USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1000 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 57 GLN : amide:sc= 0.171 X(o=0.1,f=-0.085) USER MOD Set 1.2: A 61 ASN : amide:sc= -0.0712 K(o=0.1,f=-0.65) USER MOD Set 2.1: A 7 SER OG : rot 80:sc= 1 USER MOD Set 2.2: A 47 LYS NZ :NH3+ -170:sc= 2.41 (180deg=1.17) USER MOD Set 3.1: A 19 LYS NZ :NH3+ -164:sc= -0.34 (180deg=-0.732) USER MOD Set 3.2: A 22 SER OG : rot -20:sc= 0.246 USER MOD Set 4.1: A 11 TYR OH : rot 173:sc= 0.0232 USER MOD Set 4.2: A 86 HIS : no HD1:sc=-0.000691 X(o=0.022,f=0.27) USER MOD Single : A 1 MET CE :methyl -158:sc= -0.151 (180deg=-0.677) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.0674 (180deg=-0.153) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0434) USER MOD Single : A 8 TYR OH : rot 57:sc= -1.41 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.0051 X(o=-0.0051,f=-0.49) USER MOD Single : A 18 THR OG1 : rot 74:sc= 0.8 USER MOD Single : A 21 HIS : no HD1:sc= -0.183 X(o=-0.18,f=0.034) USER MOD Single : A 26 GLN : amide:sc= -0.439 X(o=-0.44,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0106) USER MOD Single : A 34 TYR OH : rot 150:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.324 K(o=-0.32,f=-5.3!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.066 K(o=-0.066,f=-0.79) USER MOD Single : A 50 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0419) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.0665 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -1.57 K(o=-1.6,f=-4!) USER MOD Single : A 56 MET CE :methyl 176:sc= -1.81 (180deg=-1.88) USER MOD Single : A 58 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.28) USER MOD Single : A 59 TYR OH : rot 109:sc= -1.11 USER MOD Single : A 62 SER OG : rot 72:sc= 1.01 USER MOD Single : A 69 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0137) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -174:sc=-0.00421 (180deg=-0.053) USER MOD Single : A 78 LYS NZ :NH3+ 167:sc= -0.0193 (180deg=-0.248) USER MOD Single : A 82 ASN : amide:sc= -0.246 X(o=-0.25,f=-0.6) USER MOD Single : A 83 SER OG : rot 80:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 167:sc= -0.0131 (180deg=-0.169) USER MOD Single : A 96 ASN : amide:sc= -0.846 K(o=-0.85,f=-7.9!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot -100:sc= -0.184 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 142:sc= 0.545 (180deg=-2.25!) USER MOD Single : A 108 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0393) USER MOD Single : A 113 HIS : no HD1:sc= -0.0539 K(o=-0.054,f=-0.64) USER MOD Single : A 114 HIS : no HD1:sc= -0.0235 X(o=-0.024,f=-0.41) USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.267 20.470 -8.413 1.00 0.00 N ATOM 2 CA MET A 1 9.832 20.570 -9.785 1.00 0.00 C ATOM 3 C MET A 1 9.054 19.700 -10.788 1.00 0.00 C ATOM 4 O MET A 1 9.039 19.997 -11.986 1.00 0.00 O ATOM 5 CB MET A 1 11.339 20.183 -9.801 1.00 0.00 C ATOM 6 CG MET A 1 11.659 18.748 -9.333 1.00 0.00 C ATOM 7 SD MET A 1 13.353 18.241 -9.714 1.00 0.00 S ATOM 8 CE MET A 1 13.325 18.218 -11.513 1.00 0.00 C ATOM 0 H1 MET A 1 9.740 21.157 -7.792 1.00 0.00 H new ATOM 0 H2 MET A 1 8.248 20.673 -8.442 1.00 0.00 H new ATOM 0 H3 MET A 1 9.418 19.509 -8.045 1.00 0.00 H new ATOM 0 HA MET A 1 9.734 21.611 -10.093 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.718 20.309 -10.815 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.883 20.883 -9.168 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.498 18.678 -8.257 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.963 18.054 -9.805 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.124 17.574 -11.881 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.364 17.836 -11.857 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.471 19.230 -11.892 1.00 0.00 H new ATOM 20 N GLU A 2 8.409 18.629 -10.299 1.00 0.00 N ATOM 21 CA GLU A 2 7.682 17.664 -11.154 1.00 0.00 C ATOM 22 C GLU A 2 6.215 17.550 -10.686 1.00 0.00 C ATOM 23 O GLU A 2 5.987 17.314 -9.494 1.00 0.00 O ATOM 24 CB GLU A 2 8.382 16.276 -11.098 1.00 0.00 C ATOM 25 CG GLU A 2 7.745 15.199 -12.004 1.00 0.00 C ATOM 26 CD GLU A 2 8.489 13.858 -11.943 1.00 0.00 C ATOM 27 OE1 GLU A 2 9.537 13.722 -12.613 1.00 0.00 O ATOM 28 OE2 GLU A 2 8.043 12.938 -11.225 1.00 0.00 O ATOM 0 H GLU A 2 8.374 18.404 -9.305 1.00 0.00 H new ATOM 0 HA GLU A 2 7.692 18.017 -12.185 1.00 0.00 H new ATOM 0 HB2 GLU A 2 9.427 16.399 -11.381 1.00 0.00 H new ATOM 0 HB3 GLU A 2 8.371 15.919 -10.068 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.707 15.048 -11.707 1.00 0.00 H new ATOM 0 HG3 GLU A 2 7.733 15.557 -13.034 1.00 0.00 H new ATOM 35 N PRO A 3 5.196 17.700 -11.610 1.00 0.00 N ATOM 36 CA PRO A 3 3.751 17.543 -11.274 1.00 0.00 C ATOM 37 C PRO A 3 3.417 16.132 -10.742 1.00 0.00 C ATOM 38 O PRO A 3 4.266 15.239 -10.757 1.00 0.00 O ATOM 39 CB PRO A 3 3.030 17.821 -12.625 1.00 0.00 C ATOM 40 CG PRO A 3 4.074 17.569 -13.669 1.00 0.00 C ATOM 41 CD PRO A 3 5.371 18.037 -13.049 1.00 0.00 C ATOM 0 HA PRO A 3 3.442 18.216 -10.474 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.170 17.165 -12.758 1.00 0.00 H new ATOM 0 HB3 PRO A 3 2.660 18.845 -12.673 1.00 0.00 H new ATOM 0 HG2 PRO A 3 4.121 16.512 -13.932 1.00 0.00 H new ATOM 0 HG3 PRO A 3 3.855 18.116 -14.586 1.00 0.00 H new ATOM 0 HD2 PRO A 3 6.232 17.527 -13.481 1.00 0.00 H new ATOM 0 HD3 PRO A 3 5.526 19.106 -13.197 1.00 0.00 H new ATOM 49 N SER A 4 2.162 15.934 -10.308 1.00 0.00 N ATOM 50 CA SER A 4 1.709 14.690 -9.640 1.00 0.00 C ATOM 51 C SER A 4 1.314 13.588 -10.668 1.00 0.00 C ATOM 52 O SER A 4 0.320 12.872 -10.490 1.00 0.00 O ATOM 53 CB SER A 4 0.527 15.032 -8.695 1.00 0.00 C ATOM 54 OG SER A 4 0.851 16.112 -7.829 1.00 0.00 O ATOM 0 H SER A 4 1.425 16.632 -10.408 1.00 0.00 H new ATOM 0 HA SER A 4 2.534 14.281 -9.057 1.00 0.00 H new ATOM 0 HB2 SER A 4 -0.351 15.289 -9.287 1.00 0.00 H new ATOM 0 HB3 SER A 4 0.267 14.154 -8.103 1.00 0.00 H new ATOM 0 HG SER A 4 0.087 16.305 -7.247 1.00 0.00 H new ATOM 60 N LYS A 5 2.152 13.424 -11.714 1.00 0.00 N ATOM 61 CA LYS A 5 1.942 12.438 -12.800 1.00 0.00 C ATOM 62 C LYS A 5 2.205 10.997 -12.320 1.00 0.00 C ATOM 63 O LYS A 5 1.853 10.044 -13.011 1.00 0.00 O ATOM 64 CB LYS A 5 2.877 12.759 -14.000 1.00 0.00 C ATOM 65 CG LYS A 5 2.698 14.165 -14.609 1.00 0.00 C ATOM 66 CD LYS A 5 1.299 14.410 -15.222 1.00 0.00 C ATOM 67 CE LYS A 5 0.965 13.454 -16.383 1.00 0.00 C ATOM 68 NZ LYS A 5 1.965 13.533 -17.484 1.00 0.00 N ATOM 0 H LYS A 5 3.001 13.976 -11.831 1.00 0.00 H new ATOM 0 HA LYS A 5 0.900 12.510 -13.111 1.00 0.00 H new ATOM 0 HB2 LYS A 5 3.911 12.650 -13.674 1.00 0.00 H new ATOM 0 HB3 LYS A 5 2.709 12.017 -14.781 1.00 0.00 H new ATOM 0 HG2 LYS A 5 2.880 14.911 -13.836 1.00 0.00 H new ATOM 0 HG3 LYS A 5 3.453 14.315 -15.381 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.545 14.301 -14.443 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.242 15.438 -15.580 1.00 0.00 H new ATOM 0 HE2 LYS A 5 0.921 12.432 -16.008 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -0.024 13.693 -16.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 1.655 12.937 -18.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 2.052 14.519 -17.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 2.888 13.199 -17.140 1.00 0.00 H new ATOM 82 N LEU A 6 2.846 10.866 -11.153 1.00 0.00 N ATOM 83 CA LEU A 6 3.159 9.575 -10.535 1.00 0.00 C ATOM 84 C LEU A 6 1.881 8.931 -9.956 1.00 0.00 C ATOM 85 O LEU A 6 1.257 9.482 -9.035 1.00 0.00 O ATOM 86 CB LEU A 6 4.228 9.801 -9.431 1.00 0.00 C ATOM 87 CG LEU A 6 4.848 8.536 -8.765 1.00 0.00 C ATOM 88 CD1 LEU A 6 5.488 7.594 -9.807 1.00 0.00 C ATOM 89 CD2 LEU A 6 5.867 8.948 -7.675 1.00 0.00 C ATOM 0 H LEU A 6 3.166 11.665 -10.605 1.00 0.00 H new ATOM 0 HA LEU A 6 3.557 8.889 -11.283 1.00 0.00 H new ATOM 0 HB2 LEU A 6 5.040 10.387 -9.863 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.778 10.409 -8.646 1.00 0.00 H new ATOM 0 HG LEU A 6 4.042 7.977 -8.289 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.909 6.725 -9.302 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.729 7.268 -10.518 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.279 8.123 -10.338 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.292 8.054 -7.218 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.664 9.539 -8.127 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.363 9.541 -6.912 1.00 0.00 H new ATOM 101 N SER A 7 1.474 7.794 -10.549 1.00 0.00 N ATOM 102 CA SER A 7 0.402 6.937 -10.000 1.00 0.00 C ATOM 103 C SER A 7 0.956 6.161 -8.795 1.00 0.00 C ATOM 104 O SER A 7 2.176 6.007 -8.677 1.00 0.00 O ATOM 105 CB SER A 7 -0.120 5.954 -11.076 1.00 0.00 C ATOM 106 OG SER A 7 -0.453 6.632 -12.270 1.00 0.00 O ATOM 0 H SER A 7 1.875 7.443 -11.418 1.00 0.00 H new ATOM 0 HA SER A 7 -0.433 7.562 -9.685 1.00 0.00 H new ATOM 0 HB2 SER A 7 0.640 5.200 -11.283 1.00 0.00 H new ATOM 0 HB3 SER A 7 -0.996 5.428 -10.697 1.00 0.00 H new ATOM 0 HG SER A 7 0.363 6.811 -12.783 1.00 0.00 H new ATOM 112 N TYR A 8 0.072 5.667 -7.915 1.00 0.00 N ATOM 113 CA TYR A 8 0.504 4.939 -6.711 1.00 0.00 C ATOM 114 C TYR A 8 1.175 3.601 -7.068 1.00 0.00 C ATOM 115 O TYR A 8 2.179 3.245 -6.463 1.00 0.00 O ATOM 116 CB TYR A 8 -0.670 4.698 -5.748 1.00 0.00 C ATOM 117 CG TYR A 8 -0.254 4.085 -4.396 1.00 0.00 C ATOM 118 CD1 TYR A 8 0.836 4.606 -3.688 1.00 0.00 C ATOM 119 CD2 TYR A 8 -0.933 3.006 -3.826 1.00 0.00 C ATOM 120 CE1 TYR A 8 1.223 4.084 -2.476 1.00 0.00 C ATOM 121 CE2 TYR A 8 -0.543 2.485 -2.603 1.00 0.00 C ATOM 122 CZ TYR A 8 0.535 3.026 -1.938 1.00 0.00 C ATOM 123 OH TYR A 8 0.928 2.505 -0.733 1.00 0.00 O ATOM 0 H TYR A 8 -0.939 5.757 -8.013 1.00 0.00 H new ATOM 0 HA TYR A 8 1.239 5.568 -6.209 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -1.178 5.645 -5.565 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -1.391 4.037 -6.229 1.00 0.00 H new ATOM 0 HD1 TYR A 8 1.386 5.437 -4.104 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -1.774 2.572 -4.346 1.00 0.00 H new ATOM 0 HE1 TYR A 8 2.066 4.506 -1.949 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -1.084 1.656 -2.172 1.00 0.00 H new ATOM 0 HH TYR A 8 0.920 3.211 -0.053 1.00 0.00 H new ATOM 133 N GLY A 9 0.630 2.901 -8.076 1.00 0.00 N ATOM 134 CA GLY A 9 1.204 1.628 -8.541 1.00 0.00 C ATOM 135 C GLY A 9 2.596 1.805 -9.130 1.00 0.00 C ATOM 136 O GLY A 9 3.484 0.969 -8.934 1.00 0.00 O ATOM 0 H GLY A 9 -0.205 3.194 -8.583 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.251 0.927 -7.708 1.00 0.00 H new ATOM 0 HA3 GLY A 9 0.547 1.188 -9.291 1.00 0.00 H new ATOM 140 N GLU A 10 2.770 2.937 -9.826 1.00 0.00 N ATOM 141 CA GLU A 10 4.045 3.354 -10.428 1.00 0.00 C ATOM 142 C GLU A 10 5.058 3.761 -9.341 1.00 0.00 C ATOM 143 O GLU A 10 6.264 3.504 -9.467 1.00 0.00 O ATOM 144 CB GLU A 10 3.781 4.544 -11.376 1.00 0.00 C ATOM 145 CG GLU A 10 2.873 4.208 -12.572 1.00 0.00 C ATOM 146 CD GLU A 10 3.551 3.307 -13.610 1.00 0.00 C ATOM 147 OE1 GLU A 10 4.357 3.830 -14.408 1.00 0.00 O ATOM 148 OE2 GLU A 10 3.299 2.085 -13.631 1.00 0.00 O ATOM 0 H GLU A 10 2.014 3.602 -9.990 1.00 0.00 H new ATOM 0 HA GLU A 10 4.468 2.518 -10.985 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.327 5.354 -10.806 1.00 0.00 H new ATOM 0 HB3 GLU A 10 4.735 4.914 -11.751 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.971 3.717 -12.208 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.560 5.134 -13.054 1.00 0.00 H new ATOM 155 N TYR A 11 4.537 4.391 -8.270 1.00 0.00 N ATOM 156 CA TYR A 11 5.344 4.785 -7.106 1.00 0.00 C ATOM 157 C TYR A 11 5.832 3.541 -6.363 1.00 0.00 C ATOM 158 O TYR A 11 6.968 3.500 -5.928 1.00 0.00 O ATOM 159 CB TYR A 11 4.539 5.696 -6.135 1.00 0.00 C ATOM 160 CG TYR A 11 5.312 6.069 -4.855 1.00 0.00 C ATOM 161 CD1 TYR A 11 6.536 6.739 -4.921 1.00 0.00 C ATOM 162 CD2 TYR A 11 4.826 5.739 -3.588 1.00 0.00 C ATOM 163 CE1 TYR A 11 7.242 7.060 -3.780 1.00 0.00 C ATOM 164 CE2 TYR A 11 5.533 6.066 -2.447 1.00 0.00 C ATOM 165 CZ TYR A 11 6.737 6.723 -2.548 1.00 0.00 C ATOM 166 OH TYR A 11 7.445 7.047 -1.415 1.00 0.00 O ATOM 0 H TYR A 11 3.551 4.638 -8.190 1.00 0.00 H new ATOM 0 HA TYR A 11 6.200 5.353 -7.471 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.256 6.610 -6.658 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.615 5.189 -5.857 1.00 0.00 H new ATOM 0 HD1 TYR A 11 6.938 7.011 -5.886 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.883 5.220 -3.499 1.00 0.00 H new ATOM 0 HE1 TYR A 11 8.189 7.575 -3.855 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.140 5.806 -1.475 1.00 0.00 H new ATOM 0 HH TYR A 11 6.904 6.848 -0.623 1.00 0.00 H new ATOM 176 N LEU A 12 4.954 2.533 -6.242 1.00 0.00 N ATOM 177 CA LEU A 12 5.256 1.266 -5.549 1.00 0.00 C ATOM 178 C LEU A 12 6.394 0.507 -6.237 1.00 0.00 C ATOM 179 O LEU A 12 7.099 -0.237 -5.580 1.00 0.00 O ATOM 180 CB LEU A 12 3.991 0.378 -5.465 1.00 0.00 C ATOM 181 CG LEU A 12 2.893 0.883 -4.484 1.00 0.00 C ATOM 182 CD1 LEU A 12 1.565 0.135 -4.695 1.00 