USER MOD reduce.3.24.130724 H: found=0, std=0, add=814, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 811 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 100 LYS NZ :NH3+ 166:sc= 2.42 (180deg=1.02) USER MOD Set 1.2: A 103 ASN : amide:sc= 0.261 K(o=2.7,f=-5.5) USER MOD Set 2.1: A 70 ASN : amide:sc= 2.24 K(o=4.5,f=-10!) USER MOD Set 2.2: A 73 LYS NZ :NH3+ 168:sc= 2.28 (180deg=1.12) USER MOD Set 3.1: A 47 THR OG1 : rot 44:sc= 1.5 USER MOD Set 3.2: A 53 LYS NZ :NH3+ -136:sc= 3.03 (180deg=-0.492!) USER MOD Set 4.1: A 33 HIS : no HE2:sc= -3.27! C(o=-3.9!,f=-11!) USER MOD Set 4.2: A 42 GLN : amide:sc= -0.619 K(o=-3.9,f=-5.1) USER MOD Set 5.1: A 16 GLN : amide:sc= 1.03 X(o=0.77,f=0.78) USER MOD Set 5.2: A 17 CYS SG : rot 180:sc= -0.554 USER MOD Set 5.3: A 28 THR OG1 : rot 16:sc= 0.299 USER MOD Single : A 1 GLY N :NH3+ -118:sc= -0.818 (180deg=-3.46!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 155:sc= 1.35 (180deg=0.558) USER MOD Single : A 8 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0441) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -169:sc=-0.00413 (180deg=-0.118) USER MOD Single : A 14 CYS SG : rot 169:sc= -1.53 USER MOD Single : A 18 HIS : no HE2:sc= 0.434 K(o=0.43,f=-4.6!) USER MOD Single : A 19 THR OG1 : rot -33:sc= 1.16 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc=-0.00825 K(o=-0.0082,f=-1) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 173:sc= 1.26 USER MOD Single : A 48 TYR OH : rot -167:sc= 0.0218 USER MOD Single : A 49 THR OG1 : rot 133:sc= 1.13 USER MOD Single : A 52 ASN : amide:sc= -0.529 K(o=-0.53,f=-4.3!) USER MOD Single : A 54 ASN : amide:sc= 1.17 K(o=1.2,f=-0.11) USER MOD Single : A 55 LYS NZ :NH3+ -179:sc= 1.52 (180deg=1.45) USER MOD Single : A 58 THR OG1 : rot -64:sc= 1.25 USER MOD Single : A 60 LYS NZ :NH3+ -177:sc= 1.19 (180deg=1.16) USER MOD Single : A 63 THR OG1 : rot -152:sc= 1.04 USER MOD Single : A 65 MET CE :methyl -113:sc= 0 (180deg=-0.105) USER MOD Single : A 67 TYR OH : rot -130:sc= 0.979 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.775 USER MOD Single : A 78 THR OG1 : rot -72:sc=-0.00811 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= 1.27 (180deg=1.11) USER MOD Single : A 88 LYS NZ :NH3+ 151:sc= 1.32 (180deg=-0.445!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0299 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -114:sc= 0.833 (180deg=-1.44!) USER MOD Single : A 102 THR OG1 : rot 161:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.029 0.882 -0.973 1.00 10.00 N ATOM 2 CA GLY A 1 1.243 1.707 0.224 1.00 10.00 C ATOM 3 C GLY A 1 0.637 1.063 1.452 1.00 10.00 C ATOM 4 O GLY A 1 1.376 0.493 2.247 1.00 10.00 O ATOM 0 H1 GLY A 1 1.948 0.585 -1.359 1.00 10.00 H new ATOM 0 H2 GLY A 1 0.472 0.041 -0.720 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.515 1.435 -1.689 1.00 10.00 H new ATOM 0 HA2 GLY A 1 2.312 1.856 0.379 1.00 10.00 H new ATOM 0 HA3 GLY A 1 0.802 2.692 0.073 1.00 10.00 H new ATOM 10 N ASP A 2 -0.682 1.160 1.619 1.00 10.00 N ATOM 11 CA ASP A 2 -1.314 1.187 2.937 1.00 10.00 C ATOM 12 C ASP A 2 -2.537 0.267 3.046 1.00 10.00 C ATOM 13 O ASP A 2 -3.230 -0.006 2.066 1.00 10.00 O ATOM 14 CB ASP A 2 -1.729 2.635 3.251 1.00 10.00 C ATOM 15 CG ASP A 2 -0.559 3.619 3.150 1.00 10.00 C ATOM 16 OD1 ASP A 2 -0.286 4.083 2.018 1.00 10.00 O ATOM 17 OD2 ASP A 2 0.058 3.877 4.206 1.00 10.00 O ATOM 0 H ASP A 2 -1.342 1.222 0.844 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.585 0.816 3.657 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -2.516 2.941 2.562 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.150 2.679 4.256 1.00 10.00 H new ATOM 22 N VAL A 3 -2.844 -0.147 4.281 1.00 10.00 N ATOM 23 CA VAL A 3 -4.003 -0.979 4.633 1.00 10.00 C ATOM 24 C VAL A 3 -5.301 -0.322 4.156 1.00 10.00 C ATOM 25 O VAL A 3 -6.071 -0.941 3.426 1.00 10.00 O ATOM 26 CB VAL A 3 -4.025 -1.250 6.154 1.00 10.00 C ATOM 27 CG1 VAL A 3 -5.278 -2.019 6.601 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.792 -2.054 6.589 1.00 10.00 C ATOM 0 H VAL A 3 -2.274 0.096 5.091 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.917 -1.940 4.125 1.00 10.00 H new ATOM 0 HB VAL A 3 -4.027 -0.269 6.628 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -5.240 -2.181 7.678 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -6.168 -1.441 6.352 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -5.316 -2.981 6.090 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -2.833 -2.230 7.664 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -2.777 -3.010 6.065 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -1.889 -1.494 6.348 1.00 10.00 H new ATOM 38 N GLU A 4 -5.529 0.944 4.520 1.00 10.00 N ATOM 39 CA GLU A 4 -6.695 1.748 4.154 1.00 10.00 C ATOM 40 C GLU A 4 -6.954 1.802 2.658 1.00 10.00 C ATOM 41 O GLU A 4 -8.052 1.459 2.211 1.00 10.00 O ATOM 42 CB GLU A 4 -6.573 3.156 4.749 1.00 10.00 C ATOM 43 CG GLU A 4 -7.053 3.274 6.201 1.00 10.00 C ATOM 44 CD GLU A 4 -6.512 2.188 7.138 1.00 10.00 C ATOM 45 OE1 GLU A 4 -5.284 1.952 7.103 1.00 10.00 O ATOM 46 OE2 GLU A 4 -7.360 1.552 7.812 1.00 10.00 O ATOM 0 H GLU A 4 -4.872 1.459 5.106 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.565 1.250 4.581 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.531 3.470 4.697 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.146 3.849 4.132 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -6.761 4.250 6.589 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -8.142 3.239 6.215 1.00 10.00 H new ATOM 53 N LYS A 5 -5.940 2.192 1.883 1.00 10.00 N ATOM 54 CA LYS A 5 -5.990 2.159 0.426 1.00 10.00 C ATOM 55 C LYS A 5 -6.331 0.754 -0.075 1.00 10.00 C ATOM 56 O LYS A 5 -7.095 0.611 -1.025 1.00 10.00 O ATOM 57 CB LYS A 5 -4.619 2.596 -0.108 1.00 10.00 C ATOM 58 CG LYS A 5 -4.127 3.974 0.372 1.00 10.00 C ATOM 59 CD LYS A 5 -4.535 5.153 -0.523 1.00 10.00 C ATOM 60 CE LYS A 5 -6.039 5.405 -0.409 1.00 10.00 C ATOM 61 NZ LYS A 5 -6.453 6.701 -0.989 1.00 10.00 N ATOM 0 H LYS A 5 -5.057 2.541 2.254 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.768 2.833 0.068 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.881 1.847 0.179 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.659 2.603 -1.197 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -4.510 4.150 1.377 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -3.040 3.951 0.444 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.986 6.048 -0.231 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.272 4.941 -1.559 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -6.576 4.600 -0.911 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -6.328 5.374 0.641 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -7.481 6.816 -0.883 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -5.965 7.475 -0.494 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -6.205 6.725 -1.999 1.00 10.00 H new ATOM 75 N GLY A 6 -5.826 -0.277 0.608 1.00 10.00 N ATOM 76 CA GLY A 6 -5.910 -1.659 0.183 1.00 10.00 C ATOM 77 C GLY A 6 -7.327 -2.177 0.344 1.00 10.00 C ATOM 78 O GLY A 6 -7.908 -2.636 -0.634 1.00 10.00 O ATOM 0 H GLY A 6 -5.336 -0.160 1.495 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.601 -1.745 -0.859 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -5.224 -2.269 0.771 1.00 10.00 H new ATOM 82 N LYS A 7 -7.926 -2.047 1.540 1.00 10.00 N ATOM 83 CA LYS A 7 -9.294 -2.531 1.766 1.00 10.00 C ATOM 84 C LYS A 7 -10.305 -1.899 0.804 1.00 10.00 C ATOM 85 O LYS A 7 -11.087 -2.609 0.179 1.00 10.00 O ATOM 86 CB LYS A 7 -9.745 -2.435 3.240 1.00 10.00 C ATOM 87 CG LYS A 7 -9.534 -1.058 3.879 1.00 10.00 C ATOM 88 CD LYS A 7 -10.086 -0.949 5.309 1.00 10.00 C ATOM 89 CE LYS A 7 -9.319 0.206 5.951 1.00 10.00 C ATOM 90 NZ LYS A 7 -9.809 0.648 7.269 1.00 10.00 N ATOM 0 H LYS A 7 -7.489 -1.616 2.355 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.267 -3.596 1.537 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.803 -2.692 3.301 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -9.202 -3.179 3.822 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.468 -0.833 3.893 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -10.011 -0.301 3.256 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.158 -0.754 5.303 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -9.934 -1.877 5.861 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -8.275 -0.089 6.053 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -9.345 1.057 5.271 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -9.033 1.098 7.795 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -10.582 1.331 7.141 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -10.158 -0.173 7.803 1.00 10.00 H new ATOM 104 N LYS A 8 -10.247 -0.576 0.620 1.00 10.00 N ATOM 105 CA LYS A 8 -11.170 0.165 -0.250 1.00 10.00 C ATOM 106 C LYS A 8 -10.976 -0.166 -1.728 1.00 10.00 C ATOM 107 O LYS A 8 -11.960 -0.432 -2.413 1.00 10.00 O ATOM 108 CB LYS A 8 -11.056 1.671 0.018 1.00 10.00 C ATOM 109 CG LYS A 8 -11.838 2.017 1.296 1.00 10.00 C ATOM 110 CD LYS A 8 -11.567 3.435 1.806 1.00 10.00 C ATOM 111 CE LYS A 8 -10.134 3.514 2.336 1.00 10.00 C ATOM 112 NZ LYS A 8 -9.950 4.682 3.222 1.00 10.00 N ATOM 0 H LYS A 8 -9.552 0.017 1.074 1.00 10.00 H new ATOM 0 HA LYS A 8 -12.183 -0.153 -0.005 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -10.009 1.955 0.130 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -11.450 2.234 -0.828 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -12.905 1.906 1.102 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -11.579 1.302 2.077 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -11.710 4.157 1.002 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -12.274 3.692 2.595 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -9.895 2.601 2.881 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -9.438 3.577 1.499 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -8.936 4.826 3.401 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -10.345 5.529 2.766 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -10.440 4.514 4.124 1.00 10.00 H new ATOM 126 N ILE A 9 -9.733 -0.195 -2.223 1.00 10.00 N ATOM 127 CA ILE A 9 -9.473 -0.609 -3.607 1.00 10.00 C ATOM 128 C ILE A 9 -9.824 -2.093 -3.821 1.00 10.00 C ATOM 129 O ILE A 9 -10.379 -2.433 -4.867 1.00 10.00 O ATOM 130 CB ILE A 9 -8.025 -0.256 -4.019 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.772 1.275 -4.047 1.00 10.00 C ATOM 132 CG2 ILE A 9 -7.669 -0.856 -5.384 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.549 2.075 -5.103 1.00 10.00 C ATOM 0 H ILE A 9 -8.900 0.060 -1.693 1.00 10.00 H new ATOM 0 HA ILE A 9 -10.130 -0.048 -4.272 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.381 -0.692 -3.255 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -8.015 1.680 -3.064 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -6.707 1.443 -4.206 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -6.645 -0.589 -5.643 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -7.761 -1.941 -5.339 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -8.348 -0.465 -6.142 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.289 3.131 -5.024 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -8.291 1.711 -6.098 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -9.619 1.952 -4.938 1.00 10.00 H new ATOM 145 N PHE A 10 -9.602 -2.963 -2.826 1.00 10.00 N ATOM 146 CA PHE A 10 -10.035 -4.356 -2.864 1.00 10.00 C ATOM 147 C PHE A 10 -11.560 -4.462 -2.976 1.00 10.00 C ATOM 148 O PHE A 10 -12.070 -5.095 -3.900 1.00 10.00 O ATOM 149 CB PHE A 10 -9.496 -5.133 -1.653 1.00 10.00 C ATOM 150 CG PHE A 10 -9.800 -6.612 -1.723 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.087 -7.079 -1.394 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.820 -7.522 -2.166 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.407 -8.430 -1.570 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.129 -8.886 -2.288 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.430 -9.333 -2.011 1.00 10.00 C ATOM 0 H PHE A 10 -9.112 -2.712 -1.967 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.615 -4.815 -3.759 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.417 -4.991 -1.587 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.928 -4.721 -0.741 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.827 -6.395 -1.006 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.829 -7.170 -2.412 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.409 -8.778 -1.366 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.368 -9.589 -2.594 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.679 -10.376 -2.138 1.00 10.00 H new ATOM 165 N VAL A 11 -12.310 -3.815 -2.080 1.00 10.00 N ATOM 166 CA VAL A 11 -13.781 -3.871 -2.088 1.00 10.00 C ATOM 167 C VAL A 11 -14.396 -3.269 -3.370 1.00 10.00 C ATOM 168 O VAL A 11 -15.565 -3.496 -3.669 1.00 10.00 O ATOM 169 CB VAL A 11 -14.333 -3.232 -0.791 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.856 -3.036 -0.749 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.983 -4.115 0.420 1.00 10.00 C ATOM 0 H VAL A 11 -11.922 -3.240 -1.332 1.00 10.00 