USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1120 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 76 MET CE :methyl 144:sc= -0.0252 (180deg=-0.638) USER MOD Set 1.2: A 91 MET CE :methyl -143:sc= -0.64 (180deg=-2.16!) USER MOD Set 2.1: A 38 ASN : amide:sc= -4.3! C(o=-3.8!,f=-6.8!) USER MOD Set 2.2: A 40 THR OG1 : rot 91:sc= 0.276 USER MOD Set 2.3: A 127 LYS NZ :NH3+ -118:sc= 0.188 (180deg=-0.348) USER MOD Set 3.1: A 18 HIS : no HD1:sc= 0.417 K(o=0.5,f=-7.7!) USER MOD Set 3.2: A 24 ASN : amide:sc= 0.606 K(o=0.5,f=-0.57) USER MOD Set 3.3: A 70 MET CE :methyl -168:sc= -0.424 (180deg=-0.684) USER MOD Set 3.4: A 74 SER OG : rot 76:sc= -0.0957 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.133 (180deg=-0.759) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0572) USER MOD Single : A 2 SER OG : rot 43:sc= 0.0854 USER MOD Single : A 4 ASN : amide:sc= -0.0344 K(o=-0.034,f=-2.1!) USER MOD Single : A 6 ASN : amide:sc= -0.0447 K(o=-0.045,f=-3.6!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot -70:sc=0.000635 USER MOD Single : A 13 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.59) USER MOD Single : A 16 MET CE :methyl -160:sc= -0.141 (180deg=-0.745) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -175:sc=-0.00621 (180deg=-0.089) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.0624 X(o=-0.062,f=0) USER MOD Single : A 31 SER OG : rot 124:sc= -0.66 USER MOD Single : A 36 MET CE :methyl 166:sc= -3.83! (180deg=-4.52!) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 48 THR OG1 : rot -21:sc= -0.0421 USER MOD Single : A 49 MET CE :methyl -141:sc= -2.6! (180deg=-3.72!) USER MOD Single : A 50 LYS NZ :NH3+ -155:sc= -1.8! (180deg=-3.47!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot -50:sc= 0.673 USER MOD Single : A 69 SER OG : rot 100:sc= -0.583 USER MOD Single : A 72 SER OG : rot 110:sc= -0.0996 USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 85:sc= 1.29 USER MOD Single : A 78 GLN : amide:sc= -0.109 K(o=-0.11,f=-0.67) USER MOD Single : A 81 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.06) USER MOD Single : A 83 LYS NZ :NH3+ 165:sc= 1.28 (180deg=1.05) USER MOD Single : A 87 THR OG1 : rot -159:sc= -0.321 USER MOD Single : A 90 SER OG : rot -89:sc= -1.37! USER MOD Single : A 92 SER OG : rot 50:sc= 1.19 USER MOD Single : A 93 LYS NZ :NH3+ 167:sc= -0.0794 (180deg=-0.297) USER MOD Single : A 96 SER OG : rot 76:sc= 0.722 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN :FLIP amide:sc= 0 F(o=-0.94,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0886) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 87:sc= 1.2 USER MOD Single : A 117 GLN : amide:sc= 1.11 K(o=1.1,f=-0.43) USER MOD Single : A 120 SER OG : rot -43:sc= 0.0421 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -88:sc= 1.23 USER MOD Single : A 134 LYS NZ :NH3+ -164:sc= -0.0463 (180deg=-0.259) USER MOD Single : A 138 LYS NZ :NH3+ -163:sc= -0.0302 (180deg=-0.266) USER MOD Single : A 142 LYS NZ :NH3+ -111:sc= 2.05 (180deg=0.641) USER MOD Single : A 147 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.258 -29.228 0.181 1.00 0.00 N ATOM 2 CA MET A 1 -1.338 -28.686 1.224 1.00 0.00 C ATOM 3 C MET A 1 -1.567 -27.196 1.421 1.00 0.00 C ATOM 4 O MET A 1 -1.542 -26.708 2.569 1.00 0.00 O ATOM 5 CB MET A 1 0.125 -28.926 0.806 1.00 0.00 C ATOM 6 CG MET A 1 1.134 -28.309 1.756 1.00 0.00 C ATOM 7 SD MET A 1 2.826 -28.538 1.171 1.00 0.00 S ATOM 8 CE MET A 1 2.936 -30.314 1.165 1.00 0.00 C ATOM 0 H1 MET A 1 -2.183 -30.265 0.157 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.236 -28.957 0.407 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.997 -28.840 -0.748 1.00 0.00 H new ATOM 0 HA MET A 1 -1.542 -29.201 2.163 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.305 -29.999 0.744 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.281 -28.518 -0.193 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.927 -27.244 1.865 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.026 -28.758 2.743 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.984 -30.614 1.178 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.434 -30.713 2.046 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.458 -30.705 0.267 1.00 0.00 H new ATOM 20 N SER A 2 -1.808 -26.461 0.340 1.00 0.00 N ATOM 21 CA SER A 2 -2.002 -25.031 0.399 1.00 0.00 C ATOM 22 C SER A 2 -3.422 -24.676 0.845 1.00 0.00 C ATOM 23 O SER A 2 -4.387 -25.030 0.209 1.00 0.00 O ATOM 24 CB SER A 2 -1.700 -24.419 -0.972 1.00 0.00 C ATOM 25 OG SER A 2 -2.338 -25.154 -2.008 1.00 0.00 O ATOM 0 H SER A 2 -1.873 -26.849 -0.601 1.00 0.00 H new ATOM 0 HA SER A 2 -1.317 -24.619 1.140 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.038 -23.383 -0.995 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.623 -24.407 -1.140 1.00 0.00 H new ATOM 0 HG SER A 2 -3.251 -25.382 -1.733 1.00 0.00 H new ATOM 31 N PHE A 3 -3.526 -23.970 1.965 1.00 0.00 N ATOM 32 CA PHE A 3 -4.816 -23.537 2.465 1.00 0.00 C ATOM 33 C PHE A 3 -4.850 -22.014 2.539 1.00 0.00 C ATOM 34 O PHE A 3 -4.501 -21.422 3.580 1.00 0.00 O ATOM 35 CB PHE A 3 -5.128 -24.151 3.835 1.00 0.00 C ATOM 36 CG PHE A 3 -5.137 -25.654 3.841 1.00 0.00 C ATOM 37 CD1 PHE A 3 -6.158 -26.363 3.223 1.00 0.00 C ATOM 38 CD2 PHE A 3 -4.114 -26.367 4.458 1.00 0.00 C ATOM 39 CE1 PHE A 3 -6.164 -27.742 3.216 1.00 0.00 C ATOM 40 CE2 PHE A 3 -4.118 -27.749 4.458 1.00 0.00 C ATOM 41 CZ PHE A 3 -5.143 -28.439 3.835 1.00 0.00 C ATOM 0 H PHE A 3 -2.732 -23.688 2.540 1.00 0.00 H new ATOM 0 HA PHE A 3 -5.584 -23.884 1.774 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -4.391 -23.799 4.556 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -6.100 -23.790 4.171 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -6.961 -25.826 2.740 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -3.308 -25.835 4.942 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -6.965 -28.277 2.728 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -3.321 -28.291 4.945 1.00 0.00 H new ATOM 0 HZ PHE A 3 -5.145 -29.519 3.832 1.00 0.00 H new ATOM 51 N ASN A 4 -5.232 -21.376 1.453 1.00 0.00 N ATOM 52 CA ASN A 4 -5.260 -19.919 1.409 1.00 0.00 C ATOM 53 C ASN A 4 -6.699 -19.424 1.418 1.00 0.00 C ATOM 54 O ASN A 4 -7.431 -19.602 0.461 1.00 0.00 O ATOM 55 CB ASN A 4 -4.534 -19.410 0.160 1.00 0.00 C ATOM 56 CG ASN A 4 -4.115 -17.947 0.294 1.00 0.00 C ATOM 57 OD1 ASN A 4 -4.696 -17.178 1.035 1.00 0.00 O ATOM 58 ND2 ASN A 4 -3.094 -17.578 -0.462 1.00 0.00 N ATOM 0 H ASN A 4 -5.527 -21.835 0.591 1.00 0.00 H new ATOM 0 HA ASN A 4 -4.748 -19.532 2.290 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -3.652 -20.024 -0.021 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -5.184 -19.522 -0.708 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -2.764 -16.613 -0.438 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -2.637 -18.258 -1.069 1.00 0.00 H new ATOM 65 N ALA A 5 -7.080 -18.800 2.521 1.00 0.00 N ATOM 66 CA ALA A 5 -8.456 -18.324 2.710 1.00 0.00 C ATOM 67 C ALA A 5 -8.469 -17.033 3.513 1.00 0.00 C ATOM 68 O ALA A 5 -9.310 -16.161 3.307 1.00 0.00 O ATOM 69 CB ALA A 5 -9.292 -19.392 3.419 1.00 0.00 C ATOM 0 H ALA A 5 -6.459 -18.607 3.306 1.00 0.00 H new ATOM 0 HA ALA A 5 -8.890 -18.128 1.730 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -10.310 -19.027 3.553 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.309 -20.300 2.817 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -8.853 -19.610 4.393 1.00 0.00 H new ATOM 75 N ASN A 6 -7.521 -16.935 4.445 1.00 0.00 N ATOM 76 CA ASN A 6 -7.284 -15.729 5.269 1.00 0.00 C ATOM 77 C ASN A 6 -7.378 -14.425 4.471 1.00 0.00 C ATOM 78 O ASN A 6 -7.823 -13.394 5.000 1.00 0.00 O ATOM 79 CB ASN A 6 -5.892 -15.810 5.918 1.00 0.00 C ATOM 80 CG ASN A 6 -5.750 -16.958 6.892 1.00 0.00 C ATOM 81 OD1 ASN A 6 -6.408 -17.995 6.772 1.00 0.00 O ATOM 82 ND2 ASN A 6 -4.882 -16.785 7.880 1.00 0.00 N ATOM 0 H ASN A 6 -6.880 -17.699 4.659 1.00 0.00 H new ATOM 0 HA ASN A 6 -8.070 -15.710 6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -5.140 -15.912 5.136 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -5.687 -14.874 6.438 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -4.742 -17.522 8.571 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -4.355 -15.915 7.949 1.00 0.00 H new ATOM 89 N LEU A 7 -6.982 -14.450 3.217 1.00 0.00 N ATOM 90 CA LEU A 7 -6.796 -13.224 2.455 1.00 0.00 C ATOM 91 C LEU A 7 -7.931 -13.039 1.462 1.00 0.00 C ATOM 92 O LEU A 7 -8.139 -11.943 0.941 1.00 0.00 O ATOM 93 CB LEU A 7 -5.436 -13.258 1.741 1.00 0.00 C ATOM 94 CG LEU A 7 -5.023 -11.960 1.042 1.00 0.00 C ATOM 95 CD1 LEU A 7 -5.047 -10.795 2.019 1.00 0.00 C ATOM 96 CD2 LEU A 7 -3.618 -12.100 0.464 1.00 0.00 C ATOM 0 H LEU A 7 -6.781 -15.305 2.698 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.808 -12.373 3.136 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.669 -13.516 2.471 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.454 -14.058 1.001 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.733 -11.766 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.751 -9.882 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.054 -10.676 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -4.353 -10.991 2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -3.334 -11.171 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -2.913 -12.313 1.268 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -3.601 -12.916 -0.259 1.00 0.00 H new ATOM 108 N ASP A 8 -8.664 -14.121 1.208 1.00 0.00 N ATOM 109 CA ASP A 8 -9.798 -14.102 0.295 1.00 0.00 C ATOM 110 C ASP A 8 -10.819 -13.054 0.721 1.00 0.00 C ATOM 111 O ASP A 8 -11.213 -12.198 -0.079 1.00 0.00 O ATOM 112 CB ASP A 8 -10.454 -15.477 0.250 1.00 0.00 C ATOM 113 CG ASP A 8 -11.664 -15.501 -0.658 1.00 0.00 C ATOM 114 OD1 ASP A 8 -11.474 -15.508 -1.899 1.00 0.00 O ATOM 115 OD2 ASP A 8 -12.801 -15.508 -0.147 1.00 0.00 O ATOM 0 H ASP A 8 -8.487 -15.033 1.630 1.00 0.00 H new ATOM 0 HA ASP A 8 -9.433 -13.844 -0.699 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -9.728 -16.213 -0.095 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -10.751 -15.770 1.257 1.00 0.00 H new ATOM 120 N THR A 9 -11.257 -13.141 1.976 1.00 0.00 N ATOM 121 CA THR A 9 -12.195 -12.167 2.516 1.00 0.00 C ATOM 122 C THR A 9 -11.592 -10.750 2.465 1.00 0.00 C ATOM 123 O THR A 9 -12.278 -9.779 2.124 1.00 0.00 O ATOM 124 CB THR A 9 -12.593 -12.532 3.955 1.00 0.00 C ATOM 125 OG1 THR A 9 -13.084 -13.875 4.010 1.00 0.00 O ATOM 126 CG2 THR A 9 -13.647 -11.587 4.500 1.00 0.00 C ATOM 0 H THR A 9 -10.978 -13.871 2.631 1.00 0.00 H new ATOM 0 HA THR A 9 -13.094 -12.182 1.900 1.00 0.00 H new ATOM 0 HB THR A 9 -11.699 -12.442 4.573 1.00 0.00 H new ATOM 0 HG1 THR A 9 -13.332 -14.095 4.932 1.00 0.00 H new ATOM 0 HG21 THR A 9 -13.903 -11.876 5.519 1.00 0.00 H new ATOM 0 HG22 THR A 9 -13.258 -10.569 4.499 1.00 0.00 H new ATOM 0 HG23 THR A 9 -14.538 -11.636 3.874 1.00 0.00 H new ATOM 134 N LEU A 10 -10.329 -10.659 2.815 1.00 0.00 N ATOM 135 CA LEU A 10 -9.593 -9.399 2.779 1.00 0.00 C ATOM 136 C LEU A 10 -9.583 -8.814 1.363 1.00 0.00 C ATOM 137 O LEU A 10 -9.686 -7.600 1.176 1.00 0.00 O ATOM 138 CB LEU A 10 -8.162 -9.598 3.296 1.00 0.00 C ATOM 139 CG LEU A 10 -8.073 -10.164 4.718 1.00 0.00 C ATOM 140 CD1 LEU A 10 -6.626 -10.242 5.170 1.00 0.00 C ATOM 141 CD2 LEU A 10 -8.893 -9.329 5.680 1.00 0.00 C ATOM 0 H LEU A 10 -9.775 -11.454 3.134 1.00 0.00 H new ATOM 0 HA LEU A 10 -10.099 -8.689 3.433 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.634 -10.269 2.618 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -7.642 -8.641 3.266 1.00 0.00 H new ATOM 0 HG LEU A 10 -8.484 -11.173 4.712 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -6.582 -10.646 6.181 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.069 -10.892 4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -6.187 -9.244 5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.816 -9.749 6.683 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.518 -8.306 5.685 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -9.937 -9.331 5.365 1.00 0.00 H new ATOM 153 N TYR A 11 -9.498 -9.693 0.388 1.00 0.00 N ATOM 154 CA TYR A 11 -9.589 -9.316 -1.018 1.00 0.00 C ATOM 155 C TYR A 11 -10.973 -8.748 -1.295 1.00 0.00 C ATOM 156 O TYR A 11 -11.112 -7.643 -1.787 1.00 0.00 O ATOM 157 CB TYR A 11 -9.353 -10.508 -1.947 1.00 0.00 C ATOM 158 CG TYR A 11 -7.905 -10.879 -2.134 1.00 0.00 C ATOM 159 CD1 TYR A 11 -6.928 -9.911 -2.322 1.00 0.00 C ATOM 160 CD2 TYR A 11 -7.527 -12.219 -2.137 1.00 0.00 C ATOM 161 CE1 TYR A 11 -5.616 -10.269 -2.517 1.00 0.00 C ATOM 162 CE2 TYR A 11 -6.205 -12.587 -2.333 1.00 0.00 C ATOM 163 CZ TYR A 11 -5.258 -11.607 -2.531 1.00 0.00 C ATOM 164 OH TYR A 11 -3.949 -11.949 -2.739 1.00 0.00 O ATOM 0 H TYR A 11 -9.364 -10.692 0.541 1.00 0.00 H new ATOM 0 HA TYR A 11 -8.815 -8.574 -1.213 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -9.888 -11.372 -1.552 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -9.786 -10.284 -2.922 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -7.202 -8.866 -2.315 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -8.275 -12.983 -1.984 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -4.864 -9.507 -2.659 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -5.921 -13.629 -2.330 1.00 0.00 H new ATOM 0 HH TYR A 11 -3.704 -11.755 -3.668 1.00 0.00 H new ATOM 174 N ARG A 12 -11.992 -9.532 -0.956 1.00 0.00 N ATOM 175 CA ARG A 12 -13.381 -9.137 -1.214 1.00 0.00 C ATOM 176 C ARG A 12 -13.716 -7.792 -0.579 1.00 0.00 C ATOM 177 O ARG A 12 -14.460 -7.009 -1.159 1.00 0.00 O ATOM 178 CB ARG A 12 -14.340 -10.219 -0.728 1.00 0.00 C ATOM 179 CG ARG A 12 -14.639 -11.281 -1.757 1.00 0.00 C ATOM 180 CD ARG A 12 -15.490 -12.395 -1.202 1.00 0.00 C ATOM 181 NE ARG A 12 -16.145 -13.151 -2.255 1.00 0.00 N ATOM 182 CZ ARG A 12 -15.985 -14.463 -2.481 1.00 0.00 C ATOM 183 NH1 ARG A 12 -15.098 -15.130 -1.746 1.00 0.00 N ATOM 184 NH2 ARG A 12 -16.649 -15.070 -3.435 1.00 0.00 N ATOM 0 H ARG A 12 -11.888 -10.441 -0.504 1.00 0.00 H new ATOM 0 HA ARG A 12 -13.497 -9.023 -2.292 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -13.917 -10.694 0.157 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.275 -9.750 -0.422 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -15.149 -10.827 -2.607 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -13.702 -11.695 -2.131 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -14.869 -13.064 -0.607 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -16.242 -11.978 -0.532 1.00 0.00 H new ATOM 0 HE ARG A 12 -16.778 -12.643 -2.873 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -14.559 -14.642 -1.030 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -14.957 -16.129 -1.898 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -17.299 -14.543 -4.019 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -16.515 -16.069 -3.594 1.00 0.00 H new ATOM 198 N GLN A 13 -13.180 -7.542 0.598 1.00 0.00 N ATOM 199 CA GLN A 13 -13.397 -6.266 1.283 1.00 0.00 C ATOM 200 C GLN A 13 -12.564 -5.159 0.646 1.00 0.00 C ATOM 201 O GLN A 13 -13.039 -4.042 0.484 1.00 0.00 O ATOM 202 CB GLN A 13 -13.058 -6.401 2.771 1.00 0.00 C ATOM 203 CG GLN A 13 -14.083 -7.197 3.567 1.00 0.00 C ATOM 204 CD GLN A 13 -13.703 -7.346 5.016 1.00 0.00 C ATOM 205 OE1 GLN A 13 -13.013 -6.496 5.589 1.00 0.00 O ATOM 206 NE2 GLN A 13 -14.143 -8.437 5.626 1.00 0.00 N ATOM 0 H GLN A 13 -12.590 -8.200 1.107 1.00 0.00 H new ATOM 0 HA GLN A 13 -14.449 -5.998 1.185 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -12.084 -6.880 2.870 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -12.969 -5.405 3.205 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -15.053 -6.704 3.499 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -14.196 -8.185 3.121 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -14.710 -9.113 5.115 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -13.914 -8.600 6.607 1.00 0.00 H new ATOM 215 N VAL A 14 -11.347 -5.491 0.228 1.00 0.00 N ATOM 216 CA VAL A 14 -10.460 -4.489 -0.331 1.00 0.00 C ATOM 217 C VAL A 14 -10.861 -4.144 -1.772 1.00 0.00 C ATOM 218 O VAL A 14 -10.786 -2.979 -2.193 1.00 0.00 O ATOM 219 CB VAL A 14 -8.973 -4.910 -0.236 1.00 0.00 C ATOM 220 CG1 VAL A 14 -8.171 -4.465 -1.452 1.00 0.00 C ATOM 221 CG2 VAL A 14 -8.372 -4.319 1.022 1.00 0.00 C ATOM 0 H VAL A 14 -10.960 -6.434 0.266 1.00 0.00 H new ATOM 0 HA VAL A 14 -10.567 -3.586 0.271 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.931 -5.999 -0.203 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.134 -4.783 -1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.593 -4.914 -2.351 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.211 -3.379 -1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -7.324 -4.611 1.097 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.444 -3.232 0.984 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -8.914 -4.688 1.892 