USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 985 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 55 MET CE :methyl -173:sc= -5.73! (180deg=-3.88!) USER MOD Set 1.2: A 111 HIS : no HE2:sc= -7.1! C(o=-12!,f=-28!) USER MOD Set 1.3: A 122 TYR OH : rot -20:sc= 0.821! USER MOD Set 2.1: A 102 ASN :FLIP amide:sc= -5.59! C(o=-22!,f=-10!) USER MOD Set 2.2: A 104 CYS SG : rot 180:sc= -4.65! USER MOD Set 3.1: A 10 TYR OH : rot -154:sc= 0.808 USER MOD Set 3.2: A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.3: A 121 HIS :FLIP no HD1:sc= -2! F(o=-5.8,f=-1.2!) USER MOD Set 4.1: A 23 HIS : no HD1:sc= -8.73! C(o=-10!,f=-15!) USER MOD Set 4.2: A 54 TYR OH : rot -140:sc= -1.65 USER MOD Set 5.1: A 26 CYS SG : rot -66:sc= -0.959 USER MOD Set 5.2: A 57 CYS SG : rot 180:sc= 0.0434 USER MOD Single : A 1 ASP N :NH3+ -175:sc= 0.913 (180deg=0.824) USER MOD Single : A 3 THR OG1 : rot -28:sc= 0.518 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= 0.37 (180deg=0.223) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot -80:sc= -1.07 USER MOD Single : A 33 THR OG1 : rot 71:sc= 0.0615 USER MOD Single : A 41 SER OG : rot 180:sc= -1.07! USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= -4.86! C(o=-4.9!,f=-13!) USER MOD Single : A 50 LYS NZ :NH3+ 164:sc= -0.0326 (180deg=-0.276) USER MOD Single : A 52 LYS NZ :NH3+ -120:sc= -3.69! (180deg=-7.12!) USER MOD Single : A 53 CYS SG : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.319 K(o=-0.32,f=-1.1) USER MOD Single : A 60 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-2.2!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.058) USER MOD Single : A 72 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.07) USER MOD Single : A 75 LYS NZ :NH3+ -148:sc= -0.0774 (180deg=-0.987) USER MOD Single : A 79 SER OG : rot -71:sc= 1.15 USER MOD Single : A 82 ASN :FLIP amide:sc= -2.42! C(o=-4.9!,f=-2.4!) USER MOD Single : A 83 SER OG : rot 96:sc= 0.742 USER MOD Single : A 85 HIS : no HD1:sc= -4.17! X(o=-4.2!,f=-3.8) USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.773 K(o=-0.77,f=-3.5!) USER MOD Single : A 91 MET CE :methyl -161:sc= -0.217 (180deg=-0.481) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 CYS SG : rot -72:sc= -2.47! USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 172:sc= -2.15 (180deg=-2.48) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 CYS SG : rot 164:sc= -1.98! USER MOD Single : A 115 LYS NZ :NH3+ -122:sc= -2.61 (180deg=-5.73!) USER MOD Single : A 116 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 3.551 8.970 -25.029 1.00 0.00 N ATOM 2 CA ASP A 1 3.292 7.553 -24.680 1.00 0.00 C ATOM 3 C ASP A 1 2.672 6.828 -25.866 1.00 0.00 C ATOM 4 O ASP A 1 1.471 6.842 -26.045 1.00 0.00 O ATOM 5 CB ASP A 1 2.314 7.475 -23.497 1.00 0.00 C ATOM 6 CG ASP A 1 1.091 8.344 -23.798 1.00 0.00 C ATOM 7 OD1 ASP A 1 1.176 9.078 -24.768 1.00 0.00 O ATOM 8 OD2 ASP A 1 0.142 8.223 -23.041 1.00 0.00 O ATOM 0 H1 ASP A 1 4.051 9.435 -24.244 1.00 0.00 H new ATOM 0 H2 ASP A 1 4.136 9.015 -25.887 1.00 0.00 H new ATOM 0 H3 ASP A 1 2.648 9.456 -25.200 1.00 0.00 H new ATOM 0 HA ASP A 1 4.240 7.085 -24.413 1.00 0.00 H new ATOM 0 HB2 ASP A 1 2.009 6.442 -23.329 1.00 0.00 H new ATOM 0 HB3 ASP A 1 2.801 7.816 -22.584 1.00 0.00 H new ATOM 12 N VAL A 2 3.502 6.206 -26.659 1.00 0.00 N ATOM 13 CA VAL A 2 2.972 5.477 -27.836 1.00 0.00 C ATOM 14 C VAL A 2 2.633 4.038 -27.473 1.00 0.00 C ATOM 15 O VAL A 2 3.171 3.487 -26.534 1.00 0.00 O ATOM 16 CB VAL A 2 4.048 5.468 -28.930 1.00 0.00 C ATOM 17 CG1 VAL A 2 5.200 4.562 -28.493 1.00 0.00 C ATOM 18 CG2 VAL A 2 3.443 4.924 -30.225 1.00 0.00 C ATOM 0 H VAL A 2 4.515 6.173 -26.541 1.00 0.00 H new ATOM 0 HA VAL A 2 2.066 5.975 -28.182 1.00 0.00 H new ATOM 0 HB VAL A 2 4.417 6.481 -29.093 1.00 0.00 H new ATOM 0 HG11 VAL A 2 5.968 4.551 -29.266 1.00 0.00 H new ATOM 0 HG12 VAL A 2 5.626 4.939 -27.563 1.00 0.00 H new ATOM 0 HG13 VAL A 2 4.828 3.549 -28.337 1.00 0.00 H new ATOM 0 HG21 VAL A 2 4.203 4.915 -31.006 1.00 0.00 H new ATOM 0 HG22 VAL A 2 3.081 3.909 -30.059 1.00 0.00 H new ATOM 0 HG23 VAL A 2 2.613 5.559 -30.534 1.00 0.00 H new ATOM 28 N THR A 3 1.745 3.455 -28.228 1.00 0.00 N ATOM 29 CA THR A 3 1.354 2.056 -27.948 1.00 0.00 C ATOM 30 C THR A 3 0.702 1.432 -29.196 1.00 0.00 C ATOM 31 O THR A 3 -0.097 2.066 -29.855 1.00 0.00 O ATOM 32 CB THR A 3 0.323 2.082 -26.807 1.00 0.00 C ATOM 33 OG1 THR A 3 0.998 2.665 -25.708 1.00 0.00 O ATOM 34 CG2 THR A 3 -0.028 0.663 -26.336 1.00 0.00 C ATOM 0 H THR A 3 1.277 3.889 -29.023 1.00 0.00 H new ATOM 0 HA THR A 3 2.230 1.467 -27.676 1.00 0.00 H new ATOM 0 HB THR A 3 -0.576 2.600 -27.141 1.00 0.00 H new ATOM 0 HG1 THR A 3 1.958 2.484 -25.780 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.759 0.718 -25.529 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.447 0.097 -27.168 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.873 0.166 -25.976 1.00 0.00 H new ATOM 42 N PRO A 4 1.053 0.187 -29.502 1.00 0.00 N ATOM 43 CA PRO A 4 0.490 -0.491 -30.665 1.00 0.00 C ATOM 44 C PRO A 4 -1.025 -0.387 -30.677 1.00 0.00 C ATOM 45 O PRO A 4 -1.668 -0.533 -29.656 1.00 0.00 O ATOM 46 CB PRO A 4 0.933 -1.963 -30.519 1.00 0.00 C ATOM 47 CG PRO A 4 1.917 -2.030 -29.307 1.00 0.00 C ATOM 48 CD PRO A 4 1.993 -0.614 -28.705 1.00 0.00 C ATOM 0 HA PRO A 4 0.833 -0.047 -31.599 1.00 0.00 H new ATOM 0 HB2 PRO A 4 0.072 -2.609 -30.352 1.00 0.00 H new ATOM 0 HB3 PRO A 4 1.420 -2.311 -31.430 1.00 0.00 H new ATOM 0 HG2 PRO A 4 1.565 -2.746 -28.564 1.00 0.00 H new ATOM 0 HG3 PRO A 4 2.903 -2.365 -29.630 1.00 0.00 H new ATOM 0 HD2 PRO A 4 1.714 -0.617 -27.651 1.00 0.00 H new ATOM 0 HD3 PRO A 4 3.005 -0.213 -28.766 1.00 0.00 H new ATOM 56 N ARG A 5 -1.572 -0.134 -31.836 1.00 0.00 N ATOM 57 CA ARG A 5 -3.043 -0.014 -31.929 1.00 0.00 C ATOM 58 C ARG A 5 -3.698 -1.344 -32.271 1.00 0.00 C ATOM 59 O ARG A 5 -3.679 -1.777 -33.406 1.00 0.00 O ATOM 60 CB ARG A 5 -3.371 0.996 -33.031 1.00 0.00 C ATOM 61 CG ARG A 5 -4.896 1.087 -33.184 1.00 0.00 C ATOM 62 CD ARG A 5 -5.268 2.374 -33.932 1.00 0.00 C ATOM 63 NE ARG A 5 -6.553 2.896 -33.383 1.00 0.00 N ATOM 64 CZ ARG A 5 -6.743 4.185 -33.307 1.00 0.00 C ATOM 65 NH1 ARG A 5 -6.004 4.975 -34.038 1.00 0.00 N ATOM 66 NH2 ARG A 5 -7.667 4.639 -32.507 1.00 0.00 N ATOM 0 H ARG A 5 -1.064 -0.007 -32.711 1.00 0.00 H new ATOM 0 HA ARG A 5 -3.427 0.310 -30.962 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -2.958 1.973 -32.782 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -2.915 0.688 -33.972 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -5.268 0.219 -33.728 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -5.370 1.076 -32.203 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -4.479 3.118 -33.818 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -5.367 2.175 -34.999 1.00 0.00 H new ATOM 0 HE ARG A 5 -7.278 2.250 -33.069 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -5.293 4.582 -34.655 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -6.138 5.985 -33.992 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -8.227 3.990 -31.954 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -7.830 5.643 -32.434 1.00 0.00 H new ATOM 80 N ARG A 6 -4.266 -1.963 -31.271 1.00 0.00 N ATOM 81 CA ARG A 6 -4.939 -3.270 -31.486 1.00 0.00 C ATOM 82 C ARG A 6 -6.299 -3.259 -30.820 1.00 0.00 C ATOM 83 O ARG A 6 -6.399 -3.099 -29.619 1.00 0.00 O ATOM 84 CB ARG A 6 -4.084 -4.374 -30.841 1.00 0.00 C ATOM 85 CG ARG A 6 -3.014 -4.835 -31.833 1.00 0.00 C ATOM 86 CD ARG A 6 -2.515 -6.221 -31.418 1.00 0.00 C ATOM 87 NE ARG A 6 -1.601 -6.077 -30.250 1.00 0.00 N ATOM 88 CZ ARG A 6 -1.983 -6.507 -29.078 1.00 0.00 C ATOM 89 NH1 ARG A 6 -2.670 -5.709 -28.306 1.00 0.00 N ATOM 90 NH2 ARG A 6 -1.668 -7.720 -28.716 1.00 0.00 N ATOM 0 H ARG A 6 -4.291 -1.616 -30.312 1.00 0.00 H new ATOM 0 HA ARG A 6 -5.057 -3.450 -32.555 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.615 -4.000 -29.931 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -4.714 -5.215 -30.552 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -3.425 -4.869 -32.842 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -2.186 -4.126 -31.850 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -3.357 -6.863 -31.160 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -1.993 -6.698 -32.248 1.00 0.00 H new ATOM 0 HE ARG A 6 -0.684 -5.646 -30.365 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -2.900 -4.767 -28.622 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -2.977 -6.028 -27.387 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -1.131 -8.317 -29.345 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -1.959 -8.072 -27.804 1.00 0.00 H new ATOM 104 N ASP A 7 -7.327 -3.425 -31.607 1.00 0.00 N ATOM 105 CA ASP A 7 -8.692 -3.426 -31.029 1.00 0.00 C ATOM 106 C ASP A 7 -9.559 -4.472 -31.680 1.00 0.00 C ATOM 107 O ASP A 7 -10.767 -4.455 -31.541 1.00 0.00 O ATOM 108 CB ASP A 7 -9.314 -2.043 -31.271 1.00 0.00 C ATOM 109 CG ASP A 7 -8.985 -1.129 -30.090 1.00 0.00 C ATOM 110 OD1 ASP A 7 -9.048 -1.634 -28.982 1.00 0.00 O ATOM 111 OD2 ASP A 7 -8.692 0.023 -30.363 1.00 0.00 O ATOM 0 H ASP A 7 -7.278 -3.559 -32.617 1.00 0.00 H new ATOM 0 HA ASP A 7 -8.627 -3.651 -29.964 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.928 -1.615 -32.196 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -10.394 -2.132 -31.387 1.00 0.00 H new ATOM 116 N ALA A 8 -8.933 -5.382 -32.353 1.00 0.00 N ATOM 117 CA ALA A 8 -9.713 -6.440 -33.023 1.00 0.00 C ATOM 118 C ALA A 8 -10.818 -5.805 -33.842 1.00 0.00 C ATOM 119 O ALA A 8 -11.677 -6.481 -34.373 1.00 0.00 O ATOM 120 CB ALA A 8 -10.340 -7.342 -31.948 1.00 0.00 C ATOM 0 H ALA A 8 -7.921 -5.439 -32.468 1.00 0.00 H new ATOM 0 HA ALA A 8 -9.065 -7.025 -33.676 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -10.921 -8.130 -32.428 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.551 -7.789 -31.343 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -10.993 -6.747 -31.310 1.00 0.00 H new ATOM 126 N GLU A 9 -10.760 -4.499 -33.929 1.00 0.00 N ATOM 127 CA GLU A 9 -11.778 -3.758 -34.698 1.00 0.00 C ATOM 128 C GLU A 9 -11.193 -3.263 -36.005 1.00 0.00 C ATOM 129 O GLU A 9 -11.873 -3.219 -37.009 1.00 0.00 O ATOM 130 CB GLU A 9 -12.225 -2.546 -33.862 1.00 0.00 C ATOM 131 CG GLU A 9 -13.391 -1.851 -34.564 1.00 0.00 C ATOM 132 CD GLU A 9 -14.304 -1.211 -33.515 1.00 0.00 C ATOM 133 OE1 GLU A 9 -13.748 -0.661 -32.578 1.00 0.00 O ATOM 134 OE2 GLU A 9 -15.504 -1.306 -33.712 1.00 0.00 O ATOM 0 H GLU A 9 -10.042 -3.920 -33.493 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.621 -4.415 -34.915 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -12.526 -2.868 -32.865 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.395 -1.851 -33.736 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -13.017 -1.091 -35.250 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -13.952 -2.570 -35.161 1.00 0.00 H new ATOM 141 N TYR A 10 -9.934 -2.897 -35.979 1.00 0.00 N ATOM 142 CA TYR A 10 -9.319 -2.405 -37.239 1.00 0.00 C ATOM 143 C TYR A 10 -8.814 -3.577 -38.109 1.00 0.00 C ATOM 144 O TYR A 10 -9.192 -3.695 -39.258 1.00 0.00 O ATOM 145 CB TYR A 10 -8.155 -1.425 -36.909 1.00 0.00 C ATOM 146 CG TYR A 10 -6.978 -1.669 -37.871 1.00 0.00 C ATOM 147 CD1 TYR A 10 -7.194 -1.732 -39.235 1.00 0.00 C ATOM 148 CD2 TYR A 10 -5.692 -1.832 -37.391 1.00 0.00 C ATOM 149 CE1 TYR A 10 -6.145 -1.955 -40.103 1.00 0.00 C ATOM 150 CE2 TYR A 10 -4.643 -2.055 -38.264 1.00 0.00 C ATOM 151 CZ TYR A 10 -4.863 -2.117 -39.625 1.00 0.00 C ATOM 152 OH TYR A 10 -3.817 -2.337 -40.495 1.00 0.00 O ATOM 0 H TYR A 10 -9.324 -2.918 -35.161 1.00 0.00 H new ATOM 0 HA TYR A 10 -10.080 -1.874 -37.811 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -8.500 -0.395 -36.996 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -7.829 -1.567 -35.878 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -8.193 -1.605 -39.625 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -5.505 -1.785 -36.328 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -6.330 -2.003 -41.166 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -3.643 -2.182 -37.877 1.00 0.00 H new ATOM 0 HH TYR A 10 -3.100 -2.818 -40.030 1.00 0.00 H new ATOM 162 N PRO A 11 -7.972 -4.434 -37.544 1.00 0.00 N ATOM 163 CA PRO A 11 -7.445 -5.574 -38.291 1.00 0.00 C ATOM 164 C PRO A 11 -8.572 -6.572 -38.638 1.00 0.00 C ATOM 165 O PRO A 11 -9.271 -7.036 -37.760 1.00 0.00 O ATOM 166 CB PRO A 11 -6.457 -6.257 -37.323 1.00 0.00 C ATOM 167 CG PRO A 11 -6.574 -5.531 -35.951 1.00 0.00 C ATOM 168 CD PRO A 11 -7.497 -4.320 -36.157 1.00 0.00 C ATOM 0 HA PRO A 11 -6.985 -5.258 -39.227 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -6.692 -7.316 -37.218 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -5.438 -6.193 -37.706 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.981 -6.201 -35.194 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -5.593 -5.212 -35.599 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -8.329 -4.334 -35.453 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -6.961 -3.384 -35.999 1.00 0.00 H new ATOM 176 N PRO A 12 -8.732 -6.888 -39.919 1.00 0.00 N ATOM 177 CA PRO A 12 -9.772 -7.824 -40.335 1.00 0.00 C ATOM 178 C PRO A 12 -9.565 -9.212 -39.678 1.00 0.00 C ATOM 179 O PRO A 12 -8.567 -9.862 -39.917 1.00 0.00 O ATOM 180 CB PRO A 12 -9.599 -7.950 -41.866 1.00 0.00 C ATOM 181 CG PRO A 12 -8.445 -6.992 -42.286 1.00 0.00 C ATOM 182 CD PRO A 12 -7.906 -6.339 -41.005 1.00 0.00 C ATOM 0 HA PRO A 12 -10.763 -7.476 -40.044 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -9.364 -8.978 -42.142 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -10.523 -7.685 -42.380 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -7.656 -7.542 -42.798 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -8.808 -6.234 -42.980 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -6.852 -6.574 -40.856 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -7.987 -5.253 -41.052 1.00 0.00 H new ATOM 190 N PRO A 13 -10.522 -9.643 -38.856 1.00 0.00 N ATOM 191 CA PRO A 13 -10.419 -10.939 -38.185 1.00 0.00 C ATOM 192 C PRO A 13 -10.250 -12.086 -39.182 1.00 0.00 C ATOM 193 O PRO A 13 -9.969 -13.204 -38.799 1.00 0.00 O ATOM 194 CB PRO A 13 -11.751 -11.099 -37.420 1.00 0.00 C ATOM 195 CG PRO A 13 -12.536 -9.761 -37.575 1.00 0.00 C ATOM 196 CD PRO A 13 -11.746 -8.881 -38.556 1.00 0.00 C ATOM 0 HA PRO A 13 -9.547 -10.973 -37.532 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -12.328 -11.932 -37.822 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.567 -11.317 -36.368 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -13.543 -9.947 -37.950 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -12.642 -9.263 -36.611 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -12.321 -8.686 -39.461 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.509 -7.913 -38.114 1.00 0.00 H new ATOM 204 N GLU A 14 -10.421 -11.790 -40.443 1.00 0.00 N ATOM 205 CA GLU A 14 -10.270 -12.859 -41.464 1.00 0.00 C ATOM 206 C GLU A 14 -8.812 -13.293 -41.586 1.00 0.00 C ATOM 207 O GLU A 14 -8.490 -14.460 -41.437 1.00 0.00 O ATOM 208 CB GLU A 14 -10.734 -12.309 -42.821 1.00 0.00 C ATOM 209 CG GLU A 14 -10.260 -13.254 -43.930 1.00 0.00 C ATOM 210 CD GLU A 14 -8.832 -12.880 -44.339 1.00 0.00 C ATOM 211 OE1 GLU A 14 -8.580 -11.688 -44.396 1.00 0.00 O ATOM 212 OE2 GLU A 14 -8.077 -13.809 -44.572 1.00 0.00 O ATOM 0 H GLU A 14 -10.656 -10.865 -40.804 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.868 -13.719 -41.164 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.820 -12.221 -42.840 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.330 -11.309 -42.980 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -10.292 -14.286 -43.582 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.926 -13.187 -44.790 1.00 0.00 H new ATOM 219 N LEU A 15 -7.953 -12.347 -41.845 1.00 0.00 N ATOM 220 CA LEU A 15 -6.526 -12.688 -41.978 1.00 0.00 C ATOM 221 C LEU A 15 -6.003 -13.212 -40.662 1.00 0.00 C ATOM 222 O LEU A 15 -5.113 -14.036 -40.624 1.00 0.00 O ATOM 223 CB LEU A 15 -5.750 -11.417 -42.349 1.00 0.00 C ATOM 224 CG LEU A 15 -4.265 -11.760 -42.482 1.00 0.00 C ATOM 225 CD1 LEU A 15 -4.110 -12.945 -43.438 1.00 0.00 C ATOM 226 CD2 LEU A 15 -3.517 -10.551 -43.051 1.00 0.00 C ATOM 0 H LEU A 15 -8.183 -11.361 -41.968 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.401 -13.450 -42.748 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.127 -11.006 -43.286 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.893 -10.653 -41.585 1.00 0.00 H new ATOM 0 HG LEU A 15 -3.856 -12.017 -41.505 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.054 -13.196 -43.538 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.651 -13.805 -43.043 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.514 -12.680 -44.415 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.458 -10.791 -43.148 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.923 -10.300 -44.031 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.637 -9.700 -42.380 1.00 0.00 H new ATOM 238 N LEU A 16 -6.572 -12.721 -39.597 1.00 0.00 N ATOM 239 CA LEU A 16 -6.127 -13.173 -38.270 1.00 0.00 C ATOM 240 C LEU A 16 -6.545 -14.613 -38.035 1.00 0.00 C ATOM 241 O LEU A 16 -5.867 -15.357 -37.354 1.00 0.00 O ATOM 242 CB LEU A 16 -6.784 -12.284 -37.205 1.00 0.00 C ATOM 243 CG LEU A 16 -6.243 -10.859 -37.334 1.00 0.00 C ATOM 244 CD1 LEU A 16 -6.792 -10.009 -36.185 1.00 0.00 C ATOM 245 CD2 LEU A 16 -4.714 -10.892 -37.257 1.00 0.00 C ATOM 0 H LEU A 16 -7.322 -12.030 -39.597 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.041 -13.106 -38.212 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.867 -12.287 -37.329 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.577 -12.676 -36.209 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.551 -10.430 -38.288 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.410 -8.992 -36.271 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.881 -9.993 -36.232 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.476 -10.436 -35.233 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.323 -9.879 -37.348 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.407 -11.314 -36.300 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.322 -11.507 -38.067 1.00 0.00 H new ATOM 257 N GLU A 17 -7.658 -14.981 -38.603 1.00 0.00 N ATOM 258 CA GLU A 17 -8.137 -16.368 -38.426 1.00 0.00 C ATOM 259 C GLU A 17 -7.204 -17.340 -39.131 1.00 0.00 C ATOM 260 O GLU A 17 -6.995 -18.444 -38.676 1.00 0.00 O ATOM 261 CB GLU A 17 -9.540 -16.480 -39.042 1.00 0.00 C ATOM 262 CG GLU A 17 -10.185 -17.790 -38.589 1.00 0.00 C ATOM 263 CD GLU A 17 -9.708 -18.926 -39.495 1.00 0.00 C ATOM 264 OE1 GLU A 17 -9.868 -18.765 -40.694 1.00 0.00 O ATOM 265 OE2 GLU A 17 -9.210 -19.890 -38.938 1.00 0.00 O ATOM 0 H GLU A 17 -8.250 -14.382 -39.178 1.00 0.00 H new ATOM 0 HA GLU A 17 -8.163 -16.612 -37.364 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.154 -15.633 -38.735 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -9.476 -16.449 -40.130 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -9.920 -18.000 -37.553 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.271 -17.708 -38.630 1.00 0.00 H new ATOM 272 N ALA A 18 -6.661 -16.911 -40.237 1.00 0.00 N ATOM 273 CA ALA A 18 -5.737 -17.800 -40.985 1.00 0.00 C ATOM 274 C ALA A 18 -4.314 -17.671 -40.441 1.00 0.00 C ATOM 275 O ALA A 18 -3.516 -18.593 -40.528 1.00 0.00 O ATOM 276 CB ALA A 18 -5.742 -17.365 -42.462 1.00 0.00 C ATOM 0 H ALA A 18 -6.817 -15.991 -40.650 1.00 0.00 H new ATOM 0 HA ALA A 18 -6.064 -18.834 -40.878 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.069 -18.005 -43.032 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.752 -17.451 -42.863 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -5.409 -16.330 -42.538 1.00 0.00 H new ATOM 282 N LEU A 19 -4.031 -16.532 -39.868 1.00 0.00 N ATOM 283 CA LEU A 19 -2.675 -16.303 -39.308 1.00 0.00 C ATOM 284 C LEU A 19 -2.500 -17.002 -37.960 1.00 0.00 C ATOM 285 O LEU A 19 -1.545 -17.726 -37.756 1.00 0.00 O ATOM 286 CB LEU A 19 -2.499 -14.779 -39.110 1.00 0.00 C ATOM 287 CG LEU A 19 -1.016 -14.429 -38.881 1.00 0.00 C ATOM 288 CD1 LEU A 19 -0.574 -14.945 -37.502 1.00 0.00 C ATOM 289 CD2 LEU A 19 -0.152 -15.062 -39.988 1.00 0.00 C ATOM 0 H LEU A 19 -4.682 -15.753 -39.765 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.932 -16.708 -39.995 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.873 -14.248 -39.985 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.092 -14.447 -38.258 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.889 -13.347 -38.914 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.475 -14.697 -37.340 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.181 -14.477 -36.727 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.702 -16.027 -37.460 1.00 0.00 H new ATOM 0 HD21 LEU A 19 0.895 -14.811 -39.820 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -0.273 -16.145 -39.969 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.466 -14.679 -40.959 1.00 0.00 H new ATOM 301 N LYS A 20 -3.427 -16.783 -37.063 1.00 0.00 N ATOM 302 CA LYS A 20 -3.312 -17.432 -35.732 1.00 0.00 C ATOM 303 C LYS A 20 -2.938 -18.927 -35.849 1.00 0.00 C ATOM 304 O LYS A 20 -2.010 -19.375 -35.206 1.00 0.00 O ATOM 305 CB LYS A 20 -4.649 -17.267 -34.967 1.00 0.00 C ATOM 306 CG LYS A 20 -4.922 -18.522 -34.120 1.00 0.00 C ATOM 307 CD LYS A 20 -6.151 -18.279 -33.239 1.00 0.00 C ATOM 308 CE LYS A 20 -5.726 -18.266 -31.767 1.00 0.00 C ATOM 309 NZ LYS A 20 -6.915 -18.092 -30.883 1.00 0.00 N ATOM 0 H LYS A 20 -4.247 -16.190 -37.196 1.00 0.00 H new ATOM 0 HA LYS A 20 -2.508 -16.944 -35.182 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.606 -16.387 -34.326 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.465 -17.108 -35.672 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.089 -19.383 -34.767 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.055 -18.752 -33.500 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.619 -17.331 -33.502 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.893 -19.059 -33.408 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.216 -19.197 -31.521 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.015 -17.458 -31.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -6.610 -18.085 -29.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -7.385 -17.192 -31.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.579 -18.877 -31.036 1.00 0.00 H new ATOM 323 N PRO A 21 -3.670 -19.683 -36.666 1.00 0.00 N ATOM 324 CA PRO A 21 -3.376 -21.099 -36.828 1.00 0.00 C ATOM 325 C PRO A 21 -1.998 -21.291 -37.430 1.00 0.00 C ATOM 326 O PRO A 21 -1.163 -21.967 -36.864 1.00 0.00 O ATOM 327 CB PRO A 21 -4.443 -21.627 -37.804 1.00 0.00 C ATOM 328 CG PRO A 21 -5.305 -20.411 -38.246 1.00 0.00 C ATOM 329 CD PRO A 21 -4.806 -19.188 -37.457 1.00 0.00 C ATOM 0 HA PRO A 21 -3.390 -21.622 -35.872 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.974 -22.100 -38.667 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.063 -22.384 -37.323 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -5.210 -20.242 -39.319 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -6.360 -20.594 -38.045 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -4.500 -18.384 -38.127 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.589 -18.787 -36.814 1.00 0.00 H new ATOM 337 N LEU A 22 -1.776 -20.697 -38.574 1.00 0.00 N ATOM 338 CA LEU A 22 -0.451 -20.851 -39.201 1.00 0.00 C ATOM 339 C LEU A 22 0.626 -20.513 -38.189 1.00 0.00 C ATOM 340 O LEU A 22 1.709 -21.066 -38.211 1.00 0.00 O ATOM 341 CB LEU A 22 -0.350 -19.882 -40.389 1.00 0.00 C ATOM 342 CG LEU A 22 -1.112 -20.472 -41.580 1.00 0.00 C ATOM 343 CD1 LEU A 22 -1.356 -19.375 -42.618 1.00 0.00 C ATOM 344 CD2 LEU A 22 -0.277 -21.588 -42.213 1.00 0.00 C ATOM 0 H LEU A 22 -2.447 -20.124 -39.085 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.319 -21.877 -39.543 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -0.766 -18.911 -40.119 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.695 -19.719 -40.654 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.066 -20.875 -41.240 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.898 -19.791 -43.467 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.944 -18.574 -42.170 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -0.400 -18.977 -42.958 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.817 -22.010 -43.061 1.00 0.00 H new ATOM 0 HD22 LEU A 22 0.675 -21.181 -42.555 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.094 -22.369 -41.475 1.00 0.00 H new ATOM 356 N HIS A 23 0.301 -19.605 -37.310 1.00 0.00 N ATOM 357 CA HIS A 23 1.274 -19.201 -36.278 1.00 0.00 C ATOM 358 C HIS A 23 1.379 -20.283 -35.211 1.00 0.00 C ATOM 359 O HIS A 23 2.455 -20.605 -34.749 1.00 0.00 O ATOM 360 CB HIS A 23 0.771 -17.890 -35.638 1.00 0.00 C ATOM 361 CG HIS A 23 1.135 -17.855 -34.149 1.00 0.00 C ATOM 362 ND1 HIS A 23 0.830 -18.735 -33.319 1.00 0.00 N ATOM 363 CD2 HIS A 23 1.827 -16.899 -33.436 1.00 0.00 C ATOM 364 CE1 HIS A 23 1.248 -18.446 -32.160 1.00 0.00 C ATOM 365 NE2 HIS A 23 1.902 -17.284 -32.131 1.00 0.00 N ATOM 0 H HIS A 23 -0.600 -19.129 -37.269 1.00 0.00 H new ATOM 0 HA HIS A 23 2.258 -19.056 -36.724 1.00 0.00 H new ATOM 0 HB2 HIS A 23 1.213 -17.034 -36.148 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -0.309 -17.809 -35.758 1.00 0.00 H new ATOM 0 HD2 HIS A 23 2.243 -15.991 -33.846 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.093 -19.070 -31.292 1.00 0.00 H new ATOM 0 HE2 HIS A 23 2.341 -16.810 -31.342 1.00 0.00 H new ATOM 373 N ASP A 24 0.251 -20.827 -34.838 1.00 0.00 N ATOM 374 CA ASP A 24 0.264 -21.887 -33.805 1.00 0.00 C ATOM 375 C ASP A 24 1.043 -23.098 -34.298 1.00 0.00 C ATOM 376 O ASP A 24 1.835 -23.669 -33.577 1.00 0.00 O ATOM 377 CB ASP A 24 -1.185 -22.312 -33.522 1.00 0.00 C ATOM 378 CG ASP A 24 -1.244 -23.034 -32.173 1.00 0.00 C ATOM 379 OD1 ASP A 24 -0.303 -23.764 -31.909 1.00 0.00 O ATOM 380 OD2 ASP A 24 -2.225 -22.813 -31.484 1.00 0.00 O ATOM 0 H ASP A 24 -0.669 -20.582 -35.204 1.00 0.00 H new ATOM 0 HA ASP A 24 0.738 -21.503 -32.902 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.837 -21.438 -33.509 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.546 -22.967 -34.315 1.00 0.00 H new ATOM 385 N ILE A 25 0.803 -23.461 -35.525 1.00 0.00 N ATOM 386 CA ILE A 25 1.511 -24.629 -36.097 1.00 0.00 C ATOM 387 C ILE A 25 3.023 -24.385 -36.129 1.00 0.00 C ATOM 388 O ILE A 25 3.793 -25.180 -35.629 1.00 0.00 O ATOM 389 CB ILE A 25 0.979 -24.839 -37.533 1.00 0.00 C ATOM 390 CG1 ILE A 25 0.037 -26.033 -37.558 1.00 0.00 C ATOM 391 CG2 ILE A 25 2.153 -25.129 -38.493 1.00 0.00 C ATOM 392 CD1 ILE A 25 -0.889 -25.919 -38.772 1.00 0.00 C ATOM 0 H ILE A 25 0.147 -22.998 -36.154 1.00 0.00 H new ATOM 0 HA ILE A 25 1.332 -25.512 -35.484 1.00 0.00 H new ATOM 0 HB ILE A 25 0.455 -23.936 -37.847 1.00 0.00 H new ATOM 0 HG12 ILE A 25 0.608 -26.960 -37.607 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.550 -26.068 -36.640 1.00 0.00 H new ATOM 0 HG21 ILE A 25 1.770 -25.276 -39.503 1.00 0.00 H new ATOM 0 HG22 ILE A 25 2.845 -24.287 -38.486 1.00 0.00 H new ATOM 0 HG23 ILE A 25 2.674 -26.029 -38.168 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.566 -26.773 -38.794 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -1.468 -24.998 -38.703 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -0.293 -25.905 -39.684 1.00 0.00 H new ATOM 404 N CYS A 26 3.415 -23.288 -36.716 1.00 0.00 N ATOM 405 CA CYS A 26 4.862 -22.976 -36.789 1.00 0.00 C ATOM 406 C CYS A 26 5.424 -22.648 -35.412 1.00 0.00 C ATOM 407 O CYS A 26 6.421 -23.210 -35.002 1.00 0.00 O ATOM 408 CB CYS A 26 5.045 -21.782 -37.723 1.00 0.00 C ATOM 409 SG CYS A 26 5.274 -22.133 -39.486 1.00 0.00 S ATOM 0 H CYS A 26 2.796 -22.600 -37.145 1.00 0.00 H new ATOM 0 HA CYS A 26 5.401 -23.845 -37.166 1.00 0.00 H new ATOM 0 HB2 CYS A 26 4.174 -21.135 -37.618 1.00 0.00 H new ATOM 0 HB3 CYS A 26 5.908 -21.213 -37.378 1.00 0.00 H new ATOM 0 HG CYS A 26 6.407 -22.745 -39.663 1.00 0.00 H new ATOM 415 N ALA A 27 4.787 -21.749 -34.713 1.00 0.00 N ATOM 416 CA ALA A 27 5.299 -21.404 -33.365 1.00 0.00 C ATOM 417 C ALA A 27 5.424 -22.668 -32.532 1.00 0.00 C ATOM 418 O ALA A 27 6.267 -22.771 -31.667 1.00 0.00 O ATOM 419 CB ALA A 27 4.302 -20.454 -32.684 1.00 0.00 C ATOM 0 H ALA A 27 3.950 -21.249 -35.013 1.00 0.00 H new ATOM 0 HA ALA A 27 6.275 -20.926 -33.453 1.00 0.00 H new ATOM 0 HB1 ALA A 27 4.668 -20.193 -31.691 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.196 -19.548 -33.281 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.333 -20.946 -32.596 1.00 0.00 H new ATOM 425 N LYS A 28 4.575 -23.613 -32.815 1.00 0.00 N ATOM 426 CA LYS A 28 4.621 -24.880 -32.060 1.00 0.00 C ATOM 427 C LYS A 28 5.799 -25.716 -32.539 1.00 0.00 C ATOM 428 O LYS A 28 6.374 -26.480 -31.788 1.00 0.00 O ATOM 429 CB LYS A 28 3.294 -25.641 -32.325 1.00 0.00 C ATOM 430 CG LYS A 28 3.377 -27.089 -31.793 1.00 0.00 C ATOM 431 CD LYS A 28 3.262 -27.084 -30.265 1.00 0.00 C ATOM 432 CE LYS A 28 3.885 -28.368 -29.712 1.00 0.00 C ATOM 433 NZ LYS A 28 5.326 -28.153 -29.399 1.00 0.00 N ATOM 0 H LYS A 28 3.855 -23.558 -33.536 1.00 0.00 H new ATOM 0 HA LYS A 28 4.741 -24.687 -30.994 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.467 -25.119 -31.843 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.084 -25.653 -33.394 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.579 -27.692 -32.226 1.00 0.00 H new ATOM 0 HG3 LYS A 28 4.320 -27.544 -32.095 1.00 0.00 H new ATOM 0 HD2 LYS A 28 3.769 -26.212 -29.853 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.216 -27.015 -29.967 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.354 -28.680 -28.813 1.00 0.00 H new ATOM 0 HE3 LYS A 28 3.780 -29.173 -30.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 5.809 -29.072 -29.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.763 -27.582 -30.