H new ATOM 0 HA VAL A 11 -14.085 -4.918 -2.104 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.866 -2.247 -0.764 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -16.138 -2.582 0.201 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -16.162 -2.384 -1.568 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.350 -4.002 -0.851 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.375 -3.658 1.329 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.426 -5.103 0.290 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.900 -4.210 0.500 1.00 10.00 H new ATOM 181 N GLN A 12 -13.588 -2.576 -4.176 1.00 10.00 N ATOM 182 CA GLN A 12 -13.951 -2.022 -5.476 1.00 10.00 C ATOM 183 C GLN A 12 -13.597 -3.001 -6.608 1.00 10.00 C ATOM 184 O GLN A 12 -14.468 -3.391 -7.381 1.00 10.00 O ATOM 185 CB GLN A 12 -13.238 -0.670 -5.652 1.00 10.00 C ATOM 186 CG GLN A 12 -13.631 0.059 -6.946 1.00 10.00 C ATOM 187 CD GLN A 12 -12.884 1.381 -7.114 1.00 10.00 C ATOM 188 OE1 GLN A 12 -13.471 2.436 -7.276 1.00 10.00 O ATOM 189 NE2 GLN A 12 -11.563 1.377 -7.100 1.00 10.00 N ATOM 0 H GLN A 12 -12.619 -2.379 -3.926 1.00 10.00 H new ATOM 0 HA GLN A 12 -15.029 -1.865 -5.522 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -13.468 -0.032 -4.799 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -12.160 -0.832 -5.647 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -13.423 -0.585 -7.801 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -14.704 0.248 -6.943 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -11.057 0.502 -6.965 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -11.049 2.249 -7.224 1.00 10.00 H new ATOM 198 N LYS A 13 -12.311 -3.368 -6.736 1.00 10.00 N ATOM 199 CA LYS A 13 -11.765 -4.102 -7.888 1.00 10.00 C ATOM 200 C LYS A 13 -11.680 -5.622 -7.699 1.00 10.00 C ATOM 201 O LYS A 13 -11.468 -6.340 -8.672 1.00 10.00 O ATOM 202 CB LYS A 13 -10.379 -3.526 -8.229 1.00 10.00 C ATOM 203 CG LYS A 13 -10.502 -2.160 -8.924 1.00 10.00 C ATOM 204 CD LYS A 13 -9.130 -1.617 -9.355 1.00 10.00 C ATOM 205 CE LYS A 13 -9.251 -0.366 -10.239 1.00 10.00 C ATOM 206 NZ LYS A 13 -9.838 -0.678 -11.565 1.00 10.00 N ATOM 0 H LYS A 13 -11.608 -3.158 -6.027 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.467 -3.961 -8.710 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -9.791 -3.422 -7.317 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -9.843 -4.220 -8.877 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -11.148 -2.253 -9.797 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -10.979 -1.450 -8.249 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -8.541 -1.378 -8.469 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -8.589 -2.392 -9.898 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -9.869 0.376 -9.734 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -8.265 0.079 -10.374 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -9.732 0.144 -12.194 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -9.346 -1.496 -11.979 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -10.848 -0.901 -11.454 1.00 10.00 H new ATOM 220 N CYS A 14 -11.853 -6.116 -6.473 1.00 10.00 N ATOM 221 CA CYS A 14 -11.557 -7.492 -6.075 1.00 10.00 C ATOM 222 C CYS A 14 -12.782 -8.183 -5.469 1.00 10.00 C ATOM 223 O CYS A 14 -13.111 -9.303 -5.865 1.00 10.00 O ATOM 224 CB CYS A 14 -10.404 -7.459 -5.075 1.00 10.00 C ATOM 225 SG CYS A 14 -8.931 -6.509 -5.567 1.00 10.00 S ATOM 0 H CYS A 14 -12.215 -5.551 -5.705 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.278 -8.070 -6.956 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.777 -7.048 -4.137 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.097 -8.485 -4.874 1.00 10.00 H new ATOM 0 HG CYS A 14 -8.139 -6.376 -4.545 1.00 10.00 H new ATOM 230 N ALA A 15 -13.525 -7.489 -4.592 1.00 10.00 N ATOM 231 CA ALA A 15 -14.860 -7.947 -4.169 1.00 10.00 C ATOM 232 C ALA A 15 -15.876 -8.019 -5.335 1.00 10.00 C ATOM 233 O ALA A 15 -16.952 -8.592 -5.193 1.00 10.00 O ATOM 234 CB ALA A 15 -15.376 -7.076 -3.024 1.00 10.00 C ATOM 0 H ALA A 15 -13.227 -6.613 -4.163 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.752 -8.971 -3.812 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.363 -7.423 -2.719 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.691 -7.143 -2.179 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.442 -6.040 -3.356 1.00 10.00 H new ATOM 240 N GLN A 16 -15.492 -7.521 -6.518 1.00 10.00 N ATOM 241 CA GLN A 16 -16.116 -7.772 -7.819 1.00 10.00 C ATOM 242 C GLN A 16 -16.162 -9.273 -8.202 1.00 10.00 C ATOM 243 O GLN A 16 -16.942 -9.644 -9.080 1.00 10.00 O ATOM 244 CB GLN A 16 -15.352 -6.918 -8.850 1.00 10.00 C ATOM 245 CG GLN A 16 -16.079 -6.692 -10.187 1.00 10.00 C ATOM 246 CD GLN A 16 -15.505 -7.516 -11.337 1.00 10.00 C ATOM 247 OE1 GLN A 16 -14.724 -7.035 -12.144 1.00 10.00 O ATOM 248 NE2 GLN A 16 -15.871 -8.774 -11.454 1.00 10.00 N ATOM 0 H GLN A 16 -14.690 -6.896 -6.594 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.167 -7.486 -7.786 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -15.137 -5.947 -8.404 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -14.393 -7.395 -9.053 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -17.134 -6.938 -10.065 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -16.027 -5.635 -10.446 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -16.523 -9.180 -10.783 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -15.503 -9.343 -12.216 1.00 10.00 H new ATOM 257 N CYS A 17 -15.374 -10.133 -7.537 1.00 10.00 N ATOM 258 CA CYS A 17 -15.301 -11.584 -7.749 1.00 10.00 C ATOM 259 C CYS A 17 -15.095 -12.401 -6.452 1.00 10.00 C ATOM 260 O CYS A 17 -15.516 -13.562 -6.403 1.00 10.00 O ATOM 261 CB CYS A 17 -14.131 -11.858 -8.695 1.00 10.00 C ATOM 262 SG CYS A 17 -14.436 -11.531 -10.458 1.00 10.00 S ATOM 0 H CYS A 17 -14.741 -9.818 -6.802 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.259 -11.901 -8.161 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.282 -11.253 -8.375 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.838 -12.902 -8.585 1.00 10.00 H new ATOM 0 HG CYS A 17 -13.364 -11.803 -11.142 1.00 10.00 H new ATOM 267 N HIS A 18 -14.463 -11.798 -5.434 1.00 10.00 N ATOM 268 CA HIS A 18 -14.115 -12.338 -4.118 1.00 10.00 C ATOM 269 C HIS A 18 -15.016 -11.733 -3.002 1.00 10.00 C ATOM 270 O HIS A 18 -16.069 -11.155 -3.280 1.00 10.00 O ATOM 271 CB HIS A 18 -12.626 -11.997 -3.899 1.00 10.00 C ATOM 272 CG HIS A 18 -11.660 -12.616 -4.872 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.134 -13.860 -4.706 1.00 10.00 N ATOM 274 CD2 HIS A 18 -11.000 -12.029 -5.919 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.160 -14.022 -5.610 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.042 -12.942 -6.391 1.00 10.00 N ATOM 0 H HIS A 18 -14.155 -10.830 -5.523 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.278 -13.415 -4.074 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.511 -10.914 -3.942 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.346 -12.307 -2.892 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.430 -14.548 -4.014 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.183 -11.040 -6.312 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.549 -14.908 -5.697 1.00 10.00 H new ATOM 284 N THR A 19 -14.619 -11.813 -1.717 1.00 10.00 N ATOM 285 CA THR A 19 -15.047 -10.814 -0.708 1.00 10.00 C ATOM 286 C THR A 19 -14.040 -10.617 0.433 1.00 10.00 C ATOM 287 O THR A 19 -13.538 -9.508 0.579 1.00 10.00 O ATOM 288 CB THR A 19 -16.447 -11.072 -0.114 1.00 10.00 C ATOM 289 OG1 THR A 19 -17.364 -11.585 -1.053 1.00 10.00 O ATOM 290 CG2 THR A 19 -17.032 -9.758 0.415 1.00 10.00 C ATOM 0 H THR A 19 -14.011 -12.547 -1.353 1.00 10.00 H new ATOM 0 HA THR A 19 -15.095 -9.892 -1.288 1.00 10.00 H new ATOM 0 HB THR A 19 -16.307 -11.810 0.675 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.168 -11.213 -1.938 1.00 10.00 H new ATOM 0 HG21 THR A 19 -18.021 -9.943 0.834 1.00 10.00 H new ATOM 0 HG22 THR A 19 -16.379 -9.355 1.189 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.112 -9.041 -0.402 1.00 10.00 H new ATOM 298 N VAL A 20 -13.749 -11.663 1.225 1.00 10.00 N ATOM 299 CA VAL A 20 -12.896 -11.739 2.439 1.00 10.00 C ATOM 300 C VAL A 20 -13.158 -10.725 3.563 1.00 10.00 C ATOM 301 O VAL A 20 -13.281 -11.140 4.717 1.00 10.00 O ATOM 302 CB VAL A 20 -11.391 -11.873 2.118 1.00 10.00 C ATOM 303 CG1 VAL A 20 -10.691 -10.590 1.657 1.00 10.00 C ATOM 304 CG2 VAL A 20 -10.629 -12.407 3.339 1.00 10.00 C ATOM 0 H VAL A 20 -14.145 -12.579 1.013 1.00 10.00 H new ATOM 0 HA VAL A 20 -13.240 -12.675 2.879 1.00 10.00 H new ATOM 0 HB VAL A 20 -11.366 -12.564 1.275 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -9.640 -10.800 1.460 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -11.165 -10.224 0.746 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -10.770 -9.832 2.437 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -9.570 -12.496 3.097 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -10.754 -11.719 4.175 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -11.022 -13.386 3.613 1.00 10.00 H new ATOM 314 N GLU A 21 -13.267 -9.423 3.280 1.00 10.00 N ATOM 315 CA GLU A 21 -13.748 -8.442 4.253 1.00 10.00 C ATOM 316 C GLU A 21 -15.133 -8.893 4.737 1.00 10.00 C ATOM 317 O GLU A 21 -15.990 -9.232 3.917 1.00 10.00 O ATOM 318 CB GLU A 21 -13.777 -7.027 3.648 1.00 10.00 C ATOM 319 CG GLU A 21 -14.037 -5.981 4.742 1.00 10.00 C ATOM 320 CD GLU A 21 -14.175 -4.565 4.173 1.00 10.00 C ATOM 321 OE1 GLU A 21 -15.322 -4.201 3.829 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.141 -3.857 4.114 1.00 10.00 O ATOM 0 H GLU A 21 -13.025 -9.023 2.374 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.069 -8.390 5.104 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.829 -6.817 3.153 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -14.554 -6.966 2.886 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -14.946 -6.243 5.283 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -13.220 -6.002 5.463 1.00 10.00 H new ATOM 329 N LYS A 22 -15.325 -8.971 6.067 1.00 10.00 N ATOM 330 CA LYS A 22 -16.488 -9.593 6.732 1.00 10.00 C ATOM 331 C LYS A 22 -16.878 -10.973 6.149 1.00 10.00 C ATOM 332 O LYS A 22 -18.045 -11.366 6.178 1.00 10.00 O ATOM 333 CB LYS A 22 -17.648 -8.575 6.879 1.00 10.00 C ATOM 334 CG LYS A 22 -18.123 -7.925 5.569 1.00 10.00 C ATOM 335 CD LYS A 22 -19.216 -6.873 5.772 1.00 10.00 C ATOM 336 CE LYS A 22 -19.417 -6.150 4.434 1.00 10.00 C ATOM 337 NZ LYS A 22 -20.333 -4.996 4.562 1.00 10.00 N ATOM 0 H LYS A 22 -14.652 -8.590 6.732 1.00 10.00 H new ATOM 0 HA LYS A 22 -16.192 -9.852 7.749 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.495 -9.080 7.343 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -17.333 -7.787 7.563 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.271 -7.461 5.073 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -18.496 -8.702 4.902 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -20.144 -7.343 6.097 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -18.928 -6.166 6.550 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -18.453 -5.808 4.058 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -19.816 -6.850 3.700 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -20.442 -4.535 3.636 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -21.261 -5.325 4.896 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -19.941 -4.315 5.244 1.00 10.00 H new ATOM 351 N GLY A 23 -15.893 -11.725 5.638 1.00 10.00 N ATOM 352 CA GLY A 23 -16.023 -13.056 5.041 1.00 10.00 C ATOM 353 C GLY A 23 -16.661 -13.015 3.653 1.00 10.00 C ATOM 354 O GLY A 23 -16.009 -13.319 2.652 1.00 10.00 O ATOM 0 H GLY A 23 -14.927 -11.398 5.631 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -15.038 -13.517 4.971 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -16.624 -13.687 5.695 1.00 10.00 H new ATOM 426 N THR A 28 -16.696 -15.808 -8.078 1.00 10.00 N ATOM 427 CA THR A 28 -15.836 -16.005 -9.258 1.00 10.00 C ATOM 428 C THR A 28 -14.370 -16.209 -8.870 1.00 10.00 C ATOM 429 O THR A 28 -13.677 -16.962 -9.545 1.00 10.00 O ATOM 430 CB THR A 28 -15.912 -14.796 -10.213 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.196 -14.216 -10.283 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.514 -15.159 -11.644 1.00 10.00 C ATOM 0 HA THR A 28 -16.207 -16.901 -9.755 1.00 10.00 H new ATOM 0 HB THR A 28 -15.209 -14.082 -9.784 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.737 -14.527 -9.527 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.584 -14.274 -12.277 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.490 -15.532 -11.653 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.184 -15.930 -12.023 1.00 10.00 H new ATOM 440 N GLY A 29 -13.919 -15.623 -7.756 1.00 10.00 N ATOM 441 CA GLY A 29 -12.750 -16.070 -7.004 1.00 10.00 C ATOM 442 C GLY A 29 -13.182 -16.481 -5.586 1.00 10.00 C ATOM 443 O GLY A 29 -14.299 -16.157 -5.174 1.00 10.00 O ATOM 0 H GLY A 29 -14.370 -14.805 -7.345 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.278 -16.912 -7.511 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.009 -15.272 -6.954 1.00 10.00 H new ATOM 447 N PRO A 30 -12.346 -17.210 -4.826 1.00 10.00 N ATOM 448 CA PRO A 30 -12.690 -17.665 -3.480 1.00 10.00 C ATOM 449 C PRO A 30 -12.731 -16.495 -2.486 1.00 10.00 C ATOM 450 O PRO A 30 -12.208 -15.413 -2.749 1.00 10.00 O ATOM 451 CB PRO A 30 -11.618 -18.699 -3.120 1.00 10.00 C ATOM 452 CG PRO A 30 -10.404 -18.185 -3.886 1.00 10.00 C ATOM 453 CD PRO A 30 -11.018 -17.675 -5.189 1.00 10.00 C ATOM 0 HA PRO A 30 -13.687 -18.102 -3.438 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.435 -18.739 -2.046 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.901 -19.704 -3.432 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.889 -17.392 -3.344 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.674 -18.975 -4.064 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.422 -16.869 -5.617 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.068 -18.466 -5.937 1.00 10.00 H new ATOM 461 N ASN A 31 -13.280 -16.720 -1.292 1.00 10.00 N ATOM 462 CA ASN A 31 -12.955 -15.859 -0.159 1.00 10.00 C ATOM 463 C ASN A 31 -11.458 -16.057 0.143 1.00 10.00 C ATOM 464 O ASN A 31 -10.978 -17.188 0.113 1.00 10.00 O ATOM 465 CB ASN A 31 -13.875 -16.175 1.037 1.00 10.00 C ATOM 466 CG ASN A 31 -13.414 -17.359 1.878 1.00 10.00 C ATOM 467 OD1 ASN A 31 -12.760 -17.187 2.893 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.717 -18.585 1.492 1.00 10.00 N ATOM 0 H ASN A 31 -13.937 -17.473 -1.088 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.129 -14.806 -0.382 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -13.941 -15.293 1.675 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.880 -16.376 0.666 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.404 -19.385 2.042 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.264 -18.732 0.644 1.00 10.00 H new ATOM 475 N LEU A 32 -10.700 -14.991 0.409 1.00 10.00 N ATOM 476 CA LEU A 32 -9.262 -15.085 0.680 1.00 10.00 C ATOM 477 C LEU A 32 -9.048 -15.545 2.132 1.00 10.00 C ATOM 478 O LEU A 32 -8.525 -14.811 2.962 1.00 10.00 O ATOM 479 CB LEU A 32 -8.536 -13.765 0.333 1.00 10.00 C ATOM 480 CG LEU A 32 -8.521 -13.326 -1.143 1.00 10.00 C ATOM 481 CD1 LEU A 32 -8.075 -14.426 -2.101 1.00 10.00 C ATOM 482 CD2 LEU A 32 -9.871 -12.814 -1.631 1.00 10.00 C ATOM 0 H LEU A 32 -11.064 -14.039 0.443 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.811 -15.836 0.031 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -8.994 -12.966 0.916 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.502 -13.852 0.668 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.792 -12.516 -1.155 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.089 -14.046 -3.123 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -7.064 -14.743 -1.845 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -8.753 -15.275 -2.021 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -9.792 -12.521 -2.678 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -10.617 -13.602 -1.530 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -10.170 -11.952 -1.035 1.00 10.00 H new ATOM 494 N HIS A 33 -9.441 -16.793 2.409 1.00 10.00 N ATOM 495 CA HIS A 33 -9.582 -17.453 3.707 1.00 10.00 C ATOM 496 C HIS A 33 -8.299 -17.330 4.547 1.00 10.00 C ATOM 497 O HIS A 33 -7.369 -18.124 4.392 1.00 10.00 O ATOM 498 CB HIS A 33 -10.023 -18.937 3.519 1.00 10.00 C ATOM 499 CG HIS A 33 -9.981 -19.565 2.128 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.115 -19.286 1.090 1.00 10.00 N ATOM 501 CD2 HIS A 33 -10.828 -20.538 1.669 1.00 10.00 C ATOM 502 CE1 HIS A 33 -9.478 -20.014 0.022 1.00 10.00 C ATOM 503 NE2 HIS A 33 -10.521 -20.795 0.330 1.00 10.00 N ATOM 0 H HIS A 33 -9.693 -17.428 1.652 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.367 -16.944 4.266 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.399 -19.548 4.172 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.046 -19.022 3.885 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -8.330 -18.635 1.128 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.602 -21.024 2.244 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -8.998 -19.975 -0.945 1.00 10.00 H new ATOM 511 N GLY A 34 -8.203 -16.280 5.375 1.00 10.00 N ATOM 512 CA GLY A 34 -6.966 -15.808 6.004 1.00 10.00 C ATOM 513 C GLY A 34 -5.965 -15.279 4.971 1.00 10.00 C ATOM 514 O GLY A 34 -5.728 -14.077 4.885 1.00 10.00 O ATOM 0 H GLY A 34 -9.014 -15.718 5.633 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -7.200 -15.020 6.719 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.511 -16.623 6.566 1.00 10.00 H new ATOM 518 N LEU A 35 -5.401 -16.203 4.180 1.00 10.00 N ATOM 519 CA LEU A 35 -4.259 -16.019 3.280 1.00 10.00 C ATOM 520 C LEU A 35 -2.973 -15.713 4.093 1.00 10.00 C ATOM 521 O LEU A 35 -3.000 -15.740 5.322 1.00 10.00 O ATOM 522 CB LEU A 35 -4.616 -14.958 2.209 1.00 10.00 C ATOM 523 CG LEU A 35 -4.165 -15.290 0.785 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.126 -16.179 0.009 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.944 -14.013 -0.021 1.00 10.00 C ATOM 0 H LEU A 35 -5.755 -17.159 4.152 1.00 10.00 H new ATOM 0 HA LEU A 35 -4.039 -16.938 2.737 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -5.697 -14.817 2.207 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.171 -14.007 2.501 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.237 -15.848 0.913 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.727 -16.363 -0.989 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.247 -17.128 0.532 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.094 -15.684 -0.073 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -3.624 -14.271 -1.030 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -4.874 -13.447 -0.069 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.176 -13.408 0.460 1.00 10.00 H new ATOM 537 N PHE A 36 -1.844 -15.442 3.421 1.00 10.00 N ATOM 538 CA PHE A 36 -0.541 -15.116 4.032 1.00 10.00 C ATOM 539 C PHE A 36 -0.033 -16.187 5.024 1.00 10.00 C ATOM 540 O PHE A 36 -0.184 -16.086 6.238 1.00 10.00 O ATOM 541 CB PHE A 36 -0.551 -13.698 4.627 1.00 10.00 C ATOM 542 CG PHE A 36 -0.464 -12.556 3.625 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.480 -12.357 2.674 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.640 -11.685 3.635 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.365 -11.355 1.698 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.745 -10.662 2.676 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.252 -10.505 1.700 1.00 10.00 C ATOM 0 H PHE A 36 -1.809 -15.443 2.402 1.00 10.00 H new ATOM 0 HA PHE A 36 0.194 -15.127 3.227 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.464 -13.576 5.209 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.284 -13.611 5.322 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.360 -12.983 2.695 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.411 -11.802 4.383 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.133 -11.240 0.947 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.595 -9.995 2.690 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.161 -9.731 0.953 1.00 10.00 H new ATOM 557 N GLY A 37 0.602 -17.217 4.460 1.00 10.00 N ATOM 558 CA GLY A 37 1.152 -18.411 5.117 1.00 10.00 C ATOM 559 C GLY A 37 0.442 -19.715 4.720 1.00 10.00 C ATOM 560 O GLY A 37 0.865 -20.795 5.123 1.00 10.00 O ATOM 0 H GLY A 37 0.759 -17.242 3.452 1.00 10.00 H new ATOM 0 HA2 GLY A 37 2.211 -18.495 4.872 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.084 -18.285 6.197 1.00 10.00 H new ATOM 564 N ARG A 38 -0.658 -19.608 3.961 1.00 10.00 N ATOM 565 CA ARG A 38 -1.594 -20.683 3.599 1.00 10.00 C ATOM 566 C ARG A 38 -1.189 -21.476 2.331 1.00 10.00 C ATOM 567 O ARG A 38 -0.016 -21.790 2.129 1.00 10.00 O ATOM 568 CB ARG A 38 -3.002 -20.056 3.560 1.00 10.00 C ATOM 569 CG ARG A 38 -4.098 -21.043 3.993 1.00 10.00 C ATOM 570 CD ARG A 38 -5.465 -20.433 3.692 1.00 10.00 C ATOM 571 NE ARG A 38 -5.798 -20.565 2.261 1.00 10.00 N ATOM 572 CZ ARG A 38 -6.107 -19.596 1.417 1.00 10.00 C ATOM 573 NH1 ARG A 38 -6.482 -18.408 1.818 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.045 -19.817 0.134 1.00 10.00 N ATOM 0 H ARG A 38 -0.935 -18.713 3.558 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.575 -21.471 4.352 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.026 -19.183 4.212 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.212 -19.705 2.550 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.983 -21.989 3.463 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -4.009 -21.261 5.057 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -6.228 -20.926 4.294 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.468 -19.380 3.974 1.00 10.00 H new ATOM 0 HE ARG A 38 -5.789 -21.511 1.880 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -6.544 -18.202 2.815 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -6.712 -17.688 1.133 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -5.760 -20.733 -0.213 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.282 -19.074 -0.524 1.00 10.00 H new ATOM 588 N LYS A 39 -2.164 -21.810 1.470 1.00 10.00 N ATOM 589 CA LYS A 39 -2.048 -22.595 0.228 1.00 10.00 C ATOM 590 C LYS A 39 -3.156 -22.221 -0.767 1.00 10.00 C ATOM 591 O LYS A 39 -4.171 -21.656 -0.359 1.00 10.00 O ATOM 592 CB LYS A 39 -2.121 -24.101 0.556 1.00 10.00 C ATOM 593 CG LYS A 39 -3.487 -24.533 1.131 1.00 10.00 C ATOM 594 CD LYS A 39 -3.589 -26.028 1.451 1.00 10.00 C ATOM 595 CE LYS A 39 -2.570 -26.450 2.518 1.00 10.00 C ATOM 596 NZ LYS A 39 -3.027 -27.648 3.257 1.00 10.00 N ATOM 0 H LYS A 39 -3.127 -21.517 1.636 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.087 -22.368 -0.234 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -1.918 -24.674 -0.349 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.338 -24.349 1.273 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -3.682 -23.964 2.040 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -4.268 -24.271 0.417 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -4.596 -26.258 1.798 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -3.425 -26.607 0.542 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -1.610 -26.657 2.045 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -2.411 -25.628 3.216 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -2.316 -27.908 3.971 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -3.931 -27.442 3.728 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -3.155 -28.438 2.593 1.00 10.00 H new ATOM 610 N THR A 40 -2.995 -22.574 -2.045 1.00 10.00 N ATOM 611 CA THR A 40 -3.981 -22.326 -3.118 1.00 10.00 C ATOM 612 C THR A 40 -5.256 -23.153 -2.908 1.00 10.00 C ATOM 613 O THR A 40 -6.353 -22.613 -2.750 1.00 10.00 O ATOM 614 CB THR A 40 -3.396 -22.599 -4.522 1.00 10.00 C ATOM 615 OG1 THR A 40 -2.890 -23.913 -4.625 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.252 -21.654 -4.876 1.00 10.00 C ATOM 0 H THR A 40 -2.158 -23.052 -2.378 1.00 10.00 H new ATOM 0 HA THR A 40 -4.238 -21.268 -3.063 1.00 10.00 H new ATOM 0 HB THR A 40 -4.228 -22.446 -5.210 1.00 10.00 H new ATOM 0 HG1 THR A 40 -2.631 -24.092 -5.553 1.00 10.00 H new ATOM 0 HG21 THR A 40 -1.879 -21.891 -5.872 1.00 10.00 H new ATOM 0 HG22 THR A 40 -2.611 -20.625 -4.858 1.00 10.00 H new ATOM 0 HG23 THR A 40 -1.447 -21.770 -4.151 1.00 10.00 H new ATOM 624 N GLY A 41 -5.107 -24.480 -2.881 1.00 10.00 N ATOM 625 CA GLY A 41 -6.179 -25.458 -2.727 1.00 10.00 C ATOM 626 C GLY A 41 -6.804 -25.475 -1.332 1.00 10.00 C ATOM 627 O GLY A 41 -6.556 -26.405 -0.571 1.00 10.00 O ATOM 0 H GLY A 41 -4.191 -24.919 -2.970 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -6.957 -25.249 -3.461 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.788 -26.450 -2.952 1.00 10.00 H new ATOM 631 N GLN A 42 -7.632 -24.468 -1.022 1.00 10.00 N ATOM 632 CA GLN A 42 -8.394 -24.394 0.235 1.00 10.00 C ATOM 633 C GLN A 42 -9.896 -24.063 0.086 1.00 10.00 C ATOM 634 O GLN A 42 -10.602 -24.006 1.090 1.00 10.00 O ATOM 635 CB GLN A 42 -7.702 -23.416 1.208 1.00 10.00 C ATOM 636 CG GLN A 42 -7.550 -24.064 2.597 1.00 10.00 C ATOM 637 CD GLN A 42 -7.665 -23.096 3.773 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.354 -22.089 3.736 1.00 10.00 O ATOM 639 NE2 GLN A 42 -6.994 -23.367 4.874 1.00 10.00 N ATOM 0 H GLN A 42 -7.794 -23.674 -1.641 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.386 -25.406 0.641 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -6.722 -23.138 0.820 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -8.285 -22.499 1.289 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.310 -24.838 2.706 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -6.581 -24.560 2.647 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -6.413 -24.204 4.924 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -7.056 -22.740 5.676 1.00 10.00 H new ATOM 648 N ALA A 43 -10.388 -23.864 -1.146 1.00 10.00 N ATOM 649 CA ALA A 43 -11.768 -23.476 -1.452 1.00 10.00 C ATOM 650 C ALA A 43 -12.825 -24.397 -0.794 1.00 10.00 C ATOM 651 O ALA A 43 -12.677 -25.618 -0.872 1.00 10.00 O ATOM 652 CB ALA A 43 -11.946 -23.458 -2.974 