642 11.239 1.00 0.00 N ATOM 2083 CA GLN A 130 3.130 -8.280 11.715 1.00 0.00 C ATOM 2084 C GLN A 130 1.895 -7.663 11.066 1.00 0.00 C ATOM 2085 O GLN A 130 1.051 -7.078 11.745 1.00 0.00 O ATOM 2086 CB GLN A 130 4.359 -7.418 11.422 1.00 0.00 C ATOM 2087 CG GLN A 130 5.449 -7.536 12.475 1.00 0.00 C ATOM 2088 CD GLN A 130 6.560 -6.522 12.281 1.00 0.00 C ATOM 2089 OE1 GLN A 130 6.527 -5.719 11.348 1.00 0.00 O ATOM 2090 NE2 GLN A 130 7.552 -6.555 13.163 1.00 0.00 N ATOM 0 H GLN A 130 4.158 -9.757 10.638 1.00 0.00 H new ATOM 0 HA GLN A 130 2.971 -8.319 12.793 1.00 0.00 H new ATOM 0 HB2 GLN A 130 4.769 -7.702 10.453 1.00 0.00 H new ATOM 0 HB3 GLN A 130 4.051 -6.375 11.345 1.00 0.00 H new ATOM 0 HG2 GLN A 130 5.010 -7.403 13.464 1.00 0.00 H new ATOM 0 HG3 GLN A 130 5.870 -8.541 12.446 1.00 0.00 H new ATOM 0 HE21 GLN A 130 7.538 -7.238 13.921 1.00 0.00 H new ATOM 0 HE22 GLN A 130 8.328 -5.898 13.083 1.00 0.00 H new ATOM 2099 N VAL A 131 1.796 -7.797 9.747 1.00 0.00 N ATOM 2100 CA VAL A 131 0.664 -7.253 9.006 1.00 0.00 C ATOM 2101 C VAL A 131 -0.629 -7.976 9.370 1.00 0.00 C ATOM 2102 O VAL A 131 -1.524 -7.398 9.989 1.00 0.00 O ATOM 2103 CB VAL A 131 0.886 -7.357 7.486 1.00 0.00 C ATOM 2104 CG1 VAL A 131 -0.321 -6.820 6.732 1.00 0.00 C ATOM 2105 CG2 VAL A 131 2.151 -6.614 7.081 1.00 0.00 C ATOM 0 H VAL A 131 2.486 -8.278 9.170 1.00 0.00 H new ATOM 0 HA VAL A 131 0.580 -6.202 9.282 1.00 0.00 H new ATOM 0 HB VAL A 131 1.009 -8.408 7.225 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -0.146 -6.902 5.659 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -1.205 -7.399 7.000 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.479 -5.774 6.995 1.00 0.00 H new ATOM 0 HG21 VAL A 131 2.293 -6.698 6.004 1.00 0.00 H new ATOM 0 HG22 VAL A 131 2.059 -5.563 7.354 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.009 -7.049 7.595 1.00 0.00 H new ATOM 2115 N THR A 132 -0.721 -9.244 8.982 1.00 0.00 N ATOM 2116 CA THR A 132 -1.905 -10.046 9.266 1.00 0.00 C ATOM 2117 C THR A 132 -2.283 -9.964 10.740 1.00 0.00 C ATOM 2118 O THR A 132 -3.450 -9.775 11.082 1.00 0.00 O ATOM 2119 CB THR A 132 -1.687 -11.522 8.885 1.00 0.00 C ATOM 2120 OG1 THR A 132 -0.927 -11.609 7.674 1.00 0.00 O ATOM 2121 CG2 THR A 132 -3.018 -12.236 8.706 1.00 0.00 C ATOM 0 H THR A 132 0.010 -9.738 8.470 1.00 0.00 H new ATOM 0 HA THR A 132 -2.716 -9.638 8.663 1.00 0.00 H new ATOM 0 HB THR A 132 -1.138 -12.006 9.693 1.00 0.00 H new ATOM 0 HG1 THR A 132 -0.018 -11.912 7.879 1.00 0.00 H new ATOM 0 HG21 THR A 132 -2.839 -13.277 8.437 1.00 0.00 H new ATOM 0 HG22 THR A 132 -3.582 -12.194 9.638 1.00 0.00 H new ATOM 0 HG23 THR A 132 -3.588 -11.750 7.914 1.00 0.00 H new ATOM 2129 N GLY A 133 -1.289 -10.107 11.611 1.00 0.00 N ATOM 2130 CA GLY A 133 -1.539 -10.045 13.039 1.00 0.00 C ATOM 2131 C GLY A 133 -2.014 -8.677 13.486 1.00 0.00 C ATOM 2132 O GLY A 133 -2.898 -8.566 14.335 1.00 0.00 O ATOM 0 H GLY A 133 -0.315 -10.265 11.353 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.287 -10.791 13.306 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -0.626 -10.302 13.576 