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.413 -27.655 -28.490 1.00 0.00 H new ATOM 447 N LYS A 29 6.152 -25.539 -33.787 1.00 0.00 N ATOM 448 CA LYS A 29 7.287 -26.311 -34.336 1.00 0.00 C ATOM 449 C LYS A 29 8.588 -25.730 -33.844 1.00 0.00 C ATOM 450 O LYS A 29 9.564 -26.431 -33.663 1.00 0.00 O ATOM 451 CB LYS A 29 7.249 -26.212 -35.870 1.00 0.00 C ATOM 452 CG LYS A 29 6.385 -27.347 -36.430 1.00 0.00 C ATOM 453 CD LYS A 29 7.182 -28.656 -36.409 1.00 0.00 C ATOM 454 CE LYS A 29 6.709 -29.547 -37.559 1.00 0.00 C ATOM 455 NZ LYS A 29 6.929 -30.982 -37.229 1.00 0.00 N ATOM 0 H LYS A 29 5.702 -24.896 -34.439 1.00 0.00 H new ATOM 0 HA LYS A 29 7.211 -27.350 -34.015 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.843 -25.247 -36.174 1.00 0.00 H new ATOM 0 HB3 LYS A 29 8.259 -26.275 -36.275 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.476 -27.453 -35.837 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.076 -27.114 -37.449 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.248 -28.449 -36.507 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.043 -29.166 -35.456 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.651 -29.370 -37.753 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.248 -29.290 -38.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.603 -31.574 -38.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.942 -31.149 -37.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.396 -31.226 -36.370 1.00 0.00 H new ATOM 469 N THR A 30 8.578 -24.456 -33.638 1.00 0.00 N ATOM 470 CA THR A 30 9.789 -23.785 -33.159 1.00 0.00 C ATOM 471 C THR A 30 9.880 -23.894 -31.645 1.00 0.00 C ATOM 472 O THR A 30 10.878 -23.540 -31.050 1.00 0.00 O ATOM 473 CB THR A 30 9.708 -22.318 -33.570 1.00 0.00 C ATOM 474 OG1 THR A 30 9.082 -22.331 -34.835 1.00 0.00 O ATOM 475 CG2 THR A 30 11.104 -21.754 -33.837 1.00 0.00 C ATOM 0 H THR A 30 7.772 -23.848 -33.784 1.00 0.00 H new ATOM 0 HA THR A 30 10.675 -24.252 -33.590 1.00 0.00 H new ATOM 0 HB THR A 30 9.204 -21.738 -32.797 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.741 -22.560 -35.524 1.00 0.00 H new ATOM 0 HG21 THR A 30 11.024 -20.707 -34.129 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.708 -21.834 -32.933 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.577 -22.319 -34.640 1.00 0.00 H new ATOM 483 N GLY A 31 8.826 -24.386 -31.050 1.00 0.00 N ATOM 484 CA GLY A 31 8.821 -24.533 -29.563 1.00 0.00 C ATOM 485 C GLY A 31 8.737 -23.165 -28.873 1.00 0.00 C ATOM 486 O GLY A 31 8.715 -23.086 -27.660 1.00 0.00 O ATOM 0 H GLY A 31 7.975 -24.690 -31.523 1.00 0.00 H new ATOM 0 HA2 GLY A 31 7.976 -25.150 -29.258 1.00 0.00 H new ATOM 0 HA3 GLY A 31 9.725 -25.051 -29.243 1.00 0.00 H new ATOM 490 N VAL A 32 8.690 -22.118 -29.652 1.00 0.00 N ATOM 491 CA VAL A 32 8.607 -20.766 -29.039 1.00 0.00 C ATOM 492 C VAL A 32 7.321 -20.622 -28.234 1.00 0.00 C ATOM 493 O VAL A 32 6.368 -21.344 -28.458 1.00 0.00 O ATOM 494 CB VAL A 32 8.616 -19.717 -30.163 1.00 0.00 C ATOM 495 CG1 VAL A 32 7.407 -19.938 -31.071 1.00 0.00 C ATOM 496 CG2 VAL A 32 8.529 -18.320 -29.545 1.00 0.00 C ATOM 0 H VAL A 32 8.705 -22.141 -30.672 1.00 0.00 H new ATOM 0 HA VAL A 32 9.456 -20.622 -28.371 1.00 0.00 H new ATOM 0 HB VAL A 32 9.534 -19.810 -30.744 1.00 0.00 H new ATOM 0 HG11 VAL A 32 7.411 -19.196 -31.869 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.455 -20.937 -31.505 1.00 0.00 H new ATOM 0 HG13 VAL A 32 6.491 -19.839 -30.488 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.535 -17.571 -30.337 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.607 -18.233 -28.970 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.383 -18.159 -28.887 1.00 0.00 H new ATOM 506 N THR A 33 7.315 -19.686 -27.313 1.00 0.00 N ATOM 507 CA THR A 33 6.098 -19.477 -26.477 1.00 0.00 C ATOM 508 C THR A 33 5.359 -18.212 -26.865 1.00 0.00 C ATOM 509 O THR A 33 5.963 -17.198 -27.155 1.00 0.00 O ATOM 510 CB THR A 33 6.534 -19.350 -25.012 1.00 0.00 C ATOM 511 OG1 THR A 33 7.925 -19.104 -25.056 1.00 0.00 O ATOM 512 CG2 THR A 33 6.402 -20.695 -24.282 1.00 0.00 C ATOM 0 H THR A 33 8.097 -19.064 -27.108 1.00 0.00 H new ATOM 0 HA THR A 33 5.430 -20.325 -26.628 1.00 0.00 H new ATOM 0 HB THR A 33 5.936 -18.586 -24.514 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.087 -18.200 -25.397 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.717 -20.579 -23.245 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.363 -21.024 -24.311 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.032 -21.438 -24.771 1.00 0.00 H new ATOM 520 N ASP A 34 4.051 -18.293 -26.863 1.00 0.00 N ATOM 521 CA ASP A 34 3.255 -17.105 -27.228 1.00 0.00 C ATOM 522 C ASP A 34 3.797 -15.887 -26.507 1.00 0.00 C ATOM 523 O ASP A 34 3.783 -14.794 -27.033 1.00 0.00 O ATOM 524 CB ASP A 34 1.798 -17.337 -26.797 1.00 0.00 C ATOM 525 CG ASP A 34 1.655 -17.036 -25.303 1.00 0.00 C ATOM 526 OD1 ASP A 34 2.240 -17.788 -24.542 1.00 0.00 O ATOM 527 OD2 ASP A 34 0.969 -16.072 -25.008 1.00 0.00 O ATOM 0 H ASP A 34 3.514 -19.127 -26.625 1.00 0.00 H new ATOM 0 HA ASP A 34 3.310 -16.942 -28.304 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.130 -16.697 -27.374 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.507 -18.367 -27.001 1.00 0.00 H new ATOM 532 N GLU A 35 4.270 -16.097 -25.303 1.00 0.00 N ATOM 533 CA GLU A 35 4.819 -14.959 -24.534 1.00 0.00 C ATOM 534 C GLU A 35 5.936 -14.304 -25.323 1.00 0.00 C ATOM 535 O GLU A 35 5.899 -13.119 -25.593 1.00 0.00 O ATOM 536 CB GLU A 35 5.386 -15.490 -23.209 1.00 0.00 C ATOM 537 CG GLU A 35 5.543 -14.326 -22.227 1.00 0.00 C ATOM 538 CD GLU A 35 4.174 -13.691 -21.974 1.00 0.00 C ATOM 539 OE1 GLU A 35 3.265 -14.457 -21.699 1.00 0.00 O ATOM 540 OE2 GLU A 35 4.114 -12.476 -22.068 1.00 0.00 O ATOM 0 H GLU A 35 4.296 -17.001 -24.831 1.00 0.00 H new ATOM 0 HA GLU A 35 4.033 -14.228 -24.344 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.721 -16.246 -22.792 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.349 -15.971 -23.378 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.971 -14.681 -21.290 1.00 0.00 H new ATOM 0 HG3 GLU A 35 6.232 -13.584 -22.631 1.00 0.00 H new ATOM 547 N ALA A 36 6.919 -15.088 -25.685 1.00 0.00 N ATOM 548 CA ALA A 36 8.041 -14.523 -26.459 1.00 0.00 C ATOM 549 C ALA A 36 7.499 -13.820 -27.687 1.00 0.00 C ATOM 550 O ALA A 36 7.918 -12.731 -28.019 1.00 0.00 O ATOM 551 CB ALA A 36 8.958 -15.673 -26.906 1.00 0.00 C ATOM 0 H ALA A 36 6.985 -16.084 -25.476 1.00 0.00 H new ATOM 0 HA ALA A 36 8.596 -13.813 -25.845 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.793 -15.271 -27.480 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.339 -16.196 -26.029 1.00 0.00 H new ATOM 0 HB3 ALA A 36 8.393 -16.369 -27.526 1.00 0.00 H new ATOM 557 N ILE A 37 6.563 -14.459 -28.345 1.00 0.00 N ATOM 558 CA ILE A 37 5.982 -13.833 -29.557 1.00 0.00 C ATOM 559 C ILE A 37 5.232 -12.553 -29.182 1.00 0.00 C ATOM 560 O ILE A 37 5.390 -11.525 -29.816 1.00 0.00 O ATOM 561 CB ILE A 37 5.002 -14.825 -30.192 1.00 0.00 C ATOM 562 CG1 ILE A 37 5.768 -15.819 -31.049 1.00 0.00 C ATOM 563 CG2 ILE A 37 4.030 -14.045 -31.095 1.00 0.00 C ATOM 564 CD1 ILE A 37 4.895 -17.052 -31.295 1.00 0.00 C ATOM 0 H ILE A 37 6.185 -15.373 -28.095 1.00 0.00 H new ATOM 0 HA ILE A 37 6.779 -13.581 -30.257 1.00 0.00 H new ATOM 0 HB ILE A 37 4.458 -15.356 -29.410 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.046 -15.360 -31.998 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.694 -16.108 -30.552 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.325 -14.738 -31.555 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.484 -13.315 -30.497 1.00 0.00 H new ATOM 0 HG23 ILE A 37 4.592 -13.529 -31.874 1.00 0.00 H new ATOM 0 HD11 ILE A 37 5.441 -17.768 -31.910 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.640 -17.513 -30.341 1.00 0.00 H new ATOM 0 HD13 ILE A 37 3.982 -16.754 -31.810 1.00 0.00 H new ATOM 576 N ILE A 38 4.432 -12.640 -28.154 1.00 0.00 N ATOM 577 CA ILE A 38 3.666 -11.447 -27.722 1.00 0.00 C ATOM 578 C ILE A 38 4.618 -10.317 -27.334 1.00 0.00 C ATOM 579 O ILE A 38 4.539 -9.226 -27.867 1.00 0.00 O ATOM 580 CB ILE A 38 2.807 -11.849 -26.505 1.00 0.00 C ATOM 581 CG1 ILE A 38 1.387 -12.167 -26.961 1.00 0.00 C ATOM 582 CG2 ILE A 38 2.743 -10.671 -25.512 1.00 0.00 C ATOM 583 CD1 ILE A 38 1.419 -13.328 -27.961 1.00 0.00 C ATOM 0 H ILE A 38 4.279 -13.483 -27.600 1.00 0.00 H new ATOM 0 HA ILE A 38 3.034 -11.094 -28.537 1.00 0.00 H new ATOM 0 HB ILE A 38 3.252 -12.723 -26.030 1.00 0.00 H new ATOM 0 HG12 ILE A 38 0.768 -12.429 -26.103 1.00 0.00 H new ATOM 0 HG13 ILE A 38 0.936 -11.288 -27.422 1.00 0.00 H new ATOM 0 HG21 ILE A 38 2.136 -10.953 -24.651 1.00 0.00 H new ATOM 0 HG22 ILE A 38 3.750 -10.420 -25.179 1.00 0.00 H new ATOM 0 HG23 ILE A 38 2.297 -9.806 -26.002 1.00 0.00 H new ATOM 0 HD11 ILE A 38 0.404 -13.555 -28.287 1.00 0.00 H new ATOM 0 HD12 ILE A 38 2.023 -13.048 -28.824 1.00 0.00 H new ATOM 0 HD13 ILE A 38 1.852 -14.207 -27.484 1.00 0.00 H new ATOM 595 N GLU A 39 5.501 -10.594 -26.411 1.00 0.00 N ATOM 596 CA GLU A 39 6.457 -9.543 -25.990 1.00 0.00 C ATOM 597 C GLU A 39 7.081 -8.887 -27.208 1.00 0.00 C ATOM 598 O GLU A 39 7.340 -7.703 -27.216 1.00 0.00 O ATOM 599 CB GLU A 39 7.567 -10.196 -25.149 1.00 0.00 C ATOM 600 CG GLU A 39 8.097 -9.178 -24.134 1.00 0.00 C ATOM 601 CD GLU A 39 8.863 -9.912 -23.032 1.00 0.00 C ATOM 602 OE1 GLU A 39 9.022 -11.111 -23.190 1.00 0.00 O ATOM 603 OE2 GLU A 39 9.245 -9.232 -22.094 1.00 0.00 O ATOM 0 H GLU A 39 5.597 -11.493 -25.939 1.00 0.00 H new ATOM 0 HA GLU A 39 5.931 -8.786 -25.408 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.179 -11.074 -24.632 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.376 -10.538 -25.795 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.750 -8.460 -24.630 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.270 -8.613 -23.703 1.00 0.00 H new ATOM 610 N PHE A 40 7.313 -9.672 -28.220 1.00 0.00 N ATOM 611 CA PHE A 40 7.918 -9.115 -29.449 1.00 0.00 C ATOM 612 C PHE A 40 6.959 -8.147 -30.124 1.00 0.00 C ATOM 613 O PHE A 40 7.373 -7.211 -30.775 1.00 0.00 O ATOM 614 CB PHE A 40 8.205 -10.275 -30.411 1.00 0.00 C ATOM 615 CG PHE A 40 9.187 -9.817 -31.490 1.00 0.00 C ATOM 616 CD1 PHE A 40 10.551 -9.859 -31.261 1.00 0.00 C ATOM 617 CD2 PHE A 40 8.727 -9.379 -32.722 1.00 0.00 C ATOM 618 CE1 PHE A 40 11.438 -9.477 -32.247 1.00 0.00 C ATOM 619 CE2 PHE A 40 9.618 -8.996 -33.706 1.00 0.00 C ATOM 620 CZ PHE A 40 10.971 -9.045 -33.469 1.00 0.00 C ATOM 0 H PHE A 40 7.109 -10.671 -28.246 1.00 0.00 H new ATOM 0 HA PHE A 40 8.833 -8.582 -29.191 1.00 0.00 H new ATOM 0 HB2 PHE A 40 8.620 -11.121 -29.863 1.00 0.00 H new ATOM 0 HB3 PHE A 40 7.278 -10.617 -30.871 1.00 0.00 H new ATOM 0 HD1 PHE A 40 10.924 -10.193 -30.304 1.00 0.00 H new ATOM 0 HD2 PHE A 40 7.665 -9.337 -32.914 1.00 0.00 H new ATOM 0 HE1 PHE A 40 12.501 -9.517 -32.060 1.00 0.00 H new ATOM 0 HE2 PHE A 40 9.251 -8.657 -34.663 1.00 0.00 H new ATOM 0 HZ PHE A 40 11.667 -8.746 -34.239 1.00 0.00 H new ATOM 630 N SER A 41 5.687 -8.393 -29.960 1.00 0.00 N ATOM 631 CA SER A 41 4.689 -7.491 -30.590 1.00 0.00 C ATOM 632 C SER A 41 4.377 -6.299 -29.685 1.00 0.00 C ATOM 633 O SER A 41 4.567 -5.162 -30.068 1.00 0.00 O ATOM 634 CB SER A 41 3.395 -8.292 -30.835 1.00 0.00 C ATOM 635 OG SER A 41 2.659 -8.152 -29.629 1.00 0.00 O ATOM 0 H SER A 41 5.302 -9.170 -29.423 1.00 0.00 H new ATOM 0 HA SER A 41 5.095 -7.111 -31.527 1.00 0.00 H new ATOM 0 HB2 SER A 41 2.840 -7.899 -31.687 1.00 0.00 H new ATOM 0 HB3 SER A 41 3.610 -9.339 -31.050 1.00 0.00 H new ATOM 0 HG SER A 41 1.811 -8.638 -29.705 1.00 0.00 H new ATOM 641 N ASP A 42 3.903 -6.578 -28.501 1.00 0.00 N ATOM 642 CA ASP A 42 3.575 -5.470 -27.566 1.00 0.00 C ATOM 643 C ASP A 42 4.771 -5.117 -26.688 1.00 0.00 C ATOM 644 O ASP A 42 5.023 -3.961 -26.413 1.00 0.00 O ATOM 645 CB ASP A 42 2.416 -5.924 -26.667 1.00 0.00 C ATOM 646 CG ASP A 42 1.198 -6.247 -27.535 1.00 0.00 C ATOM 647 OD1 ASP A 42 0.718 -5.317 -28.160 1.00 0.00 O ATOM 648 OD2 ASP A 42 0.817 -7.406 -27.524 1.00 0.00 O ATOM 0 H ASP A 42 3.731 -7.518 -28.145 1.00 0.00 H new ATOM 0 HA ASP A 42 3.303 -4.588 -28.146 1.00 0.00 H new ATOM 0 HB2 ASP A 42 2.710 -6.802 -26.091 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.169 -5.141 -25.950 1.00 0.00 H new ATOM 653 N GLY A 43 5.486 -6.122 -26.261 1.00 0.00 N ATOM 654 CA GLY A 43 6.672 -5.861 -25.393 1.00 0.00 C ATOM 655 C GLY A 43 7.849 -5.356 -26.231 1.00 0.00 C ATOM 656 O GLY A 43 7.739 -5.203 -27.431 1.00 0.00 O ATOM 0 H GLY A 43 5.304 -7.103 -26.472 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.417 -5.124 -24.631 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.956 -6.774 -24.870 1.00 0.00 H new ATOM 660 N LYS A 44 8.954 -5.111 -25.580 1.00 0.00 N ATOM 661 CA LYS A 44 10.138 -4.620 -26.324 1.00 0.00 C ATOM 662 C LYS A 44 10.813 -5.757 -27.080 1.00 0.00 C ATOM 663 O LYS A 44 11.026 -6.826 -26.543 1.00 0.00 O ATOM 664 CB LYS A 44 11.141 -4.026 -25.322 1.00 0.00 C ATOM 665 CG LYS A 44 11.152 -4.875 -24.047 1.00 0.00 C ATOM 666 CD LYS A 44 10.485 -4.092 -22.912 1.00 0.00 C ATOM 667 CE LYS A 44 10.805 -4.770 -21.579 1.00 0.00 C ATOM 668 NZ LYS A 44 9.910 -4.256 -20.506 1.00 0.00 N ATOM 0 H LYS A 44 9.083 -5.230 -24.575 1.00 0.00 H new ATOM 0 HA LYS A 44 9.814 -3.866 -27.041 1.00 0.00 H new ATOM 0 HB2 LYS A 44 12.138 -3.998 -25.762 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.869 -2.998 -25.085 1.00 0.00 H new ATOM 0 HG2 LYS A 44 10.624 -5.813 -24.216 1.00 0.00 H new ATOM 0 HG3 LYS A 44 12.176 -5.130 -23.775 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.842 -3.062 -22.905 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.406 -4.054 -23.065 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.685 -5.849 -21.675 1.00 0.00 H new ATOM 0 HE3 LYS A 44 11.846 -4.587 -21.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 10.140 -4.726 -19.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 10.044 -3.230 -20.