1.00 0.00 H new ATOM 231 N ILE A 15 -11.348 -5.125 -2.516 1.00 0.00 N ATOM 232 CA ILE A 15 -11.865 -4.880 -3.850 1.00 0.00 C ATOM 233 C ILE A 15 -13.256 -4.276 -3.760 1.00 0.00 C ATOM 234 O ILE A 15 -13.756 -3.688 -4.714 1.00 0.00 O ATOM 235 CB ILE A 15 -11.912 -6.163 -4.724 1.00 0.00 C ATOM 236 CG1 ILE A 15 -12.887 -7.195 -4.148 1.00 0.00 C ATOM 237 CG2 ILE A 15 -10.520 -6.764 -4.860 1.00 0.00 C ATOM 238 CD1 ILE A 15 -12.979 -8.469 -4.972 1.00 0.00 C ATOM 0 H ILE A 15 -11.395 -6.099 -2.217 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.179 -4.185 -4.334 1.00 0.00 H new ATOM 0 HB ILE A 15 -12.271 -5.881 -5.714 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -12.577 -7.449 -3.134 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -13.878 -6.746 -4.076 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -10.570 -7.662 -5.475 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.855 -6.039 -5.330 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.137 -7.021 -3.873 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -13.687 -9.154 -4.505 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -13.318 -8.227 -5.979 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -11.998 -8.941 -5.023 1.00 0.00 H new ATOM 250 N MET A 16 -13.894 -4.426 -2.604 1.00 0.00 N ATOM 251 CA MET A 16 -15.199 -3.829 -2.376 1.00 0.00 C ATOM 252 C MET A 16 -15.041 -2.316 -2.304 1.00 0.00 C ATOM 253 O MET A 16 -15.782 -1.563 -2.943 1.00 0.00 O ATOM 254 CB MET A 16 -15.837 -4.357 -1.100 1.00 0.00 C ATOM 255 CG MET A 16 -17.280 -3.920 -0.918 1.00 0.00 C ATOM 256 SD MET A 16 -18.027 -4.522 0.608 1.00 0.00 S ATOM 257 CE MET A 16 -17.815 -6.291 0.416 1.00 0.00 C ATOM 0 H MET A 16 -13.527 -4.956 -1.813 1.00 0.00 H new ATOM 0 HA MET A 16 -15.859 -4.096 -3.202 1.00 0.00 H new ATOM 0 HB2 MET A 16 -15.794 -5.446 -1.105 1.00 0.00 H new ATOM 0 HB3 MET A 16 -15.253 -4.019 -0.244 1.00 0.00 H new ATOM 0 HG2 MET A 16 -17.326 -2.831 -0.931 1.00 0.00 H new ATOM 0 HG3 MET A 16 -17.868 -4.274 -1.765 1.00 0.00 H new ATOM 0 HE1 MET A 16 -18.514 -6.814 1.069 1.00 0.00 H new ATOM 0 HE2 MET A 16 -18.008 -6.570 -0.620 1.00 0.00 H new ATOM 0 HE3 MET A 16 -16.794 -6.566 0.682 1.00 0.00 H new ATOM 267 N ASP A 17 -14.050 -1.878 -1.522 1.00 0.00 N ATOM 268 CA ASP A 17 -13.666 -0.466 -1.485 1.00 0.00 C ATOM 269 C ASP A 17 -13.205 -0.024 -2.862 1.00 0.00 C ATOM 270 O ASP A 17 -13.592 1.042 -3.341 1.00 0.00 O ATOM 271 CB ASP A 17 -12.555 -0.215 -0.461 1.00 0.00 C ATOM 272 CG ASP A 17 -13.022 -0.338 0.967 1.00 0.00 C ATOM 273 OD1 ASP A 17 -13.713 0.606 1.459 1.00 0.00 O ATOM 274 OD2 ASP A 17 -12.721 -1.361 1.622 1.00 0.00 O ATOM 0 H ASP A 17 -13.501 -2.480 -0.908 1.00 0.00 H new ATOM 0 HA ASP A 17 -14.539 0.114 -1.185 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.745 -0.923 -0.633 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -12.145 0.783 -0.617 1.00 0.00 H new ATOM 279 N HIS A 18 -12.348 -0.856 -3.477 1.00 0.00 N ATOM 280 CA HIS A 18 -11.846 -0.598 -4.816 1.00 0.00 C ATOM 281 C HIS A 18 -12.960 -0.320 -5.802 1.00 0.00 C ATOM 282 O HIS A 18 -12.879 0.594 -6.609 1.00 0.00 O ATOM 283 CB HIS A 18 -11.018 -1.807 -5.293 1.00 0.00 C ATOM 284 CG HIS A 18 -10.325 -1.592 -6.610 1.00 0.00 C ATOM 285 ND1 HIS A 18 -10.883 -1.920 -7.816 1.00 0.00 N ATOM 286 CD2 HIS A 18 -9.130 -1.048 -6.882 1.00 0.00 C ATOM 287 CE1 HIS A 18 -10.055 -1.587 -8.794 1.00 0.00 C ATOM 288 NE2 HIS A 18 -8.971 -1.064 -8.249 1.00 0.00 N ATOM 0 H HIS A 18 -11.993 -1.715 -3.056 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.222 0.295 -4.771 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -10.271 -2.044 -4.536 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -11.674 -2.674 -5.376 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -8.422 -0.667 -6.161 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -10.234 -1.719 -9.851 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -8.153 -0.728 -8.757 1.00 0.00 H new ATOM 297 N TYR A 19 -13.998 -1.142 -5.758 1.00 0.00 N ATOM 298 CA TYR A 19 -15.180 -0.937 -6.585 1.00 0.00 C ATOM 299 C TYR A 19 -15.933 0.329 -6.177 1.00 0.00 C ATOM 300 O TYR A 19 -16.361 1.101 -7.023 1.00 0.00 O ATOM 301 CB TYR A 19 -16.055 -2.156 -6.411 1.00 0.00 C ATOM 302 CG TYR A 19 -17.193 -2.252 -7.399 1.00 0.00 C ATOM 303 CD1 TYR A 19 -16.955 -2.707 -8.699 1.00 0.00 C ATOM 304 CD2 TYR A 19 -18.488 -1.922 -7.037 1.00 0.00 C ATOM 305 CE1 TYR A 19 -17.990 -2.814 -9.599 1.00 0.00 C ATOM 306 CE2 TYR A 19 -19.523 -2.032 -7.936 1.00 0.00 C ATOM 307 CZ TYR A 19 -19.267 -2.476 -9.213 1.00 0.00 C ATOM 308 OH TYR A 19 -20.310 -2.589 -10.124 1.00 0.00 O ATOM 0 H TYR A 19 -14.046 -1.963 -5.154 1.00 0.00 H new ATOM 0 HA TYR A 19 -14.894 -0.806 -7.628 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -15.436 -3.049 -6.500 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -16.466 -2.153 -5.401 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -15.953 -2.976 -8.999 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -18.688 -1.573 -6.035 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -17.801 -3.162 -10.604 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -20.529 -1.772 -7.642 1.00 0.00 H new ATOM 0 HH TYR A 19 -21.148 -2.313 -9.697 1.00 0.00 H new ATOM 318 N LYS A 20 -16.177 0.453 -4.865 1.00 0.00 N ATOM 319 CA LYS A 20 -16.777 1.666 -4.310 1.00 0.00 C ATOM 320 C LYS A 20 -16.143 2.945 -4.885 1.00 0.00 C ATOM 321 O LYS A 20 -16.845 3.911 -5.195 1.00 0.00 O ATOM 322 CB LYS A 20 -16.624 1.657 -2.784 1.00 0.00 C ATOM 323 CG LYS A 20 -17.477 2.693 -2.065 1.00 0.00 C ATOM 324 CD LYS A 20 -17.327 2.579 -0.548 1.00 0.00 C ATOM 325 CE LYS A 20 -17.668 1.182 -0.036 1.00 0.00 C ATOM 326 NZ LYS A 20 -19.038 0.764 -0.410 1.00 0.00 N ATOM 0 H LYS A 20 -15.968 -0.269 -4.175 1.00 0.00 H new ATOM 0 HA LYS A 20 -17.831 1.671 -4.587 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -16.883 0.667 -2.410 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.577 1.828 -2.534 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -17.187 3.693 -2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -18.523 2.560 -2.340 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.304 2.827 -0.267 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.976 3.309 -0.065 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.950 0.466 -0.436 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.568 1.161 1.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -19.254 -0.153 0.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -19.720 1.476 -0.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.104 0.675 -1.444 1.00 0.00 H new ATOM 340 N ASN A 21 -14.836 2.925 -5.022 1.00 0.00 N ATOM 341 CA ASN A 21 -14.113 4.045 -5.615 1.00 0.00 C ATOM 342 C ASN A 21 -13.148 3.526 -6.666 1.00 0.00 C ATOM 343 O ASN A 21 -11.959 3.373 -6.420 1.00 0.00 O ATOM 344 CB ASN A 21 -13.345 4.860 -4.566 1.00 0.00 C ATOM 345 CG ASN A 21 -14.263 5.599 -3.598 1.00 0.00 C ATOM 346 OD1 ASN A 21 -14.695 6.716 -3.869 1.00 0.00 O ATOM 347 ND2 ASN A 21 -14.563 4.996 -2.448 1.00 0.00 N ATOM 0 H ASN A 21 -14.244 2.146 -4.732 1.00 0.00 H new ATOM 0 HA ASN A 21 -14.848 4.708 -6.071 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -12.692 4.193 -4.002 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -12.703 5.581 -5.072 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -15.164 5.463 -1.769 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -14.191 4.068 -2.247 1.00 0.00 H new ATOM 354 N PRO A 22 -13.662 3.248 -7.886 1.00 0.00 N ATOM 355 CA PRO A 22 -12.903 2.585 -8.935 1.00 0.00 C ATOM 356 C PRO A 22 -12.127 3.563 -9.815 1.00 0.00 C ATOM 357 O PRO A 22 -12.662 4.149 -10.747 1.00 0.00 O ATOM 358 CB PRO A 22 -13.992 1.863 -9.725 1.00 0.00 C ATOM 359 CG PRO A 22 -15.230 2.674 -9.557 1.00 0.00 C ATOM 360 CD PRO A 22 -15.027 3.553 -8.333 1.00 0.00 C ATOM 0 HA PRO A 22 -12.132 1.924 -8.540 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -13.720 1.780 -10.777 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -14.137 0.849 -9.352 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -15.414 3.283 -10.442 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.099 2.028 -9.428 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.138 4.609 -8.580 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -15.759 3.328 -7.557 1.00 0.00 H new ATOM 368 N ARG A 23 -10.864 3.757 -9.460 1.00 0.00 N ATOM 369 CA ARG A 23 -9.973 4.567 -10.271 1.00 0.00 C ATOM 370 C ARG A 23 -8.530 4.259 -9.922 1.00 0.00 C ATOM 371 O ARG A 23 -8.086 4.484 -8.802 1.00 0.00 O ATOM 372 CB ARG A 23 -10.241 6.062 -10.033 1.00 0.00 C ATOM 373 CG ARG A 23 -9.496 6.995 -10.961 1.00 0.00 C ATOM 374 CD ARG A 23 -9.794 8.462 -10.642 1.00 0.00 C ATOM 375 NE ARG A 23 -11.235 8.709 -10.638 1.00 0.00 N ATOM 376 CZ ARG A 23 -11.769 9.895 -10.343 1.00 0.00 C ATOM 377 NH1 ARG A 23 -11.008 10.945 -10.035 1.00 0.00 N ATOM 378 NH2 ARG A 23 -13.096 10.034 -10.323 1.00 0.00 N ATOM 0 H ARG A 23 -10.438 3.366 -8.620 1.00 0.00 H new ATOM 0 HA ARG A 23 -10.155 4.332 -11.320 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -11.310 6.246 -10.137 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.974 6.305 -9.005 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -8.424 6.814 -10.877 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.775 6.782 -11.993 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.373 8.720 -9.670 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -9.312 9.104 -11.379 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.861 7.938 -10.872 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -9.992 10.852 -10.021 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.441 11.841 -9.813 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.696 9.236 -10.533 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -13.511 10.938 -10.098 1.00 0.00 H new ATOM 392 N ASN A 24 -7.808 3.706 -10.883 1.00 0.00 N ATOM 393 CA ASN A 24 -6.382 3.436 -10.706 1.00 0.00 C ATOM 394 C ASN A 24 -5.597 4.329 -11.642 1.00 0.00 C ATOM 395 O ASN A 24 -4.470 4.009 -12.026 1.00 0.00 O ATOM 396 CB ASN A 24 -6.041 1.968 -10.968 1.00 0.00 C ATOM 397 CG ASN A 24 -6.442 1.057 -9.816 1.00 0.00 C ATOM 398 OD1 ASN A 24 -7.540 0.526 -9.798 1.00 0.00 O ATOM 399 ND2 ASN A 24 -5.539 0.887 -8.855 1.00 0.00 N ATOM 0 H ASN A 24 -8.180 3.434 -11.793 1.00 0.00 H new ATOM 0 HA ASN A 24 -6.116 3.646 -9.670 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -6.544 1.639 -11.878 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.969 1.874 -11.144 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.751 0.290 -8.056 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.634 1.354 -8.917 1.00 0.00 H new ATOM 406 N LYS A 25 -6.203 5.444 -12.006 1.00 0.00 N ATOM 407 CA LYS A 25 -5.580 6.412 -12.891 1.00 0.00 C ATOM 408 C LYS A 25 -5.168 7.651 -12.101 1.00 0.00 C ATOM 409 O LYS A 25 -6.010 8.491 -11.752 1.00 0.00 O ATOM 410 CB LYS A 25 -6.526 6.794 -14.011 1.00 0.00 C ATOM 411 CG LYS A 25 -5.987 7.856 -14.955 1.00 0.00 C ATOM 412 CD LYS A 25 -7.001 8.231 -16.009 1.00 0.00 C ATOM 413 CE LYS A 25 -6.473 9.318 -16.943 1.00 0.00 C ATOM 414 NZ LYS A 25 -7.485 9.709 -17.955 1.00 0.00 N ATOM 0 H LYS A 25 -7.140 5.704 -11.697 1.00 0.00 H new ATOM 0 HA LYS A 25 -4.691 5.961 -13.331 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.766 5.901 -14.588 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.459 7.152 -13.576 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.709 8.743 -14.385 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -5.080 7.489 -15.436 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.264 7.348 -16.591 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.915 8.578 -15.527 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -6.186 10.192 -16.359 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.574 8.961 -17.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.092 10.449 -18.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.741 8.880 -18.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.333 10.073 -17.475 1.00 0.00 H new ATOM 428 N GLY A 26 -3.889 7.739 -11.781 1.00 0.00 N ATOM 429 CA GLY A 26 -3.357 8.902 -11.112 1.00 0.00 C ATOM 430 C GLY A 26 -1.863 8.877 -11.109 1.00 0.00 C ATOM 431 O GLY A 26 -1.247 7.949 -10.583 1.00 0.00 O ATOM 0 H GLY A 26 -3.200 7.012 -11.977 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.709 9.806 -11.610 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.726 8.938 -10.087 1.00 0.00 H new ATOM 435 N VAL A 27 -1.230 9.873 -11.686 1.00 0.00 N ATOM 436 CA VAL A 27 0.214 9.870 -11.820 1.00 0.00 C ATOM 437 C VAL A 27 0.722 11.232 -12.240 1.00 0.00 C ATOM 438 O VAL A 27 0.546 11.656 -13.385 1.00 0.00 O ATOM 439 CB VAL A 27 0.692 8.783 -12.818 1.00 0.00 C ATOM 440 CG1 VAL A 27 -0.103 8.816 -14.110 1.00 0.00 C ATOM 441 CG2 VAL A 27 2.172 8.920 -13.092 1.00 0.00 C ATOM 0 H VAL A 27 -1.690 10.698 -12.071 1.00 0.00 H new ATOM 0 HA VAL A 27 0.630 9.632 -10.841 1.00 0.00 H new ATOM 0 HB VAL A 27 0.516 7.813 -12.353 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.263 8.040 -14.782 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.157 8.642 -13.893 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.014 9.791 -14.584 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.485 8.147 -13.794 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.373 9.902 -13.519 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.726 8.809 -12.160 1.00 0.00 H new ATOM 451 N LEU A 28 1.307 11.949 -11.302 1.00 0.00 N ATOM 452 CA LEU A 28 1.944 13.207 -11.632 1.00 0.00 C ATOM 453 C LEU A 28 3.397 12.968 -12.055 1.00 0.00 C ATOM 454 O LEU A 28 3.769 11.875 -12.483 1.00 0.00 O ATOM 455 CB LEU A 28 1.920 14.100 -10.390 1.00 0.00 C ATOM 456 CG LEU A 28 0.673 13.963 -9.515 1.00 0.00 C ATOM 457 CD1 LEU A 28 1.062 13.846 -8.053 1.00 0.00 C ATOM 458 CD2 LEU A 28 -0.254 15.152 -9.729 1.00 0.00 C ATOM 0 H LEU A 28 1.355 11.687 -10.317 1.00 0.00 H new ATOM 0 HA LEU A 28 1.412 13.683 -12.456 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.797 13.875 -9.783 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.010 15.139 -10.707 1.00 0.00 H new ATOM 0 HG LEU A 28 0.143 13.055 -9.802 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.163 13.749 -7.444 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.691 12.967 -7.913 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.611 14.737 -7.750 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.138 15.042 -9.100 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.267 16.072 -9.465 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.556 15.194 -10.775 1.00 0.00 H new ATOM 470 N ASN A 29 4.207 14.004 -11.888 1.00 0.00 N ATOM 471 CA ASN A 29 5.636 13.940 -12.224 1.00 0.00 C ATOM 472 C ASN A 29 6.377 15.136 -11.626 1.00 0.00 C ATOM 473 O ASN A 29 7.508 15.419 -11.997 1.00 0.00 O ATOM 474 CB ASN A 29 5.858 13.905 -13.741 1.00 0.00 C ATOM 475 CG ASN A 29 5.372 15.156 -14.462 1.00 0.00 C ATOM 476 OD1 ASN A 29 4.218 15.245 -14.877 1.00 0.00 O ATOM 477 ND2 ASN A 29 6.236 16.150 -14.601 1.00 0.00 N ATOM 0 H ASN A 29 3.904 14.906 -11.521 1.00 0.00 H new ATOM 0 HA ASN A 29 6.030 13.017 -11.799 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.921 13.772 -13.940 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.345 13.036 -14.154 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.950 17.014 -15.061 1.00 0.00 H new ATOM 0 HD22 ASN A 29 7.188 16.051 -14.248 1.00 0.00 H new ATOM 484 N ASP A 30 5.699 15.828 -10.720 1.00 0.00 N ATOM 485 CA ASP A 30 6.274 17.034 -10.126 1.00 0.00 C ATOM 486 C ASP A 30 6.876 16.757 -8.750 1.00 0.00 C ATOM 487 O ASP A 30 8.100 16.786 -8.596 1.00 0.00 O ATOM 488 CB ASP A 30 5.242 18.170 -10.066 1.00 0.00 C ATOM 489 CG ASP A 30 3.924 17.731 -9.468 1.00 0.00 C ATOM 490 OD1 ASP A 30 3.209 16.937 -10.120 1.00 0.00 O ATOM 491 OD2 ASP A 30 3.582 18.180 -8.359 1.00 0.00 O ATOM 0 H ASP A 30 4.768 15.584 -10.383 1.00 0.00 H new ATOM 0 HA ASP A 30 7.089 17.358 -10.774 1.00 0.00 H new ATOM 0 HB2 ASP A 30 5.647 18.993 -9.477 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.070 18.553 -11.072 1.00 0.00 H new ATOM 496 N SER A 31 6.020 16.514 -7.754 1.00 0.00 N ATOM 497 CA SER A 31 6.491 16.222 -6.406 1.00 0.00 C ATOM 498 C SER A 31 7.086 14.818 -6.336 1.00 0.00 C ATOM 499 O SER A 31 7.714 14.354 -7.297 1.00 0.00 O ATOM 500 CB SER A 31 5.328 16.402 -5.421 1.00 0.00 C ATOM 501 OG SER A 31 5.766 16.391 -4.068 1.00 0.00 O ATOM 0 H SER A 31 5.005 16.514 -7.858 1.00 0.00 H new ATOM 0 HA SER A 31 7.287 16.915 -6.133 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.820 17.343 -5.629 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.599 15.606 -5.572 1.00 0.00 H new ATOM 0 HG SER A 31 5.477 17.216 -3.624 1.00 0.00 H new ATOM 507 N ILE A 32 6.885 14.144 -5.226 1.00 0.00 N ATOM 508 CA ILE A 32 7.495 12.832 -5.070 1.00 0.00 C ATOM 509 C ILE A 32 6.721 11.760 -5.820 1.00 0.00 C ATOM 510 O ILE A 32 5.539 11.561 -5.589 1.00 0.00 O ATOM 511 CB ILE A 32 7.675 12.416 -3.602 1.00 0.00 C ATOM 512 CG1 ILE A 32 6.350 12.532 -2.847 1.00 0.00 C ATOM 513 CG2 ILE A 32 8.755 13.259 -2.940 1.00 0.00 C ATOM 514 CD1 ILE A 32 6.408 12.010 -1.442 1.00 0.00 C ATOM 0 H ILE A 32 6.323 14.464 -4.437 1.00 0.00 H new ATOM 0 HA ILE A 32 8.490 12.923 -5.505 1.00 0.00 H new ATOM 0 HB ILE A 32 7.992 11.374 -3.571 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.046 13.578 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.581 11.988 -3.396 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.870 12.952 -1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.699 13.119 -3.466 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.470 14.310 -2.978 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.432 12.126 -0.970 1.00 0.00 H new ATOM 0 HD12 ILE A 32 6.681 10.955 -1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 32 7.153 12.570 -0.876 1.00 0.00 H new ATOM 526 N VAL A 33 7.397 11.120 -6.750 1.00 0.00 N ATOM 527 CA VAL A 33 6.787 10.099 -7.592 1.00 0.00 C ATOM 528 C VAL A 33 7.489 8.765 -7.394 1.00 0.00 C ATOM 529 O VAL A 33 8.717 8.711 -7.362 1.00 0.00 O ATOM 530 CB VAL A 33 6.813 10.527 -9.074 1.00 0.00 C ATOM 531 CG1 VAL A 33 6.301 9.410 -9.978 1.00 0.00 C ATOM 532 CG2 VAL A 33 5.985 11.798 -9.278 1.00 0.00 C ATOM 0 H VAL A 33 8.383 11.288 -6.948 1.00 0.00 H new ATOM 0 HA VAL A 33 5.744 9.982 -7.298 1.00 0.00 H new ATOM 0 HB VAL A 33 7.848 10.735 -9.346 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.331 9.740 -11.016 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.931 8.528 -9.859 1.00 0.00 H new ATOM 0 HG13 VAL A 33 5.275 9.163 -9.705 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.014 12.086 -10.329 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.953 11.611 -8.981 1.00 0.00 H new ATOM 0 HG23 VAL A 33 6.398 12.603 -8.670 1.00 0.00 H new ATOM 542 N VAL A 34 6.706 7.703 -7.257 1.00 0.00 N ATOM 543 CA VAL A 34 7.226 6.375 -6.977 1.00 0.00 C ATOM 544 C VAL A 34 6.756 5.401 -8.055 1.00 0.00 C ATOM 545 O VAL A 34 5.555 5.204 -8.216 1.00 0.00 O ATOM 546 CB VAL A 34 6.741 5.900 -5.594 1.00 0.00 C ATOM 547 CG1 VAL A 34 7.142 4.467 -5.309 1.00 0.00 C ATOM 548 CG2 VAL A 34 7.250 6.820 -4.504 1.00 0.00 C ATOM 0 H VAL A 34 5.690 7.740 -7.338 1.00 0.00 H new ATOM 0 HA VAL A 34 8.315 6.411 -6.976 1.00 0.00 H new ATOM 0 HB VAL A 34 5.652 5.936 -5.606 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.778 4.177 -4.323 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.708 3.811 -6.064 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.228 4.381 -5.335 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.896 6.467 -3.535 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.340 6.826 -4.512 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.881 7.830 -4.679 1.00 0.00 H new ATOM 558 N ASP A 35 7.691 4.792 -8.771 1.00 0.00 N ATOM 559 CA ASP A 35 7.347 3.880 -9.865 1.00 0.00 C ATOM 560 C ASP A 35 7.914 2.496 -9.610 1.00 0.00 C ATOM 561 O ASP A 35 9.129 2.331 -9.481 1.00 0.00 O ATOM 562 CB ASP A 35 7.871 4.427 -11.187 1.00 0.00 C ATOM 563 CG ASP A 35 7.672 3.483 -12.354 1.00 0.00 C ATOM 564 OD1 ASP A 35 6.578 3.471 -12.930 1.00 0.00 O ATOM 565 OD2 ASP A 35 8.621 2.776 -12.720 1.00 0.00 O ATOM 0 H ASP A 35 8.693 4.909 -8.618 1.00 0.00 H new ATOM 0 HA ASP A 35 6.261 3.801 -9.919 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.371 5.371 -11.404 1.00 0.00 H new ATOM 0 HB3 ASP A 35 8.934 4.646 -11.084 1.00 0.00 H new ATOM 570 N MET A 36 7.029 1.506 -9.505 1.00 0.00 N ATOM 571 CA MET A 36 7.436 0.122 -9.290 1.00 0.00 C ATOM 572 C MET A 36 6.515 -0.841 -10.023 1.00 0.00 C ATOM 573 O MET A 36 5.309 -0.836 -9.815 1.00 0.00 O ATOM 574 CB MET A 36 7.426 -0.218 -7.797 1.00 0.00 C ATOM 575 CG MET A 36 8.585 0.359 -6.999 1.00 0.00 C ATOM 576 SD MET A 36 10.088 -0.655 -7.086 1.00 0.00 S ATOM 577 CE MET A 36 10.625 -0.368 -8.778 1.00 0.00 C ATOM 0 H MET A 36 6.020 1.640 -9.566 1.00 0.00 H new ATOM 0 HA MET A 36 8.447 0.016 -9.682 1.00 0.00 H new ATOM 0 HB2 MET A 36 6.492 0.141 -7.364 1.00 0.00 H new ATOM 0 HB3 MET A 36 7.433 -1.302 -7.687 1.00 0.00 H new ATOM 0 HG2 MET A 36 8.808 1.360 -7.367 1.00 0.00 H new ATOM 0 HG3 MET A 36 8.284 0.462 -5.956 1.00 0.00 H new ATOM 0 HE1 MET A 36 11.650 -0.718 -8.899 1.00 0.00 H new ATOM 0 HE2 MET A 36 9.974 -0.910 -9.463 1.00 0.00 H new ATOM 0 HE3 MET A 36 10.577 0.698 -8.999 1.00 0.00 H new ATOM 587 N ASN A 37 7.080 -1.639 -10.912 1.00 0.00 N ATOM 588 CA ASN A 37 6.329 -2.718 -11.557 1.00 0.00 C ATOM 589 C ASN A 37 7.004 -4.048 -11.234 1.00 0.00 C ATOM 590 O ASN A 37 8.180 -4.062 -10.878 1.00 0.00 O ATOM 591 CB ASN A 37 6.241 -2.517 -13.080 1.00 0.00 C ATOM 592 CG ASN A 37 7.431 -3.087 -13.851 1.00 0.00 C ATOM 593 OD1 ASN A 37 7.417 -4.242 -14.271 1.00 0.00 O ATOM 594 ND2 ASN A 37 8.441 -2.256 -14.056 1.00 0.00 N ATOM 0 H ASN A 37 8.053 -1.566 -11.208 1.00 0.00 H new ATOM 0 HA ASN A 37 5.309 -2.713 -11.173 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.327 -2.984 -13.446 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.161 -1.451 -13.292 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.257 -2.565 -14.584 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.403 -1.306 -13.686 1.00 0.00 H new ATOM 601 N ASN A 38 6.265 -5.153 -11.345 1.00 0.00 N ATOM 602 CA ASN A 38 6.824 -6.443 -11.032 1.00 0.00 C ATOM 603 C ASN A 38 6.892 -7.295 -12.291 1.00 0.00 C ATOM 604 O ASN A 38 5.888 -7.859 -12.742 1.00 0.00 O ATOM 605 CB ASN A 38 5.998 -7.133 -9.952 1.00 0.00 C ATOM 606 CG ASN A 38 6.435 -8.564 -9.668 1.00 0.00 C ATOM 607 OD1 ASN A 38 7.579 -8.945 -9.937 1.00 0.00 O ATOM 608 ND2 ASN A 38 5.538 -9.360 -9.109 1.00 0.00 N ATOM 0 H ASN A 38 5.291 -5.169 -11.647 1.00 0.00 H new ATOM 0 HA ASN A 38 7.835 -6.310 -10.648 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.063 -6.553 -9.031 1.00 0.00 H new ATOM 0 HB3 ASN A 38 4.951 -7.135 -10.254 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.781 -10.325 -8.885 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.603 -9.009 -8.902 1.00 0.00 H new ATOM 615 N PRO A 39 8.078 -7.368 -12.889 1.00 0.00 N ATOM 616 CA PRO A 39 8.286 -8.033 -14.178 1.00 0.00 C ATOM 617 C PRO A 39 7.872 -9.502 -14.168 1.00 0.00 C ATOM 618 O PRO A 39 7.636 -10.106 -15.228 1.00 0.00 O ATOM 619 CB PRO A 39 9.790 -7.904 -14.419 1.00 0.00 C ATOM 620 CG PRO A 39 10.208 -6.747 -13.580 1.00 0.00 C ATOM 621 CD PRO A 39 9.329 -6.798 -12.375 1.00 0.00 C ATOM 0 HA PRO A 39 7.675 -7.579 -14.958 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.317 -8.814 -14.131 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.009 -7.729 -15.472 1.00 0.00 H new ATOM 0 HG2 PRO A 39 11.260 -6.821 -13.303 1.00 0.00 H new ATOM 0 HG3 PRO A 39 10.085 -5.807 -14.117 1.00 0.00 H new ATOM 0 HD2 PRO A 39 9.760 -7.419 -11.589 1.00 0.00 H new ATOM 0 HD3 PRO A 39 9.174 -5.807 -11.949 1.00 0.00 H new ATOM 629 N THR A 40 7.776 -10.069 -12.968 1.00 0.00 N ATOM 630 CA THR A 40 7.402 -11.457 -12.824 1.00 0.00 C ATOM 631 C THR A 40 5.991 -11.696 -13.355 1.00 0.00 C ATOM 632 O THR A 40 5.746 -12.684 -14.057 1.00 0.00 O ATOM 633 CB THR A 40 7.491 -11.905 -11.355 1.00 0.00 C ATOM 634 OG1 THR A 40 8.809 -11.660 -10.848 1.00 0.00 O ATOM 635 CG2 THR A 40 7.150 -13.385 -11.203 1.00 0.00 C ATOM 0 H THR A 40 7.953 -9.583 -12.089 1.00 0.00 H new ATOM 0 HA THR A 40 8.104 -12.050 -13.410 1.00 0.00 H new ATOM 0 HB THR A 40 6.764 -11.327 -10.784 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.842 -10.770 -10.440 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.222 -13.669 -10.153 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.135 -13.563 -11.558 1.00 0.00 H new ATOM 0 HG23 THR A 40 7.849 -13.981 -11.789 1.00 0.00 H new ATOM 643 N CYS A 41 5.063 -10.805 -13.024 1.00 0.00 N ATOM 644 CA CYS A 41 3.672 -11.019 -13.408 1.00 0.00 C ATOM 645 C CYS A 41 2.993 -9.790 -14.032 1.00 0.00 C ATOM 646 O CYS A 41 1.776 -9.795 -14.187 1.00 0.00 O ATOM 647 CB CYS A 41 2.872 -11.530 -12.212 1.00 0.00 C ATOM 648 SG CYS A 41 3.001 -10.516 -10.716 1.00 0.00 S ATOM 0 H CYS A 41 5.241 -9.947 -12.503 1.00 0.00 H new ATOM 0 HA CYS A 41 3.687 -11.772 -14.196 1.00 0.00 H new ATOM 0 HB2 CYS A 41 1.822 -11.597 -12.498 1.00 0.00 H new ATOM 0 HB3 CYS A 41 3.204 -12.541 -11.977 1.00 0.00 H new ATOM 654 N GLY A 42 3.732 -8.724 -14.333 1.00 0.00 N ATOM 655 CA GLY A 42 3.207 -7.712 -15.235 1.00 0.00 C ATOM 656 C GLY A 42 2.386 -6.648 -14.536 1.00 0.00 C ATOM 657 O GLY A 42 1.743 -5.812 -15.187 1.00 0.00 O ATOM 0 H GLY A 42 4.670 -8.544 -13.975 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.037 -7.235 -15.756 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.591 -8.196 -15.993 1.00 0.00 H new ATOM 661 N ASP A 43 2.369 -6.688 -13.216 1.00 0.00 N ATOM 662 CA ASP A 43 1.679 -5.683 -12.432 1.00 0.00 C ATOM 663 C ASP A 43 2.559 -4.447 -12.270 1.00 0.00 C ATOM 664 O ASP A 43 3.787 -4.539 -12.223 1.00 0.00 O ATOM 665 CB ASP A 43 1.254 -6.229 -11.047 1.00 0.00 C ATOM 666 CG ASP A 43 2.017 -7.459 -10.588 1.00 0.00 C ATOM 667 OD1 ASP A 43 3.202 -7.606 -10.908 1.00 0.00 O ATOM 668 OD2 ASP A 43 1.410 -8.318 -9.912 1.00 0.00 O ATOM 0 H ASP A 43 2.829 -7.411 -12.663 1.00 0.00 H new ATOM 0 HA ASP A 43 0.771 -5.408 -12.968 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.383 -5.440 -10.306 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.191 -6.468 -11.076 1.00 0.00 H new ATOM 673 N ARG A 44 1.929 -3.278 -12.226 1.00 0.00 N ATOM 674 CA ARG A 44 2.640 -2.014 -12.055 1.00 0.00 C ATOM 675 C ARG A 44 1.875 -1.091 -11.115 1.00 0.00 C ATOM 676 O ARG A 44 0.633 -1.133 -11.067 1.00 0.00 O ATOM 677 CB ARG A 44 2.853 -1.323 -13.396 1.00 0.00 C ATOM 678 CG ARG A 44 3.767 -0.107 -13.308 1.00 0.00 C ATOM 679 CD ARG A 44 3.998 0.510 -14.660 1.00 0.00 C ATOM 680 NE ARG A 44 5.055 1.515 -14.649 1.00 0.00 N ATOM 681 CZ ARG A 44 5.738 1.911 -15.715 1.00 0.00 C ATOM 682 NH1 ARG A 44 5.446 1.381 -16.896 1.00 0.00 N ATOM 683 NH2 ARG A 44 6.698 2.803 -15.592 1.00 0.00 N ATOM 0 H ARG A 44 0.917 -3.179 -12.307 1.00 0.00 H new ATOM 0 HA ARG A 44 3.614 -2.236 -11.619 1.00 0.00 H new ATOM 0 HB2 ARG A 44 3.277 -2.037 -14.102 1.00 0.00 H new ATOM 0 HB3 ARG A 44 1.887 -1.015 -13.796 1.00 0.00 H new ATOM 0 HG2 ARG A 44 3.326 0.633 -12.640 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.722 -0.400 -12.873 1.00 0.00 H new ATOM 0 HD2 ARG A 44 4.255 -0.273 -15.373 1.00 0.00 H new ATOM 0 HD3 ARG A 44 3.072 0.967 -15.009 1.00 0.00 H new ATOM 0 HE ARG A 44 5.287 1.946 -13.754 1.00 0.00 H new ATOM 0 HH11 ARG A 44 4.707 0.682 -16.973 1.00 0.00 H new ATOM 0 HH12 ARG A 44 5.960 1.673 -17.727 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.919 3.192 -14.675 1.00 0.00 H new ATOM 0 HH22 ARG A 44 7.221 3.105 -16.414 1.00 0.00 H new ATOM 697 N ILE A 45 2.605 -0.276 -10.380 1.00 0.00 N ATOM 698 CA ILE A 45 2.026 0.736 -9.532 1.00 0.00 C ATOM 699 C ILE A 45 2.858 2.025 -9.604 1.00 0.00 C ATOM 700 O ILE A 45 4.078 1.976 -9.773 1.00 0.00 O ATOM 701 CB ILE A 45 1.928 0.250 -8.058 1.00 0.00 C ATOM 702 CG1 ILE A 45 1.123 1.231 -7.208 1.00 0.00 C ATOM 703 CG2 ILE A 45 3.334 0.066 -7.479 1.00 0.00 C ATOM 704 CD1 ILE A 45 1.017 0.852 -5.746 1.00 0.00 C ATOM 0 H ILE A 45 3.624 -0.301 -10.357 1.00 0.00 H new ATOM 0 HA ILE A 45 1.016 0.937 -9.891 1.00 0.00 H new ATOM 0 HB ILE A 45 1.407 -0.707 -8.043 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.580 2.218 -7.283 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.119 1.313 -7.623 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.260 -0.275 -6.446 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.876 -0.674 -8.068 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.868 1.016 -7.511 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.429 1.603 -5.217 1.00 0.00 H new ATOM 0 HD12 ILE A 45 0.530 -0.119 -5.656 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.015 0.799 -5.310 1.00 0.00 H new ATOM 716 N ARG A 46 2.201 3.170 -9.494 1.00 0.00 N ATOM 717 CA ARG A 46 2.877 4.448 -9.547 1.00 0.00 C ATOM 718 C ARG A 46 2.258 5.419 -8.539 1.00 0.00 C ATOM 719 O ARG A 46 1.195 5.998 -8.778 1.00 0.00 O ATOM 720 CB ARG A 46 2.826 5.042 -10.966 1.00 0.00 C ATOM 721 CG ARG A 46 3.775 4.355 -11.944 1.00 0.00 C ATOM 722 CD ARG A 46 3.695 4.937 -13.341 1.00 0.00 C ATOM 723 NE ARG A 46 3.989 6.381 -13.363 1.00 0.00 N ATOM 724 CZ ARG A 46 5.205 6.886 -13.480 1.00 0.00 C ATOM 725 NH1 ARG A 46 6.265 6.092 -13.502 1.00 0.00 N ATOM 726 NH2 ARG A 46 5.393 8.201 -13.559 1.00 0.00 N ATOM 0 H ARG A 46 1.191 3.235 -9.366 1.00 0.00 H new ATOM 0 HA ARG A 46 3.923 4.290 -9.285 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.807 4.968 -11.347 1.00 0.00 H new ATOM 0 HB3 ARG A 46 3.072 6.103 -10.917 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.797 4.444 -11.576 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.542 3.291 -11.984 1.00 0.00 H new ATOM 0 HD2 ARG A 46 4.398 4.415 -13.990 1.00 0.00 H new ATOM 0 HD3 ARG A 46 2.698 4.765 -13.747 1.00 0.00 H new ATOM 0 HE ARG A 46 3.206 7.030 -13.283 1.00 0.00 H new ATOM 0 HH11 ARG A 46 6.147 5.082 -13.428 1.00 0.00 H new ATOM 0 HH12 ARG A 46 7.199 6.491 -13.593 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.593 8.833 -13.530 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.337 8.577 -13.649 1.00 0.00 H new ATOM 740 N LEU A 47 2.933 5.563 -7.400 1.00 0.00 N ATOM 741 CA LEU A 47 2.484 6.426 -6.338 1.00 0.00 C ATOM 742 C LEU A 47 3.062 7.820 -6.538 1.00 0.00 C ATOM 743 O LEU A 47 4.183 8.105 -6.120 1.00 0.00 O ATOM 744 CB LEU A 47 2.937 5.894 -4.967 1.00 0.00 C ATOM 745 CG LEU A 47 2.077 6.270 -3.751 1.00 0.00 C ATOM 746 CD1 LEU A 47 2.857 6.036 -2.466 1.00 0.00 C ATOM 747 CD2 LEU A 47 1.594 7.710 -3.810 1.00 0.00 C ATOM 0 H LEU A 47 3.807 5.078 -7.199 1.00 0.00 H new ATOM 0 HA LEU A 47 1.395 6.458 -6.363 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.984 4.807 -5.025 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.952 6.247 -4.786 1.00 0.00 H new ATOM 0 HG LEU A 47 1.195 5.629 -3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.238 6.306 -1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.135 4.984 -2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.758 6.650 -2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.990 7.928 -2.929 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.453 8.381 -3.837 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.992 7.855 -4.707 1.00 0.00 H new ATOM 759 N THR A 48 2.339 8.686 -7.216 1.00 0.00 N ATOM 760 CA THR A 48 2.743 10.065 -7.353 1.00 0.00 C ATOM 761 C THR A 48 2.103 10.898 -6.261 1.00 0.00 C ATOM 762 O THR A 48 0.911 10.798 -6.015 1.00 0.00 O ATOM 763 CB THR A 48 2.362 10.594 -8.734 1.00 0.00 C ATOM 764 OG1 THR A 48 0.948 10.544 -8.903 1.00 0.00 O ATOM 765 CG2 THR A 48 3.031 9.762 -9.817 1.00 0.00 C ATOM 0 H THR A 48 1.462 8.455 -7.683 1.00 0.00 H new ATOM 0 HA THR A 48 3.826 10.132 -7.252 1.00 0.00 H new ATOM 0 HB THR A 48 2.699 11.627 -8.816 1.00 0.00 H new ATOM 0 HG1 THR A 48 0.566 9.900 -8.271 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.752 10.149 -10.797 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.113 9.816 -9.700 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.708 8.725 -9.731 1.00 0.00 H new ATOM 773 N MET A 49 2.892 11.704 -5.571 1.00 0.00 N ATOM 774 CA MET A 49 2.419 12.409 -4.416 1.00 0.00 C ATOM 775 C MET A 49 2.697 13.888 -4.539 1.00 0.00 C ATOM 776 O MET A 49 3.226 14.355 -5.549 1.00 0.00 O ATOM 777 CB MET A 49 3.067 11.898 -3.115 1.00 0.00 C ATOM 778 CG MET A 49 2.371 10.679 -2.518 1.00 0.00 C ATOM 779 SD MET A 49 3.048 10.226 -0.906 1.00 0.00 S ATOM 780 CE MET A 49 1.993 8.868 -0.448 1.00 0.00 C ATOM 0 H MET A 49 3.870 11.880 -5.802 1.00 0.00 H new ATOM 0 HA MET A 49 1.345 12.230 -4.367 1.00 0.00 H new ATOM 0 HB2 MET A 49 4.110 11.649 -3.313 1.00 0.00 H new ATOM 0 HB3 MET A 49 3.066 12.702 -2.379 1.00 0.00 H new ATOM 0 HG2 MET A 49 1.305 10.885 -2.418 1.00 0.00 H new ATOM 0 HG3 MET A 49 2.470 9.836 -3.201 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.772 8.922 0.618 1.00 0.00 H new ATOM 0 HE2 MET A 49 1.063 8.922 -1.015 1.00 0.00 H new ATOM 0 HE3 MET A 49 2.497 7.926 -0.666 1.00 0.00 H new ATOM 790 N LYS A 50 2.340 14.603 -3.506 1.00 0.00 N ATOM 791 CA LYS A 50 2.508 16.027 -3.458 1.00 0.00 C ATOM 792 C LYS A 50 2.453 16.431 -2.009 1.00 0.00 C ATOM 793 O LYS A 50 1.414 16.327 -1.386 1.00 0.00 O ATOM 794 CB LYS A 50 1.402 16.701 -4.283 1.00 0.00 C ATOM 795 CG LYS A 50 1.756 18.068 -4.843 1.00 0.00 C ATOM 796 CD LYS A 50 1.757 19.152 -3.789 1.00 0.00 C ATOM 797 CE LYS A 50 1.961 20.529 -4.408 1.00 0.00 C ATOM 798 NZ LYS A 50 1.813 21.615 -3.407 1.00 0.00 N ATOM 0 H LYS A 50 1.920 14.207 -2.665 1.00 0.00 H new ATOM 0 HA LYS A 50 3.461 16.338 -3.885 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.137 16.044 -5.111 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.514 16.800 -3.658 1.00 0.00 H new ATOM 0 HG2 LYS A 50 2.740 18.021 -5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.044 18.330 -5.626 1.00 0.00 H new ATOM 0 HD2 LYS A 50 0.813 19.133 -3.244 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.547 18.956 -3.064 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.953 20.582 -4.856 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.240 20.676 -5.