1.00 0.00 H new ATOM 2136 N PHE A 134 -1.424 -7.632 12.915 1.00 0.00 N ATOM 2137 CA PHE A 134 -1.791 -6.264 13.261 1.00 0.00 C ATOM 2138 C PHE A 134 -3.244 -5.979 12.892 1.00 0.00 C ATOM 2139 O PHE A 134 -3.978 -5.347 13.652 1.00 0.00 O ATOM 2140 CB PHE A 134 -0.868 -5.271 12.551 1.00 0.00 C ATOM 2141 CG PHE A 134 -1.285 -3.838 12.721 1.00 0.00 C ATOM 2142 CD1 PHE A 134 -2.439 -3.362 12.118 1.00 0.00 C ATOM 2143 CD2 PHE A 134 -0.525 -2.967 13.485 1.00 0.00 C ATOM 2144 CE1 PHE A 134 -2.824 -2.044 12.273 1.00 0.00 C ATOM 2145 CE2 PHE A 134 -0.905 -1.648 13.643 1.00 0.00 C ATOM 2146 CZ PHE A 134 -2.057 -1.186 13.037 1.00 0.00 C ATOM 0 H PHE A 134 -0.690 -7.707 12.211 1.00 0.00 H new ATOM 0 HA PHE A 134 -1.680 -6.147 14.339 1.00 0.00 H new ATOM 0 HB2 PHE A 134 0.146 -5.394 12.932 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -0.840 -5.509 11.488 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -3.044 -4.028 11.521 1.00 0.00 H new ATOM 0 HD2 PHE A 134 0.376 -3.323 13.963 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -3.724 -1.685 11.797 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -0.302 -0.979 14.239 1.00 0.00 H new ATOM 0 HZ PHE A 134 -2.357 -0.156 13.160 1.00 0.00 H new ATOM 2156 N LEU A 135 -3.652 -6.450 11.718 1.00 0.00 N ATOM 2157 CA LEU A 135 -5.017 -6.247 11.245 1.00 0.00 C ATOM 2158 C LEU A 135 -6.029 -6.746 12.272 1.00 0.00 C ATOM 2159 O LEU A 135 -7.010 -6.068 12.573 1.00 0.00 O ATOM 2160 CB LEU A 135 -5.228 -6.966 9.912 1.00 0.00 C ATOM 2161 CG LEU A 135 -4.416 -6.438 8.729 1.00 0.00 C ATOM 2162 CD1 LEU A 135 -4.218 -7.529 7.688 1.00 0.00 C ATOM 2163 CD2 LEU A 135 -5.099 -5.227 8.111 1.00 0.00 C ATOM 0 H LEU A 135 -3.057 -6.975 11.077 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.171 -5.177 11.101 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -4.989 -8.021 10.049 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.286 -6.910 9.655 1.00 0.00 H new ATOM 0 HG LEU A 135 -3.436 -6.130 9.094 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.638 -7.135 6.854 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.685 -8.367 8.136 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.189 -7.868 7.327 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.507 -4.865 7.271 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -6.092 -5.509 7.761 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.188 -4.439 8.858 1.00 0.00 H new ATOM 2175 N GLY A 136 -5.782 -7.938 12.807 1.00 0.00 N ATOM 2176 CA GLY A 136 -6.679 -8.507 13.796 1.00 0.00 C ATOM 2177 C GLY A 136 -6.591 -7.801 15.134 1.00 0.00 C ATOM 2178 O GLY A 136 -7.611 -7.514 15.759 1.00 0.00 O ATOM 0 H GLY A 136 -4.977 -8.519 12.573 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -7.703 -8.453 13.427 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -6.444 -9.563 13.930 1.00 0.00 H new ATOM 2182 N GLU A 137 -5.368 -7.521 15.574 1.00 0.00 N ATOM 2183 CA GLU A 137 -5.152 -6.846 16.849 1.00 0.00 C ATOM 2184 C GLU A 137 -5.693 -5.419 16.807 1.00 0.00 C ATOM 2185 O GLU A 137 -6.598 -5.065 17.563 1.00 0.00 O ATOM 