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.920 -4.453 -20.756 1.00 0.00 H new ATOM 682 N ILE A 45 11.136 -5.501 -28.314 1.00 0.00 N ATOM 683 CA ILE A 45 11.797 -6.542 -29.134 1.00 0.00 C ATOM 684 C ILE A 45 12.861 -7.290 -28.341 1.00 0.00 C ATOM 685 O ILE A 45 13.575 -6.702 -27.551 1.00 0.00 O ATOM 686 CB ILE A 45 12.481 -5.848 -30.312 1.00 0.00 C ATOM 687 CG1 ILE A 45 11.534 -4.846 -30.941 1.00 0.00 C ATOM 688 CG2 ILE A 45 12.838 -6.906 -31.361 1.00 0.00 C ATOM 689 CD1 ILE A 45 12.173 -4.290 -32.215 1.00 0.00 C ATOM 0 H ILE A 45 10.969 -4.614 -28.788 1.00 0.00 H new ATOM 0 HA ILE A 45 11.044 -7.259 -29.461 1.00 0.00 H new ATOM 0 HB ILE A 45 13.375 -5.333 -29.961 1.00 0.00 H new ATOM 0 HG12 ILE A 45 10.582 -5.323 -31.174 1.00 0.00 H new ATOM 0 HG13 ILE A 45 11.323 -4.037 -30.242 1.00 0.00 H new ATOM 0 HG21 ILE A 45 13.327 -6.427 -32.209 1.00 0.00 H new ATOM 0 HG22 ILE A 45 13.512 -7.641 -30.921 1.00 0.00 H new ATOM 0 HG23 ILE A 45 11.929 -7.403 -31.700 1.00 0.00 H new ATOM 0 HD11 ILE A 45 11.499 -3.568 -32.675 1.00 0.00 H new ATOM 0 HD12 ILE A 45 13.114 -3.800 -31.966 1.00 0.00 H new ATOM 0 HD13 ILE A 45 12.362 -5.106 -32.913 1.00 0.00 H new ATOM 701 N HIS A 46 12.942 -8.582 -28.570 1.00 0.00 N ATOM 702 CA HIS A 46 13.952 -9.402 -27.847 1.00 0.00 C ATOM 703 C HIS A 46 14.693 -10.306 -28.831 1.00 0.00 C ATOM 704 O HIS A 46 14.269 -10.469 -29.958 1.00 0.00 O ATOM 705 CB HIS A 46 13.245 -10.261 -26.776 1.00 0.00 C ATOM 706 CG HIS A 46 12.066 -11.020 -27.391 1.00 0.00 C ATOM 707 ND1 HIS A 46 12.080 -12.233 -27.688 1.00 0.00 N ATOM 708 CD2 HIS A 46 10.788 -10.583 -27.696 1.00 0.00 C ATOM 709 CE1 HIS A 46 10.961 -12.615 -28.141 1.00 0.00 C ATOM 710 NE2 HIS A 46 10.067 -11.627 -28.187 1.00 0.00 N ATOM 0 H HIS A 46 12.352 -9.096 -29.225 1.00 0.00 H new ATOM 0 HA HIS A 46 14.673 -8.742 -27.364 1.00 0.00 H new ATOM 0 HB2 HIS A 46 13.953 -10.967 -26.342 1.00 0.00 H new ATOM 0 HB3 HIS A 46 12.892 -9.624 -25.965 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.422 -9.575 -27.565 1.00 0.00 H new ATOM 0 HE1 HIS A 46 10.754 -13.627 -28.455 1.00 0.00 H new ATOM 0 HE2 HIS A 46 9.098 -11.648 -28.506 1.00 0.00 H new ATOM 718 N GLU A 47 15.784 -10.880 -28.386 1.00 0.00 N ATOM 719 CA GLU A 47 16.568 -11.775 -29.283 1.00 0.00 C ATOM 720 C GLU A 47 16.325 -13.248 -28.971 1.00 0.00 C ATOM 721 O GLU A 47 17.206 -13.932 -28.487 1.00 0.00 O ATOM 722 CB GLU A 47 18.061 -11.473 -29.068 1.00 0.00 C ATOM 723 CG GLU A 47 18.278 -9.958 -29.081 1.00 0.00 C ATOM 724 CD GLU A 47 19.708 -9.645 -28.629 1.00 0.00 C ATOM 725 OE1 GLU A 47 19.926 -9.724 -27.431 1.00 0.00 O ATOM 726 OE2 GLU A 47 20.498 -9.344 -29.508 1.00 0.00 O ATOM 0 H GLU A 47 16.161 -10.766 -27.445 1.00 0.00 H new ATOM 0 HA GLU A 47 16.258 -11.591 -30.312 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.395 -11.892 -28.119 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.655 -11.944 -29.851 1.00 0.00 H new ATOM 0 HG2 GLU A 47 18.107 -9.564 -30.083 1.00 0.00 H new ATOM 0 HG3 GLU A 47 17.561 -9.471 -28.420 1.00 0.00 H new ATOM 733 N ASP A 48 15.140 -13.713 -29.249 1.00 0.00 N ATOM 734 CA ASP A 48 14.839 -15.139 -28.972 1.00 0.00 C ATOM 735 C ASP A 48 15.206 -15.999 -30.176 1.00 0.00 C ATOM 736 O ASP A 48 14.531 -15.982 -31.187 1.00 0.00 O ATOM 737 CB ASP A 48 13.338 -15.284 -28.696 1.00 0.00 C ATOM 738 CG ASP A 48 13.118 -16.425 -27.698 1.00 0.00 C ATOM 739 OD1 ASP A 48 13.305 -16.160 -26.521 1.00 0.00 O ATOM 740 OD2 ASP A 48 12.778 -17.498 -28.169 1.00 0.00 O ATOM 0 H ASP A 48 14.375 -13.172 -29.652 1.00 0.00 H new ATOM 0 HA ASP A 48 15.419 -15.467 -28.109 1.00 0.00 H new ATOM 0 HB2 ASP A 48 12.938 -14.352 -28.296 1.00 0.00 H new ATOM 0 HB3 ASP A 48 12.803 -15.488 -29.624 1.00 0.00 H new ATOM 745 N GLU A 49 16.272 -16.736 -30.044 1.00 0.00 N ATOM 746 CA GLU A 49 16.713 -17.609 -31.164 1.00 0.00 C ATOM 747 C GLU A 49 15.531 -18.316 -31.826 1.00 0.00 C ATOM 748 O GLU A 49 15.587 -18.668 -32.992 1.00 0.00 O ATOM 749 CB GLU A 49 17.665 -18.666 -30.593 1.00 0.00 C ATOM 750 CG GLU A 49 18.328 -18.107 -29.333 1.00 0.00 C ATOM 751 CD GLU A 49 19.560 -18.946 -28.989 1.00 0.00 C ATOM 752 OE1 GLU A 49 19.375 -20.141 -28.841 1.00 0.00 O ATOM 753 OE2 GLU A 49 20.616 -18.342 -28.895 1.00 0.00 O ATOM 0 H GLU A 49 16.857 -16.771 -29.209 1.00 0.00 H new ATOM 0 HA GLU A 49 17.202 -16.993 -31.919 1.00 0.00 H new ATOM 0 HB2 GLU A 49 17.117 -19.579 -30.358 1.00 0.00 H new ATOM 0 HB3 GLU A 49 18.422 -18.930 -31.332 1.00 0.00 H new ATOM 0 HG2 GLU A 49 18.615 -17.068 -29.491 1.00 0.00 H new ATOM 0 HG3 GLU A 49 17.623 -18.120 -28.502 1.00 0.00 H new ATOM 760 N LYS A 50 14.480 -18.510 -31.082 1.00 0.00 N ATOM 761 CA LYS A 50 13.301 -19.193 -31.671 1.00 0.00 C ATOM 762 C LYS A 50 12.506 -18.232 -32.518 1.00 0.00 C ATOM 763 O LYS A 50 12.227 -18.507 -33.666 1.00 0.00 O ATOM 764 CB LYS A 50 12.407 -19.712 -30.533 1.00 0.00 C ATOM 765 CG LYS A 50 13.264 -20.488 -29.530 1.00 0.00 C ATOM 766 CD LYS A 50 12.777 -21.937 -29.464 1.00 0.00 C ATOM 767 CE LYS A 50 13.614 -22.701 -28.434 1.00 0.00 C ATOM 768 NZ LYS A 50 13.324 -22.209 -27.058 1.00 0.00 N ATOM 0 H LYS A 50 14.387 -18.229 -30.106 1.00 0.00 H new ATOM 0 HA LYS A 50 13.643 -20.018 -32.296 1.00 0.00 H new ATOM 0 HB2 LYS A 50 11.910 -18.878 -30.036 1.00 0.00 H new ATOM 0 HB3 LYS A 50 11.624 -20.356 -30.935 1.00 0.00 H new ATOM 0 HG2 LYS A 50 14.312 -20.458 -29.829 1.00 0.00 H new ATOM 0 HG3 LYS A 50 13.200 -20.025 -28.545 1.00 0.00 H new ATOM 0 HD2 LYS A 50 11.723 -21.967 -29.189 1.00 0.00 H new ATOM 0 HD3 LYS A 50 12.864 -22.408 -30.443 1.00 0.00 H new ATOM 0 HE2 LYS A 50 13.397 -23.767 -28.499 1.00 0.00 H new ATOM 0 HE3 LYS A 50 14.674 -22.578 -28.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 13.678 -22.896 -26.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 13.794 -21.293 -26.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 12.297 -22.094 -26.940 1.00 0.00 H new ATOM 782 N LEU A 51 12.145 -17.116 -31.945 1.00 0.00 N ATOM 783 CA LEU A 51 11.369 -16.140 -32.728 1.00 0.00 C ATOM 784 C LEU A 51 12.017 -15.964 -34.088 1.00 0.00 C ATOM 785 O LEU A 51 11.378 -15.577 -35.045 1.00 0.00 O ATOM 786 CB LEU A 51 11.366 -14.800 -31.986 1.00 0.00 C ATOM 787 CG LEU A 51 10.282 -13.910 -32.583 1.00 0.00 C ATOM 788 CD1 LEU A 51 8.945 -14.214 -31.905 1.00 0.00 C ATOM 789 CD2 LEU A 51 10.645 -12.451 -32.343 1.00 0.00 C ATOM 0 H LEU A 51 12.354 -16.849 -30.983 1.00 0.00 H new ATOM 0 HA LEU A 51 10.346 -16.492 -32.856 1.00 0.00 H new ATOM 0 HB2 LEU A 51 11.182 -14.958 -30.923 1.00 0.00 H new ATOM 0 HB3 LEU A 51 12.340 -14.318 -32.073 1.00 0.00 H new ATOM 0 HG LEU A 51 10.201 -14.099 -33.653 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.168 -13.578 -32.331 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.686 -15.261 -32.065 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.027 -14.020 -30.836 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.873 -11.809 -32.768 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.721 -12.266 -31.271 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.601 -12.231 -32.818 1.00 0.00 H new ATOM 801 N LYS A 52 13.290 -16.263 -34.146 1.00 0.00 N ATOM 802 CA LYS A 52 14.010 -16.128 -35.428 1.00 0.00 C ATOM 803 C LYS A 52 13.679 -17.311 -36.314 1.00 0.00 C ATOM 804 O LYS A 52 13.359 -17.153 -37.475 1.00 0.00 O ATOM 805 CB LYS A 52 15.519 -16.128 -35.153 1.00 0.00 C ATOM 806 CG LYS A 52 15.856 -14.997 -34.186 1.00 0.00 C ATOM 807 CD LYS A 52 17.210 -14.398 -34.574 1.00 0.00 C ATOM 808 CE LYS A 52 18.278 -15.492 -34.508 1.00 0.00 C ATOM 809 NZ LYS A 52 19.627 -14.921 -34.781 1.00 0.00 N ATOM 0 H LYS A 52 13.851 -16.592 -33.361 1.00 0.00 H new ATOM 0 HA LYS A 52 13.715 -15.201 -35.920 1.00 0.00 H new ATOM 0 HB2 LYS A 52 15.823 -17.086 -34.731 1.00 0.00 H new ATOM 0 HB3 LYS A 52 16.070 -16.001 -36.085 1.00 0.00 H new ATOM 0 HG2 LYS A 52 15.082 -14.230 -34.218 1.00 0.00 H new ATOM 0 HG3 LYS A 52 15.890 -15.373 -33.163 1.00 0.00 H new ATOM 0 HD2 LYS A 52 17.162 -13.979 -35.579 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.467 -13.581 -33.900 1.00 0.00 H new ATOM 0 HE2 LYS A 52 18.267 -15.960 -33.524 1.00 0.00 H new ATOM 0 HE3 LYS A 52 18.053 -16.273 -35.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 20.037 -15.383 -35.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 19.543 -13.899 -34.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 20.244 -15.081 -33.960 1.00 0.00 H new ATOM 823 N CYS A 53 13.758 -18.490 -35.744 1.00 0.00 N ATOM 824 CA CYS A 53 13.448 -19.693 -36.540 1.00 0.00 C ATOM 825 C CYS A 53 11.963 -19.749 -36.786 1.00 0.00 C ATOM 826 O CYS A 53 11.517 -20.065 -37.872 1.00 0.00 O ATOM 827 CB CYS A 53 13.878 -20.940 -35.748 1.00 0.00 C ATOM 828 SG CYS A 53 15.594 -21.486 -35.925 1.00 0.00 S ATOM 0 H CYS A 53 14.021 -18.659 -34.773 1.00 0.00 H new ATOM 0 HA CYS A 53 13.978 -19.658 -37.492 1.00 0.00 H new ATOM 0 HB2 CYS A 53 13.692 -20.749 -34.691 1.00 0.00 H new ATOM 0 HB3 CYS A 53 13.230 -21.766 -36.041 1.00 0.00 H new ATOM 0 HG CYS A 53 15.791 -22.543 -35.194 1.00 0.00 H new ATOM 834 N TYR A 54 11.211 -19.444 -35.768 1.00 0.00 N ATOM 835 CA TYR A 54 9.755 -19.472 -35.928 1.00 0.00 C ATOM 836 C TYR A 54 9.392 -18.670 -37.166 1.00 0.00 C ATOM 837 O TYR A 54 8.794 -19.186 -38.090 1.00 0.00 O ATOM 838 CB TYR A 54 9.121 -18.836 -34.672 1.00 0.00 C ATOM 839 CG TYR A 54 7.644 -18.500 -34.922 1.00 0.00 C ATOM 840 CD1 TYR A 54 6.912 -19.161 -35.887 1.00 0.00 C ATOM 841 CD2 TYR A 54 7.027 -17.517 -34.183 1.00 0.00 C ATOM 842 CE1 TYR A 54 5.587 -18.834 -36.105 1.00 0.00 C ATOM 843 CE2 TYR A 54 5.706 -17.196 -34.401 1.00 0.00 C ATOM 844 CZ TYR A 54 4.978 -17.851 -35.363 1.00 0.00 C ATOM 845 OH TYR A 54 3.654 -17.528 -35.579 1.00 0.00 O ATOM 0 H TYR A 54 11.549 -19.180 -34.843 1.00 0.00 H new ATOM 0 HA TYR A 54 9.389 -20.492 -36.043 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.206 -19.521 -33.829 1.00 0.00 H new ATOM 0 HB3 TYR A 54 9.665 -17.931 -34.403 1.00 0.00 H new ATOM 0 HD1 TYR A 54 7.377 -19.938 -36.475 1.00 0.00 H new ATOM 0 HD2 TYR A 54 7.586 -16.991 -33.423 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.025 -19.356 -36.866 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.239 -16.422 -33.810 1.00 0.00 H new ATOM 0 HH TYR A 54 3.541 -16.556 -35.522 1.00 0.00 H new ATOM 855 N MET A 55 9.783 -17.421 -37.177 1.00 0.00 N ATOM 856 CA MET A 55 9.466 -16.588 -38.353 1.00 0.00 C ATOM 857 C MET A 55 9.833 -17.355 -39.606 1.00 0.00 C ATOM 858 O MET A 55 8.999 -17.617 -40.449 1.00 0.00 O ATOM 859 CB MET A 55 10.309 -15.307 -38.288 1.00 0.00 C ATOM 860 CG MET A 55 9.494 -14.212 -37.610 1.00 0.00 C ATOM 861 SD MET A 55 9.085 -14.438 -35.866 1.00 0.00 S ATOM 862 CE MET A 55 9.221 -12.700 -35.385 1.00 0.00 C ATOM 0 H MET A 55 10.300 -16.956 -36.430 1.00 0.00 H new ATOM 0 HA MET A 55 8.405 -16.339 -38.365 1.00 0.00 H new ATOM 0 HB2 MET A 55 11.229 -15.490 -37.733 1.00 0.00 H new ATOM 0 HB3 MET A 55 10.598 -14.995 -39.292 1.00 0.00 H new ATOM 0 HG2 MET A 55 10.042 -13.275 -37.709 1.00 0.00 H new ATOM 0 HG3 MET A 55 8.561 -14.096 -38.162 1.00 0.00 H new ATOM 0 HE1 MET A 55 9.128 -12.614 -34.302 1.00 0.00 H new ATOM 0 HE2 MET A 55 10.190 -12.311 -35.698 1.00 0.00 H new ATOM 0 HE3 MET A 55 8.427 -12.127 -35.864 1.00 0.00 H new ATOM 872 N ASN A 56 11.089 -17.699 -39.707 1.00 0.00 N ATOM 873 CA ASN A 56 11.541 -18.453 -40.891 1.00 0.00 C ATOM 874 C ASN A 56 10.584 -19.611 -41.161 1.00 0.00 C ATOM 875 O ASN A 56 10.218 -19.877 -42.296 1.00 0.00 O ATOM 876 CB ASN A 56 12.940 -19.018 -40.601 1.00 0.00 C ATOM 877 CG ASN A 56 13.424 -19.816 -41.812 1.00 0.00 C ATOM 878 OD1 ASN A 56 13.422 -19.333 -42.928 1.00 0.00 O ATOM 879 ND2 ASN A 56 13.846 -21.038 -41.638 1.00 0.00 N ATOM 0 H ASN A 56 11.812 -17.488 -39.019 1.00 0.00 H new ATOM 0 HA ASN A 56 11.565 -17.796 -41.761 1.00 0.00 H new ATOM 0 HB2 ASN A 56 13.635 -18.206 -40.385 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.911 -19.657 -39.718 1.00 0.00 H new ATOM 0 HD21 ASN A 56 14.172 -21.583 -42.436 1.00 0.00 H new ATOM 0 HD22 ASN A 56 13.850 -21.448 -40.704 1.00 0.00 H new ATOM 886 N CYS A 57 10.191 -20.278 -40.104 1.00 0.00 N ATOM 887 CA CYS A 57 9.262 -21.417 -40.266 1.00 0.00 C ATOM 888 C CYS A 57 7.992 -20.964 -40.967 1.00 0.00 C ATOM 889 O CYS A 57 7.419 -21.689 -41.756 1.00 0.00 O ATOM 890 CB CYS A 57 8.896 -21.950 -38.873 1.00 0.00 C ATOM 891 SG CYS A 57 8.710 -23.741 -38.692 1.00 0.00 S ATOM 0 H CYS A 57 10.476 -20.078 -39.145 1.00 0.00 H new ATOM 0 HA CYS A 57 9.741 -22.193 -40.863 1.00 0.00 H new ATOM 0 HB2 CYS A 57 9.663 -21.618 -38.173 1.00 0.00 H new ATOM 0 HB3 CYS A 57 7.961 -21.481 -38.568 1.00 0.00 H new ATOM 0 HG CYS A 57 8.404 -24.023 -37.461 1.00 0.00 H new ATOM 897 N LEU A 58 7.573 -19.766 -40.659 1.00 0.00 N ATOM 898 CA LEU A 58 6.344 -19.239 -41.292 1.00 0.00 C ATOM 899 C LEU A 58 6.554 -19.054 -42.788 1.00 0.00 C ATOM 900 O LEU A 58 5.735 -19.462 -43.588 1.00 0.00 O ATOM 901 CB LEU A 58 6.022 -17.874 -40.664 1.00 0.00 C ATOM 902 CG LEU A 58 4.531 -17.579 -40.840 1.00 0.00 C ATOM 903 CD1 LEU A 58 3.773 -18.069 -39.605 1.00 0.00 C ATOM 904 CD2 LEU A 58 4.331 -16.069 -40.987 1.00 0.00 C ATOM 0 H LEU A 58 8.030 -19.137 -39.999 1.00 0.00 H new ATOM 0 HA LEU A 58 5.527 -19.943 -41.134 1.00 0.00 H new ATOM 0 HB2 LEU A 58 6.282 -17.877 -39.605 1.00 0.00 H new ATOM 0 HB3 LEU A 58 6.618 -17.093 -41.137 1.00 0.00 H new ATOM 0 HG LEU A 58 4.157 -18.088 -41.728 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.710 -17.861 -39.725 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.922 -19.142 -39.489 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.146 -17.553 -38.720 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.270 -15.853 -41.113 1.00 0.00 H new ATOM 0 HD22 LEU A 58 4.701 -15.564 -40.094 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.880 -15.712 -41.859 1.00 0.00 H new ATOM 916 N PHE A 59 7.652 -18.438 -43.142 1.00 0.00 N ATOM 917 CA PHE A 59 7.925 -18.220 -44.582 1.00 0.00 C ATOM 918 C PHE A 59 7.672 -19.505 -45.358 1.00 0.00 C ATOM 919 O PHE A 59 7.043 -19.498 -46.395 1.00 0.00 O ATOM 920 CB PHE A 59 9.406 -17.834 -44.756 1.00 0.00 C ATOM 921 CG PHE A 59 9.674 -16.425 -44.191 1.00 0.00 C ATOM 922 CD1 PHE A 59 8.730 -15.762 -43.411 1.00 0.00 C ATOM 923 CD2 PHE A 59 10.888 -15.805 -44.441 1.00 0.00 C ATOM 924 CE1 PHE A 59 9.009 -14.510 -42.898 1.00 0.00 C ATOM 925 CE2 PHE A 59 11.155 -14.556 -43.924 1.00 0.00 C ATOM 926 CZ PHE A 59 10.221 -13.911 -43.156 1.00 0.00 C ATOM 0 H PHE A 59 8.360 -18.082 -42.500 1.00 0.00 H new ATOM 0 HA PHE A 59 7.273 -17.430 -44.954 1.00 0.00 H new ATOM 0 HB2 PHE A 59 10.038 -18.561 -44.247 1.00 0.00 H new ATOM 0 HB3 PHE A 59 9.673 -17.864 -45.812 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.777 -16.228 -43.207 1.00 0.00 H new ATOM 0 HD2 PHE A 59 11.630 -16.305 -45.046 1.00 0.00 H new ATOM 0 HE1 PHE A 59 8.274 -14.000 -42.293 1.00 0.00 H new ATOM 0 HE2 PHE A 59 12.105 -14.083 -44.125 1.00 0.00 H new ATOM 0 HZ PHE A 59 10.436 -12.932 -42.753 1.00 0.00 H new ATOM 936 N HIS A 60 8.172 -20.593 -44.833 1.00 0.00 N ATOM 937 CA HIS A 60 7.973 -21.893 -45.523 1.00 0.00 C ATOM 938 C HIS A 60 6.489 -22.236 -45.632 1.00 0.00 C ATOM 939 O HIS A 60 5.941 -22.294 -46.715 1.00 0.00 O ATOM 940 CB HIS A 60 8.674 -22.988 -44.706 1.00 0.00 C ATOM 941 CG HIS A 60 10.136 -23.090 -45.144 1.00 0.00 C ATOM 942 ND1 HIS A 60 10.549 -23.779 -46.100 1.00 0.00 N ATOM 943 CD2 HIS A 60 11.259 -22.482 -44.616 1.00 0.00 C ATOM 944 CE1 HIS A 60 11.805 -23.679 -46.239 1.00 0.00 C ATOM 945 NE2 HIS A 60 12.352 -22.868 -45.332 1.00 0.00 N ATOM 0 H HIS A 60 8.704 -20.634 -43.964 1.00 0.00 H new ATOM 0 HA HIS A 60 8.388 -21.825 -46.529 1.00 0.00 H new ATOM 0 HB2 HIS A 60 8.617 -22.757 -43.642 1.00 0.00 H new ATOM 0 HB3 HIS A 60 8.171 -23.944 -44.852 1.00 0.00 H new ATOM 0 HD2 HIS A 60 11.269 -21.809 -43.771 1.00 0.00 H new ATOM 0 HE1 HIS A 60 12.368 -24.192 -47.005 1.00 0.00 H new ATOM 0 HE2 HIS A 60 13.330 -22.606 -45.207 1.00 0.00 H new ATOM 953 N GLU A 61 5.867 -22.458 -44.507 1.00 0.00 N ATOM 954 CA GLU A 61 4.421 -22.801 -44.528 1.00 0.00 C ATOM 955 C GLU A 61 3.631 -21.791 -45.355 1.00 0.00 C ATOM 956 O GLU A 61 2.545 -22.080 -45.820 1.00 0.00 O ATOM 957 CB GLU A 61 3.897 -22.772 -43.084 1.00 0.00 C ATOM 958 CG GLU A 61 2.626 -23.618 -42.997 1.00 0.00 C ATOM 959 CD GLU A 61 2.972 -25.084 -43.268 1.00 0.00 C ATOM 960 OE1 GLU A 61 3.367 -25.732 -42.314 1.00 0.00 O ATOM 961 OE2 GLU A 61 2.821 -25.473 -44.415 1.00 0.00 O ATOM 0 H GLU A 61 6.295 -22.417 -43.582 1.00 0.00 H new ATOM 0 HA GLU A 61 4.297 -23.788 -44.974 1.00 0.00 H new ATOM 0 HB2 GLU A 61 4.654 -23.159 -42.401 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.688 -21.746 -42.780 1.00 0.00 H new ATOM 0 HG2 GLU A 61 2.175 -23.516 -42.010 1.00 0.00 H new ATOM 0 HG3 GLU A 61 1.891 -23.266 -43.721 1.00 0.00 H new ATOM 968 N ALA A 62 4.188 -20.624 -45.526 1.00 0.00 N ATOM 969 CA ALA A 62 3.480 -19.589 -46.321 1.00 0.00 C ATOM 970 C ALA A 62 3.687 -19.817 -47.814 1.00 0.00 C ATOM 971 O ALA A 62 3.200 -19.066 -48.633 1.00 0.00 O ATOM 972 CB ALA A 62 4.053 -18.215 -45.945 1.00 0.00 C ATOM 0 H ALA A 62 5.095 -20.346 -45.152 1.00 0.00 H new ATOM 0 HA ALA A 62 2.413 -19.641 -46.106 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.545 -17.440 -46.519 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.901 -18.036 -44.880 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.120 -18.192 -46.168 1.00 0.00 H new ATOM 978 N LYS A 63 4.409 -20.856 -48.138 1.00 0.00 N ATOM 979 CA LYS A 63 4.662 -21.156 -49.572 1.00 0.00 C ATOM 980 C LYS A 63 5.324 -19.976 -50.276 1.00 0.00 C ATOM 981 O LYS A 63 4.871 -19.543 -51.317 1.00 0.00 O ATOM 982 CB LYS A 63 3.315 -21.445 -50.257 1.00 0.00 C ATOM 983 CG LYS A 63 2.462 -22.327 -49.343 1.00 0.00 C ATOM 984 CD LYS A 63 1.130 -22.625 -50.037 1.00 0.00 C ATOM 985 CE LYS A 63 0.707 -24.062 -49.724 1.00 0.00 C ATOM 986 NZ LYS A 63 1.434 -25.023 -50.600 1.00 0.00 N ATOM 0 H LYS A 63 4.831 -21.505 -47.474 1.00 0.00 H new ATOM 0 HA LYS A 63 5.329 -22.015 -49.635 1.00 0.00 H new ATOM 0 HB2 LYS A 63 2.794 -20.511 -50.470 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.479 -21.943 -51.212 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.986 -23.256 -49.120 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.287 -21.824 -48.392 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.365 -21.926 -49.697 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.230 -22.489 -51.114 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.912 -24.288 -48.678 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.368 -24.171 -49.