0.00 C ATOM 183 CD2 LEU A 12 3.378 0.782 -3.019 1.00 0.00 C ATOM 0 H LEU A 12 4.009 2.572 -6.624 1.00 0.00 H new ATOM 0 HA LEU A 12 5.582 1.512 -4.538 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.556 0.297 -6.461 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.290 -0.626 -5.165 1.00 0.00 H new ATOM 0 HG LEU A 12 2.706 1.935 -4.700 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.820 0.512 -3.994 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.216 0.294 -5.715 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.717 -0.931 -4.525 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.595 1.140 -2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.609 -0.257 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.272 1.391 -2.889 1.00 0.00 H new ATOM 195 N GLU A 13 6.551 0.696 -7.561 1.00 0.00 N ATOM 196 CA GLU A 13 7.664 0.097 -8.328 1.00 0.00 C ATOM 197 C GLU A 13 9.011 0.656 -7.828 1.00 0.00 C ATOM 198 O GLU A 13 9.868 -0.096 -7.358 1.00 0.00 O ATOM 199 CB GLU A 13 7.492 0.358 -9.851 1.00 0.00 C ATOM 200 CG GLU A 13 6.185 -0.202 -10.441 1.00 0.00 C ATOM 201 CD GLU A 13 6.003 -1.709 -10.183 1.00 0.00 C ATOM 202 OE1 GLU A 13 6.793 -2.517 -10.728 1.00 0.00 O ATOM 203 OE2 GLU A 13 5.078 -2.095 -9.438 1.00 0.00 O ATOM 0 H GLU A 13 5.918 1.262 -8.126 1.00 0.00 H new ATOM 0 HA GLU A 13 7.652 -0.982 -8.171 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.528 1.432 -10.031 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.336 -0.083 -10.382 1.00 0.00 H new ATOM 0 HG2 GLU A 13 5.340 0.338 -10.014 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.171 -0.019 -11.515 1.00 0.00 H new ATOM 210 N SER A 14 9.128 1.994 -7.877 1.00 0.00 N ATOM 211 CA SER A 14 10.352 2.724 -7.494 1.00 0.00 C ATOM 212 C SER A 14 10.636 2.575 -5.979 1.00 0.00 C ATOM 213 O SER A 14 11.773 2.344 -5.567 1.00 0.00 O ATOM 214 CB SER A 14 10.204 4.215 -7.883 1.00 0.00 C ATOM 215 OG SER A 14 11.367 4.962 -7.559 1.00 0.00 O ATOM 0 H SER A 14 8.372 2.605 -8.185 1.00 0.00 H new ATOM 0 HA SER A 14 11.201 2.298 -8.029 1.00 0.00 H new ATOM 0 HB2 SER A 14 10.007 4.294 -8.952 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.343 4.641 -7.368 1.00 0.00 H new ATOM 0 HG SER A 14 11.238 5.898 -7.820 1.00 0.00 H new ATOM 221 N TRP A 15 9.559 2.682 -5.177 1.00 0.00 N ATOM 222 CA TRP A 15 9.584 2.546 -3.702 1.00 0.00 C ATOM 223 C TRP A 15 10.136 1.172 -3.300 1.00 0.00 C ATOM 224 O TRP A 15 11.021 1.080 -2.453 1.00 0.00 O ATOM 225 CB TRP A 15 8.149 2.751 -3.111 1.00 0.00 C ATOM 226 CG TRP A 15 8.028 2.455 -1.627 1.00 0.00 C ATOM 227 CD1 TRP A 15 8.321 3.298 -0.593 1.00 0.00 C ATOM 228 CD2 TRP A 15 7.606 1.217 -1.021 1.00 0.00 C ATOM 229 NE1 TRP A 15 8.105 2.669 0.607 1.00 0.00 N ATOM 230 CE2 TRP A 15 7.672 1.390 0.371 1.00 0.00 C ATOM 231 CE3 TRP A 15 7.179 -0.017 -1.528 1.00 0.00 C ATOM 232 CZ2 TRP A 15 7.337 0.377 1.264 1.00 0.00 C ATOM 233 CZ3 TRP A 15 6.845 -1.023 -0.640 1.00 0.00 C ATOM 234 CH2 TRP A 15 6.927 -0.820 0.745 1.00 0.00 C ATOM 0 H TRP A 15 8.625 2.870 -5.542 1.00 0.00 H new ATOM 0 HA TRP A 15 10.240 3.315 -3.295 1.00 0.00 H new ATOM 0 HB2 TRP A 15 7.841 3.781 -3.289 1.00 0.00 H new ATOM 0 HB3 TRP A 15 7.452 2.112 -3.653 1.00 0.00 H new ATOM 0 HD1 TRP A 15 8.672 4.313 -0.704 1.00 0.00 H new ATOM 0 HE1 TRP A 15 8.244 3.086 1.527 1.00 0.00 H new ATOM 0 HE3 TRP A 15 7.112 -0.180 -2.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 7.399 0.531 2.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 6.516 -1.979 -1.019 1.00 0.00 H new ATOM 0 HH2 TRP A 15 6.661 -1.624 1.415 1.00 0.00 H new ATOM 245 N PHE A 16 9.587 0.119 -3.932 1.00 0.00 N ATOM 246 CA PHE A 16 9.927 -1.287 -3.637 1.00 0.00 C ATOM 247 C PHE A 16 11.393 -1.587 -3.998 1.00 0.00 C ATOM 248 O PHE A 16 12.084 -2.261 -3.245 1.00 0.00 O ATOM 249 CB PHE A 16 8.961 -2.231 -4.398 1.00 0.00 C ATOM 250 CG PHE A 16 9.255 -3.714 -4.253 1.00 0.00 C ATOM 251 CD1 PHE A 16 9.032 -4.375 -3.046 1.00 0.00 C ATOM 252 CD2 PHE A 16 9.760 -4.446 -5.327 1.00 0.00 C ATOM 253 CE1 PHE A 16 9.315 -5.715 -2.923 1.00 0.00 C ATOM 254 CE2 PHE A 16 10.040 -5.783 -5.197 1.00 0.00 C ATOM 255 CZ PHE A 16 9.814 -6.417 -4.001 1.00 0.00 C ATOM 0 H PHE A 16 8.889 0.220 -4.669 1.00 0.00 H new ATOM 0 HA PHE A 16 9.813 -1.459 -2.567 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.946 -2.043 -4.049 1.00 0.00 H new ATOM 0 HB3 PHE A 16 8.987 -1.974 -5.457 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.634 -3.831 -2.202 1.00 0.00 H new ATOM 0 HD2 PHE A 16 9.933 -3.954 -6.273 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.147 -6.218 -1.982 1.00 0.00 H new ATOM 0 HE2 PHE A 16 10.438 -6.336 -6.035 1.00 0.00 H new ATOM 0 HZ PHE A 16 10.028 -7.471 -3.903 1.00 0.00 H new ATOM 265 N ASN A 17 11.849 -1.061 -5.155 1.00 0.00 N ATOM 266 CA ASN A 17 13.242 -1.239 -5.636 1.00 0.00 C ATOM 267 C ASN A 17 14.237 -0.566 -4.669 1.00 0.00 C ATOM 268 O ASN A 17 15.325 -1.099 -4.406 1.00 0.00 O ATOM 269 CB ASN A 17 13.405 -0.684 -7.082 1.00 0.00 C ATOM 270 CG ASN A 17 12.547 -1.421 -8.117 1.00 0.00 C ATOM 271 OD1 ASN A 17 12.239 -2.605 -7.970 1.00 0.00 O ATOM 272 ND2 ASN A 17 12.148 -0.718 -9.165 1.00 0.00 N ATOM 0 H ASN A 17 11.268 -0.504 -5.781 1.00 0.00 H new ATOM 0 HA ASN A 17 13.462 -2.306 -5.662 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.141 0.374 -7.089 1.00 0.00 H new ATOM 0 HB3 ASN A 17 14.453 -0.753 -7.374 1.00 0.00 H new ATOM 0 HD21 ASN A 17 11.568 -1.155 -9.881 1.00 0.00 H new ATOM 0 HD22 ASN A 17 12.421 0.261 -9.256 1.00 0.00 H new ATOM 279 N THR A 18 13.831 0.600 -4.132 1.00 0.00 N ATOM 280 CA THR A 18 14.568 1.298 -3.065 1.00 0.00 C ATOM 281 C THR A 18 14.527 0.464 -1.766 1.00 0.00 C ATOM 282 O THR A 18 15.541 0.300 -1.095 1.00 0.00 O ATOM 283 CB THR A 18 13.951 2.711 -2.785 1.00 0.00 C ATOM 284 OG1 THR A 18 13.909 3.472 -3.997 1.00 0.00 O ATOM 285 CG2 THR A 18 14.737 3.505 -1.720 1.00 0.00 C ATOM 0 H THR A 18 12.983 1.084 -4.427 1.00 0.00 H new ATOM 0 HA THR A 18 15.599 1.424 -3.396 1.00 0.00 H new ATOM 0 HB THR A 18 12.945 2.545 -2.399 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.196 3.128 -4.575 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.264 4.475 -1.567 1.00 0.00 H new ATOM 0 HG22 THR A 18 14.740 2.951 -0.781 1.00 0.00 H new ATOM 0 HG23 THR A 18 15.763 3.651 -2.058 1.00 0.00 H new ATOM 293 N LYS A 19 13.345 -0.112 -1.469 1.00 0.00 N ATOM 294 CA LYS A 19 13.055 -0.763 -0.170 1.00 0.00 C ATOM 295 C LYS A 19 13.680 -2.177 -0.105 1.00 0.00 C ATOM 296 O LYS A 19 13.774 -2.771 0.972 1.00 0.00 O ATOM 297 CB LYS A 19 11.510 -0.820 0.072 1.00 0.00 C ATOM 298 CG LYS A 19 11.092 -1.071 1.539 1.00 0.00 C ATOM 299 CD LYS A 19 11.563 0.073 2.477 1.00 0.00 C ATOM 300 CE LYS A 19 11.139 -0.127 3.941 1.00 0.00 C ATOM 301 NZ LYS A 19 11.705 -1.373 4.522 1.00 0.00 N ATOM 0 H LYS A 19 12.562 -0.140 -2.122 1.00 0.00 H new ATOM 0 HA LYS A 19 13.507 -0.167 0.623 1.00 0.00 H new ATOM 0 HB2 LYS A 19 11.069 0.120 -0.261 1.00 0.00 H new ATOM 0 HB3 LYS A 19 11.088 -1.608 -0.551 1.00 0.00 H new ATOM 0 HG2 LYS A 19 10.008 -1.165 1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 19 11.513 -2.017 1.880 1.00 0.00 H new ATOM 0 HD2 LYS A 19 12.649 0.150 2.428 1.00 0.00 H new ATOM 0 HD3 LYS A 19 11.160 1.019 2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 19 11.465 0.729 4.532 1.00 0.00 H new ATOM 0 HE3 LYS A 19 10.051 -0.161 4.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 11.193 -1.613 5.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 11.607 -2.151 3.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 12.712 -1.228 4.740 1.00 0.00 H new ATOM 315 N ARG A 20 14.083 -2.714 -1.279 1.00 0.00 N ATOM 316 CA ARG A 20 14.874 -3.966 -1.380 1.00 0.00 C ATOM 317 C ARG A 20 16.294 -3.804 -0.789 1.00 0.00 C ATOM 318 O ARG A 20 16.974 -4.795 -0.543 1.00 0.00 O ATOM 319 CB ARG A 20 14.933 -4.471 -2.850 1.00 0.00 C ATOM 320 CG ARG A 20 13.602 -5.040 -3.393 1.00 0.00 C ATOM 321 CD ARG A 20 13.690 -5.478 -4.869 1.00 0.00 C ATOM 322 NE ARG A 20 14.708 -6.527 -5.090 1.00 0.00 N ATOM 323 CZ ARG A 20 14.816 -7.299 -6.187 1.00 0.00 C ATOM 324 NH1 ARG A 20 13.964 -7.187 -7.203 1.00 0.00 N ATOM 325 NH2 ARG A 20 15.798 -8.186 -6.258 1.00 0.00 N ATOM 0 H ARG A 20 13.870 -2.293 -2.184 1.00 0.00 H new ATOM 0 HA ARG A 20 14.362 -4.720 -0.782 1.00 0.00 H new ATOM 0 HB2 ARG A 20 15.248 -3.647 -3.490 1.00 0.00 H new ATOM 0 HB3 ARG A 20 15.699 -5.243 -2.924 1.00 0.00 H new ATOM 0 HG2 ARG A 20 13.303 -5.893 -2.784 1.00 0.00 H new ATOM 0 HG3 ARG A 20 12.822 -4.286 -3.290 1.00 0.00 H new ATOM 0 HD2 ARG A 20 12.717 -5.847 -5.194 1.00 0.00 H new ATOM 0 HD3 ARG A 20 13.925 -4.612 -5.488 1.00 0.00 H new ATOM 0 HE ARG A 20 15.388 -6.679 -4.345 1.00 0.00 H new ATOM 0 HH11 ARG A 20 13.208 -6.504 -7.161 1.00 0.00 H new ATOM 0 HH12 ARG A 20 14.067 -7.784 -8.024 1.00 0.00 H new ATOM 0 HH21 ARG A 20 16.460 -8.277 -5.487 1.00 0.00 H new ATOM 0 HH22 ARG A 20 15.892 -8.778 -7.083 1.00 0.00 H new ATOM 339 N HIS A 21 16.742 -2.553 -0.580 1.00 0.00 N ATOM 340 CA HIS A 21 17.983 -2.261 0.179 1.00 0.00 C ATOM 341 C HIS A 21 17.773 -2.491 1.692 1.00 0.00 C ATOM 342 O HIS A 21 18.739 -2.626 2.452 1.00 0.00 O ATOM 343 CB HIS A 21 18.470 -0.811 -0.094 1.00 0.00 C ATOM 344 CG HIS A 21 18.912 -0.577 -1.517 1.00 0.00 C ATOM 345 ND1 HIS A 21 20.198 -0.813 -1.956 1.00 0.00 N ATOM 346 CD2 HIS A 21 18.232 -0.136 -2.599 1.00 0.00 C ATOM 347 CE1 HIS A 21 20.283 -0.525 -3.239 1.00 0.00 C ATOM 348 NE2 HIS A 21 19.106 -0.111 -3.652 1.00 0.00 N ATOM 0 H HIS A 21 16.264 -1.721 -0.926 1.00 0.00 H new ATOM 0 HA HIS A 21 18.755 -2.950 -0.164 1.00 0.00 H new ATOM 0 HB2 HIS A 21 17.665 -0.116 0.146 1.00 0.00 H new ATOM 0 HB3 HIS A 21 19.299 -0.583 0.576 1.00 0.00 H new ATOM 0 HD2 HIS A 21 17.190 0.145 -2.627 1.00 0.00 H new ATOM 0 HE1 HIS A 21 21.170 -0.614 -3.848 1.00 0.00 H new ATOM 0 HE2 HIS A 21 18.881 0.181 -4.603 1.00 0.00 H new ATOM 357 N SER A 22 16.499 -2.526 2.117 1.00 0.00 N ATOM 358 CA SER A 22 16.106 -2.733 3.526 1.00 0.00 C ATOM 359 C SER A 22 15.491 -4.136 3.744 1.00 0.00 C ATOM 360 O SER A 22 15.405 -4.603 4.891 1.00 0.00 O ATOM 361 CB SER A 22 15.105 -1.628 3.936 1.00 0.00 C ATOM 362 OG SER A 22 14.735 -1.718 5.301 1.00 0.00 O ATOM 0 H SER A 22 15.704 -2.411 1.489 1.00 0.00 H new ATOM 0 HA SER A 22 16.996 -2.674 4.152 1.00 0.00 H new ATOM 0 HB2 SER A 22 15.548 -0.650 3.746 1.00 0.00 H new ATOM 0 HB3 SER A 22 14.213 -1.700 3.314 1.00 0.00 H new ATOM 0 HG SER A 22 14.916 -2.623 5.630 1.00 0.00 H new ATOM 368 N VAL A 23 15.044 -4.812 2.657 1.00 0.00 N ATOM 369 CA VAL A 23 14.423 -6.162 2.742 1.00 0.00 C ATOM 370 C VAL A 23 15.212 -7.188 1.896 1.00 0.00 C ATOM 371 O VAL A 23 15.836 -6.827 0.895 1.00 0.00 O ATOM 372 CB VAL A 23 12.890 -6.154 2.323 1.00 0.00 C ATOM 373 CG1 VAL A 23 12.088 -5.093 3.123 1.00 0.00 C ATOM 374 CG2 VAL A 23 12.682 -5.967 0.798 1.00 0.00 C ATOM 0 H VAL A 23 15.101 -4.445 1.707 1.00 0.00 H new ATOM 0 HA VAL A 23 14.468 -6.462 3.789 1.00 0.00 H new ATOM 0 HB VAL A 23 12.503 -7.141 2.576 1.00 0.00 H new ATOM 0 HG11 VAL A 23 11.044 -5.115 2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.153 -5.315 4.188 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.503 -4.103 2.932 1.00 0.00 H new ATOM 0 HG21 VAL A 23 11.615 -5.970 0.573 1.00 0.00 H new ATOM 0 HG22 VAL A 23 13.116 -5.017 0.485 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.168 -6.782 0.262 1.00 0.00 H new ATOM 384 N GLY A 24 15.199 -8.464 2.324 1.00 0.00 N ATOM 385 CA GLY A 24 15.813 -9.556 1.551 1.00 0.00 C ATOM 386 C GLY A 24 14.898 -10.059 0.452 1.00 0.00 C ATOM 387 O GLY A 24 13.754 -9.631 0.375 1.00 0.00 O ATOM 0 H GLY A 24 14.770 -8.762 3.200 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.749 -9.208 1.113 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.061 -10.379 2.221 1.00 0.00 H new ATOM 391 N ILE A 25 15.406 -10.976 -0.395 1.00 0.00 N ATOM 392 CA ILE A 25 14.648 -11.551 -1.541 1.00 0.00 C ATOM 393 C ILE A 25 13.386 -12.300 -1.064 1.00 0.00 C ATOM 394 O ILE A 25 12.318 -12.169 -1.670 1.00 0.00 O ATOM 395 CB ILE A 25 15.550 -12.513 -2.421 1.00 0.00 C ATOM 396 CG1 ILE A 25 16.754 -11.733 -3.043 1.00 0.00 C ATOM 397 CG2 ILE A 25 14.735 -13.252 -3.534 1.00 0.00 C ATOM 398 CD1 ILE A 25 16.363 -10.590 -3.961 1.00 0.00 C ATOM 0 H ILE A 25 16.354 -11.344 -0.310 1.00 0.00 H new ATOM 0 HA ILE A 25 14.339 -10.711 -2.163 1.00 0.00 H new ATOM 0 HB ILE A 25 15.937 -13.280 -1.750 1.00 0.00 H new ATOM 0 HG12 ILE A 25 17.370 -11.338 -2.235 1.00 0.00 H new ATOM 0 HG13 ILE A 25 17.374 -12.434 -3.602 1.00 0.00 H new ATOM 0 HG21 ILE A 25 15.402 -13.897 -4.106 1.00 0.00 H new ATOM 0 HG22 ILE A 25 13.954 -13.856 -3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 25 14.281 -12.518 -4.200 1.00 0.00 H new ATOM 0 HD11 ILE A 25 17.262 -10.108 -4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 25 15.775 -10.977 -4.793 1.00 0.00 H new ATOM 0 HD13 ILE A 25 15.771 -9.863 -3.405 1.00 0.00 H new ATOM 410 N GLN A 26 13.517 -13.065 0.041 1.00 0.00 N ATOM 411 CA GLN A 26 12.393 -13.840 0.615 1.00 0.00 C ATOM 412 C GLN A 26 11.266 -12.909 1.099 1.00 0.00 C ATOM 413 O GLN A 26 10.082 -13.214 0.928 1.00 0.00 O ATOM 414 CB GLN A 26 12.887 -14.754 1.772 1.00 0.00 C ATOM 415 CG GLN A 26 13.500 -14.015 2.986 1.00 0.00 C ATOM 416 CD GLN A 26 13.968 -14.932 4.128 1.00 0.00 C ATOM 417 OE1 GLN A 26 13.925 -14.547 5.296 1.00 0.00 O ATOM 418 NE2 GLN A 26 14.429 -16.139 3.808 1.00 0.00 N ATOM 0 H GLN A 26 14.392 -13.163 0.556 1.00 0.00 H new ATOM 0 HA GLN A 26 11.988 -14.475 -0.173 1.00 0.00 H new ATOM 0 HB2 GLN A 26 12.048 -15.356 2.120 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.631 -15.444 1.375 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.348 -13.423 2.643 1.00 0.00 H new ATOM 0 HG3 GLN A 26 12.762 -13.316 3.379 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.454 -16.433 2.832 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.758 -16.770 4.539 1.00 0.00 H new ATOM 427 N THR A 27 11.661 -11.763 1.660 1.00 0.00 N ATOM 428 CA THR A 27 10.734 -10.761 2.201 1.00 0.00 C ATOM 429 C THR A 27 10.115 -9.947 1.054 1.00 0.00 C ATOM 430 O THR A 27 8.913 -9.675 1.047 1.00 0.00 O ATOM 431 CB THR A 27 11.477 -9.825 3.211 1.00 0.00 C ATOM 432 OG1 THR A 27 12.109 -10.634 4.214 1.00 0.00 O ATOM 433 CG2 THR A 27 10.528 -8.813 3.896 1.00 0.00 C ATOM 0 H THR A 27 12.642 -11.501 1.753 1.00 0.00 H new ATOM 0 HA THR A 27 9.932 -11.269 2.736 1.00 0.00 H new ATOM 0 HB THR A 27 12.212 -9.249 2.648 1.00 0.00 H new ATOM 0 HG1 THR A 27 12.579 -10.057 4.851 1.00 0.00 H new ATOM 0 HG21 THR A 27 11.097 -8.190 4.586 1.00 0.00 H new ATOM 0 HG22 THR A 27 10.060 -8.183 3.139 1.00 0.00 H new ATOM 0 HG23 THR A 27 9.757 -9.352 4.446 1.00 0.00 H new ATOM 441 N ALA A 28 10.958 -9.639 0.052 1.00 0.00 N ATOM 442 CA ALA A 28 10.604 -8.799 -1.104 1.00 0.00 C ATOM 443 C ALA A 28 9.543 -9.497 -1.966 1.00 0.00 C ATOM 444 O ALA A 28 8.587 -8.874 -2.411 1.00 0.00 O ATOM 445 CB ALA A 28 11.872 -8.501 -1.931 1.00 0.00 C ATOM 0 H ALA A 28 11.921 -9.973 0.023 1.00 0.00 H new ATOM 0 HA ALA A 28 10.184 -7.857 -0.751 1.00 0.00 H new ATOM 0 HB1 ALA A 28 11.610 -7.879 -2.787 1.00 0.00 H new ATOM 0 HB2 ALA A 28 12.597 -7.976 -1.309 1.00 0.00 H new ATOM 0 HB3 ALA A 28 12.306 -9.437 -2.282 1.00 0.00 H new ATOM 451 N LYS A 29 9.726 -10.818 -2.141 1.00 0.00 N ATOM 452 CA LYS A 29 8.829 -11.684 -2.933 1.00 0.00 C ATOM 453 C LYS A 29 7.410 -11.672 -2.321 1.00 0.00 C ATOM 454 O LYS A 29 6.409 -11.629 -3.043 1.00 0.00 O ATOM 455 CB LYS A 29 9.444 -13.130 -2.993 1.00 0.00 C ATOM 456 CG LYS A 29 8.837 -14.117 -4.046 1.00 0.00 C ATOM 457 CD LYS A 29 7.471 -14.723 -3.657 1.00 0.00 C ATOM 458 CE LYS A 29 7.514 -15.483 -2.321 1.00 0.00 C ATOM 459 NZ LYS A 29 6.183 -16.020 -1.959 1.00 0.00 N ATOM 0 H LYS A 29 10.512 -11.323 -1.731 1.00 0.00 H new ATOM 0 HA LYS A 29 8.737 -11.312 -3.954 1.00 0.00 H new ATOM 0 HB2 LYS A 29 10.511 -13.036 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.343 -13.583 -2.007 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.728 -13.591 -4.995 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.545 -14.929 -4.211 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.730 -13.926 -3.592 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.142 -15.401 -4.445 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.231 -16.301 -2.390 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.865 -14.816 -1.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.248 -16.527 -1.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.505 -15.236 -1.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.860 -16.675 -2.699 1.00 0.00 H new ATOM 473 N VAL A 30 7.357 -11.681 -0.976 1.00 0.00 N ATOM 474 CA VAL A 30 6.095 -11.683 -0.208 1.00 0.00 C ATOM 475 C VAL A 30 5.349 -10.342 -0.394 1.00 0.00 C ATOM 476 O VAL A 30 4.161 -10.332 -0.736 1.00 0.00 O ATOM 477 CB VAL A 30 6.368 -11.982 1.322 1.00 0.00 C ATOM 478 CG1 VAL A 30 5.089 -11.852 2.185 1.00 0.00 C ATOM 479 CG2 VAL A 30 6.993 -13.389 1.491 1.00 0.00 C ATOM 0 H VAL A 30 8.191 -11.687 -0.388 1.00 0.00 H new ATOM 0 HA VAL A 30 5.457 -12.480 -0.591 1.00 0.00 H new ATOM 0 HB VAL A 30 7.072 -11.230 1.677 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.329 -12.067 3.226 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.697 -10.838 2.105 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.339 -12.560 1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.176 -13.581 2.548 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.308 -14.141 1.098 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.936 -13.436 0.946 1.00 0.00 H new ATOM 489 N LEU A 31 6.095 -9.222 -0.239 1.00 0.00 N ATOM 490 CA LEU A 31 5.539 -7.850 -0.329 1.00 0.00 C ATOM 491 C LEU A 31 5.055 -7.549 -1.763 1.00 0.00 C ATOM 492 O LEU A 31 3.988 -6.974 -1.959 1.00 0.00 O ATOM 493 CB LEU A 31 6.606 -6.795 0.107 1.00 0.00 C ATOM 494 CG LEU A 31 7.256 -6.988 1.520 1.00 0.00 C ATOM 495 CD1 LEU A 31 8.295 -5.881 1.817 1.00 0.00 C ATOM 496 CD2 LEU A 31 6.189 -7.095 2.635 1.00 0.00 C ATOM 0 H LEU A 31 7.097 -9.244 -0.048 1.00 0.00 H new ATOM 0 HA LEU A 31 4.686 -7.787 0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.404 -6.792 -0.636 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.140 -5.810 0.079 1.00 0.00 H new ATOM 0 HG LEU A 31 7.790 -7.938 1.506 1.00 0.00 H new ATOM 0 HD11 LEU A 31 8.727 -6.043 2.804 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.084 -5.912 1.066 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.806 -4.907 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 31 6.681 -7.228 3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.592 -6.184 2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.541 -7.949 2.438 1.00 0.00 H new ATOM 508 N LYS A 32 5.856 -7.988 -2.750 1.00 0.00 N ATOM 509 CA LYS A 32 5.585 -7.775 -4.189 1.00 0.00 C ATOM 510 C LYS A 32 4.385 -8.615 -4.645 1.00 0.00 C ATOM 511 O LYS A 32 3.575 -8.176 -5.476 1.00 0.00 O ATOM 512 CB LYS A 32 6.837 -8.138 -5.024 1.00 0.00 C ATOM 513 CG LYS A 32 6.750 -7.750 -6.514 1.00 0.00 C ATOM 514 CD LYS A 32 8.020 -8.124 -7.306 1.00 0.00 C ATOM 515 CE LYS A 32 7.973 -7.662 -8.774 1.00 0.00 C ATOM 516 NZ LYS A 32 6.859 -8.297 -9.531 1.00 0.00 N ATOM 0 H LYS A 32 6.717 -8.505 -2.573 1.00 0.00 H new ATOM 0 HA LYS A 32 5.347 -6.723 -4.343 1.00 0.00 H new ATOM 0 HB2 LYS A 32 7.705 -7.647 -4.584 1.00 0.00 H new ATOM 0 HB3 LYS A 32 7.007 -9.212 -4.951 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.889 -8.244 -6.963 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.580 -6.676 -6.596 1.00 0.00 H new ATOM 0 HD2 LYS A 32 8.889 -7.680 -6.819 1.00 0.00 H new ATOM 0 HD3 LYS A 32 8.155 -9.205 -7.276 1.00 0.00 H new ATOM 0 HE2 LYS A 32 7.861 -6.578 -8.808 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.920 -7.900 -9.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 6.899 -7.995 -10.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 6.950 -9.332 -9.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 5.949 -8.008 -9.117 1.00 0.00 H new ATOM 530 N GLY A 33 4.292 -9.832 -4.070 1.00 0.00 N ATOM 531 CA GLY A 33 3.162 -10.736 -4.299 1.00 0.00 C ATOM 532 C GLY A 33 1.838 -10.139 -3.849 1.00 0.00 C ATOM 533 O GLY A 33 0.780 -10.452 -4.403 1.00 0.00 O ATOM 0 H GLY A 33 4.999 -10.208 -3.438 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.105 -10.980 -5.360 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.335 -11.671 -3.766 1.00 0.00 H new ATOM 537 N TYR A 34 1.917 -9.272 -2.837 1.00 0.00 N ATOM 538 CA TYR A 34 0.775 -8.525 -2.320 1.00 0.00 C ATOM 539 C TYR A 34 0.488 -7.306 -3.194 1.00 0.00 C ATOM 540 O TYR A 34 -0.670 -6.974 -3.423 1.00 0.00 O ATOM 541 CB TYR A 34 1.058 -8.066 -0.877 1.00 0.00 C ATOM 542 CG TYR A 34 1.206 -9.194 0.147 1.00 0.00 C ATOM 543 CD1 TYR A 34 0.566 -10.427 -0.020 1.00 0.00 C ATOM 544 CD2 TYR A 34 1.982 -9.016 1.294 1.00 0.00 C ATOM 545 CE1 TYR A 34 0.700 -11.430 0.912 1.00 0.00 C ATOM 546 CE2 TYR A 34 2.111 -10.019 2.226 1.00 0.00 C ATOM 547 CZ TYR A 34 1.471 -11.226 2.026 1.00 0.00 C ATOM 548 OH TYR A 34 1.611 -12.235 2.949 1.00 0.00 O ATOM 0 H TYR A 34 2.789 -9.068 -2.349 1.00 0.00 H new ATOM 0 HA TYR A 34 -0.097 -9.179 -2.331 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.972 -7.472 -0.874 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.249 -7.409 -0.556 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.044 -10.594 -0.896 1.00 0.00 H new ATOM 0 HD2 TYR A 34 2.489 -8.076 1.452 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.199 -12.375 0.766 1.00 0.00 H new ATOM 0 HE2 TYR A 34 2.710 -9.863 3.111 1.00 0.00 H new ATOM 0 HH TYR A 34 2.486 -12.162 3.383 1.00 0.00 H new ATOM 558 N LEU A 35 1.556 -6.642 -3.671 1.00 0.00 N ATOM 559 CA LEU A 35 1.444 -5.376 -4.416 1.00 0.00 C ATOM 560 C LEU A 35 0.620 -5.565 -5.703 1.00 0.00 C ATOM 561 O LEU A 35 -0.468 -5.002 -5.816 1.00 0.00 O ATOM 562 CB LEU A 35 2.854 -4.784 -4.694 1.00 0.00 C ATOM 563 CG LEU A 35 3.576 -4.171 -3.451 1.00 0.00 C ATOM 564 CD1 LEU A 35 5.026 -3.750 -3.776 1.00 0.00 C ATOM 565 CD2 LEU A 35 2.753 -2.997 -2.875 1.00 0.00 C ATOM 0 H LEU A 35 2.516 -6.966 -3.552 1.00 0.00 H new ATOM 0 HA LEU A 35 0.905 -4.653 -3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.485 -5.570 -5.109 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.762 -4.012 -5.458 1.00 0.00 H new ATOM 0 HG LEU A 35 3.643 -4.945 -2.686 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.491 -3.329 -2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 35 5.593 -4.621 -4.104 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.019 -3.002 -4.569 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.269 -2.581 -2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.639 -2.225 -3.636 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.769 -3.356 -2.573 1.00 0.00 H new ATOM 577 N ASN A 36 1.097 -6.427 -6.606 1.00 0.00 N ATOM 578 CA ASN A 36 0.451 -6.665 -7.926 1.00 0.00 C ATOM 579 C ASN A 36 -0.969 -7.271 -7.811 1.00 0.00 C ATOM 580 O ASN A 36 -1.826 -7.024 -8.667 1.00 0.00 O ATOM 581 CB ASN A 36 1.369 -7.558 -8.808 1.00 0.00 C ATOM 582 CG ASN A 36 1.854 -8.854 -8.128 1.00 0.00 C ATOM 583 OD1 ASN A 36 1.170 -9.453 -7.298 1.00 0.00 O ATOM 584 ND2 ASN A 36 3.053 -9.289 -8.472 1.00 0.00 N ATOM 0 H ASN A 36 1.938 -6.984 -6.455 1.00 0.00 H new ATOM 0 HA ASN A 36 0.322 -5.693 -8.401 1.00 0.00 H new ATOM 0 HB2 ASN A 36 0.831 -7.821 -9.718 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.239 -6.975 -9.110 1.00 0.00 H new ATOM 0 HD21 ASN A 36 3.429 -10.137 -8.048 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.603 -8.777 -9.162 1.00 0.00 H new ATOM 591 N SER A 37 -1.204 -8.055 -6.752 1.00 0.00 N ATOM 592 CA SER A 37 -2.465 -8.792 -6.548 1.00 0.00 C ATOM 593 C SER A 37 -3.540 -7.904 -5.888 1.00 0.00 C ATOM 594 O SER A 37 -4.691 -7.870 -6.328 1.00 0.00 O ATOM 595 CB SER A 37 -2.196 -10.035 -5.667 1.00 0.00 C ATOM 596 OG SER A 37 -3.362 -10.828 -5.492 1.00 0.00 O ATOM 0 H SER A 37 -0.523 -8.199 -6.006 1.00 0.00 H new ATOM 0 HA SER A 37 -2.842 -9.101 -7.523 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.412 -10.639 -6.123 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.826 -9.715 -4.693 1.00 0.00 H new ATOM 0 HG SER A 37 -3.149 -11.603 -4.931 1.00 0.00 H new ATOM 602 N ARG A 38 -3.144 -7.219 -4.812 1.00 0.00 N ATOM 603 CA ARG A 38 -4.059 -6.465 -3.935 1.00 0.00 C ATOM 604 C ARG A 38 -4.082 -4.963 -4.263 1.00 0.00 C ATOM 605 O ARG A 38 -5.135 -4.415 -4.621 1.00 0.00 O ATOM 606 CB ARG A 38 -3.678 -6.706 -2.445 1.00 0.00 C ATOM 607 CG ARG A 38 -3.884 -8.155 -1.925 1.00 0.00 C ATOM 608 CD ARG A 38 -5.374 -8.558 -1.733 1.00 0.00 C ATOM 609 NE ARG A 38 -6.164 -8.540 -2.985 1.00 0.00 N ATOM 610 CZ ARG A 38 -6.810 -9.583 -3.523 1.00 0.00 C ATOM 611 NH1 ARG A 38 -6.706 -10.791 -2.996 1.00 0.00 N ATOM 612 NH2 ARG A 38 -7.516 -9.416 -4.624 1.00 0.00 N ATOM 0 H ARG A 38 -2.169 -7.169 -4.517 1.00 0.00 H new ATOM 0 HA ARG A 38 -5.069 -6.834 -4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -2.631 -6.436 -2.308 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -4.266 -6.030 -1.824 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.419 -8.850 -2.624 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.364 -8.265 -0.973 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -5.417 -9.558 -1.301 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.834 -7.880 -1.014 1.00 0.00 H new ATOM 0 HE ARG A 38 -6.222 -7.652 -3.484 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -6.128 -10.938 -2.169 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -7.204 -11.576 -3.417 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -7.568 -8.496 -5.062 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -8.010 -10.207 -5.038 1.00 0.00 H new ATOM 626 N ILE A 39 -2.919 -4.297 -4.144 1.00 0.00 N ATOM 627 CA ILE A 39 -2.854 -2.822 -4.137 1.00 0.00 C ATOM 628 C ILE A 39 -2.953 -2.244 -5.579 1.00 0.00 C ATOM 629 O ILE A 39 -3.756 -1.357 -5.821 1.00 0.00 O ATOM 630 CB ILE A 39 -1.562 -2.248 -3.412 1.00 0.00 C ATOM 631 CG1 ILE A 39 -1.410 -2.760 -1.926 1.00 0.00 C ATOM 632 CG2 ILE A 39 -1.593 -0.700 -3.430 1.00 0.00 C ATOM 633 CD1 ILE A 39 -0.856 -4.165 -1.749 1.00 0.00 C ATOM 0 H ILE A 39 -2.012 -4.755 -4.051 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.717 -2.496 -3.556 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.699 -2.616 -3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -0.761 -2.067 -1.390 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.388 -2.716 -1.447 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.705 -0.312 -2.931 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.613 -0.348 -4.462 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.484 -0.348 -2.910 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.799 -4.402 -0.687 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.512 -4.880 -2.246 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.140 -4.221 -2.188 1.00 0.00 H new ATOM 645 N ILE A 40 -2.163 -2.788 -6.522 1.00 0.00 N ATOM 646 CA ILE A 40 -2.067 -2.283 -7.929 1.00 0.00 C ATOM 647 C ILE A 40 -3.465 -2.195 -8.654 1.00 0.00 C ATOM 648 O ILE A 40 -3.756 -1.145 -9.238 1.00 0.00 O ATOM 649 CB ILE A 40 -0.985 -3.105 -8.786 1.00 0.00 C ATOM 650 CG1 ILE A 40 0.433 -2.419 -8.764 1.00 0.00 C ATOM 651 CG2 ILE A 40 -1.431 -3.359 -10.250 1.00 0.00 C ATOM 652 CD1 ILE A 40 1.051 -2.239 -7.391 1.00 0.00 C ATOM 0 H ILE A 40 -1.565 -3.595 -6.342 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.708 -1.256 -7.859 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.910 -4.075 -8.295 1.00 0.00 H new ATOM 0 HG12 ILE A 40 1.114 -3.012 -9.374 1.00 0.00 H new ATOM 0 HG13 ILE A 40 0.351 -1.441 -9.237 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.656 -3.918 -10.774 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.358 -3.932 -10.254 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.592 -2.405 -10.752 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.024 -1.758 -7.490 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.400 -1.617 -6.778 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.174 -3.213 -6.917 1.00 0.00 H new ATOM 664 N PRO A 41 -4.364 -3.249 -8.616 1.00 0.00 N ATOM 665 CA PRO A 41 -5.709 -3.153 -9.253 1.00 0.00 C ATOM 666 C PRO A 41 -6.649 -2.144 -8.546 1.00 0.00 C ATOM 667 O PRO A 41 -7.554 -1.594 -9.177 1.00 0.00 O ATOM 668 CB PRO A 41 -6.259 -4.598 -9.168 1.00 0.00 C ATOM 669 CG PRO A 41 -5.548 -5.202 -8.000 1.00 0.00 C ATOM 670 CD PRO A 41 -4.156 -4.606 -8.019 1.00 0.00 C ATOM 0 HA PRO A 41 -5.644 -2.776 -10.274 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.339 -4.603 -9.021 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.059 -5.153 -10.085 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -6.061 -4.971 -7.066 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.511 -6.288 -8.083 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.733 -4.543 -7.016 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.471 -5.207 -8.617 1.00 0.00 H new ATOM 678 N SER A 42 -6.414 -1.896 -7.246 1.00 0.00 N ATOM 679 CA SER A 42 -7.293 -1.036 -6.437 1.00 0.00 C ATOM 680 C SER A 42 -6.736 0.403 -6.354 1.00 0.00 C ATOM 681 O SER A 42 -7.230 1.311 -7.034 1.00 0.00 O ATOM 682 CB SER A 42 -7.451 -1.656 -5.022 1.00 0.00 C ATOM 683 OG SER A 42 -8.288 -0.871 -4.181 1.00 0.00 O ATOM 0 H SER A 42 -5.621 -2.280 -6.733 1.00 0.00 H new ATOM 0 HA SER A 42 -8.272 -0.976 -6.912 1.00 0.00 H new ATOM 0 HB2 SER A 42 -7.867 -2.659 -5.111 1.00 0.00 H new ATOM 0 HB3 SER A 42 -6.469 -1.758 -4.560 1.00 0.00 H new ATOM 0 HG SER A 42 -8.361 -1.298 -3.302 1.00 0.00 H new ATOM 689 N LEU A 43 -5.659 0.573 -5.567 1.00 0.00 N ATOM 690 CA LEU A 43 -5.076 1.889 -5.237 1.00 0.00 C ATOM 691 C LEU A 43 -3.961 2.272 -6.226 1.00 0.00 C ATOM 692 O LEU A 43 -3.585 3.440 -6.308 1.00 0.00 O ATOM 693 CB LEU A 43 -4.521 1.854 -3.781 1.00 0.00 C ATOM 694 CG LEU A 43 -5.509 1.327 -2.687 1.00 0.00 C ATOM 695 CD1 LEU A 43 -4.864 1.326 -1.287 1.00 0.00 C ATOM 696 CD2 LEU A 43 -6.836 2.116 -2.701 1.00 0.00 C ATOM 0 H LEU A 43 -5.162 -0.207 -5.137 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.857 2.646 -5.314 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.628 1.230 -3.768 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.209 2.862 -3.507 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.742 0.291 -2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.582 0.954 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.984 0.682 -1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.569 2.341 -1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.500 1.725 -1.930 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.635 3.170 -2.507 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.312 2.011 -3.676 1.00 0.00 H new ATOM 708 N GLY A 44 -3.457 1.279 -6.980 1.00 0.00 N ATOM 709 CA GLY A 44 -2.358 1.486 -7.923 1.00 0.00 C ATOM 710 C GLY A 44 -2.793 2.223 -9.185 1.00 0.00 C ATOM 711 O GLY A 44 -2.053 3.077 -9.696 1.00 0.00 O ATOM 0 H GLY A 44 -3.801 0.319 -6.949 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.566 2.052 -7.432 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.936 0.520 -8.199 1.00 0.00 H new ATOM 715 N ASN A 45 -3.996 1.862 -9.694 1.00 0.00 N ATOM 716 CA ASN A 45 -4.676 2.590 -10.798 1.00 0.00 C ATOM 717 C ASN A 45 -5.019 4.042 -10.399 1.00 0.00 C ATOM 718 O ASN A 45 -5.192 4.907 -11.267 1.00 0.00 O ATOM 719 CB ASN A 45 -5.974 1.851 -11.240 1.00 0.00 C ATOM 720 CG ASN A 45 -5.704 0.526 -11.957 1.00 0.00 C ATOM 721 OD1 ASN A 45 -5.651 -0.531 -11.339 1.00 0.00 O ATOM 722 ND2 ASN A 45 -5.536 0.579 -13.272 1.00 0.00 N ATOM 0 H ASN A 45 -4.524 1.059 -9.352 1.00 0.00 H new ATOM 0 HA ASN A 45 -3.978 2.618 -11.635 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -6.592 1.662 -10.363 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -6.548 2.502 -11.899 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.357 -0.276 -13.798 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.586 1.475 -13.757 1.00 0.00 H new ATOM 729 N ILE A 46 -5.150 4.282 -9.087 1.00 0.00 N ATOM 730 CA ILE A 46 -5.363 5.632 -8.533 1.00 0.00 C ATOM 731 C ILE A 46 -4.012 6.375 -8.474 1.00 0.00 C ATOM 732 O ILE A 46 -2.951 5.754 -8.294 1.00 0.00 O ATOM 733 CB ILE A 46 -6.019 5.563 -7.095 1.00 0.00 C ATOM 734 CG1 ILE A 46 -7.322 4.700 -7.120 1.00 0.00 C ATOM 735 CG2 ILE A 46 -6.306 6.978 -6.526 1.00 0.00 C ATOM 736 CD1 ILE A 46 -7.956 4.443 -5.757 1.00 0.00 C ATOM 0 H ILE A 46 -5.112 3.549 -8.379 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.051 6.174 -9.182 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.300 5.083 -6.431 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.055 5.196 -7.756 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.094 3.740 -7.584 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.756 6.888 -5.537 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -5.373 7.536 -6.450 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -6.991 7.505 -7.190 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -8.853 3.836 -5.882 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.247 3.915 -5.119 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -8.222 5.393 -5.295 1.00 0.00 H new ATOM 748 N LYS A 47 -4.057 7.708 -8.649 1.00 0.00 N ATOM 749 CA LYS A 47 -2.870 8.566 -8.580 1.00 0.00 C ATOM 750 C LYS A 47 -2.434 8.722 -7.109 1.00 0.00 C ATOM 751 O LYS A 47 -3.293 8.809 -6.228 1.00 0.00 O ATOM 752 CB LYS A 47 -3.181 9.943 -9.215 1.00 0.00 C ATOM 753 CG LYS A 47 -3.809 9.877 -10.629 1.00 0.00 C ATOM 754 CD LYS A 47 -2.899 9.197 -11.679 1.00 0.00 C ATOM 755 CE LYS A 47 -1.591 9.963 -11.915 1.00 0.00 C ATOM 756 NZ LYS A 47 -0.793 9.349 -12.989 1.00 0.00 N ATOM 0 H LYS A 47 -4.920 8.217 -8.842 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.052 8.110 -9.138 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.858 10.487 -8.557 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.258 10.520 -9.269 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.753 9.335 -10.573 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.041 10.889 -10.962 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.667 8.184 -11.351 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -3.440 9.111 -12.621 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.816 10.998 -12.173 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.009 9.984 -10.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.152 9.782 -13.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.702 8.328 -12.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -1.265 9.503 -13.903 1.00 0.00 H new ATOM 770 N LEU A 48 -1.111 8.768 -6.877 1.00 0.00 N ATOM 771 CA LEU A 48 -0.494 8.771 -5.524 1.00 0.00 C ATOM 772 C LEU A 48 -1.095 9.852 -4.587 1.00 0.00 C ATOM 773 O LEU A 48 -1.518 9.542 -3.464 1.00 0.00 O ATOM 774 CB LEU A 48 1.046 8.953 -5.672 1.00 0.00 C ATOM 775 CG LEU A 48 1.879 9.152 -4.358 1.00 0.00 C ATOM 776 CD1 LEU A 48 1.673 8.003 -3.351 1.00 0.00 C ATOM 777 CD2 LEU A 48 3.373 9.335 -4.684 1.00 0.00 C ATOM 0 H LEU A 48 -0.424 8.805 -7.630 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.714 7.814 -5.051 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.440 8.079 -6.191 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.223 9.814 -6.317 1.00 0.00 H new ATOM 0 HG LEU A 48 1.511 10.060 -3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.271 8.189 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.620 7.945 -3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.982 7.061 -3.805 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.933 9.472 -3.759 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.743 8.452 -5.205 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.502 10.211 -5.319 1.00 0.00 H new ATOM 789 N ALA A 49 -1.155 11.103 -5.076 1.00 0.00 N ATOM 790 CA ALA A 49 -1.657 12.250 -4.283 1.00 0.00 C ATOM 791 C ALA A 49 -3.199 12.235 -4.139 1.00 0.00 C ATOM 792 O ALA A 49 -3.754 12.928 -3.282 1.00 0.00 O ATOM 793 CB ALA A 49 -1.161 13.575 -4.891 1.00 0.00 C ATOM 0 H ALA A 49 -0.862 11.351 -6.021 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.254 12.157 -3.275 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -1.537 14.410 -4.299 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.071 13.591 -4.890 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.524 13.664 -5.915 1.00 0.00 H new ATOM 799 N LYS A 50 -3.884 11.429 -4.974 1.00 0.00 N ATOM 800 CA LYS A 50 -5.361 11.284 -4.934 1.00 0.00 C ATOM 801 C LYS A 50 -5.817 10.219 -3.916 1.00 0.00 C ATOM 802 O LYS A 50 -7.021 10.025 -3.730 1.00 0.00 O ATOM 803 CB LYS A 50 -5.911 10.947 -6.350 1.00 0.00 C ATOM 804 CG LYS A 50 -5.685 12.045 -7.413 1.00 0.00 C ATOM 805 CD LYS A 50 -6.210 13.432 -6.969 1.00 0.00 C ATOM 806 CE LYS A 50 -6.145 14.481 -8.088 1.00 0.00 C ATOM 807 NZ LYS A 50 -7.139 14.200 -9.160 1.00 0.00 N ATOM 0 H LYS A 50 -3.436 10.861 -5.693 1.00 0.00 H new ATOM 0 HA LYS A 50 -5.769 12.240 -4.607 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -5.443 10.025 -6.696 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -6.981 10.752 -6.272 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.620 12.118 -7.631 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.181 11.754 -8.339 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -7.241 13.333 -6.630 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.626 13.780 -6.117 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -6.329 15.471 -7.671 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.142 14.496 -8.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -7.151 14.988 -9.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -6.878 13.323 -9.