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.537 22.495 -3.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.080 21.353 -2.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.718 21.759 -2.914 1.00 0.00 H new ATOM 812 N LEU A 51 3.564 16.862 -1.456 1.00 0.00 N ATOM 813 CA LEU A 51 3.648 17.078 -0.026 1.00 0.00 C ATOM 814 C LEU A 51 4.187 18.476 0.231 1.00 0.00 C ATOM 815 O LEU A 51 5.399 18.724 0.212 1.00 0.00 O ATOM 816 CB LEU A 51 4.506 15.991 0.674 1.00 0.00 C ATOM 817 CG LEU A 51 6.021 16.002 0.389 1.00 0.00 C ATOM 818 CD1 LEU A 51 6.741 15.077 1.344 1.00 0.00 C ATOM 819 CD2 LEU A 51 6.312 15.597 -1.061 1.00 0.00 C ATOM 0 H LEU A 51 4.420 17.070 -1.971 1.00 0.00 H new ATOM 0 HA LEU A 51 2.650 16.996 0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 51 4.363 16.088 1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 51 4.115 15.015 0.388 1.00 0.00 H new ATOM 0 HG LEU A 51 6.386 17.018 0.538 1.00 0.00 H new ATOM 0 HD11 LEU A 51 7.810 15.095 1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 51 6.569 15.407 2.369 1.00 0.00 H new ATOM 0 HD13 LEU A 51 6.363 14.062 1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.388 15.613 -1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 51 5.931 14.592 -1.242 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.825 16.297 -1.739 1.00 0.00 H new ATOM 831 N ASP A 52 3.289 19.409 0.415 1.00 0.00 N ATOM 832 CA ASP A 52 3.667 20.816 0.485 1.00 0.00 C ATOM 833 C ASP A 52 3.685 21.276 1.931 1.00 0.00 C ATOM 834 O ASP A 52 2.923 22.139 2.341 1.00 0.00 O ATOM 835 CB ASP A 52 2.669 21.642 -0.336 1.00 0.00 C ATOM 836 CG ASP A 52 3.009 23.111 -0.420 1.00 0.00 C ATOM 837 OD1 ASP A 52 4.038 23.453 -1.034 1.00 0.00 O ATOM 838 OD2 ASP A 52 2.229 23.938 0.088 1.00 0.00 O ATOM 0 H ASP A 52 2.290 19.231 0.520 1.00 0.00 H new ATOM 0 HA ASP A 52 4.667 20.953 0.073 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.618 21.233 -1.345 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.677 21.534 0.102 1.00 0.00 H new ATOM 843 N GLY A 53 4.520 20.630 2.721 1.00 0.00 N ATOM 844 CA GLY A 53 4.766 21.111 4.050 1.00 0.00 C ATOM 845 C GLY A 53 5.041 19.953 4.968 1.00 0.00 C ATOM 846 O GLY A 53 6.173 19.496 5.083 1.00 0.00 O ATOM 0 H GLY A 53 5.029 19.784 2.464 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.615 21.795 4.048 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.904 21.674 4.408 1.00 0.00 H new ATOM 850 N ASP A 54 4.001 19.491 5.640 1.00 0.00 N ATOM 851 CA ASP A 54 4.123 18.388 6.581 1.00 0.00 C ATOM 852 C ASP A 54 2.994 17.392 6.334 1.00 0.00 C ATOM 853 O ASP A 54 2.609 16.633 7.224 1.00 0.00 O ATOM 854 CB ASP A 54 4.042 18.903 8.024 1.00 0.00 C ATOM 855 CG ASP A 54 5.120 19.915 8.345 1.00 0.00 C ATOM 856 OD1 ASP A 54 6.239 19.497 8.748 1.00 0.00 O ATOM 857 OD2 ASP A 54 4.875 21.134 8.186 1.00 0.00 O ATOM 0 H ASP A 54 3.056 19.865 5.551 1.00 0.00 H new ATOM 0 HA ASP A 54 5.088 17.903 6.436 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.064 19.355 8.190 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.124 18.061 8.711 1.00 0.00 H new ATOM 862 N ILE A 55 2.477 17.392 5.110 1.00 0.00 N ATOM 863 CA ILE A 55 1.308 16.601 4.772 1.00 0.00 C ATOM 864 C ILE A 55 1.531 15.998 3.398 1.00 0.00 C ATOM 865 O ILE A 55 2.383 16.472 2.639 1.00 0.00 O ATOM 866 CB ILE A 55 0.019 17.460 4.733 1.00 0.00 C ATOM 867 CG1 ILE A 55 -0.133 18.232 3.397 1.00 0.00 C ATOM 868 CG2 ILE A 55 -0.047 18.416 5.904 1.00 0.00 C ATOM 869 CD1 ILE A 55 1.031 19.129 3.015 1.00 0.00 C ATOM 0 H ILE A 55 2.855 17.936 4.334 1.00 0.00 H new ATOM 0 HA ILE A 55 1.176 15.834 5.535 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.816 16.764 4.809 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.287 17.508 2.597 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.034 18.842 3.453 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -0.964 19.002 5.844 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -0.038 17.851 6.836 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.813 19.085 5.877 1.00 0.00 H new ATOM 0 HD11 ILE A 55 0.817 19.618 2.065 1.00 0.00 H new ATOM 0 HD12 ILE A 55 1.177 19.884 3.787 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.936 18.529 2.918 1.00 0.00 H new ATOM 881 N VAL A 56 0.801 14.951 3.078 1.00 0.00 N ATOM 882 CA VAL A 56 0.711 14.503 1.708 1.00 0.00 C ATOM 883 C VAL A 56 -0.550 15.120 1.120 1.00 0.00 C ATOM 884 O VAL A 56 -1.678 14.666 1.306 1.00 0.00 O ATOM 885 CB VAL A 56 0.752 12.943 1.606 1.00 0.00 C ATOM 886 CG1 VAL A 56 -0.177 12.336 2.601 1.00 0.00 C ATOM 887 CG2 VAL A 56 0.427 12.405 0.215 1.00 0.00 C ATOM 0 H VAL A 56 0.264 14.397 3.746 1.00 0.00 H new ATOM 0 HA VAL A 56 1.574 14.832 1.128 1.00 0.00 H new ATOM 0 HB VAL A 56 1.782 12.659 1.819 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.139 11.250 2.519 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.120 12.635 3.606 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -1.193 12.679 2.406 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.476 11.316 0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.576 12.720 -0.072 1.00 0.00 H new ATOM 0 HG23 VAL A 56 1.149 12.794 -0.503 1.00 0.00 H new ATOM 897 N GLU A 57 -0.300 16.230 0.430 1.00 0.00 N ATOM 898 CA GLU A 57 -1.332 17.166 -0.012 1.00 0.00 C ATOM 899 C GLU A 57 -2.221 16.513 -1.040 1.00 0.00 C ATOM 900 O GLU A 57 -3.445 16.670 -1.030 1.00 0.00 O ATOM 901 CB GLU A 57 -0.673 18.430 -0.584 1.00 0.00 C ATOM 902 CG GLU A 57 -1.670 19.521 -0.968 1.00 0.00 C ATOM 903 CD GLU A 57 -0.996 20.788 -1.445 1.00 0.00 C ATOM 904 OE1 GLU A 57 -0.664 21.635 -0.606 1.00 0.00 O ATOM 905 OE2 GLU A 57 -0.769 20.949 -2.677 1.00 0.00 O ATOM 0 H GLU A 57 0.642 16.510 0.157 1.00 0.00 H new ATOM 0 HA GLU A 57 -1.950 17.450 0.840 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.025 18.830 0.152 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.088 18.158 -1.463 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.327 19.147 -1.753 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.299 19.751 -0.108 1.00 0.00 H new ATOM 912 N ASP A 58 -1.596 15.785 -1.932 1.00 0.00 N ATOM 913 CA ASP A 58 -2.321 14.986 -2.921 1.00 0.00 C ATOM 914 C ASP A 58 -1.515 13.748 -3.263 1.00 0.00 C ATOM 915 O ASP A 58 -0.280 13.775 -3.212 1.00 0.00 O ATOM 916 CB ASP A 58 -2.617 15.812 -4.181 1.00 0.00 C ATOM 917 CG ASP A 58 -3.513 15.064 -5.154 1.00 0.00 C ATOM 918 OD1 ASP A 58 -4.576 14.571 -4.728 1.00 0.00 O ATOM 919 OD2 ASP A 58 -3.178 15.009 -6.353 1.00 0.00 O ATOM 0 H ASP A 58 -0.580 15.721 -2.003 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.277 14.679 -2.496 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -3.094 16.750 -3.896 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.680 16.069 -4.675 1.00 0.00 H new ATOM 924 N ALA A 59 -2.191 12.658 -3.543 1.00 0.00 N ATOM 925 CA ALA A 59 -1.544 11.412 -3.882 1.00 0.00 C ATOM 926 C ALA A 59 -2.369 10.657 -4.911 1.00 0.00 C ATOM 927 O ALA A 59 -3.536 10.349 -4.677 1.00 0.00 O ATOM 928 CB ALA A 59 -1.348 10.573 -2.630 1.00 0.00 C ATOM 0 H ALA A 59 -3.210 12.611 -3.542 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.566 11.623 -4.315 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.860 9.635 -2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.727 11.119 -1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.317 10.363 -2.177 1.00 0.00 H new ATOM 934 N LYS A 60 -1.751 10.371 -6.046 1.00 0.00 N ATOM 935 CA LYS A 60 -2.417 9.681 -7.123 1.00 0.00 C ATOM 936 C LYS A 60 -1.609 8.457 -7.525 1.00 0.00 C ATOM 937 O LYS A 60 -0.375 8.493 -7.546 1.00 0.00 O ATOM 938 CB LYS A 60 -2.593 10.623 -8.326 1.00 0.00 C ATOM 939 CG LYS A 60 -3.568 11.751 -8.035 1.00 0.00 C ATOM 940 CD LYS A 60 -3.550 12.813 -9.131 1.00 0.00 C ATOM 941 CE LYS A 60 -4.634 13.844 -8.886 1.00 0.00 C ATOM 942 NZ LYS A 60 -4.479 15.034 -9.753 1.00 0.00 N ATOM 0 H LYS A 60 -0.779 10.612 -6.240 1.00 0.00 H new ATOM 0 HA LYS A 60 -3.403 9.360 -6.787 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.625 11.043 -8.600 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.947 10.051 -9.184 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -4.575 11.345 -7.939 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -3.317 12.211 -7.079 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -2.575 13.300 -9.158 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -3.699 12.344 -10.103 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -5.610 13.392 -9.063 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -4.610 14.152 -7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -5.241 15.712 -9.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.559 15.482 -9.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.528 14.745 -10.751 1.00 0.00 H new ATOM 956 N PHE A 61 -2.299 7.367 -7.826 1.00 0.00 N ATOM 957 CA PHE A 61 -1.662 6.101 -8.078 1.00 0.00 C ATOM 958 C PHE A 61 -2.141 5.514 -9.402 1.00 0.00 C ATOM 959 O PHE A 61 -3.305 5.651 -9.770 1.00 0.00 O ATOM 960 CB PHE A 61 -1.974 5.122 -6.929 1.00 0.00 C ATOM 961 CG PHE A 61 -3.444 4.891 -6.754 1.00 0.00 C ATOM 962 CD1 PHE A 61 -4.227 5.816 -6.094 1.00 0.00 C ATOM 963 CD2 PHE A 61 -4.045 3.750 -7.259 1.00 0.00 C ATOM 964 CE1 PHE A 61 -5.580 5.622 -5.939 1.00 0.00 C ATOM 965 CE2 PHE A 61 -5.396 3.547 -7.106 1.00 0.00 C ATOM 966 CZ PHE A 61 -6.166 4.481 -6.450 1.00 0.00 C ATOM 0 H PHE A 61 -3.316 7.344 -7.900 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.585 6.259 -8.137 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.481 4.170 -7.124 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.558 5.513 -6.000 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.769 6.708 -5.692 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.448 3.014 -7.777 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.179 6.357 -5.422 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -5.855 2.653 -7.501 1.00 0.00 H new ATOM 0 HZ PHE A 61 -7.228 4.321 -6.335 1.00 0.00 H new ATOM 976 N GLU A 62 -1.244 4.868 -10.111 1.00 0.00 N ATOM 977 CA GLU A 62 -1.587 4.255 -11.380 1.00 0.00 C ATOM 978 C GLU A 62 -1.389 2.748 -11.268 1.00 0.00 C ATOM 979 O GLU A 62 -0.258 2.278 -11.087 1.00 0.00 O ATOM 980 CB GLU A 62 -0.719 4.833 -12.505 1.00 0.00 C ATOM 981 CG GLU A 62 -1.063 4.272 -13.869 1.00 0.00 C ATOM 982 CD GLU A 62 -0.200 4.855 -14.969 1.00 0.00 C ATOM 983 OE1 GLU A 62 0.992 4.495 -15.047 1.00 0.00 O ATOM 984 OE2 GLU A 62 -0.716 5.682 -15.756 1.00 0.00 O ATOM 0 H GLU A 62 -0.270 4.752 -9.833 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.629 4.467 -11.620 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.835 5.917 -12.525 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.329 4.628 -12.288 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -0.944 3.189 -13.854 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.111 4.474 -14.088 1.00 0.00 H new ATOM 991 N GLY A 63 -2.480 1.992 -11.352 1.00 0.00 N ATOM 992 CA GLY A 63 -2.408 0.573 -11.109 1.00 0.00 C ATOM 993 C GLY A 63 -2.871 -0.259 -12.285 1.00 0.00 C ATOM 994 O GLY A 63 -3.958 -0.055 -12.813 1.00 0.00 O ATOM 0 H GLY A 63 -3.409 2.342 -11.584 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.380 0.305 -10.865 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.016 0.329 -10.238 1.00 0.00 H new ATOM 998 N GLU A 64 -2.030 -1.213 -12.676 1.00 0.00 N ATOM 999 CA GLU A 64 -2.341 -2.134 -13.769 1.00 0.00 C ATOM 1000 C GLU A 64 -1.671 -3.477 -13.475 1.00 0.00 C ATOM 1001 O GLU A 64 -0.455 -3.591 -13.546 1.00 0.00 O ATOM 1002 CB GLU A 64 -1.820 -1.587 -15.097 1.00 0.00 C ATOM 1003 CG GLU A 64 -2.156 -2.437 -16.307 1.00 0.00 C ATOM 1004 CD GLU A 64 -3.595 -2.290 -16.747 1.00 0.00 C ATOM 1005 OE1 GLU A 64 -4.493 -2.790 -16.039 1.00 0.00 O ATOM 1006 OE2 GLU A 64 -3.846 -1.658 -17.807 1.00 0.00 O ATOM 0 H GLU A 64 -1.118 -1.370 -12.247 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.422 -2.253 -13.846 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -2.227 -0.587 -15.248 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.737 -1.483 -15.032 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -1.499 -2.162 -17.132 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.957 -3.484 -16.076 1.00 0.00 H new ATOM 1013 N GLY A 65 -2.451 -4.481 -13.133 1.00 0.00 N ATOM 1014 CA GLY A 65 -1.855 -5.737 -12.727 1.00 0.00 C ATOM 1015 C GLY A 65 -2.876 -6.711 -12.156 1.00 0.00 C ATOM 1016 O GLY A 65 -3.939 -6.915 -12.730 1.00 0.00 O ATOM 0 H GLY A 65 -3.471 -4.456 -13.127 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -1.361 -6.195 -13.584 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -1.084 -5.545 -11.980 1.00 0.00 H new ATOM 1020 N CYS A 66 -2.546 -7.303 -11.007 1.00 0.00 N ATOM 1021 CA CYS A 66 -3.422 -8.290 -10.396 1.00 0.00 C ATOM 1022 C CYS A 66 -4.313 -7.630 -9.352 1.00 0.00 C ATOM 1023 O CYS A 66 -3.983 -6.556 -8.823 1.00 0.00 O ATOM 1024 CB CYS A 66 -2.627 -9.436 -9.779 1.00 0.00 C ATOM 1025 SG CYS A 66 -1.086 -8.941 -8.986 1.00 0.00 S ATOM 0 H CYS A 66 -1.687 -7.116 -10.489 1.00 0.00 H new ATOM 0 HA CYS A 66 -4.052 -8.712 -11.179 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -3.253 -9.940 -9.043 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -2.402 -10.165 -10.558 1.00 0.00 H new ATOM 1031 N SER A 67 -5.409 -8.291 -9.042 1.00 0.00 N ATOM 1032 CA SER A 67 -6.503 -7.706 -8.268 1.00 0.00 C ATOM 1033 C SER A 67 -6.182 -7.684 -6.775 1.00 0.00 C ATOM 1034 O SER A 67 -7.072 -7.620 -5.928 1.00 0.00 O ATOM 1035 CB SER A 67 -7.798 -8.487 -8.535 1.00 0.00 C ATOM 1036 OG SER A 67 -8.911 -7.852 -7.923 1.00 0.00 O ATOM 0 H SER A 67 -5.574 -9.259 -9.319 1.00 0.00 H new ATOM 0 HA SER A 67 -6.636 -6.672 -8.585 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.965 -8.565 -9.609 1.00 0.00 H new ATOM 0 HB3 SER A 67 -7.699 -9.503 -8.153 1.00 0.00 H new ATOM 0 HG SER A 67 -8.700 -7.654 -6.987 1.00 0.00 H new ATOM 1042 N ILE A 68 -4.896 -7.680 -6.471 1.00 0.00 N ATOM 1043 CA ILE A 68 -4.430 -7.639 -5.103 1.00 0.00 C ATOM 1044 C ILE A 68 -3.617 -6.369 -4.876 1.00 0.00 C ATOM 1045 O ILE A 68 -3.879 -5.569 -3.974 1.00 0.00 O ATOM 1046 CB ILE A 68 -3.599 -8.917 -4.747 1.00 0.00 C ATOM 1047 CG1 ILE A 68 -2.837 -8.747 -3.421 1.00 0.00 C ATOM 1048 CG2 ILE A 68 -2.656 -9.297 -5.878 1.00 0.00 C ATOM 1049 CD1 ILE A 68 -1.470 -8.094 -3.569 1.00 0.00 C ATOM 0 H ILE A 68 -4.150 -7.705 -7.166 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.294 -7.625 -4.439 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.306 -9.736 -4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -3.442 -8.148 -2.741 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.712 -9.726 -2.958 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.094 -10.188 -5.599 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -3.233 -9.500 -6.780 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.964 -8.476 -6.066 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.999 -8.011 -2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.845 -8.703 -4.222 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.586 -7.100 -4.001 1.00 0.00 H new ATOM 1061 N SER A 69 -2.626 -6.160 -5.742 1.00 0.00 N ATOM 1062 CA SER A 69 -1.646 -5.100 -5.534 1.00 0.00 C ATOM 1063 C SER A 69 -2.223 -3.745 -5.894 1.00 0.00 C ATOM 1064 O SER A 69 -2.064 -2.771 -5.182 1.00 0.00 O ATOM 1065 CB SER A 69 -0.446 -5.410 -6.386 1.00 0.00 C ATOM 1066 OG SER A 69 -0.238 -6.806 -6.431 1.00 0.00 O ATOM 0 H SER A 69 -2.483 -6.709 -6.590 1.00 0.00 H new ATOM 0 HA SER A 69 -1.363 -5.057 -4.482 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.595 -5.023 -7.394 1.00 0.00 H new ATOM 0 HB3 SER A 69 0.436 -4.915 -5.981 1.00 0.00 H new ATOM 0 HG SER A 69 -0.594 -7.163 -7.272 1.00 0.00 H new ATOM 1072 N MET A 70 -2.909 -3.710 -7.020 1.00 0.00 N ATOM 1073 CA MET A 70 -3.542 -2.501 -7.475 1.00 0.00 C ATOM 1074 C MET A 70 -4.749 -2.182 -6.617 1.00 0.00 C ATOM 1075 O MET A 70 -5.284 -1.071 -6.664 1.00 0.00 O ATOM 1076 CB MET A 70 -3.962 -2.638 -8.941 1.00 0.00 C ATOM 1077 CG MET A 70 -5.049 -3.670 -9.192 1.00 0.00 C ATOM 1078 SD MET A 70 -5.499 -3.813 -10.927 1.00 0.00 S ATOM 1079 CE MET A 70 -6.068 -2.161 -11.270 1.00 0.00 C ATOM 0 H MET A 70 -3.039 -4.513 -7.635 1.00 0.00 H new ATOM 0 HA MET A 70 -2.825 -1.684 -7.390 1.00 0.00 H new ATOM 0 HB2 MET A 70 -4.310 -1.669 -9.298 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.086 -2.901 -9.534 1.00 0.00 H new ATOM 0 HG2 MET A 70 -4.711 -4.641 -8.829 1.00 0.00 H new ATOM 0 HG3 MET A 70 -5.934 -3.405 -8.614 1.00 0.00 H new ATOM 0 HE1 MET A 70 -6.576 -2.144 -12.234 1.00 0.00 H new ATOM 0 HE2 MET A 70 -6.760 -1.845 -10.490 1.00 0.00 H new ATOM 0 HE3 MET A 70 -5.216 -1.481 -11.297 