1.00 10.00 C ATOM 0 H ALA A 43 -9.815 -23.973 -1.983 1.00 10.00 H new ATOM 0 HA ALA A 43 -11.935 -22.484 -1.031 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -12.969 -23.171 -3.217 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.253 -22.740 -3.413 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -11.743 -24.451 -3.376 1.00 10.00 H new ATOM 658 N PRO A 44 -13.891 -23.839 -0.173 1.00 10.00 N ATOM 659 CA PRO A 44 -14.952 -24.612 0.472 1.00 10.00 C ATOM 660 C PRO A 44 -15.996 -25.091 -0.561 1.00 10.00 C ATOM 661 O PRO A 44 -15.706 -25.960 -1.378 1.00 10.00 O ATOM 662 CB PRO A 44 -15.489 -23.664 1.556 1.00 10.00 C ATOM 663 CG PRO A 44 -15.369 -22.287 0.900 1.00 10.00 C ATOM 664 CD PRO A 44 -14.090 -22.413 0.071 1.00 10.00 C ATOM 0 HA PRO A 44 -14.617 -25.546 0.924 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -16.521 -23.896 1.820 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -14.903 -23.727 2.473 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.234 -22.060 0.276 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -15.293 -21.492 1.641 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.182 -21.868 -0.869 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -13.239 -21.988 0.604 1.00 10.00 H new ATOM 672 N GLY A 45 -17.209 -24.519 -0.582 1.00 10.00 N ATOM 673 CA GLY A 45 -18.277 -24.857 -1.528 1.00 10.00 C ATOM 674 C GLY A 45 -18.071 -24.233 -2.910 1.00 10.00 C ATOM 675 O GLY A 45 -18.987 -23.609 -3.440 1.00 10.00 O ATOM 0 H GLY A 45 -17.479 -23.789 0.077 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -18.335 -25.941 -1.630 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -19.232 -24.523 -1.123 1.00 10.00 H new ATOM 679 N PHE A 46 -16.865 -24.364 -3.476 1.00 10.00 N ATOM 680 CA PHE A 46 -16.492 -23.775 -4.761 1.00 10.00 C ATOM 681 C PHE A 46 -15.405 -24.594 -5.476 1.00 10.00 C ATOM 682 O PHE A 46 -14.700 -25.428 -4.906 1.00 10.00 O ATOM 683 CB PHE A 46 -16.051 -22.315 -4.516 1.00 10.00 C ATOM 684 CG PHE A 46 -15.710 -21.442 -5.722 1.00 10.00 C ATOM 685 CD1 PHE A 46 -16.418 -21.542 -6.939 1.00 10.00 C ATOM 686 CD2 PHE A 46 -14.688 -20.481 -5.608 1.00 10.00 C ATOM 687 CE1 PHE A 46 -16.096 -20.717 -8.030 1.00 10.00 C ATOM 688 CE2 PHE A 46 -14.372 -19.650 -6.697 1.00 10.00 C ATOM 689 CZ PHE A 46 -15.071 -19.769 -7.909 1.00 10.00 C ATOM 0 H PHE A 46 -16.109 -24.893 -3.042 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.353 -23.786 -5.429 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.847 -21.817 -3.962 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -15.176 -22.338 -3.866 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -17.218 -22.262 -7.033 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -14.144 -20.382 -4.680 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -16.637 -20.813 -8.960 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -13.586 -18.915 -6.601 1.00 10.00 H new ATOM 0 HZ PHE A 46 -14.820 -19.133 -8.745 1.00 10.00 H new ATOM 699 N THR A 47 -15.255 -24.333 -6.771 1.00 10.00 N ATOM 700 CA THR A 47 -14.139 -24.761 -7.598 1.00 10.00 C ATOM 701 C THR A 47 -14.036 -23.774 -8.754 1.00 10.00 C ATOM 702 O THR A 47 -14.925 -23.685 -9.596 1.00 10.00 O ATOM 703 CB THR A 47 -14.308 -26.238 -8.001 1.00 10.00 C ATOM 704 OG1 THR A 47 -13.622 -26.976 -7.006 1.00 10.00 O ATOM 705 CG2 THR A 47 -13.743 -26.632 -9.364 1.00 10.00 C ATOM 0 H THR A 47 -15.943 -23.791 -7.294 1.00 10.00 H new ATOM 0 HA THR A 47 -13.187 -24.741 -7.067 1.00 10.00 H new ATOM 0 HB THR A 47 -15.377 -26.437 -8.081 1.00 10.00 H new ATOM 0 HG1 THR A 47 -13.839 -26.613 -6.122 1.00 10.00 H new ATOM 0 HG21 THR A 47 -13.920 -27.693 -9.538 1.00 10.00 H new ATOM 0 HG22 THR A 47 -14.234 -26.049 -10.144 1.00 10.00 H new ATOM 0 HG23 THR A 47 -12.671 -26.435 -9.384 1.00 10.00 H new ATOM 713 N TYR A 48 -12.958 -22.992 -8.733 1.00 10.00 N ATOM 714 CA TYR A 48 -12.665 -21.929 -9.688 1.00 10.00 C ATOM 715 C TYR A 48 -12.030 -22.506 -10.964 1.00 10.00 C ATOM 716 O TYR A 48 -12.420 -22.148 -12.071 1.00 10.00 O ATOM 717 CB TYR A 48 -11.770 -20.896 -8.997 1.00 10.00 C ATOM 718 CG TYR A 48 -10.767 -21.406 -7.966 1.00 10.00 C ATOM 719 CD1 TYR A 48 -9.568 -21.964 -8.421 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.954 -21.205 -6.583 1.00 10.00 C ATOM 721 CE1 TYR A 48 -8.530 -22.270 -7.529 1.00 10.00 C ATOM 722 CE2 TYR A 48 -9.914 -21.502 -5.675 1.00 10.00 C ATOM 723 CZ TYR A 48 -8.687 -22.021 -6.150 1.00 10.00 C ATOM 724 OH TYR A 48 -7.643 -22.277 -5.312 1.00 10.00 O ATOM 0 H TYR A 48 -12.236 -23.087 -8.019 1.00 10.00 H new ATOM 0 HA TYR A 48 -13.583 -21.434 -10.006 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -11.216 -20.362 -9.769 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -12.415 -20.168 -8.506 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -9.440 -22.162 -9.475 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.895 -20.823 -6.217 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -7.609 -22.697 -7.899 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.056 -21.333 -4.618 1.00 10.00 H new ATOM 0 HH TYR A 48 -7.956 -22.257 -4.384 1.00 10.00 H new ATOM 734 N THR A 49 -11.092 -23.440 -10.787 1.00 10.00 N ATOM 735 CA THR A 49 -10.342 -24.210 -11.786 1.00 10.00 C ATOM 736 C THR A 49 -9.846 -25.504 -11.108 1.00 10.00 C ATOM 737 O THR A 49 -10.402 -25.936 -10.091 1.00 10.00 O ATOM 738 CB THR A 49 -9.141 -23.403 -12.340 1.00 10.00 C ATOM 739 OG1 THR A 49 -8.218 -23.169 -11.301 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.486 -22.079 -13.024 1.00 10.00 C ATOM 0 H THR A 49 -10.809 -23.704 -9.843 1.00 10.00 H new ATOM 0 HA THR A 49 -10.991 -24.439 -12.631 1.00 10.00 H new ATOM 0 HB THR A 49 -8.720 -24.025 -13.129 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.313 -23.376 -11.615 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.571 -21.600 -13.372 1.00 10.00 H new ATOM 0 HG22 THR A 49 -10.142 -22.268 -13.873 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.991 -21.424 -12.314 1.00 10.00 H new ATOM 748 N ASP A 50 -8.742 -26.069 -11.601 1.00 10.00 N ATOM 749 CA ASP A 50 -7.856 -26.978 -10.887 1.00 10.00 C ATOM 750 C ASP A 50 -6.496 -26.984 -11.602 1.00 10.00 C ATOM 751 O ASP A 50 -6.205 -26.077 -12.385 1.00 10.00 O ATOM 752 CB ASP A 50 -8.464 -28.386 -10.725 1.00 10.00 C ATOM 753 CG ASP A 50 -8.074 -28.968 -9.362 1.00 10.00 C ATOM 754 OD1 ASP A 50 -6.850 -29.134 -9.132 1.00 10.00 O ATOM 755 OD2 ASP A 50 -8.992 -29.150 -8.531 1.00 10.00 O ATOM 0 H ASP A 50 -8.430 -25.894 -12.556 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.715 -26.626 -9.865 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -9.549 -28.335 -10.812 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -8.111 -29.038 -11.524 1.00 10.00 H new ATOM 760 N ALA A 51 -5.607 -27.894 -11.208 1.00 10.00 N ATOM 761 CA ALA A 51 -4.160 -27.842 -11.375 1.00 10.00 C ATOM 762 C ALA A 51 -3.488 -26.694 -10.603 1.00 10.00 C ATOM 763 O ALA A 51 -2.363 -26.896 -10.160 1.00 10.00 O ATOM 764 CB ALA A 51 -3.761 -27.896 -12.857 1.00 10.00 C ATOM 0 H ALA A 51 -5.902 -28.746 -10.731 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.764 -28.745 -10.909 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.675 -27.855 -12.943 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -4.125 -28.824 -13.298 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.199 -27.048 -13.383 1.00 10.00 H new ATOM 770 N ASN A 52 -4.108 -25.518 -10.392 1.00 10.00 N ATOM 771 CA ASN A 52 -3.623 -24.517 -9.431 1.00 10.00 C ATOM 772 C ASN A 52 -3.904 -24.885 -7.955 1.00 10.00 C ATOM 773 O ASN A 52 -3.013 -24.760 -7.113 1.00 10.00 O ATOM 774 CB ASN A 52 -4.148 -23.114 -9.765 1.00 10.00 C ATOM 775 CG ASN A 52 -3.443 -22.095 -8.878 1.00 10.00 C ATOM 776 OD1 ASN A 52 -2.274 -22.247 -8.561 1.00 10.00 O ATOM 777 ND2 ASN A 52 -4.122 -21.068 -8.422 1.00 10.00 N ATOM 0 H ASN A 52 -4.957 -25.238 -10.883 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.538 -24.511 -9.536 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.969 -22.886 -10.816 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -5.226 -23.068 -9.608 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -3.673 -20.395 -7.801 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -5.099 -20.943 -8.689 1.00 10.00 H new ATOM 784 N LYS A 53 -5.102 -25.395 -7.627 1.00 10.00 N ATOM 785 CA LYS A 53 -5.427 -25.934 -6.288 1.00 10.00 C ATOM 786 C LYS A 53 -4.376 -26.950 -5.824 1.00 10.00 C ATOM 787 O LYS A 53 -3.802 -26.807 -4.748 1.00 10.00 O ATOM 788 CB LYS A 53 -6.846 -26.543 -6.283 1.00 10.00 C ATOM 789 CG LYS A 53 -7.921 -25.442 -6.299 1.00 10.00 C ATOM 790 CD LYS A 53 -9.118 -25.745 -7.205 1.00 10.00 C ATOM 791 CE LYS A 53 -10.073 -26.806 -6.657 1.00 10.00 C ATOM 792 NZ LYS A 53 -10.850 -27.411 -7.761 1.00 10.00 N ATOM 0 H LYS A 53 -5.880 -25.447 -8.285 1.00 10.00 H new ATOM 0 HA LYS A 53 -5.410 -25.110 -5.575 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.971 -27.190 -7.151 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.974 -27.168 -5.399 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.280 -25.286 -5.282 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.463 -24.507 -6.622 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -9.675 -24.823 -7.371 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -8.749 -26.073 -8.177 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -9.509 -27.578 -6.133 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -10.749 -26.357 -5.930 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -11.848 -27.494 -7.479 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -10.778 -26.810 -8.606 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -10.471 -28.356 -7.975 1.00 10.00 H new ATOM 806 N ASN A 54 -4.079 -27.932 -6.675 1.00 10.00 N ATOM 807 CA ASN A 54 -3.001 -28.901 -6.508 1.00 10.00 C ATOM 808 C ASN A 54 -1.565 -28.320 -6.564 1.00 10.00 C ATOM 809 O ASN A 54 -0.636 -28.998 -6.134 1.00 10.00 O ATOM 810 CB ASN A 54 -3.235 -29.999 -7.561 1.00 10.00 C ATOM 811 CG ASN A 54 -4.303 -30.987 -7.106 1.00 10.00 C ATOM 812 OD1 ASN A 54 -4.028 -31.890 -6.334 1.00 10.00 O ATOM 813 ND2 ASN A 54 -5.546 -30.865 -7.530 1.00 10.00 N ATOM 0 H ASN A 54 -4.607 -28.078 -7.535 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.044 -29.297 -5.493 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -3.537 -29.543 -8.504 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.302 -30.530 -7.749 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -6.260 -31.520 -7.212 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -5.793 -30.115 -8.176 1.00 10.00 H new ATOM 820 N LYS A 55 -1.349 -27.092 -7.071 1.00 10.00 N ATOM 821 CA LYS A 55 -0.024 -26.442 -7.176 1.00 10.00 C ATOM 822 C LYS A 55 0.513 -25.889 -5.849 1.00 10.00 C ATOM 823 O LYS A 55 1.701 -25.597 -5.740 1.00 10.00 O ATOM 824 CB LYS A 55 -0.070 -25.338 -8.249 1.00 10.00 C ATOM 825 CG LYS A 55 1.253 -25.148 -9.000 1.00 10.00 C ATOM 826 CD LYS A 55 1.077 -24.361 -10.311 1.00 10.00 C ATOM 827 CE LYS A 55 0.723 -25.248 -11.517 1.00 10.00 C ATOM 828 NZ LYS A 55 -0.733 -25.362 -11.782 1.00 10.00 N ATOM 0 H LYS A 55 -2.106 -26.509 -7.428 1.00 10.00 H new ATOM 0 HA LYS A 55 0.679 -27.222 -7.468 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.854 -25.576 -8.968 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -0.347 -24.396 -7.776 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.960 -24.624 -8.357 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.686 -26.124 -9.221 1.00 10.00 H new ATOM 0 HD2 LYS A 55 0.293 -23.616 -10.176 1.00 10.00 H new ATOM 0 HD3 LYS A 55 1.998 -23.819 -10.527 1.00 10.00 H new ATOM 0 HE2 LYS A 55 1.212 -24.847 -12.405 1.00 10.00 H new ATOM 0 HE3 LYS A 55 1.130 -26.246 -11.352 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -0.889 -25.988 -12.597 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -1.208 -25.757 -10.946 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -1.123 -24.420 -11.989 1.00 10.00 H new ATOM 842 N GLY A 56 -0.346 -25.715 -4.842 1.00 10.00 N ATOM 843 CA GLY A 56 0.016 -25.383 -3.462 1.00 10.00 C ATOM 844 C GLY A 56 0.410 -23.923 -3.186 1.00 10.00 C ATOM 845 O GLY A 56 -0.109 -23.372 -2.219 1.00 10.00 O ATOM 0 H GLY A 56 -1.354 -25.805 -4.971 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.827 -25.636 -2.819 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.847 -26.022 -3.165 1.00 10.00 H new ATOM 849 N ILE A 57 1.239 -23.298 -4.042 1.00 10.00 N ATOM 850 CA ILE A 57 2.436 -22.421 -3.871 1.00 10.00 C ATOM 851 C ILE A 57 2.607 -21.461 -2.667 1.00 10.00 C ATOM 852 O ILE A 57 3.629 -20.782 -2.588 1.00 10.00 O ATOM 853 CB ILE A 57 2.672 -21.630 -5.191 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.479 -20.780 -5.688 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.079 -22.579 -6.329 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.986 -19.707 -4.712 1.00 10.00 C ATOM 0 H ILE A 57 1.060 -23.411 -5.040 1.00 10.00 H new ATOM 0 HA ILE A 57 3.184 -23.171 -3.614 1.00 10.00 H new ATOM 0 HB ILE A 57 3.469 -20.933 -4.932 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.764 -20.295 -6.621 