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -8.083 14.092 -8.738 1.00 0.00 H new ATOM 821 N LEU A 51 -4.863 9.524 -3.270 1.00 0.00 N ATOM 822 CA LEU A 51 -5.174 8.542 -2.210 1.00 0.00 C ATOM 823 C LEU A 51 -5.802 9.240 -0.986 1.00 0.00 C ATOM 824 O LEU A 51 -5.112 9.909 -0.223 1.00 0.00 O ATOM 825 CB LEU A 51 -3.906 7.721 -1.793 1.00 0.00 C ATOM 826 CG LEU A 51 -3.672 6.370 -2.548 1.00 0.00 C ATOM 827 CD1 LEU A 51 -3.567 6.560 -4.069 1.00 0.00 C ATOM 828 CD2 LEU A 51 -2.434 5.644 -1.989 1.00 0.00 C ATOM 0 H LEU A 51 -3.866 9.624 -3.463 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.901 7.838 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.028 8.350 -1.939 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.972 7.509 -0.726 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.548 5.745 -2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.405 5.593 -4.546 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -4.490 7.000 -4.445 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.731 7.221 -4.296 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.288 4.707 -2.527 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.554 6.275 -2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.582 5.435 -0.930 1.00 0.00 H new ATOM 840 N THR A 52 -7.130 9.109 -0.854 1.00 0.00 N ATOM 841 CA THR A 52 -7.879 9.543 0.342 1.00 0.00 C ATOM 842 C THR A 52 -8.172 8.322 1.248 1.00 0.00 C ATOM 843 O THR A 52 -8.011 7.171 0.818 1.00 0.00 O ATOM 844 CB THR A 52 -9.203 10.278 -0.064 1.00 0.00 C ATOM 845 OG1 THR A 52 -9.904 10.726 1.102 1.00 0.00 O ATOM 846 CG2 THR A 52 -10.137 9.392 -0.904 1.00 0.00 C ATOM 0 H THR A 52 -7.721 8.697 -1.576 1.00 0.00 H new ATOM 0 HA THR A 52 -7.270 10.253 0.902 1.00 0.00 H new ATOM 0 HB THR A 52 -8.909 11.130 -0.677 1.00 0.00 H new ATOM 0 HG1 THR A 52 -10.727 11.184 0.833 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.038 9.951 -1.157 1.00 0.00 H new ATOM 0 HG22 THR A 52 -9.627 9.091 -1.819 1.00 0.00 H new ATOM 0 HG23 THR A 52 -10.409 8.505 -0.332 1.00 0.00 H new ATOM 854 N SER A 53 -8.604 8.579 2.501 1.00 0.00 N ATOM 855 CA SER A 53 -8.851 7.517 3.509 1.00 0.00 C ATOM 856 C SER A 53 -10.090 6.668 3.133 1.00 0.00 C ATOM 857 O SER A 53 -10.236 5.532 3.600 1.00 0.00 O ATOM 858 CB SER A 53 -9.006 8.132 4.923 1.00 0.00 C ATOM 859 OG SER A 53 -9.097 7.126 5.925 1.00 0.00 O ATOM 0 H SER A 53 -8.791 9.521 2.844 1.00 0.00 H new ATOM 0 HA SER A 53 -7.987 6.853 3.520 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.155 8.780 5.134 1.00 0.00 H new ATOM 0 HB3 SER A 53 -9.898 8.757 4.953 1.00 0.00 H new ATOM 0 HG SER A 53 -9.192 7.548 6.804 1.00 0.00 H new ATOM 865 N LEU A 54 -10.967 7.234 2.270 1.00 0.00 N ATOM 866 CA LEU A 54 -12.105 6.502 1.666 1.00 0.00 C ATOM 867 C LEU A 54 -11.591 5.297 0.850 1.00 0.00 C ATOM 868 O LEU A 54 -12.151 4.207 0.924 1.00 0.00 O ATOM 869 CB LEU A 54 -12.946 7.452 0.758 1.00 0.00 C ATOM 870 CG LEU A 54 -14.099 6.793 -0.079 1.00 0.00 C ATOM 871 CD1 LEU A 54 -15.139 6.082 0.819 1.00 0.00 C ATOM 872 CD2 LEU A 54 -14.770 7.827 -1.018 1.00 0.00 C ATOM 0 H LEU A 54 -10.906 8.208 1.974 1.00 0.00 H new ATOM 0 HA LEU A 54 -12.746 6.135 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -13.384 8.226 1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -12.267 7.951 0.067 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.644 6.023 -0.702 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -15.917 5.641 0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -14.647 5.298 1.394 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -15.586 6.805 1.501 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -15.565 7.342 -1.585 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -15.191 8.638 -0.424 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -14.027 8.229 -1.706 1.00 0.00 H new ATOM 884 N HIS A 55 -10.490 5.521 0.098 1.00 0.00 N ATOM 885 CA HIS A 55 -9.844 4.482 -0.742 1.00 0.00 C ATOM 886 C HIS A 55 -9.314 3.326 0.115 1.00 0.00 C ATOM 887 O HIS A 55 -9.364 2.160 -0.294 1.00 0.00 O ATOM 888 CB HIS A 55 -8.681 5.090 -1.578 1.00 0.00 C ATOM 889 CG HIS A 55 -9.104 6.088 -2.609 1.00 0.00 C ATOM 890 ND1 HIS A 55 -8.210 6.894 -3.273 1.00 0.00 N ATOM 891 CD2 HIS A 55 -10.321 6.399 -3.103 1.00 0.00 C ATOM 892 CE1 HIS A 55 -8.861 7.655 -4.124 1.00 0.00 C ATOM 893 NE2 HIS A 55 -10.142 7.375 -4.045 1.00 0.00 N ATOM 0 H HIS A 55 -10.023 6.427 0.055 1.00 0.00 H new ATOM 0 HA HIS A 55 -10.603 4.093 -1.420 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -7.975 5.568 -0.899 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -8.147 4.280 -2.075 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -11.262 5.959 -2.809 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.416 8.389 -4.780 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -10.881 7.813 -4.595 1.00 0.00 H new ATOM 902 N MET A 56 -8.831 3.677 1.312 1.00 0.00 N ATOM 903 CA MET A 56 -8.253 2.720 2.271 1.00 0.00 C ATOM 904 C MET A 56 -9.358 1.892 2.934 1.00 0.00 C ATOM 905 O MET A 56 -9.170 0.705 3.213 1.00 0.00 O ATOM 906 CB MET A 56 -7.426 3.478 3.329 1.00 0.00 C ATOM 907 CG MET A 56 -6.282 4.283 2.729 1.00 0.00 C ATOM 908 SD MET A 56 -5.204 3.248 1.723 1.00 0.00 S ATOM 909 CE MET A 56 -4.222 4.479 0.891 1.00 0.00 C ATOM 0 H MET A 56 -8.829 4.640 1.648 1.00 0.00 H new ATOM 0 HA MET A 56 -7.594 2.035 1.737 1.00 0.00 H new ATOM 0 HB2 MET A 56 -8.083 4.149 3.883 1.00 0.00 H new ATOM 0 HB3 MET A 56 -7.022 2.763 4.046 1.00 0.00 H new ATOM 0 HG2 MET A 56 -6.685 5.091 2.119 1.00 0.00 H new ATOM 0 HG3 MET A 56 -5.702 4.745 3.528 1.00 0.00 H new ATOM 0 HE1 MET A 56 -3.460 3.988 0.286 1.00 0.00 H new ATOM 0 HE2 MET A 56 -4.863 5.082 0.248 1.00 0.00 H new ATOM 0 HE3 MET A 56 -3.741 5.121 1.629 1.00 0.00 H new ATOM 919 N GLN A 57 -10.517 2.539 3.168 1.00 0.00 N ATOM 920 CA GLN A 57 -11.716 1.878 3.710 1.00 0.00 C ATOM 921 C GLN A 57 -12.254 0.853 2.690 1.00 0.00 C ATOM 922 O GLN A 57 -12.529 -0.294 3.052 1.00 0.00 O ATOM 923 CB GLN A 57 -12.813 2.921 4.072 1.00 0.00 C ATOM 924 CG GLN A 57 -14.106 2.321 4.677 1.00 0.00 C ATOM 925 CD GLN A 57 -13.877 1.568 5.989 1.00 0.00 C ATOM 926 OE1 GLN A 57 -13.978 2.135 7.074 1.00 0.00 O ATOM 927 NE2 GLN A 57 -13.564 0.282 5.903 1.00 0.00 N ATOM 0 H GLN A 57 -10.646 3.534 2.986 1.00 0.00 H new ATOM 0 HA GLN A 57 -11.441 1.355 4.626 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -12.395 3.636 4.781 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -13.074 3.479 3.173 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -14.823 3.124 4.849 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -14.555 1.642 3.952 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -13.487 -0.164 4.989 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -13.401 -0.261 6.751 1.00 0.00 H new ATOM 936 N ASN A 58 -12.360 1.285 1.412 1.00 0.00 N ATOM 937 CA ASN A 58 -12.797 0.429 0.277 1.00 0.00 C ATOM 938 C ASN A 58 -11.892 -0.801 0.163 1.00 0.00 C ATOM 939 O ASN A 58 -12.362 -1.919 -0.071 1.00 0.00 O ATOM 940 CB ASN A 58 -12.737 1.215 -1.063 1.00 0.00 C ATOM 941 CG ASN A 58 -13.670 2.421 -1.119 1.00 0.00 C ATOM 942 OD1 ASN A 58 -14.757 2.418 -0.553 1.00 0.00 O ATOM 943 ND2 ASN A 58 -13.247 3.469 -1.803 1.00 0.00 N ATOM 0 H ASN A 58 -12.144 2.242 1.134 1.00 0.00 H new ATOM 0 HA ASN A 58 -13.824 0.120 0.470 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -11.714 1.552 -1.229 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -12.986 0.538 -1.880 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -13.830 4.303 -1.870 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -12.338 3.444 -2.264 1.00 0.00 H new ATOM 950 N TYR A 59 -10.584 -0.551 0.354 1.00 0.00 N ATOM 951 CA TYR A 59 -9.539 -1.572 0.264 1.00 0.00 C ATOM 952 C TYR A 59 -9.743 -2.659 1.345 1.00 0.00 C ATOM 953 O TYR A 59 -9.823 -3.840 1.022 1.00 0.00 O ATOM 954 CB TYR A 59 -8.144 -0.904 0.386 1.00 0.00 C ATOM 955 CG TYR A 59 -6.960 -1.871 0.244 1.00 0.00 C ATOM 956 CD1 TYR A 59 -6.589 -2.376 -1.010 1.00 0.00 C ATOM 957 CD2 TYR A 59 -6.232 -2.299 1.359 1.00 0.00 C ATOM 958 CE1 TYR A 59 -5.529 -3.251 -1.136 1.00 0.00 C ATOM 959 CE2 TYR A 59 -5.176 -3.173 1.228 1.00 0.00 C ATOM 960 CZ TYR A 59 -4.835 -3.652 -0.016 1.00 0.00 C ATOM 961 OH TYR A 59 -3.789 -4.528 -0.136 1.00 0.00 O ATOM 0 H TYR A 59 -10.225 0.377 0.577 1.00 0.00 H new ATOM 0 HA TYR A 59 -9.601 -2.064 -0.707 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -8.058 -0.130 -0.377 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -8.077 -0.407 1.354 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.140 -2.076 -1.889 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.503 -1.938 2.340 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -5.245 -3.620 -2.110 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -4.617 -3.482 2.099 1.00 0.00 H new ATOM 0 HH TYR A 59 -2.946 -4.056 0.031 1.00 0.00 H new ATOM 971 N VAL A 60 -9.879 -2.224 2.619 1.00 0.00 N ATOM 972 CA VAL A 60 -10.048 -3.130 3.789 1.00 0.00 C ATOM 973 C VAL A 60 -11.354 -3.943 3.689 1.00 0.00 C ATOM 974 O VAL A 60 -11.401 -5.122 4.074 1.00 0.00 O ATOM 975 CB VAL A 60 -9.985 -2.332 5.147 1.00 0.00 C ATOM 976 CG1 VAL A 60 -10.307 -3.221 6.382 1.00 0.00 C ATOM 977 CG2 VAL A 60 -8.600 -1.671 5.301 1.00 0.00 C ATOM 0 H VAL A 60 -9.875 -1.235 2.870 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.216 -3.834 3.776 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.756 -1.563 5.109 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.249 -2.619 7.289 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.312 -3.631 6.283 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.586 -4.037 6.441 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.562 -1.121 6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.828 -2.440 5.299 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.430 -0.984 4.472 1.00 0.00 H new ATOM 987 N ASN A 61 -12.399 -3.310 3.140 1.00 0.00 N ATOM 988 CA ASN A 61 -13.701 -3.967 2.916 1.00 0.00 C ATOM 989 C ASN A 61 -13.570 -5.063 1.840 1.00 0.00 C ATOM 990 O ASN A 61 -14.185 -6.128 1.956 1.00 0.00 O ATOM 991 CB ASN A 61 -14.782 -2.920 2.536 1.00 0.00 C ATOM 992 CG ASN A 61 -15.095 -1.940 3.671 1.00 0.00 C ATOM 993 OD1 ASN A 61 -14.942 -2.256 4.856 1.00 0.00 O ATOM 994 ND2 ASN A 61 -15.549 -0.746 3.326 1.00 0.00 N ATOM 0 H ASN A 61 -12.371 -2.336 2.839 1.00 0.00 H new ATOM 0 HA ASN A 61 -14.018 -4.446 3.842 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -14.446 -2.360 1.663 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -15.697 -3.439 2.249 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -15.782 -0.061 4.045 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -15.666 -0.510 2.341 1.00 0.00 H new ATOM 1001 N SER A 62 -12.722 -4.801 0.822 1.00 0.00 N ATOM 1002 CA SER A 62 -12.414 -5.771 -0.248 1.00 0.00 C ATOM 1003 C SER A 62 -11.584 -6.954 0.287 1.00 0.00 C ATOM 1004 O SER A 62 -11.676 -8.056 -0.242 1.00 0.00 O ATOM 1005 CB SER A 62 -11.670 -5.075 -1.409 1.00 0.00 C ATOM 1006 OG SER A 62 -12.436 -4.016 -1.956 1.00 0.00 O ATOM 0 H SER A 62 -12.233 -3.912 0.720 1.00 0.00 H new ATOM 0 HA SER A 62 -13.359 -6.167 -0.621 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.716 -4.688 -1.051 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.446 -5.804 -2.188 1.00 0.00 H new ATOM 0 HG SER A 62 -12.455 -3.266 -1.325 1.00 0.00 H new ATOM 1012 N LEU A 63 -10.774 -6.708 1.342 1.00 0.00 N ATOM 1013 CA LEU A 63 -9.971 -7.766 2.011 1.00 0.00 C ATOM 1014 C LEU A 63 -10.898 -8.731 2.769 1.00 0.00 C ATOM 1015 O LEU A 63 -10.620 -9.932 2.876 1.00 0.00 O ATOM 1016 CB LEU A 63 -8.943 -7.145 2.991 1.00 0.00 C ATOM 1017 CG LEU A 63 -8.052 -6.011 2.410 1.00 0.00 C ATOM 1018 CD1 LEU A 63 -7.074 -5.470 3.470 1.00 0.00 C ATOM 1019 CD2 LEU A 63 -7.340 -6.445 1.106 1.00 0.00 C ATOM 0 H LEU A 63 -10.657 -5.782 1.753 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.426 -8.316 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.483 -6.752 3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -8.293 -7.940 3.358 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.707 -5.184 2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.465 -4.679 3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.637 -5.071 4.314 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.427 -6.277 3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.728 -5.623 0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.705 -7.307 1.308 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.085 -6.711 0.356 1.00 0.00 H new ATOM 1031 N ARG A 64 -12.000 -8.170 3.295 1.00 0.00 N ATOM 1032 CA ARG A 64 -13.065 -8.932 3.960 1.00 0.00 C ATOM 1033 C ARG A 64 -13.853 -9.753 2.907 1.00 0.00 C ATOM 1034 O ARG A 64 -14.276 -10.879 3.183 1.00 0.00 O ATOM 1035 CB ARG A 64 -13.992 -7.962 4.743 1.00 0.00 C ATOM 1036 CG ARG A 64 -15.136 -8.637 5.537 1.00 0.00 C ATOM 1037 CD ARG A 64 -16.012 -7.621 6.297 1.00 0.00 C ATOM 1038 NE ARG A 64 -17.220 -8.247 6.883 1.00 0.00 N ATOM 1039 CZ ARG A 64 -18.065 -7.642 7.740 1.00 0.00 C ATOM 1040 NH1 ARG A 64 -17.835 -6.415 8.187 1.00 0.00 N ATOM 1041 NH2 ARG A 64 -19.132 -8.288 8.166 1.00 0.00 N ATOM 0 H ARG A 64 -12.176 -7.166 3.269 1.00 0.00 H new ATOM 0 HA ARG A 64 -12.632 -9.631 4.675 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -13.382 -7.384 5.437 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -14.429 -7.255 4.038 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -15.761 -9.208 4.851 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -14.711 -9.347 6.247 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -15.424 -7.159 7.090 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -16.312 -6.824 5.617 1.00 0.00 H new ATOM 0 HE ARG A 64 -17.428 -9.210 6.617 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -17.004 -5.909 7.882 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -18.489 -5.977 8.836 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -19.313 -9.240 7.847 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -19.776 -7.836 8.815 1.00 0.00 H new ATOM 1055 N ASP A 65 -14.015 -9.183 1.686 1.00 0.00 N ATOM 1056 CA ASP A 65 -14.620 -9.896 0.531 1.00 0.00 C ATOM 1057 C ASP A 65 -13.709 -11.054 0.068 1.00 