2186 CB GLU A 137 -3.662 -6.828 17.196 1.00 0.00 C ATOM 2187 CG GLU A 137 -3.385 -6.733 18.687 1.00 0.00 C ATOM 2188 CD GLU A 137 -3.514 -5.317 19.214 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -2.834 -4.418 18.677 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -4.297 -5.108 20.165 1.00 0.00 O ATOM 0 H GLU A 137 -4.513 -7.751 15.067 1.00 0.00 H new ATOM 0 HA GLU A 137 -5.690 -7.398 17.619 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -3.196 -7.732 16.805 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.191 -5.984 16.693 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -4.078 -7.381 19.224 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -2.380 -7.103 18.891 1.00 0.00 H new ATOM 2197 N HIS A 138 -5.130 -4.605 15.920 1.00 0.00 N ATOM 2198 CA HIS A 138 -5.555 -3.217 15.779 1.00 0.00 C ATOM 2199 C HIS A 138 -6.932 -3.134 15.126 1.00 0.00 C ATOM 2200 O HIS A 138 -7.842 -2.497 15.653 1.00 0.00 O ATOM 2201 CB HIS A 138 -4.537 -2.431 14.952 1.00 0.00 C ATOM 2202 CG HIS A 138 -3.317 -2.034 15.724 1.00 0.00 C ATOM 2203 ND1 HIS A 138 -2.978 -0.721 15.973 1.00 0.00 N ATOM 2204 CD2 HIS A 138 -2.354 -2.787 16.306 1.00 0.00 C ATOM 2205 CE1 HIS A 138 -1.858 -0.683 16.673 1.00 0.00 C ATOM 2206 NE2 HIS A 138 -1.459 -1.923 16.888 1.00 0.00 N ATOM 0 H HIS A 138 -4.379 -4.882 15.288 1.00 0.00 H new ATOM 0 HA HIS A 138 -5.618 -2.779 16.775 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -4.235 -3.033 14.095 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -5.016 -1.534 14.558 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -2.300 -3.866 16.312 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -1.355 0.210 17.012 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -0.622 -2.195 17.403 1.00 0.00 H new ATOM 2215 N GLY A 139 -7.075 -3.782 13.974 1.00 0.00 N ATOM 2216 CA GLY A 139 -8.343 -3.767 13.267 1.00 0.00 C ATOM 2217 C GLY A 139 -8.224 -3.180 11.875 1.00 0.00 C ATOM 2218 O GLY A 139 -7.119 -2.953 11.383 1.00 0.00 O ATOM 0 H GLY A 139 -6.336 -4.317 13.518 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.729 -4.784 13.197 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -9.068 -3.190 13.840 1.00 0.00 H new ATOM 2222 N GLN A 140 -9.365 -2.936 11.238 1.00 0.00 N ATOM 2223 CA GLN A 140 -9.383 -2.374 9.893 1.00 0.00 C ATOM 2224 C GLN A 140 -10.126 -1.043 9.869 1.00 0.00 C ATOM 2225 O GLN A 140 -11.082 -0.840 10.618 1.00 0.00 O ATOM 2226 CB GLN A 140 -10.036 -3.354 8.917 1.00 0.00 C ATOM 2227 CG GLN A 140 -9.052 -4.317 8.271 1.00 0.00 C ATOM 2228 CD GLN A 140 -9.498 -4.773 6.896 1.00 0.00 C ATOM 2229 OE1 GLN A 140 -9.861 -5.933 6.702 1.00 0.00 O ATOM 2230 NE2 GLN A 140 -9.474 -3.859 5.933 1.00 0.00 N ATOM 0 H GLN A 140 -10.288 -3.119 11.632 1.00 0.00 H new ATOM 0 HA GLN A 140 -8.352 -2.199 9.586 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -10.798 -3.927 9.446 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -10.546 -2.790 8.136 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -8.077 -3.835 8.191 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.926 -5.187 8.915 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -9.166 -2.909 6.139 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -9.764 -4.107 4.987 1.00 0.00 H new ATOM 2239 N LEU A 141 -9.681 -0.138 9.004 1.00 0.00 N ATOM 2240 CA LEU A 141 -10.304 1.176 8.882 1.00 0.00 C ATOM 2241 C LEU A 141 -11.824 1.066 8.951 1.00 0.00 C ATOM 2242 O LEU A 141 -12.470 1.744 9.751 1.00 0.00 O ATOM 2243 CB LEU A 141 -9.889 1.839 7.568 1.00 0.00 C ATOM 2244 CG LEU A 141 -8.615 2.685 7.617 1.00 0.00 C ATOM 2245 CD1 LEU A 141 -7.384 1.806 7.460 1.00 0.00 C ATOM 2246 CD2 LEU A 141 -8.647 3.758 6.538 1.00 0.00 C ATOM 0 H LEU A 141 -8.891 -0.290 8.377 1.00 0.00 H new ATOM 0 HA LEU A 141 -9.964 1.791 9.715 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -9.756 1.060 6.817 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -10.709 2.472 7.228 1.00 0.00 H new ATOM 0 HG LEU A 141 -8.564 3.175 8.589 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -6.488 2.425 7.497 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -7.354 1.075 8.268 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -7.427 1.287 6.502 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -7.733 4.351 6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -8.722 3.286 5.558 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -9.509 4.406 6.695 1.00 0.00 H new ATOM 2258 N ASP A 142 -12.389 0.206 8.110 1.00 0.00 N ATOM 2259 CA ASP A 142 -13.833 0.005 8.078 1.00 0.00 C ATOM 2260 C ASP A 142 -14.386 -0.189 9.486 1.00 0.00 C ATOM 2261 O ASP A 142 -15.396 0.408 9.855 1.00 0.00 O ATOM 2262 CB ASP A 142 -14.181 -1.205 7.209 1.00 0.00 C ATOM 2263 CG ASP A 142 -15.542 -1.784 7.541 1.00 0.00 C ATOM 2264 OD1 ASP A 142 -16.558 -1.184 7.133 1.00 0.00 O ATOM 2265 OD2 ASP A 142 -15.591 -2.838 8.209 1.00 0.00 O ATOM 0 H ASP A 142 -11.869 -0.363 7.442 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.290 0.896 7.647 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -14.160 -0.913 6.159 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -13.420 -1.974 7.341 1.00 0.00 H new ATOM 2270 N GLY A 143 -13.716 -1.029 10.270 1.00 0.00 N ATOM 2271 CA GLY A 143 -14.157 -1.288 11.628 1.00 0.00 C ATOM 2272 C GLY A 143 -14.778 -0.068 12.278 1.00 0.00 C ATOM 2273 O GLY A 143 -14.208 1.024 12.238 1.00 0.00 O ATOM 0 H GLY A 143 -12.876 -1.534 9.989 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -14.882 -2.102 11.622 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -13.308 -1.622 12.225 1.00 0.00 H new ATOM 2277 N LEU A 144 -15.949 -0.250 12.877 1.00 0.00 N ATOM 2278 CA LEU A 144 -16.650 0.845 13.538 1.00 0.00 C ATOM 2279 C LEU A 144 -16.294 0.905 15.020 1.00 0.00 C ATOM 2280 O LEU A 144 -15.745 1.897 15.498 1.00 0.00 O ATOM 2281 CB LEU A 144 -18.162 0.684 13.371 1.00 0.00 C ATOM 2282 CG LEU A 144 -18.766 1.292 12.104 1.00 0.00 C ATOM 2283 CD1 LEU A 144 -18.449 2.777 12.021 1.00 0.00 C ATOM 2284 CD2 LEU A 144 -18.254 0.565 10.869 1.00 0.00 C ATOM 0 H LEU A 144 -16.434 -1.146 12.919 1.00 0.00 H new ATOM 0 HA LEU A 144 -16.336 1.778 13.070 