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.135 -25.993 -50.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.218 -24.817 -51.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.458 -24.931 -50.442 1.00 0.00 H new ATOM 1000 N VAL A 64 6.387 -19.474 -49.692 1.00 0.00 N ATOM 1001 CA VAL A 64 7.098 -18.319 -50.313 1.00 0.00 C ATOM 1002 C VAL A 64 8.608 -18.518 -50.237 1.00 0.00 C ATOM 1003 O VAL A 64 9.346 -17.591 -49.963 1.00 0.00 O ATOM 1004 CB VAL A 64 6.729 -17.035 -49.542 1.00 0.00 C ATOM 1005 CG1 VAL A 64 5.237 -16.741 -49.727 1.00 0.00 C ATOM 1006 CG2 VAL A 64 7.022 -17.234 -48.056 1.00 0.00 C ATOM 0 H VAL A 64 6.788 -19.814 -48.818 1.00 0.00 H new ATOM 0 HA VAL A 64 6.801 -18.241 -51.359 1.00 0.00 H new ATOM 0 HB VAL A 64 7.317 -16.200 -49.923 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.975 -15.834 -49.183 1.00 0.00 H new ATOM 0 HG12 VAL A 64 5.022 -16.603 -50.787 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.651 -17.576 -49.343 1.00 0.00 H new ATOM 0 HG21 VAL A 64 6.762 -16.328 -47.509 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.432 -18.068 -47.677 1.00 0.00 H new ATOM 0 HG23 VAL A 64 8.082 -17.448 -47.920 1.00 0.00 H new ATOM 1016 N VAL A 65 9.040 -19.733 -50.483 1.00 0.00 N ATOM 1017 CA VAL A 65 10.498 -20.025 -50.433 1.00 0.00 C ATOM 1018 C VAL A 65 10.899 -20.956 -51.571 1.00 0.00 C ATOM 1019 O VAL A 65 10.052 -21.503 -52.252 1.00 0.00 O ATOM 1020 CB VAL A 65 10.812 -20.718 -49.096 1.00 0.00 C ATOM 1021 CG1 VAL A 65 10.631 -19.719 -47.951 1.00 0.00 C ATOM 1022 CG2 VAL A 65 9.847 -21.889 -48.897 1.00 0.00 C ATOM 0 H VAL A 65 8.444 -20.528 -50.715 1.00 0.00 H new ATOM 0 HA VAL A 65 11.052 -19.091 -50.529 1.00 0.00 H new ATOM 0 HB VAL A 65 11.839 -21.082 -49.106 1.00 0.00 H new ATOM 0 HG11 VAL A 65 10.853 -20.208 -47.003 1.00 0.00 H new ATOM 0 HG12 VAL A 65 11.309 -18.877 -48.092 1.00 0.00 H new ATOM 0 HG13 VAL A 65 9.602 -19.359 -47.941 1.00 0.00 H new ATOM 0 HG21 VAL A 65 10.065 -22.384 -47.951 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.822 -21.518 -48.884 1.00 0.00 H new ATOM 0 HG23 VAL A 65 9.965 -22.601 -49.714 1.00 0.00 H new ATOM 1032 N ASP A 66 12.190 -21.120 -51.753 1.00 0.00 N ATOM 1033 CA ASP A 66 12.685 -22.012 -52.841 1.00 0.00 C ATOM 1034 C ASP A 66 13.367 -23.249 -52.265 1.00 0.00 C ATOM 1035 O ASP A 66 13.047 -23.689 -51.177 1.00 0.00 O ATOM 1036 CB ASP A 66 13.711 -21.229 -53.673 1.00 0.00 C ATOM 1037 CG ASP A 66 13.734 -21.783 -55.099 1.00 0.00 C ATOM 1038 OD1 ASP A 66 12.933 -21.299 -55.880 1.00 0.00 O ATOM 1039 OD2 ASP A 66 14.553 -22.658 -55.325 1.00 0.00 O ATOM 0 H ASP A 66 12.917 -20.674 -51.194 1.00 0.00 H new ATOM 0 HA ASP A 66 11.840 -22.332 -53.451 1.00 0.00 H new ATOM 0 HB2 ASP A 66 13.454 -20.170 -53.686 1.00 0.00 H new ATOM 0 HB3 ASP A 66 14.700 -21.311 -53.223 1.00 0.00 H new ATOM 1044 N ASP A 67 14.298 -23.788 -53.006 1.00 0.00 N ATOM 1045 CA ASP A 67 15.012 -24.994 -52.519 1.00 0.00 C ATOM 1046 C ASP A 67 16.191 -24.607 -51.634 1.00 0.00 C ATOM 1047 O ASP A 67 16.997 -25.441 -51.274 1.00 0.00 O ATOM 1048 CB ASP A 67 15.542 -25.768 -53.736 1.00 0.00 C ATOM 1049 CG ASP A 67 14.398 -26.556 -54.376 1.00 0.00 C ATOM 1050 OD1 ASP A 67 13.932 -27.467 -53.713 1.00 0.00 O ATOM 1051 OD2 ASP A 67 14.055 -26.203 -55.493 1.00 0.00 O ATOM 0 H ASP A 67 14.591 -23.445 -53.921 1.00 0.00 H new ATOM 0 HA ASP A 67 14.322 -25.603 -51.935 1.00 0.00 H new ATOM 0 HB2 ASP A 67 15.972 -25.077 -54.461 1.00 0.00 H new ATOM 0 HB3 ASP A 67 16.339 -26.446 -53.430 1.00 0.00 H new ATOM 1056 N ASN A 68 16.267 -23.342 -51.303 1.00 0.00 N ATOM 1057 CA ASN A 68 17.384 -22.869 -50.440 1.00 0.00 C ATOM 1058 C ASN A 68 16.866 -21.929 -49.361 1.00 0.00 C ATOM 1059 O ASN A 68 17.611 -21.485 -48.511 1.00 0.00 O ATOM 1060 CB ASN A 68 18.387 -22.108 -51.320 1.00 0.00 C ATOM 1061 CG ASN A 68 19.057 -23.089 -52.285 1.00 0.00 C ATOM 1062 OD1 ASN A 68 20.117 -23.616 -52.013 1.00 0.00 O ATOM 1063 ND2 ASN A 68 18.474 -23.358 -53.420 1.00 0.00 N ATOM 0 H ASN A 68 15.605 -22.622 -51.593 1.00 0.00 H new ATOM 0 HA ASN A 68 17.856 -23.727 -49.961 1.00 0.00 H new ATOM 0 HB2 ASN A 68 17.877 -21.322 -51.877 1.00 0.00 H new ATOM 0 HB3 ASN A 68 19.138 -21.621 -50.698 1.00 0.00 H new ATOM 0 HD21 ASN A 68 18.908 -24.008 -54.075 1.00 0.00 H new ATOM 0 HD22 ASN A 68 17.584 -22.918 -53.653 1.00 0.00 H new ATOM 1070 N GLY A 69 15.595 -21.642 -49.415 1.00 0.00 N ATOM 1071 CA GLY A 69 15.008 -20.729 -48.395 1.00 0.00 C ATOM 1072 C GLY A 69 15.291 -19.268 -48.752 1.00 0.00 C ATOM 1073 O GLY A 69 15.474 -18.439 -47.882 1.00 0.00 O ATOM 0 H GLY A 69 14.943 -21.996 -50.114 1.00 0.00 H new ATOM 0 HA2 GLY A 69 13.932 -20.891 -48.330 1.00 0.00 H new ATOM 0 HA3 GLY A 69 15.424 -20.956 -47.414 1.00 0.00 H new ATOM 1077 N ASP A 70 15.321 -18.979 -50.025 1.00 0.00 N ATOM 1078 CA ASP A 70 15.590 -17.582 -50.446 1.00 0.00 C ATOM 1079 C ASP A 70 14.401 -16.691 -50.138 1.00 0.00 C ATOM 1080 O ASP A 70 14.376 -15.534 -50.507 1.00 0.00 O ATOM 1081 CB ASP A 70 15.845 -17.567 -51.961 1.00 0.00 C ATOM 1082 CG ASP A 70 16.621 -16.301 -52.328 1.00 0.00 C ATOM 1083 OD1 ASP A 70 17.529 -15.986 -51.578 1.00 0.00 O ATOM 1084 OD2 ASP A 70 16.262 -15.721 -53.340 1.00 0.00 O ATOM 0 H ASP A 70 15.172 -19.646 -50.783 1.00 0.00 H new ATOM 0 HA ASP A 70 16.458 -17.208 -49.903 1.00 0.00 H new ATOM 0 HB2 ASP A 70 16.409 -18.452 -52.256 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.899 -17.598 -52.501 1.00 0.00 H new ATOM 1089 N VAL A 71 13.437 -17.247 -49.468 1.00 0.00 N ATOM 1090 CA VAL A 71 12.239 -16.453 -49.123 1.00 0.00 C ATOM 1091 C VAL A 71 11.754 -15.639 -50.322 1.00 0.00 C ATOM 1092 O VAL A 71 12.079 -14.475 -50.458 1.00 0.00 O ATOM 1093 CB VAL A 71 12.611 -15.488 -47.984 1.00 0.00 C ATOM 1094 CG1 VAL A 71 11.332 -14.975 -47.322 1.00 0.00 C ATOM 1095 CG2 VAL A 71 13.449 -16.236 -46.946 1.00 0.00 C ATOM 0 H VAL A 71 13.429 -18.215 -49.146 1.00 0.00 H new ATOM 0 HA VAL A 71 11.440 -17.130 -48.821 1.00 0.00 H new ATOM 0 HB VAL A 71 13.181 -14.649 -48.383 1.00 0.00 H new ATOM 0 HG11 VAL A 71 11.590 -14.291 -46.514 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.725 -14.452 -48.061 1.00 0.00 H new ATOM 0 HG13 VAL A 71 10.768 -15.816 -46.919 1.00 0.00 H new ATOM 0 HG21 VAL A 71 13.716 -15.557 -46.136 1.00 0.00 H new ATOM 0 HG22 VAL A 71 12.873 -17.070 -46.545 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.357 -16.615 -47.416 1.00 0.00 H new ATOM 1105 N HIS A 72 10.983 -16.265 -51.171 1.00 0.00 N ATOM 1106 CA HIS A 72 10.471 -15.540 -52.362 1.00 0.00 C ATOM 1107 C HIS A 72 9.747 -14.265 -51.942 1.00 0.00 C ATOM 1108 O HIS A 72 8.588 -14.295 -51.577 1.00 0.00 O ATOM 1109 CB HIS A 72 9.482 -16.456 -53.102 1.00 0.00 C ATOM 1110 CG HIS A 72 10.191 -17.115 -54.290 1.00 0.00 C ATOM 1111 ND1 HIS A 72 9.620 -17.551 -55.311 1.00 0.00 N ATOM 1112 CD2 HIS A 72 11.538 -17.357 -54.491 1.00 0.00 C ATOM 1113 CE1 HIS A 72 10.449 -18.041 -56.136 1.00 0.00 C ATOM 1114 NE2 HIS A 72 11.707 -17.963 -55.699 1.00 0.00 N ATOM 0 H HIS A 72 10.690 -17.239 -51.090 1.00 0.00 H new ATOM 0 HA HIS A 72 11.308 -15.272 -53.007 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.099 -17.219 -52.424 1.00 0.00 H new ATOM 0 HB3 HIS A 72 8.625 -15.879 -53.450 1.00 0.00 H new ATOM 0 HD2 HIS A 72 12.329 -17.106 -53.800 1.00 0.00 H new ATOM 0 HE1 HIS A 72 10.168 -18.473 -57.085 1.00 0.00 H new ATOM 0 HE2 HIS A 72 12.567 -18.275 -56.150 1.00 0.00 H new ATOM 1122 N LEU A 73 10.445 -13.166 -52.006 1.00 0.00 N ATOM 1123 CA LEU A 73 9.821 -11.876 -51.617 1.00 0.00 C ATOM 1124 C LEU A 73 8.671 -11.512 -52.551 1.00 0.00 C ATOM 1125 O LEU A 73 7.678 -10.954 -52.128 1.00 0.00 O ATOM 1126 CB LEU A 73 10.895 -10.779 -51.710 1.00 0.00 C ATOM 1127 CG LEU A 73 10.440 -9.557 -50.908 1.00 0.00 C ATOM 1128 CD1 LEU A 73 10.483 -9.890 -49.415 1.00 0.00 C ATOM 1129 CD2 LEU A 73 11.390 -8.390 -51.191 1.00 0.00 C ATOM 0 H LEU A 73 11.417 -13.107 -52.310 1.00 0.00 H new ATOM 0 HA LEU A 73 9.426 -11.966 -50.605 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.844 -11.150 -51.323 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.061 -10.504 -52.752 1.00 0.00 H new ATOM 0 HG LEU A 73 9.424 -9.285 -51.195 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.160 -9.023 -48.839 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.819 -10.730 -49.210 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.501 -10.155 -49.131 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.072 -7.516 -50.623 1.00 0.00 H new ATOM 0 HD22 LEU A 73 12.403 -8.665 -50.896 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.373 -8.157 -52.256 1.00 0.00 H new ATOM 1141 N GLU A 74 8.823 -11.837 -53.804 1.00 0.00 N ATOM 1142 CA GLU A 74 7.748 -11.516 -54.779 1.00 0.00 C ATOM 1143 C GLU A 74 6.416 -12.152 -54.373 1.00 0.00 C ATOM 1144 O GLU A 74 5.394 -11.491 -54.344 1.00 0.00 O ATOM 1145 CB GLU A 74 8.160 -12.072 -56.150 1.00 0.00 C ATOM 1146 CG GLU A 74 7.250 -11.479 -57.228 1.00 0.00 C ATOM 1147 CD GLU A 74 7.729 -11.938 -58.608 1.00 0.00 C ATOM 1148 OE1 GLU A 74 7.752 -13.142 -58.799 1.00 0.00 O ATOM 1149 OE2 GLU A 74 8.045 -11.057 -59.392 1.00 0.00 O ATOM 0 H GLU A 74 9.640 -12.308 -54.192 1.00 0.00 H new ATOM 0 HA GLU A 74 7.616 -10.434 -54.810 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.201 -11.824 -56.359 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.085 -13.159 -56.152 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.220 -11.796 -57.065 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.261 -10.391 -57.171 1.00 0.00 H new ATOM 1156 N LYS A 75 6.451 -13.418 -54.060 1.00 0.00 N ATOM 1157 CA LYS A 75 5.199 -14.103 -53.657 1.00 0.00 C ATOM 1158 C LYS A 75 4.810 -13.730 -52.237 1.00 0.00 C ATOM 1159 O LYS A 75 3.645 -13.717 -51.891 1.00 0.00 O ATOM 1160 CB LYS A 75 5.432 -15.622 -53.724 1.00 0.00 C ATOM 1161 CG LYS A 75 4.088 -16.332 -53.898 1.00 0.00 C ATOM 1162 CD LYS A 75 3.628 -16.196 -55.353 1.00 0.00 C ATOM 1163 CE LYS A 75 2.130 -15.889 -55.378 1.00 0.00 C ATOM 1164 NZ LYS A 75 1.397 -16.803 -54.458 1.00 0.00 N ATOM 0 H LYS A 75 7.288 -14.001 -54.067 1.00 0.00 H new ATOM 0 HA LYS A 75 4.397 -13.799 -54.329 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.094 -15.864 -54.555 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.923 -15.967 -52.814 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.183 -17.385 -53.631 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.345 -15.899 -53.228 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.183 -15.400 -55.850 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.832 -17.117 -55.900 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.960 -14.853 -55.084 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.747 -15.999 -56.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.446 -16.988 -54.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.916 -17.700 -54.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.316 -16.360 -53.521 1.00 0.00 H new ATOM 1178 N LEU A 76 5.791 -13.430 -51.437 1.00 0.00 N ATOM 1179 CA LEU A 76 5.493 -13.057 -50.039 1.00 0.00 C ATOM 1180 C LEU A 76 4.599 -11.822 -49.985 1.00 0.00 C ATOM 1181 O LEU A 76 3.556 -11.833 -49.359 1.00 0.00 O ATOM 1182 CB LEU A 76 6.819 -12.745 -49.326 1.00 0.00 C ATOM 1183 CG LEU A 76 6.595 -12.791 -47.810 1.00 0.00 C ATOM 1184 CD1 LEU A 76 7.950 -12.891 -47.105 1.00 0.00 C ATOM 1185 CD2 LEU A 76 5.884 -11.509 -47.359 1.00 0.00 C ATOM 0 H LEU A 76 6.779 -13.428 -51.692 1.00 0.00 H new ATOM 0 HA LEU A 76 4.973 -13.883 -49.553 1.00 0.00 H new ATOM 0 HB2 LEU A 76 7.581 -13.468 -49.616 1.00 0.00 H new ATOM 0 HB3 LEU A 76 7.183 -11.762 -49.623 1.00 0.00 H new ATOM 0 HG LEU A 76 5.982 -13.656 -47.557 1.00 0.00 H new ATOM 0 HD11 LEU A 76 7.797 -12.924 -46.026 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.462 -13.798 -47.427 1.00 0.00 H new ATOM 0 HD13 LEU A 76 8.557 -12.022 -47.359 1.00 0.00 H new ATOM 0 HD21 LEU A 76 5.725 -11.541 -46.281 1.00 0.00 H new ATOM 0 HD22 LEU A 76 6.499 -10.645 -47.609 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.922 -11.429 -47.866 1.00 0.00 H new ATOM 1197 N ARG A 77 5.020 -10.779 -50.646 1.00 0.00 N ATOM 1198 CA ARG A 77 4.207 -9.537 -50.644 1.00 0.00 C ATOM 1199 C ARG A 77 2.864 -9.762 -51.332 1.00 0.00 C ATOM 1200 O ARG A 77 1.826 -9.419 -50.803 1.00 0.00 O ATOM 1201 CB ARG A 77 4.976 -8.452 -51.412 1.00 0.00 C ATOM 1202 CG ARG A 77 5.755 -7.585 -50.417 1.00 0.00 C ATOM 1203 CD ARG A 77 4.901 -6.378 -50.020 1.00 0.00 C ATOM 1204 NE ARG A 77 5.766 -5.381 -49.329 1.00 0.00 N ATOM 1205 CZ ARG A 77 6.433 -4.512 -50.038 1.00 0.00 C ATOM 1206 NH1 ARG A 77 7.526 -4.896 -50.640 1.00 0.00 N ATOM 1207 NH2 ARG A 77 5.986 -3.289 -50.120 1.00 0.00 N ATOM 0 H ARG A 77 5.886 -10.735 -51.183 1.00 0.00 H new ATOM 0 HA ARG A 77 4.025 -9.236 -49.612 1.00 0.00 H new ATOM 0 HB2 ARG A 77 5.660 -8.911 -52.126 1.00 0.00 H new ATOM 0 HB3 ARG A 77 4.283 -7.836 -51.985 1.00 0.00 H new ATOM 0 HG2 ARG A 77 6.013 -8.168 -49.533 1.00 0.00 H new ATOM 0 HG3 ARG A 77 6.692 -7.251 -50.864 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.444 -5.932 -50.904 1.00 0.00 H new ATOM 0 HD3 ARG A 77 4.088 -6.691 -49.364 1.00 0.00 H new ATOM 0 HE ARG A 77 5.836 -5.378 -48.311 1.00 0.00 H new ATOM 0 HH11 ARG A 77 7.845 -5.861 -50.552 1.00 0.00 H new ATOM 0 HH12 ARG A 77 8.061 -4.231 -51.199 1.00 0.00 H new ATOM 0 HH21 ARG A 77 5.128 -3.026 -49.634 1.00 0.00 H new ATOM 0 HH22 ARG A 77 6.494 -2.596 -50.670 1.00 0.00 H new ATOM 1221 N ASP A 78 2.907 -10.335 -52.505 1.00 0.00 N ATOM 1222 CA ASP A 78 1.642 -10.587 -53.239 1.00 0.00 C ATOM 1223 C ASP A 78 0.652 -11.371 -52.382 1.00 0.00 C ATOM 1224 O ASP A 78 -0.538 -11.335 -52.617 1.00 0.00 O ATOM 1225 CB ASP A 78 1.968 -11.413 -54.490 1.00 0.00 C ATOM 1226 CG ASP A 78 0.756 -11.419 -55.422 1.00 0.00 C ATOM 1227 OD1 ASP A 78 0.316 -10.327 -55.743 1.00 0.00 O ATOM 1228 OD2 ASP A 78 0.337 -12.513 -55.758 1.00 0.00 O ATOM 0 H ASP A 78 3.758 -10.636 -52.980 1.00 0.00 H new ATOM 0 HA ASP A 78 1.191 -9.630 -53.500 1.00 