1.00 0.00 H new ATOM 1089 N ALA A 71 -5.181 -3.137 -5.807 1.00 0.00 N ATOM 1090 CA ALA A 71 -6.334 -2.937 -4.942 1.00 0.00 C ATOM 1091 C ALA A 71 -5.934 -2.282 -3.626 1.00 0.00 C ATOM 1092 O ALA A 71 -6.556 -1.321 -3.189 1.00 0.00 O ATOM 1093 CB ALA A 71 -7.020 -4.269 -4.690 1.00 0.00 C ATOM 0 H ALA A 71 -4.750 -4.058 -5.731 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.029 -2.264 -5.444 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.883 -4.117 -4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.349 -4.694 -5.638 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.321 -4.953 -4.209 1.00 0.00 H new ATOM 1099 N SER A 72 -4.853 -2.783 -3.004 1.00 0.00 N ATOM 1100 CA SER A 72 -4.365 -2.197 -1.766 1.00 0.00 C ATOM 1101 C SER A 72 -3.930 -0.760 -2.011 1.00 0.00 C ATOM 1102 O SER A 72 -3.984 0.090 -1.117 1.00 0.00 O ATOM 1103 CB SER A 72 -3.201 -3.036 -1.240 1.00 0.00 C ATOM 1104 OG SER A 72 -2.203 -3.219 -2.240 1.00 0.00 O ATOM 0 H SER A 72 -4.314 -3.581 -3.340 1.00 0.00 H new ATOM 0 HA SER A 72 -5.160 -2.189 -1.020 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.762 -2.548 -0.370 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.570 -4.007 -0.909 1.00 0.00 H new ATOM 0 HG SER A 72 -1.402 -2.708 -2.000 1.00 0.00 H new ATOM 1110 N ALA A 73 -3.513 -0.510 -3.239 1.00 0.00 N ATOM 1111 CA ALA A 73 -3.098 0.805 -3.662 1.00 0.00 C ATOM 1112 C ALA A 73 -4.286 1.754 -3.606 1.00 0.00 C ATOM 1113 O ALA A 73 -4.197 2.822 -3.008 1.00 0.00 O ATOM 1114 CB ALA A 73 -2.527 0.745 -5.059 1.00 0.00 C ATOM 0 H ALA A 73 -3.454 -1.219 -3.970 1.00 0.00 H new ATOM 0 HA ALA A 73 -2.321 1.174 -2.993 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -2.217 1.743 -5.368 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.666 0.077 -5.072 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.286 0.371 -5.747 1.00 0.00 H new ATOM 1120 N SER A 74 -5.394 1.354 -4.198 1.00 0.00 N ATOM 1121 CA SER A 74 -6.595 2.164 -4.184 1.00 0.00 C ATOM 1122 C SER A 74 -7.083 2.439 -2.770 1.00 0.00 C ATOM 1123 O SER A 74 -7.473 3.556 -2.461 1.00 0.00 O ATOM 1124 CB SER A 74 -7.694 1.476 -4.992 1.00 0.00 C ATOM 1125 OG SER A 74 -7.260 1.188 -6.312 1.00 0.00 O ATOM 0 H SER A 74 -5.487 0.469 -4.697 1.00 0.00 H new ATOM 0 HA SER A 74 -6.350 3.125 -4.637 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.990 0.552 -4.495 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.576 2.115 -5.028 1.00 0.00 H new ATOM 0 HG SER A 74 -6.662 0.412 -6.298 1.00 0.00 H new ATOM 1131 N MET A 75 -6.995 1.449 -1.904 1.00 0.00 N ATOM 1132 CA MET A 75 -7.551 1.591 -0.575 1.00 0.00 C ATOM 1133 C MET A 75 -6.634 2.458 0.279 1.00 0.00 C ATOM 1134 O MET A 75 -7.049 3.489 0.797 1.00 0.00 O ATOM 1135 CB MET A 75 -7.757 0.218 0.074 1.00 0.00 C ATOM 1136 CG MET A 75 -8.864 0.191 1.132 1.00 0.00 C ATOM 1137 SD MET A 75 -8.581 1.316 2.514 1.00 0.00 S ATOM 1138 CE MET A 75 -10.042 1.007 3.499 1.00 0.00 C ATOM 0 H MET A 75 -6.551 0.551 -2.093 1.00 0.00 H new ATOM 0 HA MET A 75 -8.524 2.077 -0.650 1.00 0.00 H new ATOM 0 HB2 MET A 75 -7.993 -0.509 -0.703 1.00 0.00 H new ATOM 0 HB3 MET A 75 -6.821 -0.100 0.533 1.00 0.00 H new ATOM 0 HG2 MET A 75 -9.812 0.444 0.658 1.00 0.00 H new ATOM 0 HG3 MET A 75 -8.961 -0.824 1.517 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.016 1.630 4.393 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.931 1.246 2.916 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.070 -0.043 3.789 1.00 0.00 H new ATOM 1148 N MET A 76 -5.385 2.009 0.419 1.00 0.00 N ATOM 1149 CA MET A 76 -4.431 2.714 1.248 1.00 0.00 C ATOM 1150 C MET A 76 -4.214 4.146 0.770 1.00 0.00 C ATOM 1151 O MET A 76 -4.038 5.023 1.598 1.00 0.00 O ATOM 1152 CB MET A 76 -3.087 1.980 1.323 1.00 0.00 C ATOM 1153 CG MET A 76 -2.317 2.267 2.610 1.00 0.00 C ATOM 1154 SD MET A 76 -1.585 3.914 2.661 1.00 0.00 S ATOM 1155 CE MET A 76 -0.821 3.895 4.285 1.00 0.00 C ATOM 0 H MET A 76 -5.022 1.168 -0.030 1.00 0.00 H new ATOM 0 HA MET A 76 -4.861 2.746 2.249 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.261 0.907 1.243 1.00 0.00 H new ATOM 0 HB3 MET A 76 -2.475 2.268 0.469 1.00 0.00 H new ATOM 0 HG2 MET A 76 -2.990 2.151 3.460 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.528 1.524 2.725 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.118 4.448 4.252 1.00 0.00 H new ATOM 0 HE2 MET A 76 -1.491 4.361 5.008 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.625 2.865 4.583 1.00 0.00 H new ATOM 1165 N THR A 77 -4.268 4.408 -0.533 1.00 0.00 N ATOM 1166 CA THR A 77 -4.076 5.777 -1.030 1.00 0.00 C ATOM 1167 C THR A 77 -5.168 6.692 -0.482 1.00 0.00 C ATOM 1168 O THR A 77 -4.907 7.819 -0.089 1.00 0.00 O ATOM 1169 CB THR A 77 -4.042 5.839 -2.556 1.00 0.00 C ATOM 1170 OG1 THR A 77 -2.949 5.060 -3.057 1.00 0.00 O ATOM 1171 CG2 THR A 77 -3.918 7.289 -3.045 1.00 0.00 C ATOM 0 H THR A 77 -4.439 3.709 -1.256 1.00 0.00 H new ATOM 0 HA THR A 77 -3.105 6.121 -0.674 1.00 0.00 H new ATOM 0 HB THR A 77 -4.979 5.428 -2.933 1.00 0.00 H new ATOM 0 HG1 THR A 77 -3.224 4.123 -3.136 1.00 0.00 H new ATOM 0 HG21 THR A 77 -3.896 7.305 -4.135 1.00 0.00 H new ATOM 0 HG22 THR A 77 -4.772 7.867 -2.691 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.998 7.726 -2.657 1.00 0.00 H new ATOM 1179 N GLN A 78 -6.385 6.200 -0.495 1.00 0.00 N ATOM 1180 CA GLN A 78 -7.522 6.870 0.126 1.00 0.00 C ATOM 1181 C GLN A 78 -7.185 7.285 1.543 1.00 0.00 C ATOM 1182 O GLN A 78 -7.583 8.356 2.021 1.00 0.00 O ATOM 1183 CB GLN A 78 -8.751 5.953 0.155 1.00 0.00 C ATOM 1184 CG GLN A 78 -9.377 5.702 -1.203 1.00 0.00 C ATOM 1185 CD GLN A 78 -10.607 4.822 -1.124 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -11.339 4.844 -0.130 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -10.843 4.049 -2.161 1.00 0.00 N ATOM 0 H GLN A 78 -6.624 5.314 -0.940 1.00 0.00 H new ATOM 0 HA GLN A 78 -7.748 7.754 -0.471 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.465 4.996 0.592 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.502 6.392 0.812 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.646 6.656 -1.657 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.641 5.234 -1.857 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.211 4.063 -2.962 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -11.658 3.435 -2.165 1.00 0.00 H new ATOM 1196 N ALA A 79 -6.429 6.445 2.219 1.00 0.00 N ATOM 1197 CA ALA A 79 -6.020 6.683 3.591 1.00 0.00 C ATOM 1198 C ALA A 79 -4.748 7.528 3.636 1.00 0.00 C ATOM 1199 O ALA A 79 -4.563 8.314 4.552 1.00 0.00 O ATOM 1200 CB ALA A 79 -5.805 5.362 4.300 1.00 0.00 C ATOM 0 H ALA A 79 -6.077 5.570 1.830 1.00 0.00 H new ATOM 0 HA ALA A 79 -6.810 7.234 4.102 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.498 5.547 5.329 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -6.734 4.791 4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.028 4.796 3.786 1.00 0.00 H new ATOM 1206 N ILE A 80 -3.908 7.357 2.629 1.00 0.00 N ATOM 1207 CA ILE A 80 -2.584 8.017 2.671 1.00 0.00 C ATOM 1208 C ILE A 80 -2.702 9.455 2.186 1.00 0.00 C ATOM 1209 O ILE A 80 -2.123 10.347 2.784 1.00 0.00 O ATOM 1210 CB ILE A 80 -1.471 7.266 1.874 1.00 0.00 C ATOM 1211 CG1 ILE A 80 -0.094 7.856 2.186 1.00 0.00 C ATOM 1212 CG2 ILE A 80 -1.717 7.312 0.373 1.00 0.00 C ATOM 1213 CD1 ILE A 80 0.277 7.796 3.657 1.00 0.00 C ATOM 0 H ILE A 80 -4.093 6.794 1.799 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.269 7.995 3.714 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.501 6.223 2.190 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.660 7.321 1.608 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.071 8.895 1.857 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.919 6.778 -0.143 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.674 6.842 0.147 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.734 8.349 0.039 1.00 0.00 H new ATOM 0 HD11 ILE A 80 1.266 8.232 3.801 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.455 8.355 4.240 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.287 6.757 3.988 1.00 0.00 H new ATOM 1225 N LYS A 81 -3.494 9.659 1.156 1.00 0.00 N ATOM 1226 CA LYS A 81 -3.840 11.008 0.674 1.00 0.00 C ATOM 1227 C LYS A 81 -4.419 11.872 1.801 1.00 0.00 C ATOM 1228 O LYS A 81 -4.485 13.098 1.713 1.00 0.00 O ATOM 1229 CB LYS A 81 -4.826 10.895 -0.503 1.00 0.00 C ATOM 1230 CG LYS A 81 -5.360 12.225 -1.029 1.00 0.00 C ATOM 1231 CD LYS A 81 -6.204 12.024 -2.284 1.00 0.00 C ATOM 1232 CE LYS A 81 -7.100 13.233 -2.583 1.00 0.00 C ATOM 1233 NZ LYS A 81 -6.338 14.470 -2.790 1.00 0.00 N ATOM 0 H LYS A 81 -3.923 8.905 0.619 1.00 0.00 H new ATOM 0 HA LYS A 81 -2.931 11.501 0.329 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -4.333 10.370 -1.321 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -5.670 10.279 -0.192 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.960 12.709 -0.258 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -4.527 12.892 -1.251 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.548 11.842 -3.135 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.824 11.136 -2.164 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.696 13.026 -3.472 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -7.797 13.375 -1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.964 15.201 -3.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.953 14.797 -1.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.556 14.290 -3.452 1.00 0.00 H new ATOM 1247 N GLY A 82 -4.838 11.220 2.857 1.00 0.00 N ATOM 1248 CA GLY A 82 -5.423 11.905 3.994 1.00 0.00 C ATOM 1249 C GLY A 82 -4.605 11.659 5.252 1.00 0.00 C ATOM 1250 O GLY A 82 -5.154 11.448 6.345 1.00 0.00 O ATOM 0 H GLY A 82 -4.786 10.206 2.957 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.475 12.975 3.792 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.445 11.559 4.146 1.00 0.00 H new ATOM 1254 N LYS A 83 -3.281 11.688 5.085 1.00 0.00 N ATOM 1255 CA LYS A 83 -2.375 11.421 6.181 1.00 0.00 C ATOM 1256 C LYS A 83 -1.289 12.495 6.206 1.00 0.00 C ATOM 1257 O LYS A 83 -1.166 13.257 5.254 1.00 0.00 O ATOM 1258 CB LYS A 83 -1.724 10.032 6.006 1.00 0.00 C ATOM 1259 CG LYS A 83 -1.090 9.445 7.255 1.00 0.00 C ATOM 1260 CD LYS A 83 -2.134 8.883 8.223 1.00 0.00 C ATOM 1261 CE LYS A 83 -2.855 7.685 7.636 1.00 0.00 C ATOM 1262 NZ LYS A 83 -3.763 7.035 8.624 1.00 0.00 N ATOM 0 H LYS A 83 -2.822 11.895 4.198 1.00 0.00 H new ATOM 0 HA LYS A 83 -2.931 11.434 7.119 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.482 9.338 5.644 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -0.961 10.103 5.231 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.397 8.653 6.971 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.506 10.214 7.760 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.648 8.595 9.155 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.858 9.660 8.468 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.432 8.000 6.767 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.122 6.958 7.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -4.415 6.395 8.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -3.199 6.492 9.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.309 7.764 9.126 1.00 0.00 H new ATOM 1276 N ASP A 84 -0.516 12.586 7.278 1.00 0.00 N ATOM 1277 CA ASP A 84 0.633 13.432 7.311 1.00 0.00 C ATOM 1278 C ASP A 84 1.874 12.573 7.171 1.00 0.00 C ATOM 1279 O ASP A 84 1.798 11.348 7.032 1.00 0.00 O ATOM 1280 CB ASP A 84 0.686 14.227 8.617 1.00 0.00 C ATOM 1281 CG ASP A 84 -0.591 15.002 8.879 1.00 0.00 C ATOM 1282 OD1 ASP A 84 -0.766 16.092 8.293 1.00 0.00 O ATOM 1283 OD2 ASP A 84 -1.431 14.523 9.669 1.00 0.00 O ATOM 0 H ASP A 84 -0.681 12.069 8.142 1.00 0.00 H new ATOM 0 HA ASP A 84 0.579 14.145 6.488 1.00 0.00 H new ATOM 0 HB2 ASP A 84 0.869 13.544 9.447 1.00 0.00 H new ATOM 0 HB3 ASP A 84 1.527 14.920 8.583 1.00 0.00 H new ATOM 1288 N ILE A 85 3.007 13.212 7.245 1.00 0.00 N ATOM 1289 CA ILE A 85 4.278 12.542 7.063 1.00 0.00 C ATOM 1290 C ILE A 85 4.724 11.846 8.346 1.00 0.00 C ATOM 1291 O ILE A 85 5.118 10.685 8.315 1.00 0.00 O ATOM 1292 CB ILE A 85 5.355 13.548 6.559 1.00 0.00 C ATOM 1293 CG1 ILE A 85 5.327 13.638 5.016 1.00 0.00 C ATOM 1294 CG2 ILE A 85 6.755 13.172 7.038 1.00 0.00 C ATOM 1295 CD1 ILE A 85 3.951 13.926 4.468 1.00 0.00 C ATOM 0 H ILE A 85 3.083 14.212 7.433 1.00 0.00 H new ATOM 0 HA ILE A 85 4.153 11.771 6.303 1.00 0.00 H new ATOM 0 HB ILE A 85 5.112 14.523 6.981 1.00 0.00 H new ATOM 0 HG12 ILE A 85 6.013 14.420 4.691 1.00 0.00 H new ATOM 0 HG13 ILE A 85 5.691 12.700 4.596 1.00 0.00 H new ATOM 0 HG21 ILE A 85 7.475 13.900 6.664 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.777 13.166 8.128 1.00 0.00 H new ATOM 0 HG23 ILE A 85 7.013 12.181 6.665 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.996 13.977 3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.267 13.131 4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.594 14.878 4.862 1.00 0.00 H new ATOM 1307 N GLU A 86 4.609 12.548 9.466 1.00 0.00 N ATOM 1308 CA GLU A 86 4.994 11.981 10.753 1.00 0.00 C ATOM 1309 C GLU A 86 4.206 10.704 11.050 1.00 0.00 C ATOM 1310 O GLU A 86 4.770 9.709 11.489 1.00 0.00 O ATOM 1311 CB GLU A 86 4.788 12.996 11.880 1.00 0.00 C ATOM 1312 CG GLU A 86 5.780 14.139 11.849 1.00 0.00 C ATOM 1313 CD GLU A 86 7.203 13.676 12.117 1.00 0.00 C ATOM 1314 OE1 GLU A 86 7.514 13.350 13.283 1.00 0.00 O ATOM 1315 OE2 GLU A 86 8.007 13.632 11.169 1.00 0.00 O ATOM 0 H GLU A 86 4.255 13.504 9.510 1.00 0.00 H new ATOM 0 HA GLU A 86 6.053 11.729 10.698 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.778 13.400 11.815 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.865 12.484 12.839 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.737 14.628 10.876 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.496 14.883 12.593 1.00 0.00 H new ATOM 1322 N THR A 87 2.905 10.734 10.782 1.00 0.00 N ATOM 1323 CA THR A 87 2.073 9.558 10.976 1.00 0.00 C ATOM 1324 C THR A 87 2.408 8.467 9.973 1.00 0.00 C ATOM 1325 O THR A 87 2.386 7.279 10.288 1.00 0.00 O ATOM 1326 CB THR A 87 0.577 9.928 10.882 1.00 0.00 C ATOM 1327 OG1 THR A 87 0.383 10.884 9.845 1.00 0.00 O ATOM 1328 CG2 THR A 87 0.070 10.498 12.205 1.00 0.00 C ATOM 0 H THR A 87 2.409 11.554 10.433 1.00 0.00 H new ATOM 0 HA THR A 87 2.279 9.172 11.974 1.00 0.00 H new ATOM 0 HB THR A 87 0.014 9.022 10.658 1.00 0.00 H new ATOM 0 HG1 THR A 87 -0.461 11.360 9.992 1.00 0.00 H new ATOM 0 HG21 THR A 87 -0.986 10.750 12.111 1.00 0.00 H new ATOM 0 HG22 THR A 87 0.197 9.756 12.993 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.636 11.395 12.456 1.00 0.00 H new ATOM 1336 N ALA A 88 2.706 8.877 8.746 1.00 0.00 N ATOM 1337 CA ALA A 88 3.139 7.920 7.714 1.00 0.00 C ATOM 1338 C ALA A 88 4.416 7.219 8.130 1.00 0.00 C ATOM 1339 O ALA A 88 4.561 6.004 7.958 1.00 0.00 O ATOM 1340 CB ALA A 88 3.344 8.648 6.389 1.00 0.00 C ATOM 0 H ALA A 88 2.660 9.848 8.436 1.00 0.00 H new ATOM 0 HA ALA A 88 2.362 7.165 7.592 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.664 7.936 5.628 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.407 9.112 6.080 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.107 9.417 6.511 1.00 0.00 H new ATOM 1346 N LEU A 89 5.328 7.979 8.723 1.00 0.00 N ATOM 1347 CA LEU A 89 6.594 7.443 9.200 1.00 0.00 C ATOM 1348 C LEU A 89 6.376 6.525 10.415 1.00 0.00 C ATOM 1349 O LEU A 89 7.038 5.491 10.568 1.00 0.00 O ATOM 1350 CB LEU A 89 7.565 8.564 9.568 1.00 0.00 C ATOM 1351 CG LEU A 89 7.839 9.608 8.473 1.00 0.00 C ATOM 1352 CD1 LEU A 89 8.953 10.539 8.899 1.00 0.00 C ATOM 1353 CD2 LEU A 89 8.158 8.934 7.149 1.00 0.00 C ATOM 0 H LEU A 89 5.211 8.979 8.886 1.00 0.00 H new ATOM 0 HA LEU A 89 7.029 6.860 8.388 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.176 9.081 10.445 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.514 8.114 9.858 1.00 0.00 H new ATOM 0 HG LEU A 89 6.937 10.203 8.329 1.00 0.00 H new ATOM 0 HD11 LEU A 89 9.135 11.272 8.113 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.666 11.054 9.816 1.00 0.00 H new ATOM 0 HD13 LEU A 89 9.861 9.963 9.075 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.348 9.693 6.391 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.042 8.307 7.264 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.313 8.318 6.842 1.00 0.00 H new ATOM 1365 N SER A 90 5.443 6.901 11.266 1.00 0.00 N ATOM 1366 CA SER A 90 5.147 6.094 12.455 1.00 0.00 C ATOM 1367 C SER A 90 4.352 4.851 12.088 1.00 0.00 C ATOM 1368 O SER A 90 4.584 3.775 12.633 1.00 0.00 O ATOM 1369 CB SER A 90 4.387 6.946 13.487 1.00 0.00 C ATOM 1370 OG SER A 90 3.500 7.831 12.868 1.00 0.00 O ATOM 0 H SER A 90 4.879 7.745 11.169 1.00 0.00 H new ATOM 0 HA SER A 90 6.088 5.764 12.895 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.837 6.293 14.165 1.00 0.00 H new ATOM 0 HB3 SER A 90 5.099 7.507 14.092 1.00 0.00 H new ATOM 0 HG SER A 90 3.960 8.675 12.678 1.00 0.00 H new ATOM 1376 N MET A 91 3.471 4.977 11.102 1.00 0.00 N ATOM 1377 CA MET A 91 2.732 3.845 10.533 1.00 0.00 C ATOM 1378 C MET A 91 3.711 2.900 9.853 1.00 0.00 C ATOM 1379 O MET A 91 3.460 1.719 9.699 1.00 0.00 O ATOM 1380 CB MET A 91 1.668 4.352 9.546 1.00 0.00 C ATOM 1381 CG MET A 91 0.897 3.259 8.818 1.00 0.00 C ATOM 1382 SD MET A 91 1.782 2.606 7.379 1.00 0.00 S ATOM 1383 CE MET A 91 2.110 4.110 6.468 1.00 0.00 C ATOM 0 H MET A 91 3.245 5.872 10.669 1.00 0.00 H new ATOM 0 HA MET A 91 2.217 3.302 11.326 1.00 0.00 H new ATOM 0 HB2 MET A 91 0.959 4.977 10.088 1.00 0.00 H new ATOM 0 HB3 MET A 91 2.153 4.989 8.806 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.691 2.444 9.512 1.00 0.00 H new ATOM 0 HG3 MET A 91 -0.066 3.655 8.496 1.00 0.00 H new ATOM 0 HE1 MET A 91 2.019 3.915 5.399 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.391 4.876 6.760 1.00 0.00 H new ATOM 0 HE3 MET A 91 3.119 4.457 6.689 1.00 0.00 H new ATOM 1393 N SER A 92 4.872 3.457 9.528 1.00 0.00 N ATOM 1394 CA SER A 92 5.909 2.735 8.825 1.00 0.00 C ATOM 1395 C SER A 92 6.727 1.984 9.860 1.00 0.00 C ATOM 1396 O SER A 92 7.077 0.813 9.684 1.00 0.00 O ATOM 1397 CB SER A 92 6.775 3.711 8.038 1.00 0.00 C ATOM 1398 OG SER A 92 7.832 3.074 7.361 1.00 0.00 O ATOM 0 H SER A 92 5.115 4.423 9.748 1.00 0.00 H new ATOM 0 HA SER A 92 5.482 2.029 8.112 1.00 0.00 H new ATOM 0 HB2 SER A 92 6.154 4.241 7.316 1.00 0.00 H new ATOM 0 HB3 SER A 92 7.183 4.459 8.718 1.00 0.00 H new ATOM 0 HG SER A 92 7.483 2.311 6.854 1.00 0.00 H new ATOM 1404 N LYS A 93 7.018 2.676 10.958 1.00 0.00 N ATOM 1405 CA LYS A 93 7.779 2.091 12.045 1.00 0.00 C ATOM 1406 C LYS A 93 6.975 0.992 12.721 1.00 0.00 C ATOM 1407 O LYS A 93 7.525 -0.026 13.131 1.00 0.00 O ATOM 1408 CB LYS A 93 8.189 3.163 13.059 1.00 0.00 C ATOM 1409 CG LYS A 93 8.978 2.607 14.236 1.00 0.00 C ATOM 1410 CD LYS A 93 9.692 3.702 14.999 1.00 0.00 C ATOM 1411 CE LYS A 93 10.419 3.155 16.215 1.00 0.00 C ATOM 1412 NZ LYS A 93 11.315 2.006 15.859 1.00 0.00 N ATOM 0 H LYS A 93 6.735 3.644 11.114 1.00 0.00 H new ATOM 0 HA LYS A 93 8.687 1.651 11.632 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.788 3.921 12.554 1.00 0.00 H new ATOM 0 HB3 LYS A 93 7.294 3.661 13.433 1.00 0.00 H new ATOM 0 HG2 LYS A 93 8.304 2.076 14.908 1.00 0.00 H new ATOM 0 HG3 LYS A 93 9.706 1.881 13.875 1.00 0.00 H new ATOM 0 HD2 LYS A 93 10.405 4.199 14.341 1.00 0.00 H new ATOM 0 HD3 LYS A 93 8.971 4.456 15.314 1.00 0.00 H new ATOM 0 HE2 LYS A 93 11.010 3.948 16.672 1.00 0.00 H new ATOM 0 HE3 LYS A 93 9.691 2.831 16.