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -18.398 -0.380 13.387 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -18.653 1.133 14.235 1.00 0.00 H new ATOM 0 HG LEU A 144 -19.849 1.175 12.148 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -18.887 3.192 11.113 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -18.864 3.287 12.890 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -17.368 2.918 12.000 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -18.694 1.010 9.976 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -17.168 0.651 10.820 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -18.533 -0.487 10.925 1.00 0.00 H new ATOM 2296 N SER A 145 -16.608 -0.166 15.742 1.00 0.00 N ATOM 2297 CA SER A 145 -16.323 -0.236 17.170 1.00 0.00 C ATOM 2298 C SER A 145 -14.968 0.392 17.485 1.00 0.00 C ATOM 2299 O SER A 145 -14.842 1.188 18.416 1.00 0.00 O ATOM 2300 CB SER A 145 -16.347 -1.689 17.647 1.00 0.00 C ATOM 2301 OG SER A 145 -16.112 -1.773 19.042 1.00 0.00 O ATOM 0 H SER A 145 -17.060 -0.997 15.361 1.00 0.00 H new ATOM 0 HA SER A 145 -17.096 0.324 17.697 1.00 0.00 H new ATOM 0 HB2 SER A 145 -17.312 -2.137 17.410 1.00 0.00 H new ATOM 0 HB3 SER A 145 -15.590 -2.263 17.113 1.00 0.00 H new ATOM 0 HG SER A 145 -16.134 -2.712 19.321 1.00 0.00 H new ATOM 2307 N SER A 146 -13.958 0.028 16.702 1.00 0.00 N ATOM 2308 CA SER A 146 -12.611 0.552 16.898 1.00 0.00 C ATOM 2309 C SER A 146 -12.250 1.546 15.799 1.00 0.00 C ATOM 2310 O SER A 146 -12.348 1.237 14.611 1.00 0.00 O ATOM 2311 CB SER A 146 -11.595 -0.592 16.922 1.00 0.00 C ATOM 2312 OG SER A 146 -11.615 -1.265 18.169 1.00 0.00 O ATOM 0 H SER A 146 -14.047 -0.628 15.926 1.00 0.00 H new ATOM 0 HA SER A 146 -12.585 1.071 17.856 1.00 0.00 H new ATOM 0 HB2 SER A 146 -11.817 -1.297 16.121 1.00 0.00 H new ATOM 0 HB3 SER A 146 -10.596 -0.199 16.733 1.00 0.00 H new ATOM 0 HG SER A 146 -10.959 -1.993 18.159 1.00 0.00 H new ATOM 2318 N SER A 147 -11.831 2.740 16.204 1.00 0.00 N ATOM 2319 CA SER A 147 -11.458 3.782 15.255 1.00 0.00 C ATOM 2320 C SER A 147 -10.694 4.904 15.952 1.00 0.00 C ATOM 2321 O SER A 147 -10.718 5.018 17.177 1.00 0.00 O ATOM 2322 CB SER A 147 -12.703 4.347 14.569 1.00 0.00 C ATOM 2323 OG SER A 147 -12.354 5.313 13.593 1.00 0.00 O ATOM 0 H SER A 147 -11.741 3.010 17.183 1.00 0.00 H new ATOM 0 HA SER A 147 -10.808 3.337 14.502 1.00 0.00 H new ATOM 0 HB2 SER A 147 -13.262 3.538 14.100 1.00 0.00 H new ATOM 0 HB3 SER A 147 -13.359 4.798 15.313 1.00 0.00 H new ATOM 0 HG SER A 147 -13.167 5.657 13.168 1.00 0.00 H new ATOM 2329 N SER A 148 -10.016 5.730 15.161 1.00 0.00 N ATOM 2330 CA SER A 148 -9.241 6.841 15.701 1.00 0.00 C ATOM 2331 C SER A 148 -10.153 7.997 16.098 1.00 0.00 C ATOM 2332 O SER A 148 -11.038 8.393 15.341 1.00 0.00 O ATOM 2333 CB SER A 148 -8.211 7.318 14.675 1.00 0.00 C ATOM 2334 OG SER A 148 -7.162 8.036 15.301 1.00 0.00 O ATOM 0 H SER A 148 -9.988 5.651 14.144 1.00 0.00 H new ATOM 0 HA SER A 148 -8.720 6.490 16.592 1.00 0.00 H new ATOM 0 HB2 SER A 148 -7.801 6.461 14.141 1.00 0.00 H new ATOM 0 HB3 SER A 148 -8.698 7.952 13.934 1.00 0.00 H new