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.649 -21.448 -5.917 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.239 -22.005 -7.242 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.000 -23.096 -6.060 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.287 -23.310 -6.494 1.00 10.00 H new ATOM 0 HD11 ILE A 57 0.149 -19.168 -5.156 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.663 -20.180 -3.785 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.795 -19.008 -4.500 1.00 10.00 H new ATOM 868 N THR A 58 1.696 -21.439 -1.700 1.00 10.00 N ATOM 869 CA THR A 58 1.653 -20.570 -0.518 1.00 10.00 C ATOM 870 C THR A 58 1.677 -19.066 -0.821 1.00 10.00 C ATOM 871 O THR A 58 2.692 -18.423 -1.105 1.00 10.00 O ATOM 872 CB THR A 58 2.681 -21.005 0.545 1.00 10.00 C ATOM 873 OG1 THR A 58 2.282 -22.260 1.049 1.00 10.00 O ATOM 874 CG2 THR A 58 2.763 -20.072 1.756 1.00 10.00 C ATOM 0 H THR A 58 0.902 -22.079 -1.720 1.00 10.00 H new ATOM 0 HA THR A 58 0.664 -20.717 -0.083 1.00 10.00 H new ATOM 0 HB THR A 58 3.651 -21.007 0.048 1.00 10.00 H new ATOM 0 HG1 THR A 58 1.423 -22.169 1.511 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.509 -20.449 2.456 1.00 10.00 H new ATOM 0 HG22 THR A 58 3.047 -19.072 1.427 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.792 -20.029 2.249 1.00 10.00 H new ATOM 882 N TRP A 59 0.492 -18.477 -0.684 1.00 10.00 N ATOM 883 CA TRP A 59 0.281 -17.048 -0.496 1.00 10.00 C ATOM 884 C TRP A 59 1.011 -16.546 0.757 1.00 10.00 C ATOM 885 O TRP A 59 1.026 -17.251 1.763 1.00 10.00 O ATOM 886 CB TRP A 59 -1.225 -16.851 -0.404 1.00 10.00 C ATOM 887 CG TRP A 59 -1.980 -17.409 -1.570 1.00 10.00 C ATOM 888 CD1 TRP A 59 -2.995 -18.301 -1.509 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.751 -17.160 -2.989 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.442 -18.574 -2.785 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.685 -17.932 -3.741 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.839 -16.364 -3.714 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.720 -17.909 -5.143 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.859 -16.341 -5.114 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.801 -17.100 -5.825 1.00 10.00 C ATOM 0 H TRP A 59 -0.381 -19.005 -0.702 1.00 10.00 H new ATOM 0 HA TRP A 59 0.689 -16.468 -1.323 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.588 -17.320 0.510 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.438 -15.785 -0.322 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.393 -18.732 -0.602 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.237 -19.178 -2.996 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -0.116 -15.764 -3.182 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.441 -18.503 -5.686 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -0.144 -15.735 -5.650 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.818 -17.061 -6.904 1.00 10.00 H new ATOM 906 N LYS A 60 1.609 -15.347 0.703 1.00 10.00 N ATOM 907 CA LYS A 60 2.605 -14.840 1.681 1.00 10.00 C ATOM 908 C LYS A 60 3.037 -13.390 1.428 1.00 10.00 C ATOM 909 O LYS A 60 3.120 -12.632 2.383 1.00 10.00 O ATOM 910 CB LYS A 60 3.832 -15.779 1.809 1.00 10.00 C ATOM 911 CG LYS A 60 4.874 -15.677 0.685 1.00 10.00 C ATOM 912 CD LYS A 60 5.943 -16.779 0.748 1.00 10.00 C ATOM 913 CE LYS A 60 5.519 -18.019 -0.053 1.00 10.00 C ATOM 914 NZ LYS A 60 6.659 -18.633 -0.771 1.00 10.00 N ATOM 0 H LYS A 60 1.413 -14.677 -0.041 1.00 10.00 H new ATOM 0 HA LYS A 60 2.085 -14.838 2.639 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.327 -15.571 2.757 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.475 -16.808 1.855 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.366 -15.727 -0.278 1.00 10.00 H new ATOM 0 HG3 LYS A 60 5.362 -14.704 0.738 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.886 -16.396 0.357 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.119 -17.058 1.787 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.078 -18.753 0.622 1.00 10.00 H new ATOM 0 HE3 LYS A 60 4.747 -17.741 -0.770 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 6.320 -19.436 -1.339 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 7.096 -17.927 -1.397 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.363 -18.969 -0.083 1.00 10.00 H new ATOM 928 N GLU A 61 3.287 -13.040 0.158 1.00 10.00 N ATOM 929 CA GLU A 61 3.436 -11.700 -0.446 1.00 10.00 C ATOM 930 C GLU A 61 4.110 -11.769 -1.816 1.00 10.00 C ATOM 931 O GLU A 61 3.473 -11.450 -2.811 1.00 10.00 O ATOM 932 CB GLU A 61 4.055 -10.610 0.441 1.00 10.00 C ATOM 933 CG GLU A 61 5.460 -10.834 1.014 1.00 10.00 C ATOM 934 CD GLU A 61 5.705 -9.810 2.130 1.00 10.00 C ATOM 935 OE1 GLU A 61 5.495 -8.596 1.906 1.00 10.00 O ATOM 936 OE2 GLU A 61 5.968 -10.198 3.287 1.00 10.00 O ATOM 0 H GLU A 61 3.403 -13.764 -0.551 1.00 10.00 H new ATOM 0 HA GLU A 61 2.407 -11.364 -0.571 1.00 10.00 H new ATOM 0 HB2 GLU A 61 4.078 -9.687 -0.138 1.00 10.00 H new ATOM 0 HB3 GLU A 61 3.379 -10.444 1.280 1.00 10.00 H new ATOM 0 HG2 GLU A 61 5.552 -11.848 1.404 1.00 10.00 H new ATOM 0 HG3 GLU A 61 6.210 -10.725 0.230 1.00 10.00 H new ATOM 943 N GLU A 62 5.359 -12.239 -1.888 1.00 10.00 N ATOM 944 CA GLU A 62 6.109 -12.487 -3.136 1.00 10.00 C ATOM 945 C GLU A 62 5.274 -13.238 -4.186 1.00 10.00 C ATOM 946 O GLU A 62 5.211 -12.855 -5.355 1.00 10.00 O ATOM 947 CB GLU A 62 7.410 -13.257 -2.824 1.00 10.00 C ATOM 948 CG GLU A 62 7.237 -14.347 -1.749 1.00 10.00 C ATOM 949 CD GLU A 62 8.272 -15.470 -1.865 1.00 10.00 C ATOM 950 OE1 GLU A 62 9.474 -15.181 -1.703 1.00 10.00 O ATOM 951 OE2 GLU A 62 7.832 -16.631 -2.058 1.00 10.00 O ATOM 0 H GLU A 62 5.900 -12.467 -1.054 1.00 10.00 H new ATOM 0 HA GLU A 62 6.355 -11.517 -3.567 1.00 10.00 H new ATOM 0 HB2 GLU A 62 7.779 -13.717 -3.741 1.00 10.00 H new ATOM 0 HB3 GLU A 62 8.171 -12.550 -2.494 1.00 10.00 H new ATOM 0 HG2 GLU A 62 7.312 -13.891 -0.762 1.00 10.00 H new ATOM 0 HG3 GLU A 62 6.237 -14.772 -1.828 1.00 10.00 H new ATOM 958 N THR A 63 4.574 -14.284 -3.747 1.00 10.00 N ATOM 959 CA THR A 63 3.691 -15.104 -4.568 1.00 10.00 C ATOM 960 C THR A 63 2.444 -14.350 -5.018 1.00 10.00 C ATOM 961 O THR A 63 2.011 -14.575 -6.142 1.00 10.00 O ATOM 962 CB THR A 63 3.360 -16.411 -3.823 1.00 10.00 C ATOM 963 OG1 THR A 63 2.734 -16.175 -2.579 1.00 10.00 O ATOM 964 CG2 THR A 63 4.633 -17.193 -3.484 1.00 10.00 C ATOM 0 H THR A 63 4.609 -14.592 -2.775 1.00 10.00 H new ATOM 0 HA THR A 63 4.214 -15.359 -5.489 1.00 10.00 H new ATOM 0 HB THR A 63 2.703 -16.961 -4.497 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.932 -16.915 -1.968 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.367 -18.110 -2.959 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.163 -17.442 -4.403 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.276 -16.584 -2.848 1.00 10.00 H new ATOM 972 N LEU A 64 1.916 -13.396 -4.237 1.00 10.00 N ATOM 973 CA LEU A 64 0.871 -12.478 -4.703 1.00 10.00 C ATOM 974 C LEU A 64 1.414 -11.393 -5.629 1.00 10.00 C ATOM 975 O LEU A 64 0.696 -10.977 -6.529 1.00 10.00 O ATOM 976 CB LEU A 64 0.145 -11.760 -3.548 1.00 10.00 C ATOM 977 CG LEU A 64 -0.807 -12.600 -2.684 1.00 10.00 C ATOM 978 CD1 LEU A 64 -0.065 -13.270 -1.520 1.00 10.00 C ATOM 979 CD2 LEU A 64 -1.867 -11.662 -2.092 1.00 10.00 C ATOM 0 H LEU A 64 2.201 -13.241 -3.270 1.00 10.00 H new ATOM 0 HA LEU A 64 0.174 -13.121 -5.240 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.900 -11.326 -2.893 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.425 -10.932 -3.970 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.250 -13.375 -3.309 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -0.769 -13.856 -0.929 1.00 10.00 H new ATOM 0 HD12 LEU A 64 0.713 -13.925 -1.913 1.00 10.00 H new ATOM 0 HD13 LEU A 64 0.389 -12.505 -0.890 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.556 -12.236 -1.473 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.380 -10.901 -1.482 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.419 -11.181 -2.900 1.00 10.00 H new ATOM 991 N MET A 65 2.648 -10.934 -5.420 1.00 10.00 N ATOM 992 CA MET A 65 3.330 -9.973 -6.283 1.00 10.00 C ATOM 993 C MET A 65 3.391 -10.525 -7.696 1.00 10.00 C ATOM 994 O MET A 65 2.902 -9.874 -8.616 1.00 10.00 O ATOM 995 CB MET A 65 4.737 -9.668 -5.726 1.00 10.00 C ATOM 996 CG MET A 65 4.834 -8.253 -5.167 1.00 10.00 C ATOM 997 SD MET A 65 6.339 -7.889 -4.226 1.00 10.00 S ATOM 998 CE MET A 65 5.849 -8.510 -2.595 1.00 10.00 C ATOM 0 H MET A 65 3.215 -11.229 -4.625 1.00 10.00 H new ATOM 0 HA MET A 65 2.777 -9.034 -6.307 1.00 10.00 H new ATOM 0 HB2 MET A 65 4.980 -10.385 -4.942 1.00 10.00 H new ATOM 0 HB3 MET A 65 5.476 -9.797 -6.517 1.00 10.00 H new ATOM 0 HG2 MET A 65 4.765 -7.548 -5.995 1.00 10.00 H new ATOM 0 HG3 MET A 65 3.972 -8.075 -4.524 1.00 10.00 H new ATOM 0 HE1 MET A 65 5.764 -7.676 -1.899 1.00 10.00 H new ATOM 0 HE2 MET A 65 4.887 -9.017 -2.673 1.00 10.00 H new ATOM 0 HE3 MET A 65 6.601 -9.211 -2.232 1.00 10.00 H new ATOM 1008 N GLU A 66 3.913 -11.745 -7.842 1.00 10.00 N ATOM 1009 CA GLU A 66 4.001 -12.400 -9.144 1.00 10.00 C ATOM 1010 C GLU A 66 2.607 -12.744 -9.669 1.00 10.00 C ATOM 1011 O GLU A 66 2.322 -12.552 -10.851 1.00 10.00 O ATOM 1012 CB GLU A 66 4.852 -13.682 -9.019 1.00 10.00 C ATOM 1013 CG GLU A 66 5.471 -14.149 -10.349 1.00 10.00 C ATOM 1014 CD GLU A 66 6.308 -13.106 -11.097 1.00 10.00 C ATOM 1015 OE1 GLU A 66 6.952 -12.268 -10.431 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.305 -13.167 -12.351 1.00 10.00 O ATOM 0 H GLU A 66 4.282 -12.299 -7.069 1.00 10.00 H new ATOM 0 HA GLU A 66 4.474 -11.718 -9.851 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.651 -13.508 -8.299 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.230 -14.482 -8.618 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.099 -15.017 -10.151 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.667 -14.481 -11.006 1.00 10.00 H new ATOM 1023 N TYR A 67 1.725 -13.231 -8.786 1.00 10.00 N ATOM 1024 CA TYR A 67 0.401 -13.674 -9.193 1.00 10.00 C ATOM 1025 C TYR A 67 -0.491 -12.521 -9.668 1.00 10.00 C ATOM 1026 O TYR A 67 -1.023 -12.597 -10.765 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.276 -14.424 -8.056 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.694 -14.843 -8.368 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.915 -15.880 -9.290 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.781 -14.216 -7.732 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.224 -16.320 -9.545 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.096 -14.616 -8.030 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.321 -15.680 -8.932 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.582 -16.097 -9.214 1.00 10.00 O ATOM 0 H TYR A 67 1.912 -13.325 -7.788 1.00 10.00 H new ATOM 0 HA TYR A 67 0.539 -14.342 -10.043 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.311 -15.310 -7.816 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.280 -13.793 -7.167 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.081 -16.337 -9.801 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.606 -13.428 -7.015 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.391 -17.152 -10.213 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.932 -14.111 -7.570 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.138 -15.324 -9.444 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.679 -11.452 -8.881 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.508 -10.319 -9.307 1.00 10.00 C ATOM 1046 C LEU A 68 -0.950 -9.682 -10.577 1.00 10.00 C ATOM 1047 O LEU A 68 -1.732 -9.371 -11.471 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.671 -9.267 -8.189 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.009 -9.294 -7.431 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.164 -8.807 -8.312 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.323 -10.674 -6.856 1.00 10.00 C ATOM 0 H LEU A 68 -0.270 -11.350 -7.952 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.501 -10.712 -9.527 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.865 -9.403 -7.468 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.544 -8.277 -8.627 1.00 10.00 H new ATOM 0 HG LEU A 68 -2.901 -8.606 -6.593 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.094 -8.840 -7.744 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -3.970 -7.783 -8.633 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.251 -9.451 -9.187 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.277 -10.641 -6.331 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.380 -11.401 -7.666 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -2.536 -10.966 -6.161 1.00 10.00 H new ATOM 1063 N GLU A 69 0.375 -9.496 -10.676 1.00 10.00 N ATOM 1064 CA GLU A 69 0.981 -8.896 -11.859 1.00 10.00 C ATOM 1065 C GLU A 69 0.986 -9.798 -13.102 1.00 10.00 C ATOM 1066 O GLU A 69 0.988 -9.268 -14.212 1.00 10.00 O ATOM 1067 CB GLU A 69 2.391 -8.410 -11.492 1.00 10.00 C ATOM 1068 CG GLU A 69 2.229 -7.090 -10.708 1.00 10.00 C ATOM 1069 CD GLU A 69 3.497 -6.499 -10.086 1.00 10.00 C ATOM 1070 OE1 GLU A 69 4.569 -6.455 -10.734 1.00 10.00 O ATOM 1071 OE2 GLU A 69 3.387 -5.924 -8.971 