0.00 C ATOM 1058 O ASP A 65 -14.200 -12.075 -0.418 1.00 0.00 O ATOM 1059 CB ASP A 65 -14.891 -8.940 -0.669 1.00 0.00 C ATOM 1060 CG ASP A 65 -16.015 -7.917 -0.427 1.00 0.00 C ATOM 1061 OD1 ASP A 65 -17.176 -8.333 -0.203 1.00 0.00 O ATOM 1062 OD2 ASP A 65 -15.756 -6.694 -0.462 1.00 0.00 O ATOM 0 H ASP A 65 -13.733 -8.226 1.475 1.00 0.00 H new ATOM 0 HA ASP A 65 -15.576 -10.295 0.871 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -13.972 -8.403 -0.904 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -15.143 -9.538 -1.544 1.00 0.00 H new ATOM 1067 N GLU A 66 -12.381 -10.879 0.213 1.00 0.00 N ATOM 1068 CA GLU A 66 -11.388 -11.941 -0.074 1.00 0.00 C ATOM 1069 C GLU A 66 -11.345 -12.970 1.068 1.00 0.00 C ATOM 1070 O GLU A 66 -10.983 -14.131 0.853 1.00 0.00 O ATOM 1071 CB GLU A 66 -9.976 -11.317 -0.295 1.00 0.00 C ATOM 1072 CG GLU A 66 -9.876 -10.378 -1.510 1.00 0.00 C ATOM 1073 CD GLU A 66 -10.259 -11.063 -2.832 1.00 0.00 C ATOM 1074 OE1 GLU A 66 -9.445 -11.859 -3.360 1.00 0.00 O ATOM 1075 OE2 GLU A 66 -11.373 -10.822 -3.352 1.00 0.00 O ATOM 0 H GLU A 66 -11.965 -10.004 0.530 1.00 0.00 H new ATOM 0 HA GLU A 66 -11.690 -12.455 -0.986 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -9.693 -10.763 0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -9.251 -12.122 -0.414 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -10.526 -9.517 -1.352 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.857 -9.998 -1.586 1.00 0.00 H new ATOM 1082 N GLY A 67 -11.740 -12.526 2.274 1.00 0.00 N ATOM 1083 CA GLY A 67 -11.699 -13.362 3.473 1.00 0.00 C ATOM 1084 C GLY A 67 -10.276 -13.610 3.962 1.00 0.00 C ATOM 1085 O GLY A 67 -9.944 -14.718 4.409 1.00 0.00 O ATOM 0 H GLY A 67 -12.093 -11.583 2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -12.274 -12.884 4.266 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -12.179 -14.318 3.263 1.00 0.00 H new ATOM 1089 N LEU A 68 -9.432 -12.568 3.848 1.00 0.00 N ATOM 1090 CA LEU A 68 -8.021 -12.607 4.275 1.00 0.00 C ATOM 1091 C LEU A 68 -7.907 -12.649 5.807 1.00 0.00 C ATOM 1092 O LEU A 68 -8.822 -12.230 6.523 1.00 0.00 O ATOM 1093 CB LEU A 68 -7.234 -11.391 3.707 1.00 0.00 C ATOM 1094 CG LEU A 68 -7.201 -11.259 2.153 1.00 0.00 C ATOM 1095 CD1 LEU A 68 -6.365 -10.040 1.715 1.00 0.00 C ATOM 1096 CD2 LEU A 68 -6.704 -12.559 1.479 1.00 0.00 C ATOM 0 H LEU A 68 -9.712 -11.670 3.454 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.580 -13.520 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.667 -10.480 4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.207 -11.448 4.068 1.00 0.00 H new ATOM 0 HG LEU A 68 -8.225 -11.095 1.817 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -6.360 -9.974 0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -6.800 -9.132 2.132 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.343 -10.151 2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.695 -12.427 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.696 -12.786 1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -7.370 -13.381 1.739 1.00 0.00 H new ATOM 1108 N LYS A 69 -6.777 -13.175 6.292 1.00 0.00 N ATOM 1109 CA LYS A 69 -6.505 -13.314 7.736 1.00 0.00 C ATOM 1110 C LYS A 69 -5.809 -12.059 8.289 1.00 0.00 C ATOM 1111 O LYS A 69 -5.294 -11.238 7.516 1.00 0.00 O ATOM 1112 CB LYS A 69 -5.659 -14.588 7.996 1.00 0.00 C ATOM 1113 CG LYS A 69 -4.299 -14.632 7.263 1.00 0.00 C ATOM 1114 CD LYS A 69 -3.571 -15.990 7.414 1.00 0.00 C ATOM 1115 CE LYS A 69 -4.382 -17.172 6.859 1.00 0.00 C ATOM 1116 NZ LYS A 69 -4.699 -17.025 5.410 1.00 0.00 N ATOM 0 H LYS A 69 -6.022 -13.518 5.698 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.454 -13.418 8.262 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -5.480 -14.674 9.068 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.242 -15.460 7.700 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.457 -14.427 6.204 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.659 -13.839 7.649 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.612 -15.941 6.899 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.358 -16.166 8.468 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.822 -18.095 7.012 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.311 -17.266 7.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.202 -17.872 5.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.300 -16.188 5.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.817 -16.912 4.871 1.00 0.00 H new ATOM 1130 N ARG A 70 -5.796 -11.945 9.634 1.00 0.00 N ATOM 1131 CA ARG A 70 -5.201 -10.805 10.370 1.00 0.00 C ATOM 1132 C ARG A 70 -3.766 -10.496 9.904 1.00 0.00 C ATOM 1133 O ARG A 70 -3.384 -9.338 9.808 1.00 0.00 O ATOM 1134 CB ARG A 70 -5.197 -11.075 11.902 1.00 0.00 C ATOM 1135 CG ARG A 70 -4.321 -12.283 12.334 1.00 0.00 C ATOM 1136 CD ARG A 70 -4.155 -12.417 13.852 1.00 0.00 C ATOM 1137 NE ARG A 70 -5.438 -12.640 14.530 1.00 0.00 N ATOM 1138 CZ ARG A 70 -5.969 -11.847 15.461 1.00 0.00 C ATOM 1139 NH1 ARG A 70 -5.379 -10.702 15.797 1.00 0.00 N ATOM 1140 NH2 ARG A 70 -7.106 -12.187 16.032 1.00 0.00 N ATOM 0 H ARG A 70 -6.203 -12.650 10.249 1.00 0.00 H new ATOM 0 HA ARG A 70 -5.824 -9.937 10.153 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -4.843 -10.182 12.416 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -6.222 -11.247 12.232 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.765 -13.199 11.944 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -3.336 -12.187 11.877 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -3.481 -13.245 14.071 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -3.689 -11.514 14.246 1.00 0.00 H new ATOM 0 HE ARG A 70 -5.967 -13.471 14.267 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -4.511 -10.423 15.341 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -5.795 -10.104 16.511 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.574 -13.052 15.761 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.518 -11.586 16.745 1.00 0.00 H new ATOM 1154 N GLY A 71 -3.003 -11.563 9.611 1.00 0.00 N ATOM 1155 CA GLY A 71 -1.635 -11.439 9.132 1.00 0.00 C ATOM 1156 C GLY A 71 -1.532 -10.712 7.805 1.00 0.00 C ATOM 1157 O GLY A 71 -0.914 -9.662 7.731 1.00 0.00 O ATOM 0 H GLY A 71 -3.324 -12.527 9.702 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -1.042 -10.908 9.877 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -1.201 -12.434 9.029 1.00 0.00 H new ATOM 1161 N THR A 72 -2.194 -11.265 6.771 1.00 0.00 N ATOM 1162 CA THR A 72 -2.140 -10.739 5.393 1.00 0.00 C ATOM 1163 C THR A 72 -2.672 -9.289 5.318 1.00 0.00 C ATOM 1164 O THR A 72 -2.031 -8.432 4.704 1.00 0.00 O ATOM 1165 CB THR A 72 -2.939 -11.657 4.413 1.00 0.00 C ATOM 1166 OG1 THR A 72 -2.479 -13.014 4.547 1.00 0.00 O ATOM 1167 CG2 THR A 72 -2.796 -11.220 2.936 1.00 0.00 C ATOM 0 H THR A 72 -2.783 -12.092 6.868 1.00 0.00 H new ATOM 0 HA THR A 72 -1.093 -10.732 5.090 1.00 0.00 H new ATOM 0 HB THR A 72 -3.992 -11.574 4.681 1.00 0.00 H new ATOM 0 HG1 THR A 72 -2.980 -13.591 3.934 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.371 -11.893 2.300 1.00 0.00 H new ATOM 0 HG22 THR A 72 -3.170 -10.203 2.820 1.00 0.00 H new ATOM 0 HG23 THR A 72 -1.746 -11.256 2.646 1.00 0.00 H new ATOM 1175 N ILE A 73 -3.821 -9.035 5.987 1.00 0.00 N ATOM 1176 CA ILE A 73 -4.430 -7.692 6.063 1.00 0.00 C ATOM 1177 C ILE A 73 -3.460 -6.696 6.715 1.00 0.00 C ATOM 1178 O ILE A 73 -3.251 -5.603 6.193 1.00 0.00 O ATOM 1179 CB ILE A 73 -5.799 -7.693 6.848 1.00 0.00 C ATOM 1180 CG1 ILE A 73 -6.836 -8.620 6.138 1.00 0.00 C ATOM 1181 CG2 ILE A 73 -6.365 -6.249 7.026 1.00 0.00 C ATOM 1182 CD1 ILE A 73 -8.182 -8.727 6.840 1.00 0.00 C ATOM 0 H ILE A 73 -4.347 -9.753 6.486 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.638 -7.384 5.038 1.00 0.00 H new ATOM 0 HB ILE A 73 -5.610 -8.088 7.846 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.999 -8.251 5.125 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.408 -9.619 6.049 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -7.308 -6.292 7.571 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.650 -5.644 7.585 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -6.532 -5.800 6.047 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -8.836 -9.391 6.274 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -8.038 -9.128 7.843 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -8.638 -7.739 6.906 1.00 0.00 H new ATOM 1194 N GLU A 74 -2.842 -7.112 7.833 1.00 0.00 N ATOM 1195 CA GLU A 74 -1.875 -6.269 8.552 1.00 0.00 C ATOM 1196 C GLU A 74 -0.677 -5.929 7.647 1.00 0.00 C ATOM 1197 O GLU A 74 -0.343 -4.764 7.501 1.00 0.00 O ATOM 1198 CB GLU A 74 -1.382 -6.962 9.844 1.00 0.00 C ATOM 1199 CG GLU A 74 -0.436 -6.112 10.707 1.00 0.00 C ATOM 1200 CD GLU A 74 0.006 -6.832 11.991 1.00 0.00 C ATOM 1201 OE1 GLU A 74 -0.703 -6.745 13.017 1.00 0.00 O ATOM 1202 OE2 GLU A 74 1.066 -7.490 11.986 1.00 0.00 O ATOM 0 H GLU A 74 -2.995 -8.027 8.257 1.00 0.00 H new ATOM 0 HA GLU A 74 -2.382 -5.345 8.831 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.248 -7.240 10.444 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -0.872 -7.886 9.573 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.445 -5.849 10.122 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -0.933 -5.179 10.972 1.00 0.00 H new ATOM 1209 N LYS A 75 -0.117 -6.961 6.977 1.00 0.00 N ATOM 1210 CA LYS A 75 1.106 -6.839 6.149 1.00 0.00 C ATOM 1211 C LYS A 75 0.910 -5.801 5.039 1.00 0.00 C ATOM 1212 O LYS A 75 1.696 -4.866 4.918 1.00 0.00 O ATOM 1213 CB LYS A 75 1.492 -8.211 5.518 1.00 0.00 C ATOM 1214 CG LYS A 75 1.927 -9.298 6.527 1.00 0.00 C ATOM 1215 CD LYS A 75 2.203 -10.657 5.844 1.00 0.00 C ATOM 1216 CE LYS A 75 2.575 -11.766 6.838 1.00 0.00 C ATOM 1217 NZ LYS A 75 3.797 -11.428 7.612 1.00 0.00 N ATOM 0 H LYS A 75 -0.501 -7.906 6.995 1.00 0.00 H new ATOM 0 HA LYS A 75 1.915 -6.512 6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 75 0.640 -8.585 4.950 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.303 -8.051 4.808 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.825 -8.967 7.049 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.149 -9.424 7.280 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.319 -10.961 5.283 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.012 -10.537 5.123 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.745 -11.932 7.524 1.00 0.00 H new ATOM 0 HE3 LYS A 75 2.734 -12.699 6.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 4.073 -12.242 8.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.570 -11.195 6.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.605 -10.610 8.225 1.00 0.00 H new ATOM 1231 N ILE A 76 -0.188 -5.959 4.282 1.00 0.00 N ATOM 1232 CA ILE A 76 -0.470 -5.121 3.101 1.00 0.00 C ATOM 1233 C ILE A 76 -0.810 -3.676 3.512 1.00 0.00 C ATOM 1234 O ILE A 76 -0.435 -2.735 2.817 1.00 0.00 O ATOM 1235 CB ILE A 76 -1.600 -5.748 2.198 1.00 0.00 C ATOM 1236 CG1 ILE A 76 -2.957 -5.872 2.956 1.00 0.00 C ATOM 1237 CG2 ILE A 76 -1.159 -7.124 1.667 1.00 0.00 C ATOM 1238 CD1 ILE A 76 -3.989 -6.771 2.284 1.00 0.00 C ATOM 0 H ILE A 76 -0.901 -6.665 4.468 1.00 0.00 H new ATOM 0 HA ILE A 76 0.438 -5.087 2.499 1.00 0.00 H new ATOM 0 HB ILE A 76 -1.756 -5.071 1.358 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -2.763 -6.253 3.959 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.384 -4.876 3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.949 -7.544 1.045 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -0.252 -7.011 1.073 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.963 -7.792 2.506 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.898 -6.794 2.885 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.220 -6.382 1.292 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.588 -7.781 2.194 1.00 0.00 H new ATOM 1250 N ILE A 77 -1.484 -3.515 4.672 1.00 0.00 N ATOM 1251 CA ILE A 77 -1.742 -2.187 5.266 1.00 0.00 C ATOM 1252 C ILE A 77 -0.406 -1.533 5.689 1.00 0.00 C ATOM 1253 O ILE A 77 -0.215 -0.346 5.472 1.00 0.00 O ATOM 1254 CB ILE A 77 -2.762 -2.275 6.479 1.00 0.00 C ATOM 1255 CG1 ILE A 77 -4.194 -2.668 5.970 1.00 0.00 C ATOM 1256 CG2 ILE A 77 -2.815 -0.967 7.318 1.00 0.00 C ATOM 1257 CD1 ILE A 77 -4.799 -1.704 4.960 1.00 0.00 C ATOM 0 H ILE A 77 -1.860 -4.292 5.216 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.212 -1.556 4.511 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.394 -3.057 7.143 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.145 -3.660 5.520 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.862 -2.740 6.828 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.529 -1.086 8.133 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.827 -0.758 7.729 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -3.126 -0.139 6.681 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.787 -2.058 4.666 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.886 -0.714 5.408 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.158 -1.649 4.080 1.00 0.00 H new ATOM 1269 N LYS A 78 0.533 -2.335 6.236 1.00 0.00 N ATOM 1270 CA LYS A 78 1.868 -1.845 6.667 1.00 0.00 C ATOM 1271 C LYS A 78 2.722 -1.423 5.454 1.00 0.00 C ATOM 1272 O LYS A 78 3.526 -0.497 5.558 1.00 0.00 O ATOM 1273 CB LYS A 78 2.641 -2.913 7.492 1.00 0.00 C ATOM 1274 CG LYS A 78 2.001 -3.314 8.839 1.00 0.00 C ATOM 1275 CD LYS A 78 1.797 -2.131 9.813 1.00 0.00 C ATOM 1276 CE LYS A 78 1.233 -2.585 11.172 1.00 0.00 C ATOM 1277 NZ LYS A 78 2.117 -3.583 11.837 1.00 0.00 N ATOM 0 H LYS A 78 0.393 -3.333 6.392 1.00 0.00 H new ATOM 0 HA LYS A 78 1.690 -0.979 7.304 1.00 0.00 H new ATOM 0 HB2 LYS A 78 2.748 -3.809 6.881 1.00 0.00 H new ATOM 0 HB3 LYS A 78 3.646 -2.538 7.686 1.00 0.00 H new ATOM 0 HG2 LYS A 78 1.036 -3.783 8.646 1.00 0.00 H new ATOM 0 HG3 LYS A 78 2.630 -4.063 9.320 1.00 0.00 H new ATOM 0 HD2 LYS A 78 2.749 -1.623 9.968 1.00 0.00 H new ATOM 0 HD3 LYS A 78 1.118 -1.406 9.364 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.111 -1.718 11.822 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.243 -3.017 11.