0.00 H new ATOM 0 HB2 ASP A 78 2.833 -10.992 -55.002 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.230 -12.433 -54.208 1.00 0.00 H new ATOM 1233 N SER A 79 1.163 -12.065 -51.405 1.00 0.00 N ATOM 1234 CA SER A 79 0.265 -12.855 -50.526 1.00 0.00 C ATOM 1235 C SER A 79 -0.752 -11.958 -49.821 1.00 0.00 C ATOM 1236 O SER A 79 -1.713 -12.438 -49.253 1.00 0.00 O ATOM 1237 CB SER A 79 1.126 -13.552 -49.463 1.00 0.00 C ATOM 1238 OG SER A 79 1.354 -12.545 -48.488 1.00 0.00 O ATOM 0 H SER A 79 2.156 -12.118 -51.180 1.00 0.00 H new ATOM 0 HA SER A 79 -0.278 -13.577 -51.136 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.612 -14.412 -49.035 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.062 -13.918 -49.885 1.00 0.00 H new ATOM 0 HG SER A 79 1.967 -11.872 -48.850 1.00 0.00 H new ATOM 1244 N LEU A 80 -0.521 -10.669 -49.872 1.00 0.00 N ATOM 1245 CA LEU A 80 -1.463 -9.724 -49.209 1.00 0.00 C ATOM 1246 C LEU A 80 -2.459 -9.126 -50.223 1.00 0.00 C ATOM 1247 O LEU A 80 -2.144 -8.974 -51.386 1.00 0.00 O ATOM 1248 CB LEU A 80 -0.632 -8.583 -48.601 1.00 0.00 C ATOM 1249 CG LEU A 80 0.593 -9.175 -47.901 1.00 0.00 C ATOM 1250 CD1 LEU A 80 1.504 -8.038 -47.432 1.00 0.00 C ATOM 1251 CD2 LEU A 80 0.135 -9.987 -46.688 1.00 0.00 C ATOM 0 H LEU A 80 0.274 -10.236 -50.341 1.00 0.00 H new ATOM 0 HA LEU A 80 -2.031 -10.258 -48.447 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.320 -7.888 -49.381 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.234 -8.016 -47.891 1.00 0.00 H new ATOM 0 HG LEU A 80 1.136 -9.820 -48.592 1.00 0.00 H new ATOM 0 HD11 LEU A 80 2.378 -8.455 -46.932 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.824 -7.450 -48.292 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.960 -7.399 -46.737 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.004 -10.411 -46.185 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.403 -9.337 -45.997 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.523 -10.792 -47.016 1.00 0.00 H new ATOM 1263 N PRO A 81 -3.658 -8.797 -49.750 1.00 0.00 N ATOM 1264 CA PRO A 81 -4.693 -8.218 -50.614 1.00 0.00 C ATOM 1265 C PRO A 81 -4.257 -6.873 -51.198 1.00 0.00 C ATOM 1266 O PRO A 81 -3.086 -6.554 -51.230 1.00 0.00 O ATOM 1267 CB PRO A 81 -5.905 -7.995 -49.685 1.00 0.00 C ATOM 1268 CG PRO A 81 -5.465 -8.390 -48.243 1.00 0.00 C ATOM 1269 CD PRO A 81 -4.053 -8.987 -48.344 1.00 0.00 C ATOM 0 HA PRO A 81 -4.907 -8.874 -51.458 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.227 -6.954 -49.717 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -6.752 -8.600 -50.007 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -5.468 -7.519 -47.588 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.158 -9.113 -47.814 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -3.362 -8.483 -47.668 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.051 -10.043 -48.073 1.00 0.00 H new ATOM 1277 N ASN A 82 -5.222 -6.108 -51.649 1.00 0.00 N ATOM 1278 CA ASN A 82 -4.897 -4.782 -52.235 1.00 0.00 C ATOM 1279 C ASN A 82 -4.831 -3.714 -51.150 1.00 0.00 C ATOM 1280 O ASN A 82 -4.063 -2.775 -51.239 1.00 0.00 O ATOM 1281 CB ASN A 82 -6.006 -4.409 -53.228 1.00 0.00 C ATOM 1282 CG ASN A 82 -7.311 -4.187 -52.464 1.00 0.00 C ATOM 1283 OD1 ASN A 82 -7.450 -3.106 -51.748 1.00 0.00 O flip ATOM 1284 ND2 ASN A 82 -8.217 -4.995 -52.513 1.00 0.00 N flip ATOM 0 H ASN A 82 -6.213 -6.348 -51.634 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.928 -4.837 -52.731 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.733 -3.506 -53.775 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.133 -5.202 -53.965 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -8.115 -5.843 -53.071 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -9.080 -4.826 -51.996 1.00 0.00 H new ATOM 1291 N SER A 83 -5.645 -3.863 -50.145 1.00 0.00 N ATOM 1292 CA SER A 83 -5.628 -2.861 -49.060 1.00 0.00 C ATOM 1293 C SER A 83 -4.252 -2.831 -48.413 1.00 0.00 C ATOM 1294 O SER A 83 -3.672 -1.777 -48.210 1.00 0.00 O ATOM 1295 CB SER A 83 -6.672 -3.264 -48.005 1.00 0.00 C ATOM 1296 OG SER A 83 -6.508 -4.668 -47.873 1.00 0.00 O ATOM 0 H SER A 83 -6.312 -4.627 -50.033 1.00 0.00 H new ATOM 0 HA SER A 83 -5.858 -1.875 -49.464 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.500 -2.752 -47.058 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.682 -3.009 -48.326 1.00 0.00 H new ATOM 0 HG SER A 83 -5.919 -4.859 -47.113 1.00 0.00 H new ATOM 1302 N MET A 84 -3.746 -3.995 -48.106 1.00 0.00 N ATOM 1303 CA MET A 84 -2.414 -4.057 -47.476 1.00 0.00 C ATOM 1304 C MET A 84 -1.339 -3.669 -48.479 1.00 0.00 C ATOM 1305 O MET A 84 -0.355 -3.061 -48.120 1.00 0.00 O ATOM 1306 CB MET A 84 -2.165 -5.492 -46.991 1.00 0.00 C ATOM 1307 CG MET A 84 -2.757 -5.649 -45.586 1.00 0.00 C ATOM 1308 SD MET A 84 -4.556 -5.795 -45.456 1.00 0.00 S ATOM 1309 CE MET A 84 -4.695 -5.397 -43.694 1.00 0.00 C ATOM 0 H MET A 84 -4.200 -4.894 -48.266 1.00 0.00 H new ATOM 0 HA MET A 84 -2.377 -3.363 -46.637 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.623 -6.206 -47.675 1.00 0.00 H new ATOM 0 HB3 MET A 84 -1.096 -5.705 -46.976 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.313 -6.534 -45.130 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.444 -4.792 -44.990 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.743 -5.430 -43.395 1.00 0.00 H new ATOM 0 HE2 MET A 84 -4.128 -6.123 -43.111 1.00 0.00 H new ATOM 0 HE3 MET A 84 -4.298 -4.398 -43.514 1.00 0.00 H new ATOM 1319 N HIS A 85 -1.540 -4.027 -49.728 1.00 0.00 N ATOM 1320 CA HIS A 85 -0.519 -3.667 -50.739 1.00 0.00 C ATOM 1321 C HIS A 85 -0.180 -2.198 -50.587 1.00 0.00 C ATOM 1322 O HIS A 85 0.967 -1.805 -50.666 1.00 0.00 O ATOM 1323 CB HIS A 85 -1.091 -3.908 -52.150 1.00 0.00 C ATOM 1324 CG HIS A 85 -0.945 -5.386 -52.518 1.00 0.00 C ATOM 1325 ND1 HIS A 85 -0.289 -6.224 -51.866 1.00 0.00 N ATOM 1326 CD2 HIS A 85 -1.472 -6.084 -53.590 1.00 0.00 C ATOM 1327 CE1 HIS A 85 -0.339 -7.373 -52.403 1.00 0.00 C ATOM 1328 NE2 HIS A 85 -1.075 -7.383 -53.515 1.00 0.00 N ATOM 0 H HIS A 85 -2.350 -4.541 -50.075 1.00 0.00 H new ATOM 0 HA HIS A 85 0.374 -4.276 -50.598 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -2.141 -3.617 -52.182 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.566 -3.288 -52.877 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -2.099 -5.664 -54.363 1.00 0.00 H new ATOM 0 HE1 HIS A 85 0.159 -8.245 -52.004 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -1.285 -8.159 -54.143 1.00 0.00 H new ATOM 1336 N ASP A 86 -1.199 -1.403 -50.372 1.00 0.00 N ATOM 1337 CA ASP A 86 -0.967 0.047 -50.206 1.00 0.00 C ATOM 1338 C ASP A 86 -0.204 0.294 -48.914 1.00 0.00 C ATOM 1339 O ASP A 86 0.821 0.960 -48.900 1.00 0.00 O ATOM 1340 CB ASP A 86 -2.330 0.754 -50.125 1.00 0.00 C ATOM 1341 CG ASP A 86 -2.200 2.174 -50.678 1.00 0.00 C ATOM 1342 OD1 ASP A 86 -1.312 2.862 -50.202 1.00 0.00 O ATOM 1343 OD2 ASP A 86 -2.996 2.492 -51.546 1.00 0.00 O ATOM 0 H ASP A 86 -2.172 -1.702 -50.306 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.390 0.429 -51.048 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -3.075 0.197 -50.694 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -2.675 0.785 -49.092 1.00 0.00 H new ATOM 1348 N ILE A 87 -0.709 -0.257 -47.838 1.00 0.00 N ATOM 1349 CA ILE A 87 -0.022 -0.063 -46.551 1.00 0.00 C ATOM 1350 C ILE A 87 1.358 -0.666 -46.645 1.00 0.00 C ATOM 1351 O ILE A 87 2.271 -0.270 -45.949 1.00 0.00 O ATOM 1352 CB ILE A 87 -0.805 -0.787 -45.453 1.00 0.00 C ATOM 1353 CG1 ILE A 87 -2.253 -0.318 -45.451 1.00 0.00 C ATOM 1354 CG2 ILE A 87 -0.179 -0.436 -44.094 1.00 0.00 C ATOM 1355 CD1 ILE A 87 -2.964 -0.904 -44.229 1.00 0.00 C ATOM 0 H ILE A 87 -1.557 -0.823 -47.807 1.00 0.00 H new ATOM 0 HA ILE A 87 0.045 1.000 -46.319 1.00 0.00 H new ATOM 0 HB ILE A 87 -0.770 -1.862 -45.632 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.296 0.771 -45.426 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.753 -0.636 -46.366 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.726 -0.944 -43.300 1.00 0.00 H new ATOM 0 HG22 ILE A 87 0.863 -0.756 -44.080 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -0.230 0.642 -43.937 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -4.003 -0.573 -44.219 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.930 -1.992 -44.276 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.466 -0.564 -43.321 1.00 0.00 H new ATOM 1367 N ALA A 88 1.486 -1.625 -47.526 1.00 0.00 N ATOM 1368 CA ALA A 88 2.788 -2.279 -47.700 1.00 0.00 C ATOM 1369 C ALA A 88 3.709 -1.381 -48.499 1.00 0.00 C ATOM 1370 O ALA A 88 4.913 -1.486 -48.413 1.00 0.00 O ATOM 1371 CB ALA A 88 2.581 -3.596 -48.463 1.00 0.00 C ATOM 0 H ALA A 88 0.738 -1.973 -48.125 1.00 0.00 H new ATOM 0 HA ALA A 88 3.234 -2.474 -46.725 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.542 -4.092 -48.599 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.915 -4.245 -47.895 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.140 -3.386 -49.437 1.00 0.00 H new ATOM 1377 N MET A 89 3.120 -0.511 -49.279 1.00 0.00 N ATOM 1378 CA MET A 89 3.948 0.402 -50.089 1.00 0.00 C ATOM 1379 C MET A 89 4.660 1.373 -49.173 1.00 0.00 C ATOM 1380 O MET A 89 5.803 1.725 -49.392 1.00 0.00 O ATOM 1381 CB MET A 89 3.033 1.193 -51.038 1.00 0.00 C ATOM 1382 CG MET A 89 3.896 2.076 -51.945 1.00 0.00 C ATOM 1383 SD MET A 89 3.049 3.033 -53.227 1.00 0.00 S ATOM 1384 CE MET A 89 3.455 4.677 -52.589 1.00 0.00 C ATOM 0 H MET A 89 2.111 -0.401 -49.383 1.00 0.00 H new ATOM 0 HA MET A 89 4.678 -0.170 -50.661 1.00 0.00 H new ATOM 0 HB2 MET A 89 2.433 0.509 -51.639 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.338 1.807 -50.465 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.446 2.773 -51.312 1.00 0.00 H new ATOM 0 HG3 MET A 89 4.634 1.439 -52.433 1.00 0.00 H new ATOM 0 HE1 MET A 89 3.023 5.437 -53.240 1.00 0.00 H new ATOM 0 HE2 MET A 89 3.049 4.787 -51.583 1.00 0.00 H new ATOM 0 HE3 MET A 89 4.538 4.798 -52.559 1.00 0.00 H new ATOM 1394 N HIS A 90 3.961 1.795 -48.152 1.00 0.00 N ATOM 1395 CA HIS A 90 4.571 2.747 -47.194 1.00 0.00 C ATOM 1396 C HIS A 90 5.575 2.026 -46.299 1.00 0.00 C ATOM 1397 O HIS A 90 6.579 2.588 -45.907 1.00 0.00 O ATOM 1398 CB HIS A 90 3.458 3.330 -46.312 1.00 0.00 C ATOM 1399 CG HIS A 90 2.463 4.094 -47.185 1.00 0.00 C ATOM 1400 ND1 HIS A 90 1.870 3.619 -48.175 1.00 0.00 N ATOM 1401 CD2 HIS A 90 2.019 5.398 -47.081 1.00 0.00 C ATOM 1402 CE1 HIS A 90 1.100 4.473 -48.710 1.00 0.00 C ATOM 1403 NE2 HIS A 90 1.127 5.646 -48.078 1.00 0.00 N ATOM 0 H HIS A 90 3.001 1.520 -47.946 1.00 0.00 H new ATOM 0 HA HIS A 90 5.084 3.535 -47.746 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.948 2.530 -45.776 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.885 3.995 -45.561 1.00 0.00 H new ATOM 0 HD2 HIS A 90 2.330 6.107 -46.328 1.00 0.00 H new ATOM 0 HE1 HIS A 90 0.491 4.272 -49.579 1.00 0.00 H new ATOM 0 HE2 HIS A 90 0.615 6.503 -48.287 1.00 0.00 H new ATOM 1411 N MET A 91 5.281 0.789 -45.994 1.00 0.00 N ATOM 1412 CA MET A 91 6.201 0.007 -45.127 1.00 0.00 C ATOM 1413 C MET A 91 7.295 -0.657 -45.957 1.00 0.00 C ATOM 1414 O MET A 91 8.430 -0.747 -45.536 1.00 0.00 O ATOM 1415 CB MET A 91 5.382 -1.094 -44.427 1.00 0.00 C ATOM 1416 CG MET A 91 4.890 -0.584 -43.068 1.00 0.00 C ATOM 1417 SD MET A 91 5.759 -1.175 -41.594 1.00 0.00 S ATOM 1418 CE MET A 91 4.552 -2.435 -41.104 1.00 0.00 C ATOM 0 H MET A 91 4.447 0.292 -46.307 1.00 0.00 H new ATOM 0 HA MET A 91 6.666 0.677 -44.404 1.00 0.00 H new ATOM 0 HB2 MET A 91 4.533 -1.380 -45.048 1.00 0.00 H new ATOM 0 HB3 MET A 91 5.994 -1.986 -44.292 1.00 0.00 H new ATOM 0 HG2 MET A 91 4.943 0.505 -43.077 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.838 -0.851 -42.969 1.00 0.00 H new ATOM 0 HE1 MET A 91 4.702 -2.694 -40.056 1.00 0.00 H new ATOM 0 HE2 MET A 91 3.543 -2.045 -41.241 1.00 0.00 H new ATOM 0 HE3 MET A 91 4.684 -3.324 -41.720 1.00 0.00 H new ATOM 1428 N GLY A 92 6.930 -1.109 -47.124 1.00 0.00 N ATOM 1429 CA GLY A 92 7.931 -1.773 -48.005 1.00 0.00 C ATOM 1430 C GLY A 92 9.186 -0.908 -48.150 1.00 0.00 C ATOM 1431 O GLY A 92 10.187 -1.349 -48.678 1.00 0.00 O ATOM 0 H GLY A 92 5.986 -1.048 -47.505 1.00 0.00 H new ATOM 0 HA2 GLY A 92 8.199 -2.745 -47.590 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.494 -1.955 -48.987 1.00 0.00 H new ATOM 1435 N LYS A 93 9.108 0.302 -47.674 1.00 0.00 N ATOM 1436 CA LYS A 93 10.285 1.202 -47.778 1.00 0.00 C ATOM 1437 C LYS A 93 11.330 0.894 -46.706 1.00 0.00 C ATOM 1438 O LYS A 93 12.433 0.489 -47.012 1.00 0.00 O ATOM 1439 CB LYS A 93 9.799 2.646 -47.596 1.00 0.00 C ATOM 1440 CG LYS A 93 8.953 3.044 -48.808 1.00 0.00 C ATOM 1441 CD LYS A 93 9.858 3.683 -49.862 1.00 0.00 C ATOM 1442 CE LYS A 93 9.000 4.176 -51.029 1.00 0.00 C ATOM 1443 NZ LYS A 93 9.394 5.559 -51.415 1.00 0.00 N ATOM 0 H LYS A 93 8.287 0.703 -47.221 1.00 0.00 H new ATOM 0 HA LYS A 93 10.751 1.056 -48.753 1.00 0.00 H new ATOM 0 HB2 LYS A 93 9.212 2.733 -46.682 1.00 0.00 H new ATOM 0 HB3 LYS A 93 10.650 3.319 -47.493 1.00 0.00 H new ATOM 0 HG2 LYS A 93 8.454 2.168 -49.222 1.00 0.00 H new ATOM 0 HG3 LYS A 93 8.173 3.744 -48.508 1.00 0.00 H new ATOM 0 HD2 LYS A 93 10.413 4.514 -49.427 1.00 0.00 H new ATOM 0 HD3 LYS A 93 10.592 2.959 -50.215 1.00 0.00 H new ATOM 0 HE2 LYS A 93 9.115 3.507 -51.882 1.00 0.00 H new ATOM 0 HE3 LYS A 93 7.947 4.156 -50.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 8.803 5.880 -52.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 9.261 6.197 -50.