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 11.952 1.803 16.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 10.737 1.166 15.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 11.877 2.252 15.019 1.00 0.00 H new ATOM 1426 N ILE A 94 5.663 1.191 12.821 1.00 0.00 N ATOM 1427 CA ILE A 94 4.807 0.198 13.424 1.00 0.00 C ATOM 1428 C ILE A 94 4.511 -0.917 12.423 1.00 0.00 C ATOM 1429 O ILE A 94 4.491 -2.078 12.811 1.00 0.00 O ATOM 1430 CB ILE A 94 3.493 0.809 14.001 1.00 0.00 C ATOM 1431 CG1 ILE A 94 2.679 -0.243 14.756 1.00 0.00 C ATOM 1432 CG2 ILE A 94 2.650 1.468 12.907 1.00 0.00 C ATOM 1433 CD1 ILE A 94 1.357 0.278 15.298 1.00 0.00 C ATOM 0 H ILE A 94 5.181 2.028 12.492 1.00 0.00 H new ATOM 0 HA ILE A 94 5.342 -0.225 14.274 1.00 0.00 H new ATOM 0 HB ILE A 94 3.781 1.586 14.709 1.00 0.00 H new ATOM 0 HG12 ILE A 94 2.482 -1.084 14.090 1.00 0.00 H new ATOM 0 HG13 ILE A 94 3.276 -0.625 15.584 1.00 0.00 H new ATOM 0 HG21 ILE A 94 1.743 1.882 13.347 1.00 0.00 H new ATOM 0 HG22 ILE A 94 3.223 2.267 12.438 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.382 0.724 12.156 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.836 -0.524 15.821 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.546 1.099 15.990 1.00 0.00 H new ATOM 0 HD13 ILE A 94 0.740 0.633 14.473 1.00 0.00 H new ATOM 1445 N PHE A 95 4.287 -0.574 11.133 1.00 0.00 N ATOM 1446 CA PHE A 95 4.197 -1.597 10.070 1.00 0.00 C ATOM 1447 C PHE A 95 5.333 -2.617 10.184 1.00 0.00 C ATOM 1448 O PHE A 95 5.140 -3.826 9.982 1.00 0.00 O ATOM 1449 CB PHE A 95 4.218 -0.969 8.662 1.00 0.00 C ATOM 1450 CG PHE A 95 3.953 -1.940 7.548 1.00 0.00 C ATOM 1451 CD1 PHE A 95 4.969 -2.761 7.062 1.00 0.00 C ATOM 1452 CD2 PHE A 95 2.709 -2.028 6.960 1.00 0.00 C ATOM 1453 CE1 PHE A 95 4.734 -3.644 6.026 1.00 0.00 C ATOM 1454 CE2 PHE A 95 2.458 -2.913 5.922 1.00 0.00 C ATOM 1455 CZ PHE A 95 3.478 -3.718 5.460 1.00 0.00 C ATOM 0 H PHE A 95 4.167 0.386 10.809 1.00 0.00 H new ATOM 0 HA PHE A 95 3.242 -2.104 10.210 1.00 0.00 H new ATOM 0 HB2 PHE A 95 3.473 -0.174 8.620 1.00 0.00 H new ATOM 0 HB3 PHE A 95 5.190 -0.504 8.499 1.00 0.00 H new ATOM 0 HD1 PHE A 95 5.954 -2.706 7.502 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.911 -1.393 7.316 1.00 0.00 H new ATOM 0 HE1 PHE A 95 5.531 -4.274 5.660 1.00 0.00 H new ATOM 0 HE2 PHE A 95 1.474 -2.971 5.480 1.00 0.00 H new ATOM 0 HZ PHE A 95 3.293 -4.410 4.651 1.00 0.00 H new ATOM 1465 N SER A 96 6.515 -2.116 10.532 1.00 0.00 N ATOM 1466 CA SER A 96 7.702 -2.966 10.590 1.00 0.00 C ATOM 1467 C SER A 96 7.789 -3.626 11.968 1.00 0.00 C ATOM 1468 O SER A 96 8.314 -4.723 12.105 1.00 0.00 O ATOM 1469 CB SER A 96 8.946 -2.137 10.303 1.00 0.00 C ATOM 1470 OG SER A 96 8.831 -1.427 9.082 1.00 0.00 O ATOM 0 H SER A 96 6.677 -1.139 10.775 1.00 0.00 H new ATOM 0 HA SER A 96 7.633 -3.748 9.834 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.111 -1.434 11.119 1.00 0.00 H new ATOM 0 HB3 SER A 96 9.818 -2.790 10.264 1.00 0.00 H new ATOM 0 HG SER A 96 8.234 -0.660 9.205 1.00 0.00 H new ATOM 1476 N ASP A 97 7.243 -2.959 12.980 1.00 0.00 N ATOM 1477 CA ASP A 97 7.282 -3.435 14.363 1.00 0.00 C ATOM 1478 C ASP A 97 6.353 -4.639 14.556 1.00 0.00 C ATOM 1479 O ASP A 97 6.515 -5.422 15.501 1.00 0.00 O ATOM 1480 CB ASP A 97 6.891 -2.294 15.311 1.00 0.00 C ATOM 1481 CG ASP A 97 7.460 -2.450 16.708 1.00 0.00 C ATOM 1482 OD1 ASP A 97 6.875 -3.180 17.529 1.00 0.00 O ATOM 1483 OD2 ASP A 97 8.494 -1.790 17.006 1.00 0.00 O ATOM 0 H ASP A 97 6.758 -2.069 12.866 1.00 0.00 H new ATOM 0 HA ASP A 97 8.297 -3.759 14.593 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.234 -1.349 14.891 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.804 -2.240 15.373 1.00 0.00 H new ATOM 1488 N MET A 98 5.373 -4.785 13.665 1.00 0.00 N ATOM 1489 CA MET A 98 4.395 -5.883 13.701 1.00 0.00 C ATOM 1490 C MET A 98 5.039 -7.231 14.037 1.00 0.00 C ATOM 1491 O MET A 98 4.543 -7.973 14.893 1.00 0.00 O ATOM 1492 CB MET A 98 3.673 -5.965 12.338 1.00 0.00 C ATOM 1493 CG MET A 98 2.430 -6.854 12.306 1.00 0.00 C ATOM 1494 SD MET A 98 2.824 -8.615 12.257 1.00 0.00 S ATOM 1495 CE MET A 98 1.183 -9.321 12.153 1.00 0.00 C ATOM 0 H MET A 98 5.230 -4.140 12.888 1.00 0.00 H new ATOM 0 HA MET A 98 3.681 -5.667 14.496 1.00 0.00 H new ATOM 0 HB2 MET A 98 3.386 -4.957 12.037 1.00 0.00 H new ATOM 0 HB3 MET A 98 4.380 -6.331 11.593 1.00 0.00 H new ATOM 0 HG2 MET A 98 1.820 -6.648 13.186 1.00 0.00 H new ATOM 0 HG3 MET A 98 1.829 -6.597 11.434 1.00 0.00 H new ATOM 0 HE1 MET A 98 1.256 -10.408 12.115 1.00 0.00 H new ATOM 0 HE2 MET A 98 0.604 -9.027 13.029 1.00 0.00 H new ATOM 0 HE3 MET A 98 0.688 -8.959 11.252 1.00 0.00 H new ATOM 1505 N MET A 99 6.143 -7.537 13.366 1.00 0.00 N ATOM 1506 CA MET A 99 6.865 -8.803 13.535 1.00 0.00 C ATOM 1507 C MET A 99 7.261 -9.082 14.997 1.00 0.00 C ATOM 1508 O MET A 99 7.503 -10.222 15.357 1.00 0.00 O ATOM 1509 CB MET A 99 8.135 -8.788 12.677 1.00 0.00 C ATOM 1510 CG MET A 99 8.888 -10.108 12.718 1.00 0.00 C ATOM 1511 SD MET A 99 10.457 -10.081 11.823 1.00 0.00 S ATOM 1512 CE MET A 99 11.019 -11.764 12.115 1.00 0.00 C ATOM 0 H MET A 99 6.570 -6.912 12.682 1.00 0.00 H new ATOM 0 HA MET A 99 6.185 -9.595 13.221 1.00 0.00 H new ATOM 0 HB2 MET A 99 7.868 -8.559 11.645 1.00 0.00 H new ATOM 0 HB3 MET A 99 8.792 -7.989 13.022 1.00 0.00 H new ATOM 0 HG2 MET A 99 9.078 -10.375 13.758 1.00 0.00 H new ATOM 0 HG3 MET A 99 8.255 -10.890 12.299 1.00 0.00 H new ATOM 0 HE1 MET A 99 11.982 -11.916 11.627 1.00 0.00 H new ATOM 0 HE2 MET A 99 11.125 -11.931 13.187 1.00 0.00 H new ATOM 0 HE3 MET A 99 10.291 -12.466 11.709 1.00 0.00 H new ATOM 1522 N GLN A 100 7.265 -8.070 15.836 1.00 0.00 N ATOM 1523 CA GLN A 100 7.739 -8.255 17.197 1.00 0.00 C ATOM 1524 C GLN A 100 6.723 -7.715 18.193 1.00 0.00 C ATOM 1525 O GLN A 100 6.644 -8.188 19.329 1.00 0.00 O ATOM 1526 CB GLN A 100 9.109 -7.586 17.401 1.00 0.00 C ATOM 1527 CG GLN A 100 9.115 -6.082 17.166 1.00 0.00 C ATOM 1528 CD GLN A 100 10.481 -5.465 17.417 1.00 0.00 C ATOM 1529 OE1 GLN A 100 11.526 -6.187 17.100 1.00 0.00 O flip ATOM 1530 NE2 GLN A 100 10.576 -4.324 17.873 1.00 0.00 N flip ATOM 0 H GLN A 100 6.952 -7.126 15.610 1.00 0.00 H new ATOM 0 HA GLN A 100 7.859 -9.324 17.371 1.00 0.00 H new ATOM 0 HB2 GLN A 100 9.449 -7.784 18.418 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.830 -8.050 16.728 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.808 -5.875 16.141 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.380 -5.611 17.819 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.735 -3.796 18.107 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.496 -3.907 18.017 1.00 0.00 H new ATOM 1539 N GLY A 101 5.924 -6.744 17.763 1.00 0.00 N ATOM 1540 CA GLY A 101 4.941 -6.163 18.628 1.00 0.00 C ATOM 1541 C GLY A 101 3.578 -6.795 18.462 1.00 0.00 C ATOM 1542 O GLY A 101 2.857 -6.967 19.450 1.00 0.00 O ATOM 0 H GLY A 101 5.949 -6.353 16.821 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.264 -6.270 19.664 1.00 0.00 H new ATOM 0 HA3 GLY A 101 4.870 -5.094 18.425 1.00 0.00 H new ATOM 1546 N LYS A 102 3.241 -7.070 17.207 1.00 0.00 N ATOM 1547 CA LYS A 102 1.975 -7.701 16.817 1.00 0.00 C ATOM 1548 C LYS A 102 0.974 -6.570 16.634 1.00 0.00 C ATOM 1549 O LYS A 102 -0.220 -6.652 16.951 1.00 0.00 O ATOM 1550 CB LYS A 102 1.493 -8.735 17.850 1.00 0.00 C ATOM 1551 CG LYS A 102 0.367 -9.640 17.350 1.00 0.00 C ATOM 1552 CD LYS A 102 0.046 -10.731 18.364 1.00 0.00 C ATOM 1553 CE LYS A 102 -0.707 -10.187 19.574 1.00 0.00 C ATOM 1554 NZ LYS A 102 -2.106 -9.809 19.231 1.00 0.00 N ATOM 0 H LYS A 102 3.847 -6.859 16.414 1.00 0.00 H new ATOM 0 HA LYS A 102 2.097 -8.268 15.894 1.00 0.00 H new ATOM 0 HB2 LYS A 102 2.338 -9.356 18.148 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.153 -8.210 18.742 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.525 -9.043 17.159 1.00 0.00 H new ATOM 0 HG3 LYS A 102 0.656 -10.094 16.402 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.551 -11.506 17.884 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.972 -11.201 18.695 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.717 -10.938 20.364 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.182 -9.317 19.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.644 -9.639 20.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.100 -8.944 18.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.552 -10.580 18.695 1.00 0.00 H new ATOM 1568 N GLU A 103 1.521 -5.488 16.089 1.00 0.00 N ATOM 1569 CA GLU A 103 0.786 -4.266 15.852 1.00 0.00 C ATOM 1570 C GLU A 103 1.091 -3.826 14.428 1.00 0.00 C ATOM 1571 O GLU A 103 2.247 -3.710 14.042 1.00 0.00 O ATOM 1572 CB GLU A 103 1.177 -3.161 16.837 1.00 0.00 C ATOM 1573 CG GLU A 103 0.885 -3.504 18.297 1.00 0.00 C ATOM 1574 CD GLU A 103 0.963 -2.272 19.177 1.00 0.00 C ATOM 1575 OE1 GLU A 103 2.051 -1.639 19.234 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -0.049 -1.914 19.809 1.00 0.00 O ATOM 0 H GLU A 103 2.498 -5.442 15.799 1.00 0.00 H new ATOM 0 HA GLU A 103 -0.279 -4.449 15.994 1.00 0.00 H new ATOM 0 HB2 GLU A 103 2.241 -2.951 16.729 1.00 0.00 H new ATOM 0 HB3 GLU A 103 0.643 -2.248 16.574 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -0.107 -3.949 18.377 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.598 -4.250 18.648 1.00 0.00 H new ATOM 1583 N TYR A 104 0.041 -3.601 13.672 1.00 0.00 N ATOM 1584 CA TYR A 104 0.189 -3.196 12.295 1.00 0.00 C ATOM 1585 C TYR A 104 0.125 -1.688 12.249 1.00 0.00 C ATOM 1586 O TYR A 104 1.150 -1.029 12.320 1.00 0.00 O ATOM 1587 CB TYR A 104 -0.902 -3.853 11.451 1.00 0.00 C ATOM 1588 CG TYR A 104 -1.871 -4.635 12.286 1.00 0.00 C ATOM 1589 CD1 TYR A 104 -2.927 -3.991 12.924 1.00 0.00 C ATOM 1590 CD2 TYR A 104 -1.742 -5.994 12.444 1.00 0.00 C ATOM 1591 CE1 TYR A 104 -3.832 -4.698 13.692 1.00 0.00 C ATOM 1592 CE2 TYR A 104 -2.645 -6.716 13.217 1.00 0.00 C ATOM 1593 CZ TYR A 104 -3.682 -6.056 13.829 1.00 0.00 C ATOM 1594 OH TYR A 104 -4.575 -6.753 14.602 1.00 0.00 O ATOM 0 H TYR A 104 -0.924 -3.692 13.988 1.00 0.00 H new ATOM 0 HA TYR A 104 1.145 -3.517 11.882 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -1.441 -3.085 10.896 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -0.442 -4.514 10.717 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -3.041 -2.922 12.817 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -0.926 -6.510 11.960 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -4.649 -4.188 14.180 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -2.532 -7.784 13.335 1.00 0.00 H new ATOM 0 HH TYR A 104 -4.337 -7.704 14.600 1.00 0.00 H new ATOM 1604 N ASP A 105 -1.063 -1.123 12.095 1.00 0.00 N ATOM 1605 CA ASP A 105 -1.305 0.238 12.534 1.00 0.00 C ATOM 1606 C ASP A 105 -2.312 0.224 13.648 1.00 0.00 C ATOM 1607 O ASP A 105 -3.443 -0.193 13.460 1.00 0.00 O ATOM 1608 CB ASP A 105 -1.784 1.096 11.360 1.00 0.00 C ATOM 1609 CG ASP A 105 -2.378 2.410 11.809 1.00 0.00 C ATOM 1610 OD1 ASP A 105 -1.783 3.086 12.674 1.00 0.00 O ATOM 1611 OD2 ASP A 105 -3.460 2.780 11.308 1.00 0.00 O ATOM 0 H ASP A 105 -1.868 -1.584 11.672 1.00 0.00 H new ATOM 0 HA ASP A 105 -0.379 0.677 12.906 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -0.946 1.290 10.690 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.528 0.541 10.788 1.00 0.00 H new ATOM 1616 N ASP A 106 -1.844 0.586 14.833 1.00 0.00 N ATOM 1617 CA ASP A 106 -2.703 0.761 16.027 1.00 0.00 C ATOM 1618 C ASP A 106 -3.925 1.642 15.754 1.00 0.00 C ATOM 1619 O ASP A 106 -4.940 1.580 16.467 1.00 0.00 O ATOM 1620 CB ASP A 106 -1.883 1.363 17.174 1.00 0.00 C ATOM 1621 CG ASP A 106 -2.685 1.605 18.429 1.00 0.00 C ATOM 1622 OD1 ASP A 106 -2.994 0.617 19.132 1.00 0.00 O ATOM 1623 OD2 ASP A 106 -2.996 2.768 18.733 1.00 0.00 O ATOM 0 H ASP A 106 -0.856 0.771 15.009 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.071 -0.227 16.302 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -1.054 0.695 17.406 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -1.449 2.306 16.843 1.00 0.00 H new ATOM 1628 N SER A 107 -3.854 2.469 14.720 1.00 0.00 N ATOM 1629 CA SER A 107 -4.968 3.311 14.350 1.00 0.00 C ATOM 1630 C SER A 107 -5.981 2.474 13.551 1.00 0.00 C ATOM 1631 O SER A 107 -7.134 2.880 13.393 1.00 0.00 O ATOM 1632 CB SER A 107 -4.478 4.514 13.535 1.00 0.00 C ATOM 1633 OG SER A 107 -3.232 4.955 14.016 1.00 0.00 O ATOM 0 H SER A 107 -3.032 2.570 14.125 1.00 0.00 H new ATOM 0 HA SER A 107 -5.455 3.697 15.246 1.00 0.00 H new ATOM 0 HB2 SER A 107 -4.393 4.239 12.484 1.00 0.00 H new ATOM 0 HB3 SER A 107 -5.206 5.323 13.595 1.00 0.00 H new ATOM 0 HG SER A 107 -2.515 4.446 13.583 1.00 0.00 H new ATOM 1639 N ILE A 108 -5.524 1.321 13.053 1.00 0.00 N ATOM 1640 CA ILE A 108 -6.363 0.342 12.380 1.00 0.00 C ATOM 1641 C ILE A 108 -6.776 0.850 11.001 1.00 0.00 C ATOM 1642 O ILE A 108 -7.782 0.434 10.413 1.00 0.00 O ATOM 1643 CB ILE A 108 -7.599 -0.047 13.243 1.00 0.00 C ATOM 1644 CG1 ILE A 108 -7.184 -0.364 14.683 1.00 0.00 C ATOM 1645 CG2 ILE A 108 -8.331 -1.265 12.659 1.00 0.00 C ATOM 1646 CD1 ILE A 108 -6.285 -1.574 14.801 1.00 0.00 C ATOM 0 H ILE A 108 -4.544 1.043 13.110 1.00 0.00 H new ATOM 0 HA ILE A 108 -5.777 -0.567 12.243 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.272 0.811 13.237 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.672 0.501 15.104 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.079 -0.527 15.283 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -9.188 -1.509 13.286 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -8.673 -1.035 11.650 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -7.651 -2.117 12.626 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -6.032 -1.738 15.848 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -6.802 -2.451 14.411 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -5.372 -1.406 14.229 1.00 0.00 H new ATOM 1658 N ASP A 109 -5.956 1.736 10.471 1.00 0.00 N ATOM 1659 CA ASP A 109 -6.157 2.287 9.139 1.00 0.00 C ATOM 1660 C ASP A 109 -5.323 1.470 8.159 1.00 0.00 C ATOM 1661 O ASP A 109 -4.347 1.952 7.571 1.00 0.00 O ATOM 1662 CB ASP A 109 -5.758 3.769 9.133 1.00 0.00 C ATOM 1663 CG ASP A 109 -6.150 4.493 7.875 1.00 0.00 C ATOM 1664 OD1 ASP A 109 -7.296 4.353 7.418 1.00 0.00 O ATOM 1665 OD2 ASP A 109 -5.323 5.285 7.354 1.00 0.00 O ATOM 0 H ASP A 109 -5.130 2.096 10.949 1.00 0.00 H new ATOM 0 HA ASP A 109 -7.204 2.230 8.842 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.221 4.265 9.987 