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 1.826 -3.698 12.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 2.040 -4.497 11.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 3.102 -3.252 11.801 1.00 0.00 H new ATOM 1291 N VAL A 79 2.540 -2.127 4.318 1.00 0.00 N ATOM 1292 CA VAL A 79 3.238 -1.827 3.047 1.00 0.00 C ATOM 1293 C VAL A 79 2.747 -0.483 2.480 1.00 0.00 C ATOM 1294 O VAL A 79 3.559 0.372 2.100 1.00 0.00 O ATOM 1295 CB VAL A 79 3.042 -2.982 1.985 1.00 0.00 C ATOM 1296 CG1 VAL A 79 3.640 -2.602 0.606 1.00 0.00 C ATOM 1297 CG2 VAL A 79 3.655 -4.312 2.492 1.00 0.00 C ATOM 0 H VAL A 79 1.904 -2.922 4.254 1.00 0.00 H new ATOM 0 HA VAL A 79 4.305 -1.757 3.259 1.00 0.00 H new ATOM 0 HB VAL A 79 1.969 -3.121 1.855 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.485 -3.421 -0.096 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.148 -1.705 0.231 1.00 0.00 H new ATOM 0 HG13 VAL A 79 4.708 -2.412 0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.507 -5.090 1.743 1.00 0.00 H new ATOM 0 HG22 VAL A 79 4.722 -4.177 2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.168 -4.606 3.422 1.00 0.00 H new ATOM 1307 N ILE A 80 1.411 -0.304 2.470 1.00 0.00 N ATOM 1308 CA ILE A 80 0.770 0.939 1.995 1.00 0.00 C ATOM 1309 C ILE A 80 1.168 2.131 2.890 1.00 0.00 C ATOM 1310 O ILE A 80 1.509 3.201 2.391 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.797 0.796 1.946 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -1.218 -0.326 0.948 1.00 0.00 C ATOM 1313 CG2 ILE A 80 -1.489 2.134 1.577 1.00 0.00 C ATOM 1314 CD1 ILE A 80 -2.703 -0.652 0.953 1.00 0.00 C ATOM 0 H ILE A 80 0.749 -1.012 2.789 1.00 0.00 H new ATOM 0 HA ILE A 80 1.123 1.125 0.981 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.127 0.519 2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.929 -0.026 -0.059 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.660 -1.232 1.183 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.569 1.991 1.554 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.239 2.890 2.321 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.146 2.463 0.596 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -2.904 -1.442 0.230 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -2.999 -0.986 1.947 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -3.272 0.238 0.686 1.00 0.00 H new ATOM 1326 N ARG A 81 1.129 1.903 4.215 1.00 0.00 N ATOM 1327 CA ARG A 81 1.516 2.905 5.225 1.00 0.00 C ATOM 1328 C ARG A 81 2.979 3.320 5.046 1.00 0.00 C ATOM 1329 O ARG A 81 3.268 4.497 5.002 1.00 0.00 O ATOM 1330 CB ARG A 81 1.277 2.381 6.668 1.00 0.00 C ATOM 1331 CG ARG A 81 -0.207 2.312 7.081 1.00 0.00 C ATOM 1332 CD ARG A 81 -0.418 1.736 8.490 1.00 0.00 C ATOM 1333 NE ARG A 81 0.327 2.497 9.509 1.00 0.00 N ATOM 1334 CZ ARG A 81 -0.191 3.074 10.602 1.00 0.00 C ATOM 1335 NH1 ARG A 81 -1.509 3.055 10.834 1.00 0.00 N ATOM 1336 NH2 ARG A 81 0.620 3.689 11.455 1.00 0.00 N ATOM 0 H ARG A 81 0.827 1.015 4.617 1.00 0.00 H new ATOM 0 HA ARG A 81 0.883 3.780 5.076 1.00 0.00 H new ATOM 0 HB2 ARG A 81 1.713 1.386 6.758 1.00 0.00 H new ATOM 0 HB3 ARG A 81 1.807 3.026 7.369 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -0.636 3.313 7.037 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -0.750 1.700 6.360 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -1.481 1.748 8.732 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -0.098 0.694 8.508 1.00 0.00 H new ATOM 0 HE ARG A 81 1.333 2.594 9.369 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -2.137 2.596 10.174 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -1.886 3.499 11.671 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.623 3.718 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.239 4.132 12.291 1.00 0.00 H new ATOM 1350 N ASN A 82 3.872 2.331 4.886 1.00 0.00 N ATOM 1351 CA ASN A 82 5.334 2.560 4.741 1.00 0.00 C ATOM 1352 C ASN A 82 5.617 3.361 3.451 1.00 0.00 C ATOM 1353 O ASN A 82 6.479 4.248 3.427 1.00 0.00 O ATOM 1354 CB ASN A 82 6.075 1.184 4.715 1.00 0.00 C ATOM 1355 CG ASN A 82 7.594 1.206 5.006 1.00 0.00 C ATOM 1356 OD1 ASN A 82 8.131 0.238 5.545 1.00 0.00 O ATOM 1357 ND2 ASN A 82 8.310 2.264 4.650 1.00 0.00 N ATOM 0 H ASN A 82 3.609 1.346 4.852 1.00 0.00 H new ATOM 0 HA ASN A 82 5.700 3.139 5.588 1.00 0.00 H new ATOM 0 HB2 ASN A 82 5.599 0.528 5.443 1.00 0.00 H new ATOM 0 HB3 ASN A 82 5.923 0.735 3.734 1.00 0.00 H new ATOM 0 HD21 ASN A 82 9.315 2.281 4.822 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.855 3.061 4.204 1.00 0.00 H new ATOM 1364 N SER A 83 4.848 3.046 2.396 1.00 0.00 N ATOM 1365 CA SER A 83 4.953 3.708 1.090 1.00 0.00 C ATOM 1366 C SER A 83 4.527 5.185 1.197 1.00 0.00 C ATOM 1367 O SER A 83 5.239 6.080 0.733 1.00 0.00 O ATOM 1368 CB SER A 83 4.095 2.947 0.056 1.00 0.00 C ATOM 1369 OG SER A 83 4.278 3.448 -1.255 1.00 0.00 O ATOM 0 H SER A 83 4.132 2.320 2.428 1.00 0.00 H new ATOM 0 HA SER A 83 5.991 3.691 0.757 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.353 1.888 0.079 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.043 3.024 0.330 1.00 0.00 H new ATOM 0 HG SER A 83 5.106 3.083 -1.632 1.00 0.00 H new ATOM 1375 N LEU A 84 3.382 5.423 1.863 1.00 0.00 N ATOM 1376 CA LEU A 84 2.822 6.772 2.038 1.00 0.00 C ATOM 1377 C LEU A 84 3.675 7.614 3.013 1.00 0.00 C ATOM 1378 O LEU A 84 3.782 8.818 2.839 1.00 0.00 O ATOM 1379 CB LEU A 84 1.348 6.716 2.509 1.00 0.00 C ATOM 1380 CG LEU A 84 0.326 6.085 1.510 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -1.112 6.181 2.063 1.00 0.00 C ATOM 1382 CD2 LEU A 84 0.449 6.715 0.101 1.00 0.00 C ATOM 0 H LEU A 84 2.822 4.687 2.293 1.00 0.00 H new ATOM 0 HA LEU A 84 2.845 7.259 1.063 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.308 6.152 3.441 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.022 7.731 2.736 1.00 0.00 H new ATOM 0 HG LEU A 84 0.566 5.027 1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.806 5.735 1.351 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -1.173 5.648 3.012 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.373 7.228 2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.276 6.253 -0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.255 7.786 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.455 6.550 -0.285 1.00 0.00 H new ATOM 1394 N GLU A 85 4.294 6.957 4.015 1.00 0.00 N ATOM 1395 CA GLU A 85 5.251 7.601 4.950 1.00 0.00 C ATOM 1396 C GLU A 85 6.463 8.132 4.169 1.00 0.00 C ATOM 1397 O GLU A 85 6.930 9.258 4.393 1.00 0.00 O ATOM 1398 CB GLU A 85 5.728 6.587 6.041 1.00 0.00 C ATOM 1399 CG GLU A 85 4.690 6.231 7.123 1.00 0.00 C ATOM 1400 CD GLU A 85 4.310 7.419 8.017 1.00 0.00 C ATOM 1401 OE1 GLU A 85 3.360 8.154 7.679 1.00 0.00 O ATOM 1402 OE2 GLU A 85 4.961 7.626 9.064 1.00 0.00 O ATOM 0 H GLU A 85 4.147 5.965 4.202 1.00 0.00 H new ATOM 0 HA GLU A 85 4.745 8.430 5.446 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.038 5.667 5.545 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.610 6.998 6.532 1.00 0.00 H new ATOM 0 HG2 GLU A 85 3.791 5.846 6.641 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.086 5.429 7.746 1.00 0.00 H new ATOM 1409 N HIS A 86 6.936 7.303 3.226 1.00 0.00 N ATOM 1410 CA HIS A 86 8.082 7.627 2.366 1.00 0.00 C ATOM 1411 C HIS A 86 7.671 8.656 1.289 1.00 0.00 C ATOM 1412 O HIS A 86 8.515 9.370 0.762 1.00 0.00 O ATOM 1413 CB HIS A 86 8.652 6.329 1.732 1.00 0.00 C ATOM 1414 CG HIS A 86 9.988 6.499 1.053 1.00 0.00 C ATOM 1415 ND1 HIS A 86 11.149 6.739 1.756 1.00 0.00 N ATOM 1416 CD2 HIS A 86 10.347 6.480 -0.255 1.00 0.00 C ATOM 1417 CE1 HIS A 86 12.157 6.863 0.918 1.00 0.00 C ATOM 1418 NE2 HIS A 86 11.698 6.711 -0.307 1.00 0.00 N ATOM 0 H HIS A 86 6.532 6.385 3.039 1.00 0.00 H new ATOM 0 HA HIS A 86 8.869 8.080 2.969 1.00 0.00 H new ATOM 0 HB2 HIS A 86 8.748 5.572 2.510 1.00 0.00 H new ATOM 0 HB3 HIS A 86 7.935 5.950 1.004 1.00 0.00 H new ATOM 0 HD2 HIS A 86 9.692 6.314 -1.097 1.00 0.00 H new ATOM 0 HE1 HIS A 86 13.184 7.056 1.189 1.00 0.00 H new ATOM 0 HE2 HIS A 86 12.258 6.758 -1.158 1.00 0.00 H new ATOM 1427 N ALA A 87 6.363 8.723 0.976 1.00 0.00 N ATOM 1428 CA ALA A 87 5.807 9.715 0.038 1.00 0.00 C ATOM 1429 C ALA A 87 5.697 11.111 0.699 1.00 0.00 C ATOM 1430 O ALA A 87 5.860 12.119 0.023 1.00 0.00 O ATOM 1431 CB ALA A 87 4.446 9.248 -0.507 1.00 0.00 C ATOM 0 H ALA A 87 5.663 8.092 1.366 1.00 0.00 H new ATOM 0 HA ALA A 87 6.494 9.804 -0.804 1.00 0.00 H new ATOM 0 HB1 ALA A 87 4.055 9.995 -1.197 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.570 8.300 -1.031 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.748 9.117 0.320 1.00 0.00 H new ATOM 1437 N ILE A 88 5.399 11.159 2.022 1.00 0.00 N ATOM 1438 CA ILE A 88 5.417 12.432 2.804 1.00 0.00 C ATOM 1439 C ILE A 88 6.875 12.922 2.933 1.00 0.00 C ATOM 1440 O ILE A 88 7.162 14.129 2.873 1.00 0.00 O ATOM 1441 CB ILE A 88 4.799 12.281 4.250 1.00 0.00 C ATOM 1442 CG1 ILE A 88 3.393 11.619 4.210 1.00 0.00 C ATOM 1443 CG2 ILE A 88 4.726 13.654 4.977 1.00 0.00 C ATOM 1444 CD1 ILE A 88 2.846 11.222 5.572 1.00 0.00 C ATOM 0 H ILE A 88 5.144 10.338 2.572 1.00 0.00 H new ATOM 0 HA ILE A 88 4.801 13.150 2.263 1.00 0.00 H new ATOM 0 HB ILE A 88 5.464 11.625 4.812 1.00 0.00 H new ATOM 0 HG12 ILE A 88 2.693 12.309 3.738 1.00 0.00 H new ATOM 0 HG13 ILE A 88 3.440 10.732 3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 88 4.296 13.518 5.969 1.00 0.00 H new ATOM 0 HG22 ILE A 88 5.729 14.070 5.070 1.00 0.00 H new ATOM 0 HG23 ILE A 88 4.101 14.337 4.402 1.00 0.00 H new ATOM 0 HD11 ILE A 88 1.862 10.768 5.451 1.00 0.00 H new ATOM 0 HD12 ILE A 88 3.521 10.506 6.040 1.00 0.00 H new ATOM 0 HD13 ILE A 88 2.762 12.107 6.203 1.00 0.00 H new ATOM 1456 N ASP A 89 7.780 11.939 3.109 1.00 0.00 N ATOM 1457 CA ASP A 89 9.241 12.150 3.150 1.00 0.00 C ATOM 1458 C ASP A 89 9.742 12.773 1.830 1.00 0.00 C ATOM 1459 O ASP A 89 10.539 13.713 1.842 1.00 0.00 O ATOM 1460 CB ASP A 89 9.948 10.796 3.422 1.00 0.00 C ATOM 1461 CG ASP A 89 11.478 10.901 3.479 1.00 0.00 C ATOM 1462 OD1 ASP A 89 12.003 11.392 4.504 1.00 0.00 O ATOM 1463 OD2 ASP A 89 12.162 10.471 2.521 1.00 0.00 O ATOM 0 H ASP A 89 7.513 10.962 3.228 1.00 0.00 H new ATOM 0 HA ASP A 89 9.479 12.846 3.955 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.585 10.390 4.366 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.670 10.087 2.642 1.00 0.00 H new ATOM 1468 N LEU A 90 9.229 12.248 0.697 1.00 0.00 N ATOM 1469 CA LEU A 90 9.554 12.746 -0.664 1.00 0.00 C ATOM 1470 C LEU A 90 8.626 13.916 -1.087 1.00 0.00 C ATOM 1471 O LEU A 90 8.660 14.339 -2.248 1.00 0.00 O ATOM 1472 CB LEU A 90 9.466 11.579 -1.699 1.00 0.00 C ATOM 1473 CG LEU A 90 10.452 10.378 -1.498 1.00 0.00 C ATOM 1474 CD1 LEU A 90 10.244 9.297 -2.588 1.00 0.00 C ATOM 1475 CD2 LEU A 90 11.925 10.851 -1.436 1.00 0.00 C ATOM 0 H LEU A 90 8.576 11.465 0.696 1.00 0.00 H new ATOM 0 HA LEU A 90 10.574 13.130 -0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 90 8.448 11.189 -1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.634 11.994 -2.693 1.00 0.00 H new ATOM 0 HG LEU A 90 10.223 9.923 -0.534 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.942 8.476 -2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 90 9.222 8.921 -2.537 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.422 9.733 -3.571 1.00 0.00 H new ATOM 0 HD21 LEU A 90 12.578 9.990 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.185 11.356 -2.367 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.051 11.541 -0.602 1.00 0.00 H new ATOM 1487 N GLU A 91 7.790 14.407 -0.134 1.00 0.00 N ATOM 1488 CA GLU A 91 6.884 15.585 -0.308 1.00 0.00 C ATOM 1489 C GLU A 91 5.820 15.395 -1.423 1.00 0.00 C ATOM 1490 O GLU A 91 5.182 16.364 -1.851 1.00 0.00 O ATOM 1491 CB GLU A 91 7.701 16.889 -0.542 1.00 0.00 C ATOM 1492 CG GLU A 91 8.709 17.223 0.569 1.00 0.00 C ATOM 1493 CD GLU A 91 9.406 18.575 0.349 