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 10.393 5.568 -51.702 1.00 0.00 H new ATOM 1457 N ARG A 94 10.966 1.092 -45.467 1.00 0.00 N ATOM 1458 CA ARG A 94 11.933 0.815 -44.372 1.00 0.00 C ATOM 1459 C ARG A 94 12.053 -0.681 -44.097 1.00 0.00 C ATOM 1460 O ARG A 94 12.054 -1.104 -42.959 1.00 0.00 O ATOM 1461 CB ARG A 94 11.433 1.512 -43.095 1.00 0.00 C ATOM 1462 CG ARG A 94 11.261 3.007 -43.374 1.00 0.00 C ATOM 1463 CD ARG A 94 12.629 3.691 -43.308 1.00 0.00 C ATOM 1464 NE ARG A 94 12.767 4.611 -44.472 1.00 0.00 N ATOM 1465 CZ ARG A 94 13.639 4.340 -45.406 1.00 0.00 C ATOM 1466 NH1 ARG A 94 14.872 4.737 -45.253 1.00 0.00 N ATOM 1467 NH2 ARG A 94 13.249 3.678 -46.460 1.00 0.00 N ATOM 0 H ARG A 94 10.050 1.430 -45.170 1.00 0.00 H new ATOM 0 HA ARG A 94 12.913 1.188 -44.671 1.00 0.00 H new ATOM 0 HB2 ARG A 94 10.485 1.078 -42.776 1.00 0.00 H new ATOM 0 HB3 ARG A 94 12.143 1.361 -42.282 1.00 0.00 H new ATOM 0 HG2 ARG A 94 10.813 3.157 -44.356 1.00 0.00 H new ATOM 0 HG3 ARG A 94 10.584 3.450 -42.644 1.00 0.00 H new ATOM 0 HD2 ARG A 94 12.728 4.246 -42.375 1.00 0.00 H new ATOM 0 HD3 ARG A 94 13.424 2.945 -43.321 1.00 0.00 H new ATOM 0 HE ARG A 94 12.185 5.446 -44.539 1.00 0.00 H new ATOM 0 HH11 ARG A 94 15.142 5.250 -44.414 1.00 0.00 H new ATOM 0 HH12 ARG A 94 15.566 4.534 -45.972 1.00 0.00 H new ATOM 0 HH21 ARG A 94 12.277 3.381 -46.545 1.00 0.00 H new ATOM 0 HH22 ARG A 94 13.916 3.457 -47.199 1.00 0.00 H new ATOM 1481 N CYS A 95 12.160 -1.456 -45.144 1.00 0.00 N ATOM 1482 CA CYS A 95 12.282 -2.925 -44.952 1.00 0.00 C ATOM 1483 C CYS A 95 12.622 -3.622 -46.264 1.00 0.00 C ATOM 1484 O CYS A 95 11.759 -4.164 -46.925 1.00 0.00 O ATOM 1485 CB CYS A 95 10.937 -3.465 -44.439 1.00 0.00 C ATOM 1486 SG CYS A 95 9.542 -3.447 -45.587 1.00 0.00 S ATOM 0 H CYS A 95 12.168 -1.137 -46.113 1.00 0.00 H new ATOM 0 HA CYS A 95 13.081 -3.121 -44.237 1.00 0.00 H new ATOM 0 HB2 CYS A 95 11.090 -4.493 -44.111 1.00 0.00 H new ATOM 0 HB3 CYS A 95 10.656 -2.888 -43.558 1.00 0.00 H new ATOM 0 HG CYS A 95 9.141 -2.223 -45.763 1.00 0.00 H new ATOM 1492 N LEU A 96 13.877 -3.594 -46.618 1.00 0.00 N ATOM 1493 CA LEU A 96 14.292 -4.248 -47.881 1.00 0.00 C ATOM 1494 C LEU A 96 15.799 -4.477 -47.897 1.00 0.00 C ATOM 1495 O LEU A 96 16.446 -4.267 -48.904 1.00 0.00 O ATOM 1496 CB LEU A 96 13.919 -3.316 -49.047 1.00 0.00 C ATOM 1497 CG LEU A 96 13.830 -4.127 -50.342 1.00 0.00 C ATOM 1498 CD1 LEU A 96 12.576 -5.002 -50.304 1.00 0.00 C ATOM 1499 CD2 LEU A 96 13.736 -3.167 -51.530 1.00 0.00 C ATOM 0 H LEU A 96 14.626 -3.148 -46.088 1.00 0.00 H new ATOM 0 HA LEU A 96 13.791 -5.212 -47.971 1.00 0.00 H new ATOM 0 HB2 LEU A 96 12.966 -2.828 -48.845 1.00 0.00 H new ATOM 0 HB3 LEU A 96 14.665 -2.528 -49.150 1.00 0.00 H new ATOM 0 HG LEU A 96 14.715 -4.756 -50.444 1.00 0.00 H new ATOM 0 HD11 LEU A 96 12.509 -5.581 -51.225 1.00 0.00 H new ATOM 0 HD12 LEU A 96 12.631 -5.680 -49.452 1.00 0.00 H new ATOM 0 HD13 LEU A 96 11.694 -4.369 -50.208 1.00 0.00 H new ATOM 0 HD21 LEU A 96 13.672 -3.739 -52.456 1.00 0.00 H new ATOM 0 HD22 LEU A 96 12.847 -2.545 -51.426 1.00 0.00 H new ATOM 0 HD23 LEU A 96 14.622 -2.532 -51.556 1.00 0.00 H new ATOM 1511 N TYR A 97 16.334 -4.907 -46.780 1.00 0.00 N ATOM 1512 CA TYR A 97 17.800 -5.148 -46.728 1.00 0.00 C ATOM 1513 C TYR A 97 18.172 -6.177 -45.653 1.00 0.00 C ATOM 1514 O TYR A 97 18.833 -5.859 -44.688 1.00 0.00 O ATOM 1515 CB TYR A 97 18.491 -3.818 -46.383 1.00 0.00 C ATOM 1516 CG TYR A 97 17.957 -2.714 -47.297 1.00 0.00 C ATOM 1517 CD1 TYR A 97 18.421 -2.588 -48.590 1.00 0.00 C ATOM 1518 CD2 TYR A 97 16.999 -1.828 -46.841 1.00 0.00 C ATOM 1519 CE1 TYR A 97 17.938 -1.593 -49.415 1.00 0.00 C ATOM 1520 CE2 TYR A 97 16.516 -0.833 -47.667 1.00 0.00 C ATOM 1521 CZ TYR A 97 16.982 -0.708 -48.960 1.00 0.00 C ATOM 1522 OH TYR A 97 16.498 0.286 -49.786 1.00 0.00 O ATOM 0 H TYR A 97 15.824 -5.098 -45.917 1.00 0.00 H new ATOM 0 HA TYR A 97 18.120 -5.535 -47.695 1.00 0.00 H new ATOM 0 HB2 TYR A 97 18.308 -3.561 -45.340 1.00 0.00 H new ATOM 0 HB3 TYR A 97 19.570 -3.914 -46.504 1.00 0.00 H new ATOM 0 HD1 TYR A 97 19.169 -3.274 -48.960 1.00 0.00 H new ATOM 0 HD2 TYR A 97 16.626 -1.915 -45.831 1.00 0.00 H new ATOM 0 HE1 TYR A 97 18.311 -1.506 -50.425 1.00 0.00 H new ATOM 0 HE2 TYR A 97 15.768 -0.147 -47.299 1.00 0.00 H new ATOM 0 HH TYR A 97 15.830 0.817 -49.303 1.00 0.00 H new ATOM 1532 N PRO A 98 17.719 -7.394 -45.845 1.00 0.00 N ATOM 1533 CA PRO A 98 17.993 -8.485 -44.908 1.00 0.00 C ATOM 1534 C PRO A 98 19.491 -8.683 -44.671 1.00 0.00 C ATOM 1535 O PRO A 98 20.267 -8.772 -45.603 1.00 0.00 O ATOM 1536 CB PRO A 98 17.398 -9.737 -45.583 1.00 0.00 C ATOM 1537 CG PRO A 98 16.603 -9.252 -46.832 1.00 0.00 C ATOM 1538 CD PRO A 98 16.875 -7.745 -46.985 1.00 0.00 C ATOM 0 HA PRO A 98 17.562 -8.277 -43.929 1.00 0.00 H new ATOM 0 HB2 PRO A 98 18.188 -10.429 -45.875 1.00 0.00 H new ATOM 0 HB3 PRO A 98 16.744 -10.272 -44.894 1.00 0.00 H new ATOM 0 HG2 PRO A 98 16.919 -9.793 -47.724 1.00 0.00 H new ATOM 0 HG3 PRO A 98 15.537 -9.440 -46.707 1.00 0.00 H new ATOM 0 HD2 PRO A 98 17.376 -7.528 -47.928 1.00 0.00 H new ATOM 0 HD3 PRO A 98 15.947 -7.174 -46.979 1.00 0.00 H new ATOM 1546 N GLU A 99 19.862 -8.743 -43.411 1.00 0.00 N ATOM 1547 CA GLU A 99 21.298 -8.935 -43.060 1.00 0.00 C ATOM 1548 C GLU A 99 21.445 -9.982 -41.968 1.00 0.00 C ATOM 1549 O GLU A 99 20.874 -9.853 -40.904 1.00 0.00 O ATOM 1550 CB GLU A 99 21.852 -7.605 -42.525 1.00 0.00 C ATOM 1551 CG GLU A 99 21.786 -6.551 -43.626 1.00 0.00 C ATOM 1552 CD GLU A 99 23.072 -6.594 -44.459 1.00 0.00 C ATOM 1553 OE1 GLU A 99 24.106 -6.827 -43.853 1.00 0.00 O ATOM 1554 OE2 GLU A 99 22.948 -6.390 -45.655 1.00 0.00 O ATOM 0 H GLU A 99 19.229 -8.667 -42.615 1.00 0.00 H new ATOM 0 HA GLU A 99 21.839 -9.261 -43.948 1.00 0.00 H new ATOM 0 HB2 GLU A 99 21.275 -7.280 -41.659 1.00 0.00 H new ATOM 0 HB3 GLU A 99 22.882 -7.735 -42.191 1.00 0.00 H new ATOM 0 HG2 GLU A 99 20.921 -6.732 -44.265 1.00 0.00 H new ATOM 0 HG3 GLU A 99 21.658 -5.561 -43.188 1.00 0.00 H new ATOM 1561 N GLY A 100 22.205 -11.005 -42.243 1.00 0.00 N ATOM 1562 CA GLY A 100 22.388 -12.061 -41.218 1.00 0.00 C ATOM 1563 C GLY A 100 23.450 -13.062 -41.657 1.00 0.00 C ATOM 1564 O GLY A 100 24.626 -12.760 -41.680 1.00 0.00 O ATOM 0 H GLY A 100 22.700 -11.152 -43.122 1.00 0.00 H new ATOM 0 HA2 GLY A 100 22.678 -11.608 -40.270 1.00 0.00 H new ATOM 0 HA3 GLY A 100 21.443 -12.577 -41.048 1.00 0.00 H new ATOM 1568 N GLU A 101 23.007 -14.235 -41.999 1.00 0.00 N ATOM 1569 CA GLU A 101 23.959 -15.281 -42.441 1.00 0.00 C ATOM 1570 C GLU A 101 23.217 -16.571 -42.759 1.00 0.00 C ATOM 1571 O GLU A 101 23.794 -17.517 -43.257 1.00 0.00 O ATOM 1572 CB GLU A 101 24.954 -15.551 -41.299 1.00 0.00 C ATOM 1573 CG GLU A 101 24.215 -15.484 -39.961 1.00 0.00 C ATOM 1574 CD GLU A 101 25.011 -16.256 -38.905 1.00 0.00 C ATOM 1575 OE1 GLU A 101 25.360 -17.384 -39.209 1.00 0.00 O ATOM 1576 OE2 GLU A 101 25.224 -15.671 -37.855 1.00 0.00 O ATOM 0 H GLU A 101 22.026 -14.514 -41.991 1.00 0.00 H new ATOM 0 HA GLU A 101 24.479 -14.940 -43.336 1.00 0.00 H new ATOM 0 HB2 GLU A 101 25.414 -16.531 -41.425 1.00 0.00 H new ATOM 0 HB3 GLU A 101 25.759 -14.816 -41.321 1.00 0.00 H new ATOM 0 HG2 GLU A 101 24.091 -14.446 -39.653 1.00 0.00 H new ATOM 0 HG3 GLU A 101 23.216 -15.908 -40.062 1.00 0.00 H new ATOM 1583 N ASN A 102 21.944 -16.584 -42.462 1.00 0.00 N ATOM 1584 CA ASN A 102 21.146 -17.801 -42.738 1.00 0.00 C ATOM 1585 C ASN A 102 19.674 -17.454 -42.937 1.00 0.00 C ATOM 1586 O ASN A 102 19.330 -16.317 -43.189 1.00 0.00 O ATOM 1587 CB ASN A 102 21.274 -18.749 -41.536 1.00 0.00 C ATOM 1588 CG ASN A 102 21.336 -17.927 -40.248 1.00 0.00 C ATOM 1589 OD1 ASN A 102 20.891 -16.699 -40.256 1.00 0.00 O flip ATOM 1590 ND2 ASN A 102 21.793 -18.393 -39.223 1.00 0.00 N flip ATOM 0 H ASN A 102 21.431 -15.808 -42.044 1.00 0.00 H new ATOM 0 HA ASN A 102 21.519 -18.270 -43.649 1.00 0.00 H new ATOM 0 HB2 ASN A 102 20.425 -19.432 -41.505 1.00 0.00 H new ATOM 0 HB3 ASN A 102 22.171 -19.360 -41.634 1.00 0.00 H new ATOM 0 HD21 ASN A 102 22.142 -19.351 -39.210 1.00 0.00 H new ATOM 0 HD22 ASN A 102 21.827 -17.826 -38.376 1.00 0.00 H new ATOM 1597 N LEU A 103 18.831 -18.445 -42.821 1.00 0.00 N ATOM 1598 CA LEU A 103 17.380 -18.193 -42.999 1.00 0.00 C ATOM 1599 C LEU A 103 16.777 -17.579 -41.742 1.00 0.00 C ATOM 1600 O LEU A 103 15.983 -16.661 -41.813 1.00 0.00 O ATOM 1601 CB LEU A 103 16.687 -19.539 -43.271 1.00 0.00 C ATOM 1602 CG LEU A 103 17.524 -20.346 -44.266 1.00 0.00 C ATOM 1603 CD1 LEU A 103 16.932 -21.750 -44.399 1.00 0.00 C ATOM 1604 CD2 LEU A 103 17.491 -19.654 -45.629 1.00 0.00 C ATOM 0 H LEU A 103 19.086 -19.410 -42.612 1.00 0.00 H new ATOM 0 HA LEU A 103 17.238 -17.500 -43.828 1.00 0.00 H new ATOM 0 HB2 LEU A 103 16.570 -20.095 -42.341 1.00 0.00 H new ATOM 0 HB3 LEU A 103 15.687 -19.372 -43.671 1.00 0.00 H new ATOM 0 HG LEU A 103 18.553 -20.413 -43.913 1.00 0.00 H new ATOM 0 HD11 LEU A 103 17.525 -22.329 -45.107 1.00 0.00 H new ATOM 0 HD12 LEU A 103 16.944 -22.243 -43.427 1.00 0.00 H new ATOM 0 HD13 LEU A 103 15.905 -21.679 -44.758 1.00 0.00 H new ATOM 0 HD21 LEU A 103 18.086 -20.225 -46.342 1.00 0.00 H new ATOM 0 HD22 LEU A 103 16.461 -19.594 -45.982 1.00 0.00 H new ATOM 0 HD23 LEU A 103 17.902 -18.649 -45.537 1.00 0.00 H new ATOM 1616 N CYS A 104 17.167 -18.096 -40.610 1.00 0.00 N ATOM 1617 CA CYS A 104 16.630 -17.559 -39.335 1.00 0.00 C ATOM 1618 C CYS A 104 16.869 -16.057 -39.223 1.00 0.00 C ATOM 1619 O CYS A 104 15.937 -15.283 -39.133 1.00 0.00 O ATOM 1620 CB CYS A 104 17.353 -18.262 -38.175 1.00 0.00 C ATOM 1621 SG CYS A 104 19.150 -18.058 -38.071 1.00 0.00 S ATOM 0 H CYS A 104 17.832 -18.864 -40.516 1.00 0.00 H new ATOM 0 HA CYS A 104 15.555 -17.739 -39.301 1.00 0.00 H new ATOM 0 HB2 CYS A 104 16.918 -17.906 -37.241 1.00 0.00 H new ATOM 0 HB3 CYS A 104 17.138 -19.329 -38.240 1.00 0.00 H new ATOM 0 HG CYS A 104 19.602 -18.710 -37.041 1.00 0.00 H new ATOM 1627 N GLU A 105 18.115 -15.670 -39.230 1.00 0.00 N ATOM 1628 CA GLU A 105 18.427 -14.222 -39.124 1.00 0.00 C ATOM 1629 C GLU A 105 17.659 -13.414 -40.163 1.00 0.00 C ATOM 1630 O GLU A 105 17.206 -12.321 -39.890 1.00 0.00 O ATOM 1631 CB GLU A 105 19.927 -14.027 -39.362 1.00 0.00 C ATOM 1632 CG GLU A 105 20.707 -14.662 -38.210 1.00 0.00 C ATOM 1633 CD GLU A 105 20.718 -13.700 -37.020 1.00 0.00 C ATOM 1634 OE1 GLU A 105 19.869 -12.825 -37.023 1.00 0.00 O ATOM 1635 OE2 GLU A 105 21.574 -13.897 -36.173 1.00 0.00 O ATOM 0 H GLU A 105 18.922 -16.289 -39.304 1.00 0.00 H new ATOM 0 HA GLU A 105 18.137 -13.875 -38.132 1.00 0.00 H new ATOM 0 HB2 GLU A 105 20.219 -14.482 -40.309 1.00 0.00 H new ATOM 0 HB3 GLU A 105 20.161 -12.965 -39.433 1.00 0.00 H new ATOM 0 HG2 GLU A 105 20.249 -15.609 -37.923 1.00 0.00 H new ATOM 0 HG3 GLU A 105 21.727 -14.883 -38.524 1.00 0.00 H new ATOM 1642 N LYS A 106 17.532 -13.957 -41.340 1.00 0.00 N ATOM 1643 CA LYS A 106 16.795 -13.220 -42.395 1.00 0.00 C ATOM 1644 C LYS A 106 15.358 -12.968 -41.948 1.00 0.00 C ATOM 1645 O LYS A 106 14.934 -11.836 -41.826 1.00 0.00 O ATOM 1646 CB LYS A 106 16.782 -14.093 -43.680 1.00 0.00 C ATOM 1647 CG LYS A 106 17.494 -13.370 -44.852 1.00 0.00 C ATOM 1648 CD LYS A 106 18.755 -14.153 -45.244 1.00 0.00 C ATOM 1649 CE LYS A 106 19.869 -13.850 -44.239 1.00 0.00 C ATOM 1650 NZ LYS A 106 21.015 -14.784 -44.433 1.00 0.00 N ATOM 0 H LYS A 106 17.902 -14.867 -41.613 1.00 0.00 H new ATOM 0 HA LYS A 106 17.280 -12.263 -42.585 1.00 0.00 H new ATOM 0 HB2 LYS A 106 17.275 -15.045 -43.482 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.753 -14.319 -43.959 1.00 0.00 H new ATOM 0 HG2 LYS A 106 16.822 -13.290 -45.706 1.00 0.00 H new ATOM 0 HG3 LYS A 106 17.760 -12.354 -44.559 1.00 0.00 H new ATOM 0 HD2 LYS A 106 18.544 -15.222 -45.259 1.00 0.00 H new ATOM 0 HD3 LYS A 106 19.071 -13.876 -46.250 1.00 0.00 H new ATOM 0 HE2 LYS A 106 20.206 -12.821 -44.360 1.00 0.00 H new ATOM 0 HE3 LYS A 106 19.485 -13.942 -43.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 21.813 -14.482 -43.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 20.728 -15.747 -44.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 21.304 -14.776 -45.432 1.00 0.00 H new ATOM 1664 N ALA A 107 14.633 -14.028 -41.716 1.00 0.00 N ATOM 1665 CA ALA A 107 13.230 -13.862 -41.277 1.00 0.00 C ATOM 1666 C ALA A 107 13.160 -12.907 -40.095 1.00 0.00 C ATOM 1667 O ALA A 107 12.178 -12.211 -39.903 1.00 0.00 O ATOM 1668 CB ALA A 107 12.696 -15.233 -40.838 1.00 0.00 C ATOM 0 H ALA A 107 14.953 -14.992 -41.812 1.00 0.00 H new ATOM 0 HA ALA A 107 12.636 -13.458 -42.097 1.00 0.00 H new ATOM 0 HB1 ALA A 107 11.661 -15.132 -40.510 1.00 0.00 H new ATOM 0 HB2 ALA A 107 12.745 -15.928 -41.676 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.302 -15.613 -40.016 1.00 0.00 H new ATOM 1674 N PHE A 108 14.215 -12.886 -39.328 1.00 0.00 N ATOM 1675 CA PHE A 108 14.242 -11.991 -38.155 1.00 0.00 C ATOM 1676 C PHE A 108 14.532 -10.557 -38.584 1.00 0.00 C ATOM 1677 O PHE A 108 14.177 -9.621 -37.897 1.00 0.00 O ATOM 1678 CB PHE A 108 15.356 -12.488 -37.204 1.00 0.00 C ATOM 1679 CG PHE A 108 15.511 -11.554 -35.982 1.00 0.00 C ATOM 1680 CD1 PHE A 108 14.415 -10.907 -35.414 1.00 0.00 C ATOM 1681 CD2 PHE A 108 16.757 -11.382 -35.401 1.00 0.00 C ATOM 1682 CE1 PHE A 108 14.577 -10.114 -34.296 1.00 0.00 C ATOM 1683 CE2 PHE A 108 16.907 -10.588 -34.283 1.00 0.00 C ATOM 1684 CZ PHE A 108 15.821 -9.957 -33.732 1.00 0.00 C ATOM 0 H PHE A 108 15.053 -13.450 -39.468 1.00 0.00 H new ATOM 0 HA PHE A 108 13.274 -12.005 -37.654 1.00 0.00 H new ATOM 0 HB2 PHE A 108 15.124 -13.498 -36.865 1.00 0.00 H new ATOM 0 HB3 PHE A 108 16.301 -12.542 -37.745 1.00 0.00 H new ATOM 0 HD1 PHE A 108 13.434 -11.027 -35.851 1.00 0.00 H new ATOM 0 HD2 PHE A 108 17.619 -11.874 -35.827 1.00 0.00 H new ATOM 0 HE1 PHE A 108 13.723 -9.615 -33.862 1.00 0.00 H new ATOM 0 HE2 PHE A 108 17.884 -10.463 -33.840 1.00 0.00 H new ATOM 0 HZ PHE A 108 15.943 -9.337 -32.856 1.00 0.00 H new ATOM 1694 N TRP A 109 15.172 -10.404 -39.724 1.00 0.00 N ATOM 1695 CA TRP A 109 15.479 -9.030 -40.192 1.00 0.00 C ATOM 1696 C TRP A 109 14.203 -8.335 -40.639 1.00 0.00 C ATOM 1697 O TRP A 109 13.898 -7.250 -40.192 1.00 0.00 O ATOM 1698 CB TRP A 109 16.452 -9.086 -41.388 1.00 0.00 C ATOM 1699 CG TRP A 109 16.957 -7.658 -41.677 1.00 0.00 C ATOM 1700 CD1 TRP A 109 17.995 -7.093 -41.067 1.00 0.00 C ATOM 1701 CD2 TRP A 109 16.373 -6.807 -42.496 1.00 0.00 C ATOM 1702 NE1 TRP A 109 18.005 -5.838 -41.553 1.00 0.00 N ATOM 1703 CE2 TRP A 109 17.003 -5.576 -42.468 1.00 0.00 C ATOM 1704 CE3 TRP A 109 15.288 -7.002 -43.334 1.00 0.00 C ATOM 1705 CZ2 TRP A 109 16.546 -4.546 -43.260 1.00 0.00 C ATOM 1706 CZ3 TRP A 109 14.835 -5.967 -44.126 1.00 0.00 C ATOM 1707 CH2 TRP A 109 15.464 -4.741 -44.089 1.00 0.00 C ATOM 0 H TRP A 109 15.485 -11.160 -40.332 1.00 0.00 H new ATOM 0 HA TRP A 109 15.933 -8.478 -39.369 1.00 0.00 H new ATOM 0 HB2 TRP A 109 17.290 -9.746 -41.164 1.00 0.00 H new ATOM 0 HB3 TRP A 109 15.951 -9.495 -42.265 1.00 0.00 H new ATOM 0 HD1 TRP A 109 18.671 -7.537 -40.351 1.00 0.00 H new ATOM 0 HE1 TRP A 109 18.693 -5.140 -41.270 1.00 0.00 H new ATOM 0 HE3 TRP A 109 14.797 -7.963 -43.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 17.037 -3.584 -43.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 13.986 -6.118 -44.776 1.00 0.00 H new ATOM 0 HH2 TRP A 109 15.108 -3.933 -44.711 1.00 0.00 H new ATOM 1718 N LEU A 110 13.475 -8.982 -41.514 1.00 0.00 N ATOM 1719 CA LEU A 110 12.214 -8.375 -42.005 1.00 0.00 C ATOM 1720 C LEU A 110 11.265 -8.102 -40.849 1.00 0.00 C ATOM 1721 O LEU A 110 10.757 -7.008 -40.713 1.00 0.00 O ATOM 1722 CB LEU A 110 11.543 -9.356 -42.979 1.00 0.00 C ATOM 1723 CG LEU A 110 12.540 -9.739 -44.076 1.00 0.00 C ATOM 1724 CD1 LEU A 110 12.171 -11.114 -44.637 1.00 0.00 C ATOM 1725 CD2 LEU A 110 12.475 -8.703 -45.200 1.00 0.00 C ATOM 0 H LEU A 110 13.702 -9.897 -41.904 1.00 0.00 H new ATOM 0 HA LEU A 110 12.443 -7.432 -42.502 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.211 -10.247 -42.446 1.00 0.00 H new ATOM 0 HB3 LEU A 110 10.657 -8.900 -43.420 1.00 0.00 H new ATOM 0 HG LEU A 110 13.548 -9.770 -43.661 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.879 -11.390 -45.419 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.206 -11.854 -43.838 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.165 -11.078 -45.055 1.00 0.00 H new ATOM 0 HD21 LEU A 110 13.183 -8.971 -45.984 1.00 0.00 H new ATOM 0 HD22 LEU A 110 11.467 -8.679 -45.615 1.00 0.00 H new ATOM 0 HD23 LEU A 110 12.728 -7.720 -44.804 1.00 0.00 H new ATOM 1737 N HIS A 111 11.028 -9.097 -40.036 1.00 0.00 N ATOM 1738 CA HIS A 111 10.112 -8.869 -38.899 1.00 0.00 C ATOM 1739 C HIS A 111 10.579 -7.661 -38.109 1.00 0.00 C ATOM 1740 O HIS A 111 9.855 -6.698 -37.957 1.00 0.00 O ATOM 1741 CB HIS A 111 10.121 -10.109 -37.998 1.00 0.00 C ATOM 1742 CG HIS A 111 8.986 -11.037 -38.433 1.00 0.00 C ATOM 1743 ND1 HIS A 111 7.854 -11.073 -37.909 1.00 0.00 N ATOM 1744 CD2 HIS A 111 8.948 -11.965 -39.455 1.00 0.00 C ATOM 1745 CE1 HIS A 111 7.102 -11.916 -38.483 1.00 0.00 C ATOM 1746 NE2 HIS A 111 7.714 -12.539 -39.489 1.00 0.00 N ATOM 0 H HIS A 111 11.422 -10.035 -40.112 1.00 0.00 H new ATOM 0 HA HIS A 111 9.102 -8.688 -39.266 1.00 0.00 H new ATOM 0 HB2 HIS A 111 11.079 -10.623 -38.072 1.00 0.00 H new ATOM 0 HB3 HIS A 111 9.994 -9.819 -36.955 1.00 0.00 H new ATOM 0 HD1 HIS A 111 7.570 -10.496 -37.117 1.00 0.00 H new ATOM 0 HD2 HIS A 111 9.766 -12.198 -40.121 1.00 0.00 H new ATOM 0 HE1 HIS A 111 6.080 -12.108 -38.190 1.00 0.00 H new ATOM 1754 N LYS A 112 11.786 -7.729 -37.617 1.00 0.00 N ATOM 1755 CA LYS A 112 12.308 -6.589 -36.840 1.00 0.00 C ATOM 1756 C LYS A 112 12.149 -5.302 -37.642 1.00 0.00 C ATOM 1757 O LYS A 112 12.092 -4.224 -37.088 1.00 0.00 O ATOM 1758 CB LYS A 112 13.803 -6.828 -36.574 1.00 0.00 C ATOM 1759 CG LYS A 112 14.254 -5.942 -35.414 1.00 0.00 C ATOM 1760 CD LYS A 112 15.768 -5.747 -35.496 1.00 0.00 C ATOM 1761 CE LYS A 112 16.235 -4.943 -34.282 1.00 0.00 C ATOM 1762 NZ LYS A 112 17.718 -5.009 -34.155 1.00 0.00 N ATOM 0 H LYS A 112 12.422 -8.520 -37.722 1.00 0.00 H new ATOM 0 HA LYS A 112 11.760 -6.499 -35.902 1.00 0.00 H new ATOM 0 HB2 LYS A 112 13.979 -7.877 -36.336 1.00 0.00 H new ATOM 0 HB3 LYS A 112 14.385 -6.602 -37.468 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.747 -4.978 -35.458 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.984 -6.401 -34.463 1.00 0.00 H new ATOM 0 HD2 LYS A 112 16.271 -6.714 -35.523 1.00 0.00 H new ATOM 0 HD3 LYS A 112 16.031 -5.225 -36.416 1.00 0.00 H new ATOM 0 HE2 LYS A 112 15.918 -3.905 -34.381 1.00 0.00 H new ATOM 0 HE3 LYS A 112 15.768 -5.334 -33.