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -4.679 3.847 9.266 1.00 0.00 H new ATOM 1670 N LEU A 110 -5.716 0.215 8.002 1.00 0.00 N ATOM 1671 CA LEU A 110 -4.865 -0.801 7.344 1.00 0.00 C ATOM 1672 C LEU A 110 -5.204 -0.964 5.863 1.00 0.00 C ATOM 1673 O LEU A 110 -5.226 -2.088 5.364 1.00 0.00 O ATOM 1674 CB LEU A 110 -5.044 -2.138 8.046 1.00 0.00 C ATOM 1675 CG LEU A 110 -4.124 -2.401 9.247 1.00 0.00 C ATOM 1676 CD1 LEU A 110 -4.128 -1.245 10.234 1.00 0.00 C ATOM 1677 CD2 LEU A 110 -4.559 -3.675 9.946 1.00 0.00 C ATOM 0 H LEU A 110 -6.619 -0.138 8.318 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.831 -0.463 7.415 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -6.078 -2.212 8.383 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -4.889 -2.932 7.315 1.00 0.00 H new ATOM 0 HG LEU A 110 -3.106 -2.506 8.871 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.464 -1.475 11.067 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.784 -0.339 9.735 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -5.140 -1.090 10.609 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.907 -3.863 10.799 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -5.587 -3.567 10.292 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -4.496 -4.511 9.250 1.00 0.00 H new ATOM 1689 N GLY A 111 -5.465 0.148 5.196 1.00 0.00 N ATOM 1690 CA GLY A 111 -5.746 0.143 3.762 1.00 0.00 C ATOM 1691 C GLY A 111 -4.907 -0.840 2.969 1.00 0.00 C ATOM 1692 O GLY A 111 -5.438 -1.627 2.169 1.00 0.00 O ATOM 0 H GLY A 111 -5.489 1.073 5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.800 -0.090 3.610 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -5.581 1.146 3.367 1.00 0.00 H new ATOM 1696 N ASP A 112 -3.595 -0.807 3.149 1.00 0.00 N ATOM 1697 CA ASP A 112 -2.690 -1.756 2.504 1.00 0.00 C ATOM 1698 C ASP A 112 -2.463 -2.967 3.407 1.00 0.00 C ATOM 1699 O ASP A 112 -2.529 -4.109 2.953 1.00 0.00 O ATOM 1700 CB ASP A 112 -1.357 -1.088 2.151 1.00 0.00 C ATOM 1701 CG ASP A 112 -0.529 -0.762 3.365 1.00 0.00 C ATOM 1702 OD1 ASP A 112 -1.027 0.034 4.205 1.00 0.00 O ATOM 1703 OD2 ASP A 112 0.573 -1.321 3.518 1.00 0.00 O ATOM 0 H ASP A 112 -3.125 -0.125 3.744 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.152 -2.094 1.576 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -0.788 -1.747 1.495 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -1.551 -0.172 1.593 1.00 0.00 H new ATOM 1708 N ILE A 113 -2.261 -2.684 4.697 1.00 0.00 N ATOM 1709 CA ILE A 113 -1.736 -3.661 5.664 1.00 0.00 C ATOM 1710 C ILE A 113 -2.680 -4.848 5.831 1.00 0.00 C ATOM 1711 O ILE A 113 -2.245 -5.960 6.050 1.00 0.00 O ATOM 1712 CB ILE A 113 -1.537 -2.989 7.047 1.00 0.00 C ATOM 1713 CG1 ILE A 113 -0.836 -1.638 6.906 1.00 0.00 C ATOM 1714 CG2 ILE A 113 -0.722 -3.916 7.954 1.00 0.00 C ATOM 1715 CD1 ILE A 113 -0.598 -0.913 8.223 1.00 0.00 C ATOM 0 H ILE A 113 -2.456 -1.770 5.104 1.00 0.00 H new ATOM 0 HA ILE A 113 -0.783 -4.020 5.277 1.00 0.00 H new ATOM 0 HB ILE A 113 -2.516 -2.813 7.492 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.123 -1.790 6.410 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.433 -0.999 6.256 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -0.582 -3.443 8.926 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -1.253 -4.859 8.082 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.251 -4.106 7.500 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -0.097 0.036 8.031 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -1.553 -0.726 8.713 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.027 -1.529 8.870 1.00 0.00 H new ATOM 1727 N GLU A 114 -3.957 -4.576 5.718 1.00 0.00 N ATOM 1728 CA GLU A 114 -4.937 -5.630 5.874 1.00 0.00 C ATOM 1729 C GLU A 114 -4.710 -6.669 4.789 1.00 0.00 C ATOM 1730 O GLU A 114 -4.579 -7.858 5.053 1.00 0.00 O ATOM 1731 CB GLU A 114 -6.364 -5.085 5.818 1.00 0.00 C ATOM 1732 CG GLU A 114 -7.425 -6.112 6.144 1.00 0.00 C ATOM 1733 CD GLU A 114 -8.783 -5.514 6.402 1.00 0.00 C ATOM 1734 OE1 GLU A 114 -9.549 -5.337 5.441 1.00 0.00 O ATOM 1735 OE2 GLU A 114 -9.111 -5.246 7.580 1.00 0.00 O ATOM 0 H GLU A 114 -4.341 -3.651 5.522 1.00 0.00 H new ATOM 0 HA GLU A 114 -4.814 -6.088 6.855 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -6.452 -4.252 6.515 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -6.552 -4.687 4.821 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -7.500 -6.820 5.318 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -7.114 -6.678 7.022 1.00 0.00 H new ATOM 1742 N ALA A 115 -4.631 -6.181 3.569 1.00 0.00 N ATOM 1743 CA ALA A 115 -4.304 -7.019 2.426 1.00 0.00 C ATOM 1744 C ALA A 115 -2.848 -7.502 2.436 1.00 0.00 C ATOM 1745 O ALA A 115 -2.596 -8.706 2.359 1.00 0.00 O ATOM 1746 CB ALA A 115 -4.619 -6.265 1.140 1.00 0.00 C ATOM 0 H ALA A 115 -4.790 -5.200 3.338 1.00 0.00 H new ATOM 0 HA ALA A 115 -4.919 -7.917 2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -4.375 -6.891 0.282 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.679 -6.014 1.116 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -4.029 -5.350 1.101 1.00 0.00 H new ATOM 1752 N LEU A 116 -1.917 -6.575 2.553 1.00 0.00 N ATOM 1753 CA LEU A 116 -0.519 -6.845 2.248 1.00 0.00 C ATOM 1754 C LEU A 116 0.238 -7.501 3.383 1.00 0.00 C ATOM 1755 O LEU A 116 1.412 -7.851 3.229 1.00 0.00 O ATOM 1756 CB LEU A 116 0.189 -5.567 1.859 1.00 0.00 C ATOM 1757 CG LEU A 116 0.148 -5.224 0.359 1.00 0.00 C ATOM 1758 CD1 LEU A 116 -1.229 -5.522 -0.219 1.00 0.00 C ATOM 1759 CD2 LEU A 116 0.482 -3.778 0.190 1.00 0.00 C ATOM 0 H LEU A 116 -2.103 -5.620 2.859 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.529 -7.551 1.418 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.254 -4.741 2.416 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.231 -5.639 2.170 1.00 0.00 H new ATOM 0 HG LEU A 116 0.875 -5.835 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -1.240 -5.274 -1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.456 -6.581 -0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -1.979 -4.925 0.301 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.457 -3.520 -0.869 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.246 -3.171 0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.479 -3.586 0.587 1.00 0.00 H new ATOM 1771 N GLN A 117 -0.424 -7.698 4.513 1.00 0.00 N ATOM 1772 CA GLN A 117 0.199 -8.418 5.608 1.00 0.00 C ATOM 1773 C GLN A 117 0.495 -9.843 5.155 1.00 0.00 C ATOM 1774 O GLN A 117 1.542 -10.409 5.458 1.00 0.00 O ATOM 1775 CB GLN A 117 -0.675 -8.435 6.866 1.00 0.00 C ATOM 1776 CG GLN A 117 -2.080 -8.980 6.610 1.00 0.00 C ATOM 1777 CD GLN A 117 -2.946 -8.965 7.840 1.00 0.00 C ATOM 1778 OE1 GLN A 117 -2.475 -9.140 8.956 1.00 0.00 O ATOM 1779 NE2 GLN A 117 -4.229 -8.759 7.647 1.00 0.00 N ATOM 0 H GLN A 117 -1.375 -7.375 4.693 1.00 0.00 H new ATOM 0 HA GLN A 117 1.122 -7.903 5.872 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -0.190 -9.042 7.631 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -0.751 -7.423 7.263 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -2.557 -8.388 5.829 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -2.006 -10.001 6.236 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -4.586 -8.617 6.702 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -4.868 -8.741 8.442 1.00 0.00 H new ATOM 1788 N GLY A 118 -0.454 -10.376 4.401 1.00 0.00 N ATOM 1789 CA GLY A 118 -0.327 -11.707 3.841 1.00 0.00 C ATOM 1790 C GLY A 118 0.445 -11.726 2.537 1.00 0.00 C ATOM 1791 O GLY A 118 0.913 -12.782 2.108 1.00 0.00 O ATOM 0 H GLY A 118 -1.325 -9.901 4.163 1.00 0.00 H new ATOM 0 HA2 GLY A 118 0.172 -12.353 4.563 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -1.321 -12.123 3.675 1.00 0.00 H new ATOM 1795 N VAL A 119 0.588 -10.554 1.903 1.00 0.00 N ATOM 1796 CA VAL A 119 1.141 -10.481 0.550 1.00 0.00 C ATOM 1797 C VAL A 119 2.669 -10.417 0.645 1.00 0.00 C ATOM 1798 O VAL A 119 3.375 -11.147 -0.047 1.00 0.00 O ATOM 1799 CB VAL A 119 0.619 -9.229 -0.170 1.00 0.00 C ATOM 1800 CG1 VAL A 119 1.210 -9.089 -1.567 1.00 0.00 C ATOM 1801 CG2 VAL A 119 -0.897 -9.262 -0.256 1.00 0.00 C ATOM 0 H VAL A 119 0.330 -9.652 2.304 1.00 0.00 H new ATOM 0 HA VAL A 119 0.836 -11.362 -0.015 1.00 0.00 H new ATOM 0 HB VAL A 119 0.933 -8.365 0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 119 0.814 -8.191 -2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.295 -9.015 -1.497 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.944 -9.961 -2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.252 -8.368 -0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.211 -10.147 -0.810 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.318 -9.295 0.749 1.00 0.00 H new ATOM 1811 N SER A 120 3.132 -9.539 1.539 1.00 0.00 N ATOM 1812 CA SER A 120 4.551 -9.385 1.888 1.00 0.00 C ATOM 1813 C SER A 120 5.251 -10.711 2.218 1.00 0.00 C ATOM 1814 O SER A 120 6.476 -10.773 2.325 1.00 0.00 O ATOM 1815 CB SER A 120 4.658 -8.406 3.079 1.00 0.00 C ATOM 1816 OG SER A 120 5.995 -7.985 3.283 1.00 0.00 O ATOM 0 H SER A 120 2.521 -8.902 2.051 1.00 0.00 H new ATOM 0 HA SER A 120 5.067 -8.993 1.012 1.00 0.00 H new ATOM 0 HB2 SER A 120 4.025 -7.537 2.896 1.00 0.00 H new ATOM 0 HB3 SER A 120 4.285 -8.888 3.983 1.00 0.00 H new ATOM 0 HG SER A 120 6.597 -8.753 3.194 1.00 0.00 H new ATOM 1822 N LYS A 121 4.467 -11.768 2.352 1.00 0.00 N ATOM 1823 CA LYS A 121 4.962 -12.951 3.065 1.00 0.00 C ATOM 1824 C LYS A 121 4.648 -14.234 2.299 1.00 0.00 C ATOM 1825 O LYS A 121 5.240 -15.291 2.569 1.00 0.00 O ATOM 1826 CB LYS A 121 4.365 -13.010 4.481 1.00 0.00 C ATOM 1827 CG LYS A 121 5.342 -13.472 5.558 1.00 0.00 C ATOM 1828 CD LYS A 121 6.383 -12.416 5.908 1.00 0.00 C ATOM 1829 CE LYS A 121 7.521 -12.332 4.872 1.00 0.00 C ATOM 1830 NZ LYS A 121 8.489 -11.236 5.188 1.00 0.00 N ATOM 0 H LYS A 121 3.515 -11.840 1.993 1.00 0.00 H new ATOM 0 HA LYS A 121 6.046 -12.867 3.143 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.992 -12.021 4.746 1.00 0.00 H new ATOM 0 HB3 LYS A 121 3.507 -13.683 4.473 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.785 -13.737 6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.849 -14.375 5.218 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.896 -11.444 5.985 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.805 -12.640 6.888 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.050 -13.284 4.838 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.098 -12.167 3.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.238 -11.215 4.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.990 -10.324 5.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.913 -11.406 6.122 1.00 0.00 H new ATOM 1844 N PHE A 122 3.723 -14.157 1.366 1.00 0.00 N ATOM 1845 CA PHE A 122 3.359 -15.317 0.587 1.00 0.00 C ATOM 1846 C PHE A 122 4.265 -15.399 -0.636 1.00 0.00 C ATOM 1847 O PHE A 122 4.439 -14.406 -1.347 1.00 0.00 O ATOM 1848 CB PHE A 122 1.889 -15.208 0.161 1.00 0.00 C ATOM 1849 CG PHE A 122 1.247 -16.546 -0.051 1.00 0.00 C ATOM 1850 CD1 PHE A 122 0.845 -17.292 1.036 1.00 0.00 C ATOM 1851 CD2 PHE A 122 1.027 -17.041 -1.332 1.00 0.00 C ATOM 1852 CE1 PHE A 122 0.236 -18.514 0.852 1.00 0.00 C ATOM 1853 CE2 PHE A 122 0.416 -18.263 -1.515 1.00 0.00 C ATOM 1854 CZ PHE A 122 0.017 -19.007 -0.427 1.00 0.00 C ATOM 0 H PHE A 122 3.212 -13.306 1.130 1.00 0.00 H new ATOM 0 HA PHE A 122 3.482 -16.221 1.183 1.00 0.00 H new ATOM 0 HB2 PHE A 122 1.334 -14.660 0.922 1.00 0.00 H new ATOM 0 HB3 PHE A 122 1.824 -14.628 -0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 122 1.008 -16.917 2.036 1.00 0.00 H new ATOM 0 HD2 PHE A 122 1.337 -16.463 -2.190 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -0.073 -19.093 1.710 1.00 0.00 H new ATOM 0 HE2 PHE A 122 0.250 -18.638 -2.514 1.00 0.00 H new ATOM 0 HZ PHE A 122 -0.462 -19.965 -0.568 1.00 0.00 H new ATOM 1864 N PRO A 123 4.860 -16.561 -0.884 1.00 0.00 N ATOM 1865 CA PRO A 123 5.774 -16.755 -2.029 1.00 0.00 C ATOM 1866 C PRO A 123 5.143 -16.347 -3.342 1.00 0.00 C ATOM 1867 O PRO A 123 5.815 -15.870 -4.258 1.00 0.00 O ATOM 1868 CB PRO A 123 6.063 -18.254 -1.993 1.00 0.00 C ATOM 1869 CG PRO A 123 5.800 -18.675 -0.587 1.00 0.00 C ATOM 1870 CD PRO A 123 4.699 -17.787 -0.085 1.00 0.00 C ATOM 0 HA PRO A 123 6.671 -16.140 -1.955 1.00 0.00 H new ATOM 0 HB2 PRO A 123 5.423 -18.794 -2.691 1.00 0.00 H new ATOM 0 HB3 PRO A 123 7.094 -18.462 -2.279 1.00 0.00 H new ATOM 0 HG2 PRO A 123 5.506 -19.724 -0.543 1.00 0.00 H new ATOM 0 HG3 PRO A 123 6.696 -18.569 0.025 1.00 0.00 H new ATOM 0 HD2 PRO A 123 3.718 -18.239 -0.235 1.00 0.00 H new ATOM 0 HD3 PRO A 123 4.798 -17.587 0.982 1.00 0.00 H new ATOM 1878 N ALA A 124 3.826 -16.497 -3.422 1.00 0.00 N ATOM 1879 CA ALA A 124 3.076 -16.199 -4.636 1.00 0.00 C ATOM 1880 C ALA A 124 2.605 -14.742 -4.654 1.00 0.00 C ATOM 1881 O ALA A 124 1.936 -14.329 -5.607 1.00 0.00 O ATOM 1882 CB ALA A 124 1.895 -17.144 -4.752 1.00 0.00 C ATOM 0 H ALA A 124 3.249 -16.828 -2.649 1.00 0.00 H new ATOM 0 HA ALA A 124 3.734 -16.342 -5.493 1.00 0.00 H new ATOM 0 HB1 ALA A 124 1.336 -16.919 -5.660 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.254 -18.172 -4.793 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.244 -17.021 -3.886 1.00 0.00 H new ATOM 1888 N ARG A 125 2.945 -13.948 -3.637 1.00 0.00 N ATOM 1889 CA ARG A 125 2.500 -12.576 -3.573 1.00 0.00 C ATOM 1890 C ARG A 125 3.658 -11.657 -3.179 1.00 0.00 C ATOM 1891 O ARG A 125 3.471 -10.458 -3.022 1.00 0.00 O ATOM 1892 CB ARG A 125 1.358 -12.411 -2.551 1.00 0.00 C ATOM 1893 CG ARG A 125 0.063 -13.117 -2.937 1.00 0.00 C ATOM 1894 CD ARG A 125 -0.495 -12.559 -4.227 1.00 0.00 C ATOM 1895 NE ARG A 125 -1.787 -13.170 -4.563 1.00 0.00 N ATOM 1896 CZ ARG A 125 -2.190 -13.437 -5.802 1.00 0.00 C ATOM 1897 NH1 ARG A 125 -1.384 -13.227 -6.836 1.00 0.00 N ATOM 1898 NH2 ARG A 125 -3.374 -13.996 -5.992 1.00 0.00 N ATOM 0 H ARG A 125 3.527 -14.242 -2.852 1.00 0.00 H new ATOM 0 HA ARG A 125 2.134 -12.302 -4.562 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.692 -12.792 -1.586 1.00 0.00 H new ATOM 0 HB3 ARG A 125 1.154 -11.348 -2.421 1.00 0.00 H new ATOM 0 HG2 ARG A 125 0.247 -14.186 -3.048 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -0.670 -13.001 -2.139 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -0.615 -11.479 -4.136 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.213 -12.734 -5.037 1.00 0.00 H new ATOM 0 HE ARG A 125 -2.417 -13.405 -3.796 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -0.445 -12.857 -6.684 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -1.703 -13.435 -7.782 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -3.967 -14.218 -5.193 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -3.693 -14.205 -6.938 1.00 0.00 H new ATOM 1912 N ILE A 126 4.862 -12.202 -3.127 1.00 0.00 N ATOM 1913 CA ILE A 126 5.971 -11.527 -2.465 1.00 0.00 C ATOM 1914 C ILE A 126 6.600 -10.550 -3.444 1.00 0.00 C ATOM 1915 O ILE A 126 7.114 -9.494 -3.060 1.00 0.00 O ATOM 1916 CB ILE A 126 7.036 -12.517 -1.945 1.00 0.00 C ATOM 1917 CG1 ILE A 126 8.100 -11.765 -1.137 1.00 0.00 C ATOM 1918 CG2 ILE A 126 7.665 -13.298 -3.100 1.00 0.00 C ATOM 1919 CD1 ILE A 126 9.143 -12.657 -0.513 1.00 0.00 C ATOM 0 H ILE A 126 5.098 -13.107 -3.533 1.00 0.00 H new ATOM 0 HA ILE A 126 5.580 -11.000 -1.595 1.00 0.00 H new ATOM 0 HB ILE A 126 6.552 -13.240 -1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 126 8.595 -11.046 -1.789 1.00 0.00 H new ATOM 0 HG13 ILE A 126 7.607 -11.194 -0.350 1.00 0.00 H new ATOM 0 HG21 ILE A 126 8.412 -13.989 -2.708 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.891 -13.859 -3.624 1.00 0.00 H new ATOM 0 HG23 ILE A 126 8.141 -12.603 -3.792 1.00 0.00 H new ATOM 0 HD11 ILE A 126 9.858 -12.049 0.041 1.00 0.00 H new ATOM 0 HD12 ILE A 126 8.661 -13.360 0.167 1.00 0.00 H new ATOM 0 HD13 ILE A 126 9.665 -13.209 -1.295 1.00 0.00 H new ATOM 1931 N LYS A 127 6.520 -10.899 -4.721 1.00 0.00 N ATOM 1932 CA LYS A 127 6.964 -10.001 -5.769 1.00 0.00 C ATOM 1933 C LYS A 127 5.932 -8.889 -5.941 1.00 0.00 C ATOM 1934 O LYS A 127 6.265 -7.747 -6.256 1.00 0.00 O ATOM 1935 CB LYS A 127 7.181 -10.768 -7.066 1.00 0.00 C ATOM 1936 CG LYS A 127 8.425 -11.636 -7.084 1.00 0.00 C ATOM 1937 CD LYS A 127 9.685 -10.805 -6.985 1.00 0.00 C ATOM 1938 CE LYS A 127 10.931 -11.636 -7.253 1.00 0.00 C ATOM 1939 NZ LYS A 127 10.969 -12.103 -8.678 1.00 0.00 N ATOM 0 H LYS A 127 6.154 -11.792 -5.051 1.00 0.00 H new ATOM 0 HA LYS A 127 7.918 -9.552 -5.494 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.311 -11.398 -7.250 1.00 0.00 H new ATOM 0 HB3 LYS A 127 7.239 -10.056 -7.889 1.00 0.00 H new ATOM 0 HG2 LYS A 127 8.388 -12.343 -6.255 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.447 -12.223 -8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.636 -9.983 -7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.751 -10.361 -5.992 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.821 -11.044 -7.037 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.950 -12.496 -6.