1.00 10.00 O ATOM 0 H GLU A 69 1.041 -9.755 -9.948 1.00 10.00 H new ATOM 0 HA GLU A 69 0.357 -8.054 -12.156 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.910 -9.155 -10.888 1.00 10.00 H new ATOM 0 HB3 GLU A 69 2.990 -8.254 -12.389 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.801 -6.346 -11.380 1.00 10.00 H new ATOM 0 HG3 GLU A 69 1.504 -7.255 -9.911 1.00 10.00 H new ATOM 1078 N ASN A 70 0.922 -11.127 -12.957 1.00 10.00 N ATOM 1079 CA ASN A 70 1.183 -12.107 -14.025 1.00 10.00 C ATOM 1080 C ASN A 70 0.559 -13.498 -13.677 1.00 10.00 C ATOM 1081 O ASN A 70 1.261 -14.510 -13.606 1.00 10.00 O ATOM 1082 CB ASN A 70 2.731 -12.156 -14.221 1.00 10.00 C ATOM 1083 CG ASN A 70 3.279 -11.485 -15.477 1.00 10.00 C ATOM 1084 OD1 ASN A 70 4.236 -11.965 -16.067 1.00 10.00 O ATOM 1085 ND2 ASN A 70 2.757 -10.365 -15.921 1.00 10.00 N ATOM 0 H ASN A 70 0.680 -11.566 -12.068 1.00 10.00 H new ATOM 0 HA ASN A 70 0.709 -11.816 -14.962 1.00 10.00 H new ATOM 0 HB2 ASN A 70 3.200 -11.691 -13.354 1.00 10.00 H new ATOM 0 HB3 ASN A 70 3.041 -13.201 -14.229 1.00 10.00 H new ATOM 0 HD21 ASN A 70 3.150 -9.911 -16.745 1.00 10.00 H new ATOM 0 HD22 ASN A 70 1.958 -9.949 -15.442 1.00 10.00 H new ATOM 1092 N PRO A 71 -0.781 -13.601 -13.517 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.430 -14.731 -12.832 1.00 10.00 C ATOM 1094 C PRO A 71 -1.250 -16.070 -13.544 1.00 10.00 C ATOM 1095 O PRO A 71 -0.621 -16.979 -13.003 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.906 -14.341 -12.657 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.134 -13.247 -13.697 1.00 10.00 C ATOM 1098 CD PRO A 71 -1.769 -12.569 -13.815 1.00 10.00 C ATOM 0 HA PRO A 71 -0.955 -14.902 -11.866 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.565 -15.193 -12.825 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.105 -13.978 -11.648 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.458 -13.663 -14.651 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -3.904 -12.545 -13.377 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -1.620 -12.163 -14.816 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.686 -11.736 -13.117 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.775 -16.185 -14.771 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.731 -17.392 -15.597 1.00 10.00 C ATOM 1108 C LYS A 72 -0.309 -17.841 -15.953 1.00 10.00 C ATOM 1109 O LYS A 72 -0.085 -19.023 -16.189 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.517 -17.125 -16.880 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.009 -16.835 -16.653 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.722 -16.670 -18.001 1.00 10.00 C ATOM 1113 CE LYS A 72 -4.460 -15.279 -18.582 1.00 10.00 C ATOM 1114 NZ LYS A 72 -4.996 -15.168 -19.956 1.00 10.00 N ATOM 0 H LYS A 72 -2.258 -15.412 -15.229 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.170 -18.202 -15.015 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.068 -16.278 -17.399 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.422 -17.989 -17.538 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.464 -17.649 -16.089 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.126 -15.930 -16.057 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.375 -17.433 -18.698 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.794 -16.820 -17.872 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -4.921 -14.523 -17.946 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -3.388 -15.080 -18.589 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -4.805 -14.215 -20.327 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -4.538 -15.875 -20.566 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.022 -15.335 -19.943 1.00 10.00 H new ATOM 1128 N LYS A 73 0.648 -16.900 -15.987 1.00 10.00 N ATOM 1129 CA LYS A 73 2.079 -17.190 -16.119 1.00 10.00 C ATOM 1130 C LYS A 73 2.616 -17.797 -14.825 1.00 10.00 C ATOM 1131 O LYS A 73 3.271 -18.833 -14.874 1.00 10.00 O ATOM 1132 CB LYS A 73 2.861 -15.917 -16.475 1.00 10.00 C ATOM 1133 CG LYS A 73 4.318 -16.244 -16.867 1.00 10.00 C ATOM 1134 CD LYS A 73 5.264 -15.051 -16.689 1.00 10.00 C ATOM 1135 CE LYS A 73 5.545 -14.800 -15.198 1.00 10.00 C ATOM 1136 NZ LYS A 73 6.211 -13.501 -14.977 1.00 10.00 N ATOM 0 H LYS A 73 0.443 -15.903 -15.922 1.00 10.00 H new ATOM 0 HA LYS A 73 2.211 -17.910 -16.927 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.367 -15.403 -17.300 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.855 -15.235 -15.625 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.674 -17.077 -16.261 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.345 -16.571 -17.906 1.00 10.00 H new ATOM 0 HD2 LYS A 73 6.200 -15.241 -17.214 1.00 10.00 H new ATOM 0 HD3 LYS A 73 4.823 -14.160 -17.136 1.00 10.00 H new ATOM 0 HE2 LYS A 73 4.608 -14.827 -14.642 1.00 10.00 H new ATOM 0 HE3 LYS A 73 6.172 -15.601 -14.806 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 6.202 -13.274 -13.962 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 7.195 -13.554 -15.311 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 5.707 -12.758 -15.502 1.00 10.00 H new ATOM 1150 N TYR A 74 2.360 -17.141 -13.686 1.00 10.00 N ATOM 1151 CA TYR A 74 2.858 -17.584 -12.389 1.00 10.00 C ATOM 1152 C TYR A 74 2.348 -18.975 -12.012 1.00 10.00 C ATOM 1153 O TYR A 74 3.131 -19.841 -11.624 1.00 10.00 O ATOM 1154 CB TYR A 74 2.530 -16.567 -11.295 1.00 10.00 C ATOM 1155 CG TYR A 74 3.142 -16.964 -9.964 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.510 -17.301 -9.875 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.326 -17.071 -8.828 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.046 -17.791 -8.672 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.870 -17.503 -7.606 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.217 -17.910 -7.539 1.00 10.00 C ATOM 1161 OH TYR A 74 4.702 -18.443 -6.390 1.00 10.00 O ATOM 0 H TYR A 74 1.801 -16.289 -13.644 1.00 10.00 H new ATOM 0 HA TYR A 74 3.942 -17.656 -12.477 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.900 -15.584 -11.588 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.449 -16.482 -11.188 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.149 -17.181 -10.737 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.277 -16.821 -8.892 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.087 -18.075 -8.616 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.255 -17.523 -6.718 1.00 10.00 H new ATOM 0 HH TYR A 74 5.662 -18.257 -6.323 1.00 10.00 H new ATOM 1171 N ILE A 75 1.038 -19.191 -12.162 1.00 10.00 N ATOM 1172 CA ILE A 75 0.389 -20.479 -11.956 1.00 10.00 C ATOM 1173 C ILE A 75 -0.629 -20.733 -13.082 1.00 10.00 C ATOM 1174 O ILE A 75 -1.666 -20.074 -13.126 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.216 -20.616 -10.538 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.171 -19.466 -10.127 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.909 -20.858 -9.513 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.278 -19.155 -8.628 1.00 10.00 C ATOM 0 H ILE A 75 0.388 -18.454 -12.437 1.00 10.00 H new ATOM 0 HA ILE A 75 1.144 -21.263 -12.010 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.870 -21.488 -10.556 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.850 -18.559 -10.640 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.168 -19.705 -10.496 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.479 -20.954 -8.516 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.442 -21.774 -9.768 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.603 -20.018 -9.529 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.977 -18.332 -8.476 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.636 -20.038 -8.098 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.297 -18.874 -8.244 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.355 -21.661 -14.020 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.338 -22.063 -15.022 1.00 10.00 C ATOM 1192 C PRO A 76 -2.455 -22.899 -14.379 1.00 10.00 C ATOM 1193 O PRO A 76 -2.238 -23.579 -13.364 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.548 -22.855 -16.067 1.00 10.00 C ATOM 1195 CG PRO A 76 0.593 -23.468 -15.255 1.00 10.00 C ATOM 1196 CD PRO A 76 0.886 -22.403 -14.198 1.00 10.00 C ATOM 0 HA PRO A 76 -1.839 -21.210 -15.480 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -1.162 -23.621 -16.540 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.174 -22.210 -16.863 1.00 10.00 H new ATOM 0 HG2 PRO A 76 0.300 -24.415 -14.801 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.466 -23.669 -15.876 1.00 10.00 H new ATOM 0 HD2 PRO A 76 1.205 -22.860 -13.261 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.692 -21.744 -14.521 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.641 -22.862 -15.002 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.875 -23.423 -14.451 1.00 10.00 C ATOM 1206 C GLY A 77 -5.629 -22.408 -13.589 1.00 10.00 C ATOM 1207 O GLY A 77 -6.035 -22.753 -12.482 1.00 10.00 O ATOM 0 H GLY A 77 -3.768 -22.433 -15.919 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.518 -23.756 -15.266 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.638 -24.303 -13.852 1.00 10.00 H new ATOM 1211 N THR A 78 -5.792 -21.166 -14.069 1.00 10.00 N ATOM 1212 CA THR A 78 -6.223 -20.029 -13.233 1.00 10.00 C ATOM 1213 C THR A 78 -7.237 -19.086 -13.860 1.00 10.00 C ATOM 1214 O THR A 78 -8.121 -18.609 -13.154 1.00 10.00 O ATOM 1215 CB THR A 78 -4.979 -19.256 -12.752 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.430 -19.922 -11.641 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.197 -17.798 -12.346 1.00 10.00 C ATOM 0 H THR A 78 -5.630 -20.919 -15.045 1.00 10.00 H new ATOM 0 HA THR A 78 -6.765 -20.470 -12.396 1.00 10.00 H new ATOM 0 HB THR A 78 -4.324 -19.231 -13.623 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.013 -19.796 -10.863 1.00 10.00 H new ATOM 0 HG21 THR A 78 -4.250 -17.364 -12.027 1.00 10.00 H new ATOM 0 HG22 THR A 78 -5.585 -17.238 -13.197 1.00 10.00 H new ATOM 0 HG23 THR A 78 -5.912 -17.752 -11.525 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.126 -18.776 -15.155 1.00 10.00 N ATOM 1226 CA LYS A 79 -7.917 -17.746 -15.842 1.00 10.00 C ATOM 1227 C LYS A 79 -7.751 -16.321 -15.281 1.00 10.00 C ATOM 1228 O LYS A 79 -7.250 -15.476 -16.018 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.388 -18.198 -15.960 1.00 10.00 C ATOM 1230 CG LYS A 79 -9.593 -19.260 -17.053 1.00 10.00 C ATOM 1231 CD LYS A 79 -9.553 -18.672 -18.472 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.525 -19.796 -19.510 1.00 10.00 C ATOM 1233 NZ LYS A 79 -9.494 -19.245 -20.884 1.00 10.00 N ATOM 0 H LYS A 79 -6.465 -19.247 -15.773 1.00 10.00 H new ATOM 0 HA LYS A 79 -7.508 -17.654 -16.848 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -9.719 -18.599 -15.002 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.014 -17.333 -16.177 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -8.821 -20.024 -16.960 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -10.552 -19.755 -16.897 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -10.425 -18.038 -18.635 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -8.673 -18.039 -18.587 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -8.651 -20.426 -19.347 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -10.402 -20.431 -19.388 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -9.475 -20.026 -21.571 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -10.341 -18.663 -21.044 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -8.644 -18.658 -21.004 1.00 10.00 H new ATOM 1247 N MET A 80 -8.183 -16.058 -14.036 1.00 10.00 N ATOM 1248 CA MET A 80 -8.308 -14.768 -13.325 1.00 10.00 C ATOM 1249 C MET A 80 -8.358 -13.561 -14.273 1.00 10.00 C ATOM 1250 O MET A 80 -7.355 -12.893 -14.541 1.00 10.00 O ATOM 1251 CB MET A 80 -7.272 -14.621 -12.191 1.00 10.00 C ATOM 1252 CG MET A 80 -7.439 -13.271 -11.467 1.00 10.00 C ATOM 1253 SD MET A 80 -6.759 -13.149 -9.791 1.00 10.00 S ATOM 1254 CE MET A 80 -6.351 -11.387 -9.765 1.00 10.00 C ATOM 0 H MET A 80 -8.487 -16.825 -13.436 1.00 10.00 H new ATOM 0 HA MET A 80 -9.282 -14.780 -12.836 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.388 -15.438 -11.478 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.265 -14.697 -12.601 1.00 10.00 H new ATOM 0 HG2 MET A 80 -6.974 -12.498 -12.079 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.503 -13.041 -11.419 1.00 10.00 H new ATOM 0 HE1 MET A 80 -5.917 -11.128 -8.799 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.634 -11.168 -10.556 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.257 -10.801 -9.924 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.566 -13.315 -14.796 1.00 10.00 N ATOM 1265 CA ILE A 81 -9.889 -12.296 -15.795 1.00 10.00 C ATOM 1266 C ILE A 81 -9.767 -10.891 -15.175 1.00 10.00 C ATOM 1267 O ILE A 81 -10.755 -10.224 -14.874 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.273 -12.561 -16.450 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.462 -14.020 -16.946 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.442 -11.628 -17.665 