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 18.020 -4.458 -33.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 18.013 -6.000 -34.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 18.158 -4.615 -35.011 1.00 0.00 H new ATOM 1776 N CYS A 113 12.081 -5.447 -38.945 1.00 0.00 N ATOM 1777 CA CYS A 113 11.923 -4.252 -39.804 1.00 0.00 C ATOM 1778 C CYS A 113 10.457 -3.877 -39.903 1.00 0.00 C ATOM 1779 O CYS A 113 10.101 -2.716 -39.849 1.00 0.00 O ATOM 1780 CB CYS A 113 12.458 -4.576 -41.211 1.00 0.00 C ATOM 1781 SG CYS A 113 14.021 -3.808 -41.702 1.00 0.00 S ATOM 0 H CYS A 113 12.129 -6.338 -39.439 1.00 0.00 H new ATOM 0 HA CYS A 113 12.477 -3.419 -39.373 1.00 0.00 H new ATOM 0 HB2 CYS A 113 12.575 -5.657 -41.287 1.00 0.00 H new ATOM 0 HB3 CYS A 113 11.697 -4.286 -41.936 1.00 0.00 H new ATOM 0 HG CYS A 113 14.501 -4.426 -42.740 1.00 0.00 H new ATOM 1787 N TRP A 114 9.626 -4.873 -40.047 1.00 0.00 N ATOM 1788 CA TRP A 114 8.180 -4.599 -40.151 1.00 0.00 C ATOM 1789 C TRP A 114 7.639 -4.157 -38.796 1.00 0.00 C ATOM 1790 O TRP A 114 6.556 -3.617 -38.699 1.00 0.00 O ATOM 1791 CB TRP A 114 7.461 -5.899 -40.575 1.00 0.00 C ATOM 1792 CG TRP A 114 7.477 -6.039 -42.114 1.00 0.00 C ATOM 1793 CD1 TRP A 114 7.227 -5.044 -42.959 1.00 0.00 C ATOM 1794 CD2 TRP A 114 7.728 -7.162 -42.765 1.00 0.00 C ATOM 1795 NE1 TRP A 114 7.339 -5.620 -44.172 1.00 0.00 N ATOM 1796 CE2 TRP A 114 7.655 -6.964 -44.136 1.00 0.00 C ATOM 1797 CE3 TRP A 114 8.026 -8.428 -42.278 1.00 0.00 C ATOM 1798 CZ2 TRP A 114 7.878 -8.014 -45.005 1.00 0.00 C ATOM 1799 CZ3 TRP A 114 8.248 -9.476 -43.154 1.00 0.00 C ATOM 1800 CH2 TRP A 114 8.174 -9.267 -44.514 1.00 0.00 C ATOM 0 H TRP A 114 9.891 -5.857 -40.096 1.00 0.00 H new ATOM 0 HA TRP A 114 8.009 -3.810 -40.884 1.00 0.00 H new ATOM 0 HB2 TRP A 114 7.951 -6.760 -40.119 1.00 0.00 H new ATOM 0 HB3 TRP A 114 6.433 -5.889 -40.214 1.00 0.00 H new ATOM 0 HD1 TRP A 114 6.990 -4.016 -42.728 1.00 0.00 H new ATOM 0 HE1 TRP A 114 7.202 -5.107 -45.043 1.00 0.00 H new ATOM 0 HE3 TRP A 114 8.085 -8.595 -41.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 7.820 -7.853 -46.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 8.480 -10.459 -42.771 1.00 0.00 H new ATOM 0 HH2 TRP A 114 8.348 -10.086 -45.196 1.00 0.00 H new ATOM 1811 N LYS A 115 8.415 -4.400 -37.770 1.00 0.00 N ATOM 1812 CA LYS A 115 7.979 -4.008 -36.406 1.00 0.00 C ATOM 1813 C LYS A 115 8.440 -2.594 -36.068 1.00 0.00 C ATOM 1814 O LYS A 115 7.658 -1.768 -35.641 1.00 0.00 O ATOM 1815 CB LYS A 115 8.607 -4.979 -35.400 1.00 0.00 C ATOM 1816 CG LYS A 115 7.926 -4.794 -34.040 1.00 0.00 C ATOM 1817 CD LYS A 115 8.959 -4.962 -32.921 1.00 0.00 C ATOM 1818 CE LYS A 115 8.391 -4.384 -31.621 1.00 0.00 C ATOM 1819 NZ LYS A 115 9.157 -3.175 -31.210 1.00 0.00 N ATOM 0 H LYS A 115 9.328 -4.852 -37.823 1.00 0.00 H new ATOM 0 HA LYS A 115 6.890 -4.040 -36.362 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.489 -6.007 -35.744 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.677 -4.793 -35.314 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.470 -3.806 -33.982 1.00 0.00 H new ATOM 0 HG3 LYS A 115 7.124 -5.523 -33.921 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.202 -6.016 -32.789 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.886 -4.452 -33.185 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.341 -4.127 -31.759 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.435 -5.135 -30.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.549 -3.320 -30.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.933 -3.010 -31.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 8.525 -2.349 -31.202 1.00 0.00 H new ATOM 1833 N GLN A 116 9.703 -2.343 -36.268 1.00 0.00 N ATOM 1834 CA GLN A 116 10.235 -0.991 -35.965 1.00 0.00 C ATOM 1835 C GLN A 116 9.522 0.074 -36.788 1.00 0.00 C ATOM 1836 O GLN A 116 9.316 1.180 -36.331 1.00 0.00 O ATOM 1837 CB GLN A 116 11.728 -0.970 -36.321 1.00 0.00 C ATOM 1838 CG GLN A 116 12.539 -1.430 -35.109 1.00 0.00 C ATOM 1839 CD GLN A 116 14.026 -1.434 -35.470 1.00 0.00 C ATOM 1840 OE1 GLN A 116 14.538 -2.491 -36.037 1.00 0.00 O flip ATOM 1841 NE2 GLN A 116 14.734 -0.473 -35.239 1.00 0.00 N flip ATOM 0 H GLN A 116 10.384 -3.012 -36.626 1.00 0.00 H new ATOM 0 HA GLN A 116 10.077 -0.777 -34.908 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.921 -1.623 -37.172 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.030 0.035 -36.616 1.00 0.00 H new ATOM 0 HG2 GLN A 116 12.360 -0.766 -34.263 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.224 -2.428 -34.803 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.339 0.357 -34.796 1.00 0.00 H new ATOM 0 HE22 GLN A 116 15.723 -0.496 -35.488 1.00 0.00 H new ATOM 1850 N ALA A 117 9.157 -0.278 -37.988 1.00 0.00 N ATOM 1851 CA ALA A 117 8.457 0.702 -38.853 1.00 0.00 C ATOM 1852 C ALA A 117 7.125 1.127 -38.240 1.00 0.00 C ATOM 1853 O ALA A 117 6.923 2.285 -37.935 1.00 0.00 O ATOM 1854 CB ALA A 117 8.185 0.040 -40.211 1.00 0.00 C ATOM 0 H ALA A 117 9.313 -1.197 -38.403 1.00 0.00 H new ATOM 0 HA ALA A 117 9.085 1.586 -38.962 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.670 0.745 -40.863 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.130 -0.254 -40.668 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.562 -0.843 -40.067 1.00 0.00 H new ATOM 1860 N ASP A 118 6.240 0.178 -38.070 1.00 0.00 N ATOM 1861 CA ASP A 118 4.917 0.508 -37.481 1.00 0.00 C ATOM 1862 C ASP A 118 4.396 -0.648 -36.607 1.00 0.00 C ATOM 1863 O ASP A 118 3.804 -1.583 -37.108 1.00 0.00 O ATOM 1864 CB ASP A 118 3.927 0.724 -38.635 1.00 0.00 C ATOM 1865 CG ASP A 118 4.189 2.088 -39.274 1.00 0.00 C ATOM 1866 OD1 ASP A 118 5.300 2.260 -39.747 1.00 0.00 O ATOM 1867 OD2 ASP A 118 3.262 2.882 -39.252 1.00 0.00 O ATOM 0 H ASP A 118 6.379 -0.803 -38.313 1.00 0.00 H new ATOM 0 HA ASP A 118 5.016 1.398 -36.860 1.00 0.00 H new ATOM 0 HB2 ASP A 118 4.038 -0.066 -39.378 1.00 0.00 H new ATOM 0 HB3 ASP A 118 2.903 0.673 -38.266 1.00 0.00 H new ATOM 1872 N PRO A 119 4.633 -0.561 -35.306 1.00 0.00 N ATOM 1873 CA PRO A 119 4.186 -1.598 -34.379 1.00 0.00 C ATOM 1874 C PRO A 119 2.663 -1.665 -34.319 1.00 0.00 C ATOM 1875 O PRO A 119 2.103 -2.519 -33.663 1.00 0.00 O ATOM 1876 CB PRO A 119 4.745 -1.169 -33.004 1.00 0.00 C ATOM 1877 CG PRO A 119 5.546 0.152 -33.220 1.00 0.00 C ATOM 1878 CD PRO A 119 5.362 0.557 -34.692 1.00 0.00 C ATOM 0 HA PRO A 119 4.532 -2.585 -34.687 1.00 0.00 H new ATOM 0 HB2 PRO A 119 3.935 -1.015 -32.291 1.00 0.00 H new ATOM 0 HB3 PRO A 119 5.389 -1.946 -32.592 1.00 0.00 H new ATOM 0 HG2 PRO A 119 5.182 0.936 -32.556 1.00 0.00 H new ATOM 0 HG3 PRO A 119 6.601 0.005 -32.990 1.00 0.00 H new ATOM 0 HD2 PRO A 119 4.802 1.488 -34.778 1.00 0.00 H new ATOM 0 HD3 PRO A 119 6.323 0.717 -35.180 1.00 0.00 H new ATOM 1886 N LYS A 120 2.023 -0.758 -35.007 1.00 0.00 N ATOM 1887 CA LYS A 120 0.538 -0.751 -35.004 1.00 0.00 C ATOM 1888 C LYS A 120 0.002 -1.755 -36.015 1.00 0.00 C ATOM 1889 O LYS A 120 -0.493 -2.805 -35.659 1.00 0.00 O ATOM 1890 CB LYS A 120 0.041 0.655 -35.414 1.00 0.00 C ATOM 1891 CG LYS A 120 1.019 1.726 -34.917 1.00 0.00 C ATOM 1892 CD LYS A 120 0.930 1.823 -33.395 1.00 0.00 C ATOM 1893 CE LYS A 120 0.852 3.296 -32.988 1.00 0.00 C ATOM 1894 NZ LYS A 120 -0.553 3.784 -33.068 1.00 0.00 N ATOM 0 H LYS A 120 2.464 -0.028 -35.566 1.00 0.00 H new ATOM 0 HA LYS A 120 0.188 -1.013 -34.006 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -0.054 0.714 -36.498 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -0.950 0.835 -34.997 1.00 0.00 H new ATOM 0 HG2 LYS A 120 2.036 1.474 -35.218 1.00 0.00 H new ATOM 0 HG3 LYS A 120 0.782 2.689 -35.369 1.00 0.00 H new ATOM 0 HD2 LYS A 120 0.052 1.287 -33.035 1.00 0.00 H new ATOM 0 HD3 LYS A 120 1.800 1.352 -32.937 1.00 0.00 H new ATOM 0 HE2 LYS A 120 1.229 3.420 -31.973 1.00 0.00 H new ATOM 0 HE3 LYS A 120 1.489 3.894 -33.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -0.589 4.785 -32.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -0.900 3.684 -34.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -1.152 3.224 -32.428 1.00 0.00 H new ATOM 1908 N HIS A 121 0.116 -1.404 -37.263 1.00 0.00 N ATOM 1909 CA HIS A 121 -0.375 -2.306 -38.338 1.00 0.00 C ATOM 1910 C HIS A 121 0.237 -3.700 -38.212 1.00 0.00 C ATOM 1911 O HIS A 121 -0.352 -4.677 -38.635 1.00 0.00 O ATOM 1912 CB HIS A 121 0.040 -1.704 -39.694 1.00 0.00 C ATOM 1913 CG HIS A 121 -0.385 -2.647 -40.824 1.00 0.00 C ATOM 1914 ND1 HIS A 121 -1.421 -3.558 -40.869 1.00 0.00 N flip ATOM 1915 CD2 HIS A 121 0.177 -2.727 -41.938 1.00 0.00 C flip ATOM 1916 CE1 HIS A 121 -1.423 -4.174 -42.085 1.00 0.00 C flip ATOM 1917 NE2 HIS A 121 -0.386 -3.586 -42.681 1.00 0.00 N flip ATOM 0 H HIS A 121 0.529 -0.529 -37.586 1.00 0.00 H new ATOM 0 HA HIS A 121 -1.458 -2.398 -38.257 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.424 -0.727 -39.827 1.00 0.00 H new ATOM 0 HB3 HIS A 121 1.119 -1.550 -39.721 1.00 0.00 H new ATOM 0 HD2 HIS A 121 1.034 -2.138 -42.230 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -2.088 -4.936 -42.464 1.00 0.00 H new ATOM 0 HE2 HIS A 121 -0.080 -3.803 -43.629 1.00 0.00 H new ATOM 1925 N TYR A 122 1.408 -3.768 -37.636 1.00 0.00 N ATOM 1926 CA TYR A 122 2.070 -5.090 -37.476 1.00 0.00 C ATOM 1927 C TYR A 122 1.070 -6.153 -37.022 1.00 0.00 C ATOM 1928 O TYR A 122 0.116 -5.856 -36.331 1.00 0.00 O ATOM 1929 CB TYR A 122 3.168 -4.953 -36.411 1.00 0.00 C ATOM 1930 CG TYR A 122 4.079 -6.179 -36.465 1.00 0.00 C ATOM 1931 CD1 TYR A 122 4.782 -6.480 -37.614 1.00 0.00 C ATOM 1932 CD2 TYR A 122 4.209 -7.001 -35.367 1.00 0.00 C ATOM 1933 CE1 TYR A 122 5.601 -7.590 -37.663 1.00 0.00 C ATOM 1934 CE2 TYR A 122 5.027 -8.110 -35.415 1.00 0.00 C ATOM 1935 CZ TYR A 122 5.729 -8.413 -36.562 1.00 0.00 C ATOM 1936 OH TYR A 122 6.543 -9.522 -36.610 1.00 0.00 O ATOM 0 H TYR A 122 1.929 -2.970 -37.273 1.00 0.00 H new ATOM 0 HA TYR A 122 2.488 -5.397 -38.435 1.00 0.00 H new ATOM 0 HB2 TYR A 122 3.748 -4.047 -36.585 1.00 0.00 H new ATOM 0 HB3 TYR A 122 2.721 -4.861 -35.421 1.00 0.00 H new ATOM 0 HD1 TYR A 122 4.691 -5.842 -38.481 1.00 0.00 H new ATOM 0 HD2 TYR A 122 3.666 -6.775 -34.461 1.00 0.00 H new ATOM 0 HE1 TYR A 122 6.145 -7.816 -38.568 1.00 0.00 H new ATOM 0 HE2 TYR A 122 5.118 -8.746 -34.547 1.00 0.00 H new ATOM 0 HH TYR A 122 6.697 -9.775 -37.544 1.00 0.00 H new ATOM 1946 N PHE A 123 1.310 -7.377 -37.420 1.00 0.00 N ATOM 1947 CA PHE A 123 0.386 -8.474 -37.024 1.00 0.00 C ATOM 1948 C PHE A 123 0.804 -9.100 -35.696 1.00 0.00 C ATOM 1949 O PHE A 123 0.968 -8.414 -34.707 1.00 0.00 O ATOM 1950 CB PHE A 123 0.426 -9.557 -38.114 1.00 0.00 C ATOM 1951 CG PHE A 123 -0.155 -8.995 -39.411 1.00 0.00 C ATOM 1952 CD1 PHE A 123 -1.515 -9.063 -39.659 1.00 0.00 C ATOM 1953 CD2 PHE A 123 0.672 -8.412 -40.356 1.00 0.00 C ATOM 1954 CE1 PHE A 123 -2.037 -8.559 -40.833 1.00 0.00 C ATOM 1955 CE2 PHE A 123 0.146 -7.908 -41.528 1.00 0.00 C ATOM 1956 CZ PHE A 123 -1.207 -7.983 -41.764 1.00 0.00 C ATOM 0 H PHE A 123 2.101 -7.659 -37.998 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.617 -8.063 -36.909 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.452 -9.888 -38.276 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -0.144 -10.430 -37.796 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -2.172 -9.513 -38.929 1.00 0.00 H new ATOM 0 HD2 PHE A 123 1.735 -8.351 -40.175 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.099 -8.617 -41.020 1.00 0.00 H new ATOM 0 HE2 PHE A 123 0.797 -7.454 -42.260 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.617 -7.589 -42.682 1.00 0.00 H new ATOM 1966 N LEU A 124 0.966 -10.401 -35.700 1.00 0.00 N ATOM 1967 CA LEU A 124 1.372 -11.093 -34.449 1.00 0.00 C ATOM 1968 C LEU A 124 0.556 -10.587 -33.266 1.00 0.00 C ATOM 1969 O LEU A 124 1.038 -9.813 -32.463 1.00 0.00 O ATOM 1970 CB LEU A 124 2.860 -10.801 -34.187 1.00 0.00 C ATOM 1971 CG LEU A 124 3.727 -11.644 -35.137 1.00 0.00 C ATOM 1972 CD1 LEU A 124 3.801 -13.084 -34.621 1.00 0.00 C ATOM 1973 CD2 LEU A 124 3.104 -11.641 -36.534 1.00 0.00 C ATOM 0 H LEU A 124 0.835 -11.005 -36.511 1.00 0.00 H new ATOM 0 HA LEU A 124 1.201 -12.163 -34.563 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.065 -9.741 -34.336 1.00 0.00 H new ATOM 0 HB3 LEU A 124 3.109 -11.031 -33.151 1.00 0.00 H new ATOM 0 HG LEU A 124 4.730 -11.220 -35.182 1.00 0.00 H new ATOM 0 HD11 LEU A 124 4.416 -13.681 -35.295 1.00 0.00 H new ATOM 0 HD12 LEU A 124 4.243 -13.091 -33.625 1.00 0.00 H new ATOM 0 HD13 LEU A 124 2.797 -13.506 -34.576 1.00 0.00 H new ATOM 0 HD21 LEU A 124 3.718 -12.238 -37.208 1.00 0.00 H new ATOM 0 HD22 LEU A 124 2.101 -12.065 -36.486 1.00 0.00 H new ATOM 0 HD23 LEU A 124 3.048 -10.618 -36.905 1.00 0.00 H new ATOM 1985 N VAL A 125 -0.666 -11.034 -33.180 1.00 0.00 N ATOM 1986 CA VAL A 125 -1.527 -10.590 -32.056 1.00 0.00 C ATOM 1987 C VAL A 125 -0.950 -11.043 -30.722 1.00 0.00 C ATOM 1988 O VAL A 125 -1.072 -10.268 -29.789 1.00 0.00 O ATOM 1989 CB VAL A 125 -2.918 -11.215 -32.232 1.00 0.00 C ATOM 1990 CG1 VAL A 125 -2.806 -12.734 -32.103 1.00 0.00 C ATOM 1991 CG2 VAL A 125 -3.853 -10.685 -31.140 1.00 0.00 C ATOM 1992 OXT VAL A 125 -0.420 -12.141 -30.709 1.00 0.00 O ATOM 0 H VAL A 125 -1.101 -11.683 -33.836 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.585 -9.502 -32.060 1.00 0.00 H new ATOM 0 HB VAL A 125 -3.315 -10.956 -33.213 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -3.791 -13.183 -32.227 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -2.134 -13.116 -32.871 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -2.413 -12.988 -31.118 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -4.842 -11.127 -31.262 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.455 -10.950 -30.160 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -3.928 -9.601 -31.220 1.00 0.00 H new TER 2002 VAL A 125