ATOM 0 HG SER A 148 -6.516 8.328 14.624 1.00 0.00 H new ATOM 2340 N GLY A 149 -9.930 8.535 17.294 1.00 0.00 N ATOM 2341 CA GLY A 149 -10.739 9.640 17.773 1.00 0.00 C ATOM 2342 C GLY A 149 -10.093 10.987 17.514 1.00 0.00 C ATOM 2343 O GLY A 149 -8.870 11.127 17.535 1.00 0.00 O ATOM 0 H GLY A 149 -9.203 8.225 17.939 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -11.715 9.609 17.288 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -10.911 9.523 18.843 1.00 0.00 H new ATOM 2347 N PRO A 150 -10.925 12.008 17.260 1.00 0.00 N ATOM 2348 CA PRO A 150 -10.450 13.368 16.990 1.00 0.00 C ATOM 2349 C PRO A 150 -9.856 14.031 18.227 1.00 0.00 C ATOM 2350 O PRO A 150 -9.459 15.196 18.189 1.00 0.00 O ATOM 2351 CB PRO A 150 -11.715 14.104 16.544 1.00 0.00 C ATOM 2352 CG PRO A 150 -12.834 13.350 17.176 1.00 0.00 C ATOM 2353 CD PRO A 150 -12.394 11.913 17.218 1.00 0.00 C ATOM 0 HA PRO A 150 -9.650 13.380 16.250 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -11.704 15.144 16.871 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -11.806 14.112 15.458 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -13.039 13.725 18.179 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -13.753 13.460 16.600 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -12.789 11.397 18.093 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -12.736 11.362 16.342 1.00 0.00 H new ATOM 2361 N SER A 151 -9.796 13.282 19.324 1.00 0.00 N ATOM 2362 CA SER A 151 -9.253 13.799 20.575 1.00 0.00 C ATOM 2363 C SER A 151 -7.949 14.552 20.330 1.00 0.00 C ATOM 2364 O SER A 151 -7.779 15.684 20.783 1.00 0.00 O ATOM 2365 CB SER A 151 -9.018 12.656 21.564 1.00 0.00 C ATOM 2366 OG SER A 151 -10.236 12.227 22.147 1.00 0.00 O ATOM 0 H SER A 151 -10.117 12.315 19.372 1.00 0.00 H new ATOM 0 HA SER A 151 -9.979 14.493 20.999 1.00 0.00 H new ATOM 0 HB2 SER A 151 -8.542 11.820 21.052 1.00 0.00 H new ATOM 0 HB3 SER A 151 -8.332 12.983 22.346 1.00 0.00 H new ATOM 0 HG SER A 151 -10.059 11.495 22.774 1.00 0.00 H new ATOM 2372 N SER A 152 -7.031 13.914 19.612 1.00 0.00 N ATOM 2373 CA SER A 152 -5.739 14.521 19.310 1.00 0.00 C ATOM 2374 C SER A 152 -5.449 14.465 17.813 1.00 0.00 C ATOM 2375 O SER A 152 -5.528 13.405 17.194 1.00 0.00 O ATOM 2376 CB SER A 152 -4.626 13.813 20.084 1.00 0.00 C ATOM 2377 OG SER A 152 -4.406 12.507 19.580 1.00 0.00 O ATOM 0 H SER A 152 -7.157 12.977 19.228 1.00 0.00 H new ATOM 0 HA SER A 152 -5.776 15.567 19.616 1.00 0.00 H new ATOM 0 HB2 SER A 152 -3.705 14.393 20.015 1.00 0.00 H new ATOM 0 HB3 SER A 152 -4.891 13.759 21.140 1.00 0.00 H new ATOM 0 HG SER A 152 -4.750 12.447 18.664 1.00 0.00 H new ATOM 2383 N GLY A 153 -5.113 15.615 17.238 1.00 0.00 N ATOM 2384 CA GLY A 153 -4.816 15.676 15.819 1.00 0.00 C ATOM 2385 C GLY A 153 -3.411 16.173 15.541 1.00 0.00 C ATOM 2386 O GLY A 153 -2.920 17.077 16.217 1.00 0.00 O ATOM 0 H GLY A 153 -5.041 16.506 17.729 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -4.941 14.685 15.382 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -5.534 16.333 15.329 1.00 0.00 H new TER 2390 GLY A 153