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -12.059 -14.980 -15.904 1.00 10.00 C ATOM 0 H ILE A 81 -10.387 -13.852 -14.516 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.165 -12.351 -16.608 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.017 -12.376 -15.675 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -12.108 -14.010 -17.824 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -10.495 -14.409 -17.266 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.411 -11.808 -18.130 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.384 -10.590 -17.337 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.650 -11.825 -18.388 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -12.155 -15.975 -16.339 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -11.404 -15.026 -15.034 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.042 -14.621 -15.600 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.519 -10.461 -14.976 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.140 -9.159 -14.430 1.00 10.00 C ATOM 1285 C PHE A 82 -6.666 -8.812 -14.698 1.00 10.00 C ATOM 1286 O PHE A 82 -6.388 -7.668 -15.046 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.420 -9.118 -12.918 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.760 -7.734 -12.427 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.925 -7.079 -12.871 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.907 -7.107 -11.513 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -10.215 -5.781 -12.416 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -8.185 -5.804 -11.067 1.00 10.00 C ATOM 1293 CZ PHE A 82 -9.336 -5.139 -11.526 1.00 10.00 C ATOM 0 H PHE A 82 -7.709 -11.039 -15.202 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.746 -8.411 -14.940 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.243 -9.794 -12.687 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.546 -9.485 -12.381 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.594 -7.573 -13.560 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.032 -7.626 -11.149 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -11.111 -5.278 -12.749 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -7.517 -5.315 -10.374 1.00 10.00 H new ATOM 0 HZ PHE A 82 -9.545 -4.133 -11.194 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.756 -9.797 -14.579 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.334 -9.769 -14.960 1.00 10.00 C ATOM 1305 C ALA A 83 -3.626 -8.407 -14.768 1.00 10.00 C ATOM 1306 O ALA A 83 -3.465 -7.630 -15.710 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.198 -10.325 -16.385 1.00 10.00 C ATOM 0 H ALA A 83 -6.017 -10.701 -14.184 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.796 -10.409 -14.261 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.149 -10.311 -16.682 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.569 -11.349 -16.413 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.778 -9.710 -17.073 1.00 10.00 H new ATOM 1313 N GLY A 84 -3.183 -8.136 -13.535 1.00 10.00 N ATOM 1314 CA GLY A 84 -2.695 -6.834 -13.089 1.00 10.00 C ATOM 1315 C GLY A 84 -3.744 -6.101 -12.248 1.00 10.00 C ATOM 1316 O GLY A 84 -4.685 -6.696 -11.726 1.00 10.00 O ATOM 0 H GLY A 84 -3.155 -8.842 -12.800 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.785 -6.966 -12.504 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.432 -6.227 -13.955 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.568 -4.784 -12.119 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.549 -3.863 -11.520 1.00 10.00 C ATOM 1322 C ILE A 85 -4.546 -2.512 -12.267 1.00 10.00 C ATOM 1323 O ILE A 85 -4.800 -1.454 -11.697 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.343 -3.790 -9.983 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.522 -3.088 -9.273 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.993 -3.178 -9.575 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.610 -3.440 -7.787 1.00 10.00 C ATOM 0 H ILE A 85 -2.720 -4.313 -12.434 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.564 -4.239 -11.646 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.320 -4.825 -9.642 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -5.415 -2.009 -9.381 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -6.454 -3.367 -9.764 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.916 -3.158 -8.488 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.182 -3.780 -9.985 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.922 -2.162 -9.963 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.456 -2.919 -7.339 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.746 -4.516 -7.675 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.691 -3.137 -7.286 1.00 10.00 H new ATOM 1339 N LYS A 86 -4.233 -2.550 -13.577 1.00 10.00 N ATOM 1340 CA LYS A 86 -4.073 -1.400 -14.500 1.00 10.00 C ATOM 1341 C LYS A 86 -2.827 -0.534 -14.214 1.00 10.00 C ATOM 1342 O LYS A 86 -2.553 0.420 -14.937 1.00 10.00 O ATOM 1343 CB LYS A 86 -5.381 -0.584 -14.516 1.00 10.00 C ATOM 1344 CG LYS A 86 -5.699 0.097 -15.856 1.00 10.00 C ATOM 1345 CD LYS A 86 -7.048 0.812 -15.718 1.00 10.00 C ATOM 1346 CE LYS A 86 -7.594 1.333 -17.049 1.00 10.00 C ATOM 1347 NZ LYS A 86 -8.880 2.039 -16.833 1.00 10.00 N ATOM 0 H LYS A 86 -4.074 -3.438 -14.052 1.00 10.00 H new ATOM 0 HA LYS A 86 -3.886 -1.794 -15.499 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -6.208 -1.244 -14.255 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -5.326 0.180 -13.740 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -4.916 0.809 -16.117 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -5.739 -0.640 -16.658 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -7.772 0.126 -15.280 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -6.940 1.647 -15.025 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -6.872 2.009 -17.507 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -7.738 0.503 -17.741 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -9.241 2.388 -17.743 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -9.570 1.383 -16.415 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -8.731 2.842 -16.189 1.00 10.00 H new ATOM 1361 N LYS A 87 -2.052 -0.925 -13.197 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.847 -0.348 -12.588 1.00 10.00 C ATOM 1363 C LYS A 87 -0.179 -1.467 -11.764 1.00 10.00 C ATOM 1364 O LYS A 87 -0.763 -2.540 -11.610 1.00 10.00 O ATOM 1365 CB LYS A 87 -1.257 0.775 -11.611 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.621 2.121 -12.262 1.00 10.00 C ATOM 1367 CD LYS A 87 -2.076 3.160 -11.226 1.00 10.00 C ATOM 1368 CE LYS A 87 -0.977 3.500 -10.209 1.00 10.00 C ATOM 1369 NZ LYS A 87 -1.491 4.359 -9.122 1.00 10.00 N ATOM 0 H LYS A 87 -2.295 -1.787 -12.708 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.182 0.051 -13.354 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -2.111 0.431 -11.028 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -0.438 0.940 -10.911 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -0.758 2.506 -12.805 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -2.415 1.967 -12.993 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -2.384 4.070 -11.741 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -2.951 2.781 -10.697 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -0.573 2.580 -9.787 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -0.155 4.006 -10.716 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -0.798 4.390 -8.347 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -1.648 5.321 -9.484 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -2.389 3.972 -8.769 1.00 10.00 H new ATOM 1383 N LYS A 88 1.020 -1.227 -11.212 1.00 10.00 N ATOM 1384 CA LYS A 88 1.523 -1.947 -10.025 1.00 10.00 C ATOM 1385 C LYS A 88 0.918 -1.469 -8.711 1.00 10.00 C ATOM 1386 O LYS A 88 0.481 -2.298 -7.921 1.00 10.00 O ATOM 1387 CB LYS A 88 3.061 -1.892 -9.927 1.00 10.00 C ATOM 1388 CG LYS A 88 3.744 -2.830 -10.930 1.00 10.00 C ATOM 1389 CD LYS A 88 5.281 -2.778 -10.841 1.00 10.00 C ATOM 1390 CE LYS A 88 5.893 -3.185 -9.490 1.00 10.00 C ATOM 1391 NZ LYS A 88 5.676 -4.612 -9.166 1.00 10.00 N ATOM 0 H LYS A 88 1.670 -0.529 -11.573 1.00 10.00 H new ATOM 0 HA LYS A 88 1.203 -2.978 -10.175 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.397 -0.870 -10.102 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.368 -2.160 -8.916 1.00 10.00 H new ATOM 0 HG2 LYS A 88 3.408 -3.852 -10.752 1.00 10.00 H new ATOM 0 HG3 LYS A 88 3.433 -2.563 -11.940 1.00 10.00 H new ATOM 0 HD2 LYS A 88 5.692 -3.428 -11.614 1.00 10.00 H new ATOM 0 HD3 LYS A 88 5.604 -1.763 -11.073 1.00 10.00 H new ATOM 0 HE2 LYS A 88 6.963 -2.980 -9.505 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.462 -2.569 -8.701 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 6.456 -4.955 -8.570 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 4.777 -4.719 -8.655 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 5.643 -5.166 -10.045 1.00 10.00 H new ATOM 1405 N THR A 89 0.965 -0.158 -8.460 1.00 10.00 N ATOM 1406 CA THR A 89 0.935 0.478 -7.134 1.00 10.00 C ATOM 1407 C THR A 89 -0.101 -0.134 -6.203 1.00 10.00 C ATOM 1408 O THR A 89 0.227 -0.546 -5.099 1.00 10.00 O ATOM 1409 CB THR A 89 0.685 1.990 -7.265 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.499 2.542 -8.281 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.991 2.743 -5.969 1.00 10.00 C ATOM 0 H THR A 89 1.028 0.527 -9.213 1.00 10.00 H new ATOM 0 HA THR A 89 1.914 0.302 -6.688 1.00 10.00 H new ATOM 0 HB THR A 89 -0.372 2.103 -7.506 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.326 3.504 -8.352 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.799 3.806 -6.112 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.355 2.364 -5.169 1.00 10.00 H new ATOM 0 HG23 THR A 89 2.037 2.596 -5.701 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.337 -0.261 -6.673 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.466 -0.695 -5.865 1.00 10.00 C ATOM 1421 C GLU A 90 -2.317 -2.150 -5.389 1.00 10.00 C ATOM 1422 O GLU A 90 -2.864 -2.500 -4.344 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.758 -0.501 -6.674 1.00 10.00 C ATOM 1424 CG GLU A 90 -4.180 0.965 -6.891 1.00 10.00 C ATOM 1425 CD GLU A 90 -3.250 1.801 -7.789 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -2.478 1.232 -8.595 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -3.284 3.047 -7.671 1.00 10.00 O ATOM 0 H GLU A 90 -1.584 -0.062 -7.642 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.504 -0.086 -4.962 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -3.633 -0.975 -7.648 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.568 -1.025 -6.166 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -5.180 0.976 -7.325 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.249 1.452 -5.918 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.542 -2.998 -6.092 1.00 10.00 N ATOM 1435 CA ARG A 91 -1.235 -4.347 -5.596 1.00 10.00 C ATOM 1436 C ARG A 91 -0.180 -4.362 -4.476 1.00 10.00 C ATOM 1437 O ARG A 91 -0.072 -5.362 -3.762 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.108 -5.379 -6.741 1.00 10.00 C ATOM 1439 CG ARG A 91 0.236 -5.573 -7.466 1.00 10.00 C ATOM 1440 CD ARG A 91 0.973 -6.842 -7.006 1.00 10.00 C ATOM 1441 NE ARG A 91 1.583 -6.657 -5.689 1.00 10.00 N ATOM 1442 CZ ARG A 91 2.636 -5.902 -5.428 1.00 10.00 C ATOM 1443 NH1 ARG A 91 3.389 -5.381 -6.363 1.00 10.00 N ATOM 1444 NH2 ARG A 91 2.909 -5.640 -4.181 1.00 10.00 N ATOM 0 H ARG A 91 -1.123 -2.774 -6.994 1.00 10.00 H new ATOM 0 HA ARG A 91 -2.103 -4.721 -5.053 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -1.399 -6.348 -6.336 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -1.847 -5.115 -7.497 1.00 10.00 H new ATOM 0 HG2 ARG A 91 0.061 -5.627 -8.541 1.00 10.00 H new ATOM 0 HG3 ARG A 91 0.870 -4.704 -7.289 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.274 -7.678 -6.971 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.743 -7.101 -7.732 1.00 10.00 H new ATOM 0 HE ARG A 91 1.159 -7.153 -4.905 1.00 10.00 H new ATOM 0 HH11 ARG A 91 3.173 -5.551 -7.345 1.00 10.00 H new ATOM 0 HH12 ARG A 91 4.191 -4.805 -6.109 1.00 10.00 H new ATOM 0 HH21 ARG A 91 2.317 -6.015 -3.440 1.00 10.00 H new ATOM 0 HH22 ARG A 91 3.715 -5.060 -3.946 1.00 10.00 H new ATOM 1458 N GLU A 92 0.537 -3.249 -4.244 1.00 10.00 N ATOM 1459 CA GLU A 92 1.268 -2.990 -2.992 1.00 10.00 C ATOM 1460 C GLU A 92 0.274 -2.797 -1.833 1.00 10.00 C ATOM 1461 O GLU A 92 0.376 -3.481 -0.816 1.00 10.00 O ATOM 1462 CB GLU A 92 2.225 -1.776 -3.098 1.00 10.00 C ATOM 1463 CG GLU A 92 3.141 -1.672 -4.340 1.00 10.00 C ATOM 1464 CD GLU A 92 4.128 -2.827 -4.527 1.00 10.00 C ATOM 1465 OE1 GLU A 92 4.395 -3.561 -3.549 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.534 -3.088 -5.685 1.00 10.00 O ATOM 0 H GLU A 92 0.626 -2.497 -4.927 1.00 10.00 H new ATOM 0 HA GLU A 92 1.892 -3.862 -2.795 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.620 -0.871 -3.054 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.862 -1.777 -2.214 1.00 10.00 H new ATOM 0 HG2 GLU A 92 2.513 -1.605 -5.229 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.705 -0.741 -4.278 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.708 -1.895 -1.987 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.768 -1.613 -1.011 1.00 10.00 C ATOM 1475 C ASP A 93 -2.594 -2.854 -0.655 1.00 10.00 C ATOM 1476 O ASP A 93 -2.830 -3.114 0.522 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.669 -0.486 -1.542 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.846 0.769 -1.796 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.129 0.797 -2.816 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -1.690 1.589 -0.868 1.00 10.00 O ATOM 0 H ASP A 93 -0.787 -1.321 -2.827 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.289 -1.293 -0.086 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -3.156 -0.803 -2.464 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.459 -0.272 -0.822 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.987 -3.661 -1.645 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.675 -4.937 -1.421 1.00 10.00 C ATOM 1487 C LEU A 94 -2.861 -5.914 -0.564 1.00 10.00 C ATOM 1488 O LEU A 94 -3.419 -6.517 0.352 1.00 10.00 O ATOM 1489 CB LEU A 94 -4.007 -5.574 -2.776 1.00 10.00 C ATOM 1490 CG LEU A 94 -5.338 -5.151 -3.424 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.864 -3.745 -3.120 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.212 -5.276 -4.940 1.00 10.00 C ATOM 0 H LEU A 94 -2.836 -3.446 -2.631 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.588 -4.724 -0.865 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.200 -5.340 -3.470 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -4.017 -6.657 -2.651 1.00 10.00 H new ATOM 0 HG LEU A 94 -6.065 -5.827 -2.974 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.807 -3.588 -3.644 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -6.023 -3.640 -2.047 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.137 -3.005 -3.453 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.150 -4.979 -5.409 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.409 -4.629 -5.293 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.987 -6.310 -5.202 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.559 -6.064 -0.838 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.657 -6.865 0.001 1.00 10.00 C ATOM 1506 C ILE A 95 -0.572 -6.276 1.414 1.00 10.00 C ATOM 1507 O ILE A 95 -0.705 -7.025 2.383 1.00 10.00 O ATOM 1508 CB ILE A 95 0.722 -7.051 -0.684 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.551 -8.113 -1.799 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.843 -7.444 0.303 1.00 10.00 C ATOM 1511 CD1 ILE A 95 1.846 -8.518 -2.509 1.00 10.00 C ATOM 0 H ILE A 95 -1.102 -5.636 -1.643 1.00 10.00 H new ATOM 0 HA ILE A 95 -1.067 -7.869 0.114 1.00 10.00 H new ATOM 0 HB ILE A 95 1.040 -6.097 -1.104 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.098 -9.004 -1.365 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -0.148 -7.729 -2.542 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.782 -7.559 -0.239 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.953 -6.665 1.058 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.587 -8.386 0.788 1.00 10.00 H new ATOM 0 HD11 ILE A 95 1.625 -9.265 -3.272 1.00 10.00 H new ATOM 0 HD12 ILE A 95 2.293 -7.642 -2.978 1.00 10.00 H new ATOM 0 HD13 ILE A 95 2.543 -8.936 -1.783 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.407 -4.950 1.542 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.411 -4.258 2.831 1.00 10.00 C ATOM 1525 C ALA A 96 -1.697 -4.545 3.635 1.00 10.00 C ATOM 1526 O ALA A 96 -1.628 -4.917 4.806 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.170 -2.756 2.604 1.00 10.00 C ATOM 0 H ALA A 96 -0.266 -4.328 0.746 1.00 10.00 H new ATOM 0 HA ALA A 96 0.404 -4.642 3.445 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.173 -2.238 3.563 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.794 -2.612 2.116 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.961 -2.352 1.971 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.862 -4.440 2.985 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.175 -4.805 3.517 1.00 10.00 C ATOM 1535 C TYR A 97 -4.265 -6.280 3.927 1.00 10.00 C ATOM 1536 O TYR A 97 -4.569 -6.560 5.084 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.249 -4.396 2.497 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.529 -5.207 2.458 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.390 -5.262 3.571 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.859 -5.907 1.282 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.591 -5.996 3.490 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.044 -6.657 1.212 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.929 -6.681 2.306 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.105 -7.355 2.222 1.00 10.00 O ATOM 0 H TYR A 97 -2.915 -4.082 2.031 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.346 -4.260 4.445 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.516 -3.357 2.690 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.800 -4.431 1.505 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.131 -4.744 4.483 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.197 -5.867 0.429 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.256 -6.033 4.340 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.277 -7.216 0.318 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.182 -7.770 1.338 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.012 -7.235 3.024 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.185 -8.663 3.324 1.00 10.00 C ATOM 1556 C LEU A 98 -3.191 -9.187 4.378 1.00 10.00 C ATOM 1557 O LEU A 98 -3.556 -10.052 5.176 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.143 -9.477 2.021 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.364 -9.247 1.107 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.128 -9.872 -0.267 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.656 -9.842 1.678 1.00 10.00 C ATOM 0 H LEU A 98 -3.686 -7.045 2.077 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.166 -8.790 3.781 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.236 -9.222 1.472 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.079 -10.537 2.267 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.482 -8.166 1.032 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -5.999 -9.700 -0.899 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.250 -9.418 -0.727 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -4.966 -10.944 -0.156 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.480 -9.649 0.991 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.535 -10.918 1.807 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.872 -9.383 2.643 1.00 10.00 H new ATOM 1573 N LYS A 99 -1.985 -8.597 4.474 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.039 -8.838 5.578 1.00 10.00 C ATOM 1575 C LYS A 99 -1.623 -8.480 6.957 1.00 10.00 C ATOM 1576 O LYS A 99 -1.255 -9.090 7.964 1.00 10.00 O ATOM 1577 CB LYS A 99 0.274 -8.087 5.286 1.00 10.00 C ATOM 1578 CG LYS A 99 1.378 -8.387 6.315 1.00 10.00 C ATOM 1579 CD LYS A 99 2.742 -7.796 5.925 1.00 10.00 C ATOM 1580 CE LYS A 99 3.413 -8.603 4.807 1.00 10.00 C ATOM 1581 NZ LYS A 99 4.777 -8.113 4.509 1.00 10.00 N ATOM 0 H LYS A 99 -1.637 -7.934 3.781 1.00 10.00 H new ATOM 0 HA LYS A 99 -0.835 -9.907 5.630 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.628 -8.358 4.291 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.078 -7.015 5.273 1.00 10.00 H new ATOM 0 HG2 LYS A 99 1.080 -7.989 7.285 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.476 -9.467 6.430 1.00 10.00 H new ATOM 0 HD2 LYS A 99 2.612 -6.764 5.600 1.00 10.00 H new ATOM 0 HD3 LYS A 99 3.393 -7.775 6.799 1.00 10.00 H new ATOM 0 HE2 LYS A 99 3.461 -9.653 5.097 1.00 10.00 H new ATOM 0 HE3 LYS A 99 2.803 -8.548 3.905 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.800 -7.714 3.549 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 5.040 -7.378 5.196 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 5.451 -8.903 4.572 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.576 -7.544 7.000 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.438 -7.302 8.160 1.00 10.00 C ATOM 1597 C LYS A 100 -4.660 -8.218 8.166 1.00 10.00 C ATOM 1598 O LYS A 100 -4.827 -8.941 9.139 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.802 -5.810 8.269 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.680 -4.958 8.894 1.00 10.00 C ATOM 1601 CD LYS A 100 -2.220 -5.391 10.300 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.397 -5.428 11.281 1.00 10.00 C ATOM 1603 NZ LYS A 100 -3.103 -6.227 12.490 1.00 10.00 N ATOM 0 H LYS A 100 -2.773 -6.923 6.216 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.876 -7.558 9.058 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.032 -5.425 7.276 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.706 -5.706 8.869 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -1.818 -4.978 8.227 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.019 -3.923 8.945 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -1.757 -6.376 10.247 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -1.460 -4.701 10.666 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -3.652 -4.410 11.576 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -4.271 -5.843 10.779 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -3.820 -6.032 13.218 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -3.120 -7.239 12.250 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -2.162 -5.973 12.854 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.460 -8.287 7.101 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.738 -9.010 7.120 1.00 10.00 C ATOM 1619 C ALA A 101 -6.653 -10.529 7.403 1.00 10.00 C ATOM 1620 O ALA A 101 -7.654 -11.124 7.793 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.489 -8.727 5.816 1.00 10.00 C ATOM 0 H ALA A 101 -5.245 -7.848 6.206 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.287 -8.626 7.980 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.440 -9.260 5.821 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.673 -7.656 5.727 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.889 -9.063 4.970 1.00 10.00 H new ATOM 1627 N THR A 102 -5.472 -11.159 7.298 1.00 10.00 N ATOM 1628 CA THR A 102 -5.215 -12.514 7.836 1.00 10.00 C ATOM 1629 C THR A 102 -5.211 -12.591 9.385 1.00 10.00 C ATOM 1630 O THR A 102 -5.092 -13.671 9.959 1.00 10.00 O ATOM 1631 CB THR A 102 -3.934 -13.112 7.215 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.923 -14.514 7.378 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.647 -12.560 7.823 1.00 10.00 C ATOM 0 H THR A 102 -4.662 -10.745 6.836 1.00 10.00 H new ATOM 0 HA THR A 102 -6.063 -13.130 7.536 1.00 10.00 H new ATOM 0 HB THR A 102 -3.958 -12.831 6.162 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.295 -14.913 6.740 1.00 10.00 H new ATOM 0 HG21 THR A 102 -1.788 -13.024 7.339 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.608 -11.481 7.674 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.625 -12.780 8.890 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.375 -11.463 10.086 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.321 -11.334 11.549 1.00 10.00 C ATOM 1643 C ASN A 103 -6.186 -10.187 12.112 1.00 10.00 C ATOM 1644 O ASN A 103 -6.599 -10.285 13.266 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.849 -11.176 12.005 1.00 10.00 C ATOM 1646 CG ASN A 103 -3.065 -10.049 11.327 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -3.079 -8.893 11.739 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.319 -10.388 10.289 1.00 10.00 N ATOM 0 H ASN A 103 -5.558 -10.571 9.627 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.748 -12.251 11.956 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.837 -11.006 13.082 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.328 -12.116 11.825 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.746 -9.685 9.821 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -2.316 -11.352 9.956 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.504 -9.152 11.321 1.00 10.00 N ATOM 1656 CA GLU A 104 -7.320 -7.984 11.687 1.00 10.00 C ATOM 1657 C GLU A 104 -7.785 -7.225 10.434 1.00 10.00 C ATOM 1658 O GLU A 104 -9.020 -7.144 10.249 1.00 10.00 O ATOM 1659 CB GLU A 104 -6.458 -7.080 12.574 1.00 10.00 C ATOM 1660 CG GLU A 104 -7.168 -5.857 13.176 1.00 10.00 C ATOM 1661 CD GLU A 104 -6.242 -5.034 14.093 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.002 -5.252 14.048 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -6.770 -4.170 14.827 1.00 10.00 O ATOM 1664 OXT GLU A 104 -6.907 -6.767 9.668 1.00 10.00 O ATOM 0 H GLU A 104 -6.181 -9.104 10.355 1.00 10.00 H new ATOM 0 HA GLU A 104 -8.216 -8.303 12.220 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -6.056 -7.681 13.390 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -5.609 -6.731 11.987 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -7.537 -5.221 12.371 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -8.037 -6.188 13.744 1.00 10.00 H new