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.947 -13.142 -8.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.145 -11.726 -9.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.842 -11.764 -9.131 1.00 0.00 H new ATOM 1953 N CYS A 128 4.683 -9.228 -5.669 1.00 0.00 N ATOM 1954 CA CYS A 128 3.597 -8.248 -5.731 1.00 0.00 C ATOM 1955 C CYS A 128 3.624 -7.402 -4.477 1.00 0.00 C ATOM 1956 O CYS A 128 3.052 -6.315 -4.423 1.00 0.00 O ATOM 1957 CB CYS A 128 2.241 -8.941 -5.885 1.00 0.00 C ATOM 1958 SG CYS A 128 2.027 -9.796 -7.466 1.00 0.00 S ATOM 0 H CYS A 128 4.391 -10.168 -5.404 1.00 0.00 H new ATOM 0 HA CYS A 128 3.740 -7.611 -6.604 1.00 0.00 H new ATOM 0 HB2 CYS A 128 2.118 -9.660 -5.075 1.00 0.00 H new ATOM 0 HB3 CYS A 128 1.450 -8.199 -5.775 1.00 0.00 H new ATOM 1964 N ALA A 129 4.315 -7.901 -3.454 1.00 0.00 N ATOM 1965 CA ALA A 129 4.421 -7.222 -2.180 1.00 0.00 C ATOM 1966 C ALA A 129 5.434 -6.108 -2.274 1.00 0.00 C ATOM 1967 O ALA A 129 5.300 -5.078 -1.616 1.00 0.00 O ATOM 1968 CB ALA A 129 4.811 -8.202 -1.085 1.00 0.00 C ATOM 0 H ALA A 129 4.815 -8.789 -3.493 1.00 0.00 H new ATOM 0 HA ALA A 129 3.450 -6.796 -1.928 1.00 0.00 H new ATOM 0 HB1 ALA A 129 4.886 -7.674 -0.134 1.00 0.00 H new ATOM 0 HB2 ALA A 129 4.054 -8.982 -1.008 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.773 -8.653 -1.326 1.00 0.00 H new ATOM 1974 N THR A 130 6.436 -6.305 -3.108 1.00 0.00 N ATOM 1975 CA THR A 130 7.433 -5.279 -3.329 1.00 0.00 C ATOM 1976 C THR A 130 6.794 -4.167 -4.142 1.00 0.00 C ATOM 1977 O THR A 130 6.920 -2.976 -3.829 1.00 0.00 O ATOM 1978 CB THR A 130 8.647 -5.848 -4.070 1.00 0.00 C ATOM 1979 OG1 THR A 130 9.114 -7.027 -3.401 1.00 0.00 O ATOM 1980 CG2 THR A 130 9.771 -4.826 -4.151 1.00 0.00 C ATOM 0 H THR A 130 6.580 -7.163 -3.641 1.00 0.00 H new ATOM 0 HA THR A 130 7.783 -4.894 -2.371 1.00 0.00 H new ATOM 0 HB THR A 130 8.339 -6.098 -5.085 1.00 0.00 H new ATOM 0 HG1 THR A 130 9.889 -7.389 -3.879 1.00 0.00 H new ATOM 0 HG21 THR A 130 10.619 -5.259 -4.682 1.00 0.00 H new ATOM 0 HG22 THR A 130 9.421 -3.942 -4.684 1.00 0.00 H new ATOM 0 HG23 THR A 130 10.079 -4.544 -3.144 1.00 0.00 H new ATOM 1988 N LEU A 131 6.060 -4.564 -5.159 1.00 0.00 N ATOM 1989 CA LEU A 131 5.282 -3.657 -5.971 1.00 0.00 C ATOM 1990 C LEU A 131 4.426 -2.754 -5.096 1.00 0.00 C ATOM 1991 O LEU A 131 4.628 -1.551 -5.032 1.00 0.00 O ATOM 1992 CB LEU A 131 4.413 -4.471 -6.916 1.00 0.00 C ATOM 1993 CG LEU A 131 3.508 -3.675 -7.874 1.00 0.00 C ATOM 1994 CD1 LEU A 131 3.252 -4.519 -9.105 1.00 0.00 C ATOM 1995 CD2 LEU A 131 2.171 -3.334 -7.224 1.00 0.00 C ATOM 0 H LEU A 131 5.987 -5.539 -5.448 1.00 0.00 H new ATOM 0 HA LEU A 131 5.950 -3.018 -6.549 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.064 -5.110 -7.513 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.782 -5.129 -6.318 1.00 0.00 H new ATOM 0 HG LEU A 131 4.010 -2.742 -8.132 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.612 -3.970 -9.796 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.200 -4.748 -9.593 1.00 0.00 H new ATOM 0 HD13 LEU A 131 2.760 -5.447 -8.814 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.557 -2.772 -7.928 1.00 0.00 H new ATOM 0 HD22 LEU A 131 1.656 -4.254 -6.947 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.343 -2.732 -6.332 1.00 0.00 H new ATOM 2007 N SER A 132 3.507 -3.356 -4.373 1.00 0.00 N ATOM 2008 CA SER A 132 2.507 -2.602 -3.627 1.00 0.00 C ATOM 2009 C SER A 132 3.096 -1.953 -2.376 1.00 0.00 C ATOM 2010 O SER A 132 3.142 -0.736 -2.273 1.00 0.00 O ATOM 2011 CB SER A 132 1.325 -3.494 -3.263 1.00 0.00 C ATOM 2012 OG SER A 132 1.766 -4.720 -2.696 1.00 0.00 O ATOM 0 H SER A 132 3.426 -4.369 -4.282 1.00 0.00 H new ATOM 0 HA SER A 132 2.155 -1.799 -4.274 1.00 0.00 H new ATOM 0 HB2 SER A 132 0.677 -2.975 -2.556 1.00 0.00 H new ATOM 0 HB3 SER A 132 0.729 -3.695 -4.153 1.00 0.00 H new ATOM 0 HG SER A 132 1.928 -5.371 -3.410 1.00 0.00 H new ATOM 2018 N TRP A 133 3.564 -2.780 -1.443 1.00 0.00 N ATOM 2019 CA TRP A 133 4.055 -2.314 -0.164 1.00 0.00 C ATOM 2020 C TRP A 133 5.328 -1.485 -0.329 1.00 0.00 C ATOM 2021 O TRP A 133 5.378 -0.364 0.123 1.00 0.00 O ATOM 2022 CB TRP A 133 4.313 -3.504 0.780 1.00 0.00 C ATOM 2023 CG TRP A 133 5.345 -3.228 1.827 1.00 0.00 C ATOM 2024 CD1 TRP A 133 5.304 -2.286 2.815 1.00 0.00 C ATOM 2025 CD2 TRP A 133 6.609 -3.902 1.973 1.00 0.00 C ATOM 2026 NE1 TRP A 133 6.451 -2.322 3.545 1.00 0.00 N ATOM 2027 CE2 TRP A 133 7.260 -3.304 3.066 1.00 0.00 C ATOM 2028 CE3 TRP A 133 7.236 -4.948 1.289 1.00 0.00 C ATOM 2029 CZ2 TRP A 133 8.536 -3.717 3.479 1.00 0.00 C ATOM 2030 CZ3 TRP A 133 8.490 -5.366 1.721 1.00 0.00 C ATOM 2031 CH2 TRP A 133 9.129 -4.740 2.803 1.00 0.00 C ATOM 0 H TRP A 133 3.610 -3.792 -1.561 1.00 0.00 H new ATOM 0 HA TRP A 133 3.289 -1.675 0.275 1.00 0.00 H new ATOM 0 HB2 TRP A 133 3.378 -3.779 1.268 1.00 0.00 H new ATOM 0 HB3 TRP A 133 4.629 -4.364 0.189 1.00 0.00 H new ATOM 0 HD1 TRP A 133 4.480 -1.610 2.991 1.00 0.00 H new ATOM 0 HE1 TRP A 133 6.670 -1.708 4.329 1.00 0.00 H new ATOM 0 HE3 TRP A 133 6.757 -5.421 0.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 9.034 -3.237 4.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.980 -6.185 1.216 1.00 0.00 H new ATOM 0 HH2 TRP A 133 10.110 -5.076 3.105 1.00 0.00 H new ATOM 2042 N LYS A 134 6.323 -2.070 -0.948 1.00 0.00 N ATOM 2043 CA LYS A 134 7.618 -1.407 -1.043 1.00 0.00 C ATOM 2044 C LYS A 134 7.463 -0.045 -1.700 1.00 0.00 C ATOM 2045 O LYS A 134 8.085 0.922 -1.258 1.00 0.00 O ATOM 2046 CB LYS A 134 8.648 -2.261 -1.776 1.00 0.00 C ATOM 2047 CG LYS A 134 10.029 -1.632 -1.881 1.00 0.00 C ATOM 2048 CD LYS A 134 10.644 -1.399 -0.501 1.00 0.00 C ATOM 2049 CE LYS A 134 12.058 -0.877 -0.615 1.00 0.00 C ATOM 2050 NZ LYS A 134 12.978 -1.859 -1.257 1.00 0.00 N ATOM 0 H LYS A 134 6.273 -2.988 -1.390 1.00 0.00 H new ATOM 0 HA LYS A 134 7.995 -1.265 -0.030 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.737 -3.219 -1.264 1.00 0.00 H new ATOM 0 HB3 LYS A 134 8.280 -2.469 -2.781 1.00 0.00 H new ATOM 0 HG2 LYS A 134 10.681 -2.280 -2.467 1.00 0.00 H new ATOM 0 HG3 LYS A 134 9.959 -0.684 -2.414 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.035 -0.688 0.056 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.642 -2.332 0.063 1.00 0.00 H new ATOM 0 HE2 LYS A 134 12.056 0.046 -1.194 1.00 0.00 H new ATOM 0 HE3 LYS A 134 12.432 -0.629 0.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 13.964 -1.583 -1.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 12.804 -2.806 -0.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 12.809 -1.874 -2.283 1.00 0.00 H new ATOM 2064 N ALA A 135 6.628 0.052 -2.724 1.00 0.00 N ATOM 2065 CA ALA A 135 6.351 1.358 -3.331 1.00 0.00 C ATOM 2066 C ALA A 135 5.566 2.293 -2.403 1.00 0.00 C ATOM 2067 O ALA A 135 5.772 3.505 -2.449 1.00 0.00 O ATOM 2068 CB ALA A 135 5.612 1.191 -4.649 1.00 0.00 C ATOM 0 H ALA A 135 6.137 -0.735 -3.149 1.00 0.00 H new ATOM 0 HA ALA A 135 7.319 1.825 -3.513 1.00 0.00 H new ATOM 0 HB1 ALA A 135 5.416 2.171 -5.083 1.00 0.00 H new ATOM 0 HB2 ALA A 135 6.222 0.605 -5.337 1.00 0.00 H new ATOM 0 HB3 ALA A 135 4.667 0.676 -4.474 1.00 0.00 H new ATOM 2074 N LEU A 136 4.696 1.752 -1.576 1.00 0.00 N ATOM 2075 CA LEU A 136 3.888 2.581 -0.675 1.00 0.00 C ATOM 2076 C LEU A 136 4.742 3.008 0.516 1.00 0.00 C ATOM 2077 O LEU A 136 4.620 4.106 1.041 1.00 0.00 O ATOM 2078 CB LEU A 136 2.643 1.806 -0.220 1.00 0.00 C ATOM 2079 CG LEU A 136 1.487 2.630 0.354 1.00 0.00 C ATOM 2080 CD1 LEU A 136 0.894 3.574 -0.685 1.00 0.00 C ATOM 2081 CD2 LEU A 136 0.390 1.719 0.898 1.00 0.00 C ATOM 0 H LEU A 136 4.523 0.750 -1.501 1.00 0.00 H new ATOM 0 HA LEU A 136 3.549 3.475 -1.198 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.266 1.239 -1.071 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.951 1.082 0.534 1.00 0.00 H new ATOM 0 HG LEU A 136 1.897 3.229 1.167 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.077 4.140 -0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.664 4.262 -1.033 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.516 2.996 -1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -0.421 2.326 1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 136 0.008 1.090 0.094 1.00 0.00 H new ATOM 0 HD23 LEU A 136 0.799 1.089 1.688 1.00 0.00 H new ATOM 2093 N GLU A 137 5.639 2.122 0.908 1.00 0.00 N ATOM 2094 CA GLU A 137 6.608 2.374 1.958 1.00 0.00 C ATOM 2095 C GLU A 137 7.614 3.409 1.479 1.00 0.00 C ATOM 2096 O GLU A 137 7.992 4.332 2.174 1.00 0.00 O ATOM 2097 CB GLU A 137 7.349 1.071 2.301 1.00 0.00 C ATOM 2098 CG GLU A 137 8.206 1.131 3.549 1.00 0.00 C ATOM 2099 CD GLU A 137 7.425 0.789 4.816 1.00 0.00 C ATOM 2100 OE1 GLU A 137 6.878 1.716 5.424 1.00 0.00 O ATOM 2101 OE2 GLU A 137 7.394 -0.404 5.193 1.00 0.00 O ATOM 0 H GLU A 137 5.716 1.191 0.498 1.00 0.00 H new ATOM 0 HA GLU A 137 6.092 2.744 2.844 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.615 0.274 2.420 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.982 0.798 1.457 1.00 0.00 H new ATOM 0 HG2 GLU A 137 9.042 0.440 3.444 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.629 2.131 3.647 1.00 0.00 H new ATOM 2108 N LYS A 138 7.999 3.244 0.220 1.00 0.00 N ATOM 2109 CA LYS A 138 8.939 4.145 -0.452 1.00 0.00 C ATOM 2110 C LYS A 138 8.187 5.341 -1.035 1.00 0.00 C ATOM 2111 O LYS A 138 8.724 6.125 -1.836 1.00 0.00 O ATOM 2112 CB LYS A 138 9.738 3.411 -1.529 1.00 0.00 C ATOM 2113 CG LYS A 138 10.929 4.206 -2.051 1.00 0.00 C ATOM 2114 CD LYS A 138 11.794 3.352 -2.962 1.00 0.00 C ATOM 2115 CE LYS A 138 12.899 4.190 -3.606 1.00 0.00 C ATOM 2116 NZ LYS A 138 12.339 5.171 -4.566 1.00 0.00 N ATOM 0 H LYS A 138 7.669 2.480 -0.370 1.00 0.00 H new ATOM 0 HA LYS A 138 9.655 4.511 0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 138 10.093 2.463 -1.124 1.00 0.00 H new ATOM 0 HB3 LYS A 138 9.077 3.174 -2.362 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.576 5.082 -2.595 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.524 4.569 -1.213 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.237 2.536 -2.390 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.176 2.899 -3.738 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.459 4.714 -2.832 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.602 3.535 -4.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 13.096 5.518 -5.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.601 4.714 -5.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 11.926 5.971 -4.044 1.00 0.00 H new ATOM 2130 N GLY A 139 6.951 5.483 -0.595 1.00 0.00 N ATOM 2131 CA GLY A 139 6.105 6.534 -1.094 1.00 0.00 C ATOM 2132 C GLY A 139 6.113 7.758 -0.204 1.00 0.00 C ATOM 2133 O GLY A 139 6.020 8.887 -0.679 1.00 0.00 O ATOM 0 H GLY A 139 6.517 4.882 0.106 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.432 6.815 -2.095 1.00 0.00 H new ATOM 0 HA3 GLY A 139 5.085 6.162 -1.185 1.00 0.00 H new ATOM 2137 N VAL A 140 6.257 7.533 1.099 1.00 0.00 N ATOM 2138 CA VAL A 140 6.244 8.610 2.067 1.00 0.00 C ATOM 2139 C VAL A 140 6.646 8.064 3.445 1.00 0.00 C ATOM 2140 O VAL A 140 7.223 8.792 4.249 1.00 0.00 O ATOM 2141 CB VAL A 140 4.859 9.305 2.150 1.00 0.00 C ATOM 2142 CG1 VAL A 140 3.800 8.379 2.750 1.00 0.00 C ATOM 2143 CG2 VAL A 140 4.957 10.606 2.936 1.00 0.00 C ATOM 0 H VAL A 140 6.384 6.606 1.504 1.00 0.00 H new ATOM 0 HA VAL A 140 6.962 9.362 1.741 1.00 0.00 H new ATOM 0 HB VAL A 140 4.545 9.542 1.134 1.00 0.00 H new ATOM 0 HG11 VAL A 140 2.843 8.900 2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 140 3.701 7.489 2.129 1.00 0.00 H new ATOM 0 HG13 VAL A 140 4.100 8.088 3.757 1.00 0.00 H new ATOM 0 HG21 VAL A 140 3.975 11.078 2.983 1.00 0.00 H new ATOM 0 HG22 VAL A 140 5.307 10.395 3.947 1.00 0.00 H new ATOM 0 HG23 VAL A 140 5.659 11.278 2.442 1.00 0.00 H new ATOM 2153 N ALA A 141 6.357 6.780 3.681 1.00 0.00 N ATOM 2154 CA ALA A 141 6.790 6.093 4.881 1.00 0.00 C ATOM 2155 C ALA A 141 8.309 6.017 4.931 1.00 0.00 C ATOM 2156 O ALA A 141 8.980 6.428 3.976 1.00 0.00 O ATOM 2157 CB ALA A 141 6.184 4.707 4.925 1.00 0.00 C ATOM 0 H ALA A 141 5.817 6.197 3.041 1.00 0.00 H new ATOM 0 HA ALA A 141 6.450 6.652 5.753 1.00 0.00 H new ATOM 0 HB1 ALA A 141 6.513 4.195 5.829 1.00 0.00 H new ATOM 0 HB2 ALA A 141 5.097 4.785 4.927 1.00 0.00 H new ATOM 0 HB3 ALA A 141 6.505 4.141 4.050 1.00 0.00 H new ATOM 2163 N LYS A 142 8.865 5.457 6.012 1.00 0.00 N ATOM 2164 CA LYS A 142 10.305 5.524 6.235 1.00 0.00 C ATOM 2165 C LYS A 142 10.706 4.869 7.551 1.00 0.00 C ATOM 2166 O LYS A 142 11.823 4.349 7.661 1.00 0.00 O ATOM 2167 CB LYS A 142 10.745 6.995 6.244 1.00 0.00 C ATOM 2168 CG LYS A 142 12.238 7.210 6.380 1.00 0.00 C ATOM 2169 CD LYS A 142 12.564 8.702 6.365 1.00 0.00 C ATOM 2170 CE LYS A 142 14.061 8.964 6.319 1.00 0.00 C ATOM 2171 NZ LYS A 142 14.347 10.418 6.271 1.00 0.00 N ATOM 0 H LYS A 142 8.344 4.960 6.734 1.00 0.00 H new ATOM 0 HA LYS A 142 10.797 4.981 5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 142 10.407 7.467 5.321 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.242 7.505 7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.593 6.763 7.308 1.00 0.00 H new ATOM 0 HG3 LYS A 142 12.760 6.709 5.565 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.089 9.167 5.501 1.00 0.00 H new ATOM 0 HD3 LYS A 142 12.142 9.173 7.253 1.00 0.00 H new ATOM 0 HE2 LYS A 142 14.537 8.525 7.196 1.00 0.00 H new ATOM 0 HE3 LYS A 142 14.492 8.476 5.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 14.735 10.665 5.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 13.468 10.950 6.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 15.039 10.660 7.009 1.00 0.00 H new ATOM 2185 N GLU A 143 9.810 4.895 8.547 1.00 0.00 N ATOM 2186 CA GLU A 143 10.133 4.450 9.908 1.00 0.00 C ATOM 2187 C GLU A 143 11.178 5.374 10.544 1.00 0.00 C ATOM 2188 O GLU A 143 10.846 6.233 11.365 1.00 0.00 O ATOM 2189 CB GLU A 143 10.642 3.002 9.938 1.00 0.00 C ATOM 2190 CG GLU A 143 11.053 2.535 11.327 1.00 0.00 C ATOM 2191 CD GLU A 143 11.826 1.231 11.321 1.00 0.00 C ATOM 2192 OE1 GLU A 143 11.193 0.159 11.207 1.00 0.00 O ATOM 2193 OE2 GLU A 143 13.071 1.276 11.421 1.00 0.00 O ATOM 0 H GLU A 143 8.850 5.222 8.433 1.00 0.00 H new ATOM 0 HA GLU A 143 9.208 4.494 10.483 1.00 0.00 H new ATOM 0 HB2 GLU A 143 9.862 2.343 9.557 1.00 0.00 H new ATOM 0 HB3 GLU A 143 11.494 2.910 9.265 1.00 0.00 H new ATOM 0 HG2 GLU A 143 11.662 3.307 11.796 1.00 0.00 H new ATOM 0 HG3 GLU A 143 10.160 2.416 11.941 1.00 0.00 H new ATOM 2200 N GLU A 144 12.416 5.203 10.126 1.00 0.00 N ATOM 2201 CA GLU A 144 13.560 5.883 10.724 1.00 0.00 C ATOM 2202 C GLU A 144 14.811 5.617 9.899 1.00 0.00 C ATOM 2203 O GLU A 144 15.169 4.473 9.678 1.00 0.00 O ATOM 2204 CB GLU A 144 13.747 5.373 12.149 1.00 0.00 C ATOM 2205 CG GLU A 144 15.011 5.871 12.825 1.00 0.00 C ATOM 2206 CD GLU A 144 15.218 5.193 14.169 1.00 0.00 C ATOM 2207 OE1 GLU A 144 15.411 3.962 14.185 1.00 0.00 O ATOM 2208 OE2 GLU A 144 15.169 5.885 15.201 1.00 0.00 O ATOM 0 H GLU A 144 12.664 4.583 9.355 1.00 0.00 H new ATOM 0 HA GLU A 144 13.383 6.958 10.743 1.00 0.00 H new ATOM 0 HB2 GLU A 144 12.886 5.673 12.747 1.00 0.00 H new ATOM 0 HB3 GLU A 144 13.761 4.283 12.134 1.00 0.00 H new ATOM 0 HG2 GLU A 144 15.870 5.680 12.182 1.00 0.00 H new ATOM 0 HG3 GLU A 144 14.951 6.950 12.964 1.00 0.00 H new ATOM 2215 N GLY A 145 15.460 6.670 9.441 1.00 0.00 N ATOM 2216 CA GLY A 145 16.678 6.489 8.672 1.00 0.00 C ATOM 2217 C GLY A 145 17.562 7.717 8.718 1.00 0.00 C ATOM 2218 O GLY A 145 17.979 8.149 9.805 1.00 0.00 O ATOM 0 H GLY A 145 15.174 7.639 9.583 1.00 0.00 H new ATOM 0 HA2 GLY A 145 17.228 5.631 9.059 1.00 0.00 H new ATOM 0 HA3 GLY A 145 16.423 6.263 7.636 1.00 0.00 H new ATOM 2222 N GLY A 146 17.844 8.278 7.556 1.00 0.00 N ATOM 2223 CA GLY A 146 18.636 9.497 7.495 1.00 0.00 C ATOM 2224 C GLY A 146 17.830 10.667 6.994 1.00 0.00 C ATOM 2225 O GLY A 146 16.746 10.962 7.529 1.00 0.00 O ATOM 0 H GLY A 146 17.542 7.916 6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 146 19.029 9.725 8.486 1.00 0.00 H new ATOM 0 HA3 GLY A 146 19.494 9.340 6.841 1.00 0.00 H new ATOM 2229 N ASN A 147 18.328 11.336 5.964 1.00 0.00 N ATOM 2230 CA ASN A 147 17.626 12.489 5.382 1.00 0.00 C ATOM 2231 C ASN A 147 16.652 12.046 4.308 1.00 0.00 C ATOM 2232 O ASN A 147 16.246 10.883 4.260 1.00 0.00 O ATOM 2233 CB ASN A 147 18.625 13.507 4.820 1.00 0.00 C ATOM 2234 CG ASN A 147 17.927 14.720 4.224 1.00 0.00 C ATOM 2235 OD1 ASN A 147 16.871 15.155 4.709 1.00 0.00 O ATOM 2236 ND2 ASN A 147 18.514 15.299 3.189 1.00 0.00 N ATOM 0 H ASN A 147 19.212 11.107 5.510 1.00 0.00 H new ATOM 0 HA ASN A 147 17.057 12.972 6.176 1.00 0.00 H new ATOM 0 HB2 ASN A 147 19.299 13.830 5.614 1.00 0.00 H new ATOM 0 HB3 ASN A 147 19.238 13.030 4.056 1.00 0.00 H new ATOM 0 HD21 ASN A 147 18.099 16.129 2.766 1.00 0.00 H new ATOM 0 HD22 ASN A 147 19.382 14.916 2.815 1.00 0.00 H new TER 2243 ASN A 147 HETATM 2244 ZN ZN A 150 0.941 -9.817 -9.813 1.00 0.00 ZN