1.00 0.00 C ATOM 1494 OE1 GLU A 91 10.394 18.632 -0.418 1.00 0.00 O ATOM 1495 OE2 GLU A 91 8.961 19.596 0.928 1.00 0.00 O ATOM 0 H GLU A 91 7.722 13.991 0.795 1.00 0.00 H new ATOM 0 HA GLU A 91 6.331 15.674 0.627 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.238 16.801 -1.486 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.007 17.723 -0.647 1.00 0.00 H new ATOM 0 HG2 GLU A 91 8.194 17.236 1.530 1.00 0.00 H new ATOM 0 HG3 GLU A 91 9.461 16.435 0.621 1.00 0.00 H new ATOM 1502 N LEU A 92 5.618 14.144 -1.843 1.00 0.00 N ATOM 1503 CA LEU A 92 4.639 13.755 -2.878 1.00 0.00 C ATOM 1504 C LEU A 92 3.197 13.839 -2.338 1.00 0.00 C ATOM 1505 O LEU A 92 2.250 14.053 -3.099 1.00 0.00 O ATOM 1506 CB LEU A 92 4.962 12.316 -3.344 1.00 0.00 C ATOM 1507 CG LEU A 92 6.394 12.111 -3.940 1.00 0.00 C ATOM 1508 CD1 LEU A 92 6.714 10.619 -4.153 1.00 0.00 C ATOM 1509 CD2 LEU A 92 6.570 12.920 -5.247 1.00 0.00 C ATOM 0 H LEU A 92 6.139 13.351 -1.469 1.00 0.00 H new ATOM 0 HA LEU A 92 4.710 14.443 -3.720 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.839 11.641 -2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.229 12.022 -4.095 1.00 0.00 H new ATOM 0 HG LEU A 92 7.111 12.491 -3.213 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.717 10.518 -4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.662 10.096 -3.198 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.990 10.187 -4.844 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.574 12.761 -5.641 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.835 12.590 -5.981 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.426 13.981 -5.041 1.00 0.00 H new ATOM 1521 N ILE A 93 3.056 13.653 -1.014 1.00 0.00 N ATOM 1522 CA ILE A 93 1.783 13.841 -0.288 1.00 0.00 C ATOM 1523 C ILE A 93 2.073 14.566 1.037 1.00 0.00 C ATOM 1524 O ILE A 93 3.222 14.607 1.493 1.00 0.00 O ATOM 1525 CB ILE A 93 1.010 12.490 0.000 1.00 0.00 C ATOM 1526 CG1 ILE A 93 1.868 11.524 0.861 1.00 0.00 C ATOM 1527 CG2 ILE A 93 0.546 11.804 -1.310 1.00 0.00 C ATOM 1528 CD1 ILE A 93 1.150 10.258 1.293 1.00 0.00 C ATOM 0 H ILE A 93 3.827 13.366 -0.411 1.00 0.00 H new ATOM 0 HA ILE A 93 1.130 14.433 -0.930 1.00 0.00 H new ATOM 0 HB ILE A 93 0.116 12.745 0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.758 11.247 0.296 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.208 12.055 1.750 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.020 10.880 -1.070 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.122 12.472 -1.854 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.414 11.577 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.824 9.643 1.889 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.276 10.521 1.889 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.834 9.700 0.412 1.00 0.00 H new ATOM 1540 N THR A 94 1.022 15.136 1.640 1.00 0.00 N ATOM 1541 CA THR A 94 1.109 15.886 2.906 1.00 0.00 C ATOM 1542 C THR A 94 0.748 14.991 4.113 1.00 0.00 C ATOM 1543 O THR A 94 1.245 15.200 5.227 1.00 0.00 O ATOM 1544 CB THR A 94 0.144 17.120 2.866 1.00 0.00 C ATOM 1545 OG1 THR A 94 -1.193 16.669 2.569 1.00 0.00 O ATOM 1546 CG2 THR A 94 0.575 18.155 1.808 1.00 0.00 C ATOM 0 H THR A 94 0.076 15.091 1.261 1.00 0.00 H new ATOM 0 HA THR A 94 2.138 16.226 3.023 1.00 0.00 H new ATOM 0 HB THR A 94 0.180 17.603 3.842 1.00 0.00 H new ATOM 0 HG1 THR A 94 -1.800 17.438 2.545 1.00 0.00 H new ATOM 0 HG21 THR A 94 -0.121 18.993 1.814 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.578 18.515 2.038 1.00 0.00 H new ATOM 0 HG23 THR A 94 0.574 17.690 0.822 1.00 0.00 H new ATOM 1554 N LYS A 95 -0.116 13.987 3.875 1.00 0.00 N ATOM 1555 CA LYS A 95 -0.719 13.175 4.945 1.00 0.00 C ATOM 1556 C LYS A 95 -0.831 11.701 4.523 1.00 0.00 C ATOM 1557 O LYS A 95 -1.223 11.403 3.393 1.00 0.00 O ATOM 1558 CB LYS A 95 -2.133 13.731 5.281 1.00 0.00 C ATOM 1559 CG LYS A 95 -2.815 13.061 6.494 1.00 0.00 C ATOM 1560 CD LYS A 95 -4.265 13.551 6.717 1.00 0.00 C ATOM 1561 CE LYS A 95 -4.879 13.007 8.019 1.00 0.00 C ATOM 1562 NZ LYS A 95 -4.171 13.529 9.218 1.00 0.00 N ATOM 0 H LYS A 95 -0.414 13.717 2.938 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.078 13.231 5.825 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.053 14.801 5.471 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.774 13.610 4.408 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -2.820 11.981 6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -2.228 13.260 7.390 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -4.277 14.641 6.741 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.882 13.244 5.873 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.932 13.284 8.069 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.835 11.918 8.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.734 13.327 10.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.242 13.069 9.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -4.042 14.557 9.125 1.00 0.00 H new ATOM 1576 N ASN A 96 -0.494 10.790 5.456 1.00 0.00 N ATOM 1577 CA ASN A 96 -0.699 9.346 5.283 1.00 0.00 C ATOM 1578 C ASN A 96 -2.158 9.021 5.651 1.00 0.00 C ATOM 1579 O ASN A 96 -2.541 9.068 6.824 1.00 0.00 O ATOM 1580 CB ASN A 96 0.294 8.551 6.169 1.00 0.00 C ATOM 1581 CG ASN A 96 0.316 7.034 5.912 1.00 0.00 C ATOM 1582 OD1 ASN A 96 -0.675 6.422 5.526 1.00 0.00 O ATOM 1583 ND2 ASN A 96 1.462 6.421 6.109 1.00 0.00 N ATOM 0 H ASN A 96 -0.072 11.039 6.351 1.00 0.00 H new ATOM 0 HA ASN A 96 -0.512 9.057 4.249 1.00 0.00 H new ATOM 0 HB2 ASN A 96 1.297 8.947 6.011 1.00 0.00 H new ATOM 0 HB3 ASN A 96 0.044 8.724 7.216 1.00 0.00 H new ATOM 0 HD21 ASN A 96 1.539 5.418 5.941 1.00 0.00 H new ATOM 0 HD22 ASN A 96 2.274 6.948 6.430 1.00 0.00 H new ATOM 1590 N VAL A 97 -2.968 8.724 4.628 1.00 0.00 N ATOM 1591 CA VAL A 97 -4.400 8.403 4.787 1.00 0.00 C ATOM 1592 C VAL A 97 -4.619 6.927 5.213 1.00 0.00 C ATOM 1593 O VAL A 97 -5.715 6.548 5.637 1.00 0.00 O ATOM 1594 CB VAL A 97 -5.174 8.724 3.458 1.00 0.00 C ATOM 1595 CG1 VAL A 97 -5.104 10.244 3.121 1.00 0.00 C ATOM 1596 CG2 VAL A 97 -4.651 7.847 2.287 1.00 0.00 C ATOM 0 H VAL A 97 -2.651 8.698 3.659 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.797 9.027 5.588 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.225 8.476 3.607 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.648 10.437 2.196 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -5.552 10.818 3.932 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.063 10.542 2.998 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.202 8.088 1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.590 8.043 2.131 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.793 6.794 2.530 1.00 0.00 H new ATOM 1606 N ALA A 98 -3.550 6.112 5.125 1.00 0.00 N ATOM 1607 CA ALA A 98 -3.555 4.705 5.576 1.00 0.00 C ATOM 1608 C ALA A 98 -3.141 4.628 7.064 1.00 0.00 C ATOM 1609 O ALA A 98 -3.260 3.578 7.697 1.00 0.00 O ATOM 1610 CB ALA A 98 -2.627 3.851 4.691 1.00 0.00 C ATOM 0 H ALA A 98 -2.655 6.411 4.738 1.00 0.00 H new ATOM 0 HA ALA A 98 -4.564 4.303 5.481 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -2.643 2.818 5.038 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -2.971 3.892 3.657 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.610 4.238 4.751 1.00 0.00 H new ATOM 1616 N ALA A 99 -2.647 5.766 7.609 1.00 0.00 N ATOM 1617 CA ALA A 99 -2.381 5.925 9.055 1.00 0.00 C ATOM 1618 C ALA A 99 -3.705 6.016 9.840 1.00 0.00 C ATOM 1619 O ALA A 99 -3.757 5.702 11.028 1.00 0.00 O ATOM 1620 CB ALA A 99 -1.510 7.163 9.317 1.00 0.00 C ATOM 0 H ALA A 99 -2.423 6.595 7.059 1.00 0.00 H new ATOM 0 HA ALA A 99 -1.835 5.047 9.400 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -1.328 7.260 10.387 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.559 7.056 8.795 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -2.025 8.053 8.955 1.00 0.00 H new ATOM 1626 N LYS A 100 -4.778 6.448 9.143 1.00 0.00 N ATOM 1627 CA LYS A 100 -6.160 6.438 9.682 1.00 0.00 C ATOM 1628 C LYS A 100 -6.760 5.014 9.648 1.00 0.00 C ATOM 1629 O LYS A 100 -7.799 4.749 10.267 1.00 0.00 O ATOM 1630 CB LYS A 100 -7.057 7.415 8.866 1.00 0.00 C ATOM 1631 CG LYS A 100 -6.715 8.909 9.051 1.00 0.00 C ATOM 1632 CD LYS A 100 -6.876 9.371 10.524 1.00 0.00 C ATOM 1633 CE LYS A 100 -6.639 10.877 10.715 1.00 0.00 C ATOM 1634 NZ LYS A 100 -6.784 11.285 12.136 1.00 0.00 N ATOM 0 H LYS A 100 -4.714 6.813 8.193 1.00 0.00 H new ATOM 0 HA LYS A 100 -6.123 6.766 10.721 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.974 7.165 7.808 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.097 7.256 9.151 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -5.690 9.088 8.726 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.362 9.510 8.411 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -7.879 9.121 10.869 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -6.176 8.817 11.150 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -5.640 11.135 10.364 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -7.346 11.436 10.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -6.616 12.308 12.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -7.745 11.063 12.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -6.092 10.771 12.717 1.00 0.00 H new ATOM 1648 N THR A 101 -6.089 4.118 8.911 1.00 0.00 N ATOM 1649 CA THR A 101 -6.531 2.747 8.676 1.00 0.00 C ATOM 1650 C THR A 101 -5.747 1.768 9.571 1.00 0.00 C ATOM 1651 O THR A 101 -4.513 1.672 9.480 1.00 0.00 O ATOM 1652 CB THR A 101 -6.336 2.400 7.173 1.00 0.00 C ATOM 1653 OG1 THR A 101 -6.945 3.434 6.380 1.00 0.00 O ATOM 1654 CG2 THR A 101 -6.942 1.044 6.801 1.00 0.00 C ATOM 0 H THR A 101 -5.204 4.337 8.454 1.00 0.00 H new ATOM 0 HA THR A 101 -7.587 2.656 8.929 1.00 0.00 H new ATOM 0 HB THR A 101 -5.266 2.336 6.978 1.00 0.00 H new ATOM 0 HG1 THR A 101 -7.824 3.133 6.069 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.778 0.851 5.741 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.468 0.259 7.391 1.00 0.00 H new ATOM 0 HG23 THR A 101 -8.012 1.055 7.006 1.00 0.00 H new ATOM 1662 N LYS A 102 -6.475 1.095 10.471 1.00 0.00 N ATOM 1663 CA LYS A 102 -5.922 0.095 11.399 1.00 0.00 C ATOM 1664 C LYS A 102 -6.319 -1.330 10.972 1.00 0.00 C ATOM 1665 O LYS A 102 -7.189 -1.511 10.108 1.00 0.00 O ATOM 1666 CB LYS A 102 -6.436 0.381 12.838 1.00 0.00 C ATOM 1667 CG LYS A 102 -6.066 1.782 13.374 1.00 0.00 C ATOM 1668 CD LYS A 102 -6.678 2.088 14.762 1.00 0.00 C ATOM 1669 CE LYS A 102 -8.219 2.074 14.756 1.00 0.00 C ATOM 1670 NZ LYS A 102 -8.790 2.402 16.081 1.00 0.00 N ATOM 0 H LYS A 102 -7.480 1.231 10.578 1.00 0.00 H new ATOM 0 HA LYS A 102 -4.834 0.165 11.379 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -7.521 0.273 12.853 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -6.031 -0.373 13.513 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -4.981 1.864 13.437 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -6.402 2.536 12.662 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -6.316 1.354 15.482 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -6.330 3.064 15.099 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -8.583 2.789 14.019 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -8.570 1.090 14.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -9.828 2.380 16.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -8.465 1.705 16.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -8.478 3.352 16.368 1.00 0.00 H new ATOM 1684 N LEU A 103 -5.654 -2.328 11.583 1.00 0.00 N ATOM 1685 CA LEU A 103 -6.035 -3.744 11.461 1.00 0.00 C ATOM 1686 C LEU A 103 -7.380 -3.973 12.203 1.00 0.00 C ATOM 1687 O LEU A 103 -7.467 -3.668 13.402 1.00 0.00 O ATOM 1688 CB LEU A 103 -4.920 -4.660 12.063 1.00 0.00 C ATOM 1689 CG LEU A 103 -5.191 -6.203 12.021 1.00 0.00 C ATOM 1690 CD1 LEU A 103 -5.337 -6.724 10.576 1.00 0.00 C ATOM 1691 CD2 LEU A 103 -4.113 -6.994 12.798 1.00 0.00 C ATOM 0 H LEU A 103 -4.838 -2.173 12.175 1.00 0.00 H new ATOM 0 HA LEU A 103 -6.153 -3.999 10.408 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -3.990 -4.461 11.531 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -4.762 -4.369 13.101 1.00 0.00 H new ATOM 0 HG LEU A 103 -6.145 -6.370 12.522 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.524 -7.798 10.593 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -6.171 -6.218 10.089 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.419 -6.524 10.023 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.335 -8.060 12.746 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -3.134 -6.806 12.356 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -4.108 -6.675 13.840 1.00 0.00 H new ATOM 1703 N PRO A 104 -8.462 -4.459 11.504 1.00 0.00 N ATOM 1704 CA PRO A 104 -9.735 -4.845 12.170 1.00 0.00 C ATOM 1705 C PRO A 104 -9.505 -5.971 13.209 1.00 0.00 C ATOM 1706 O PRO A 104 -8.996 -7.049 12.863 1.00 0.00 O ATOM 1707 CB PRO A 104 -10.645 -5.312 10.993 1.00 0.00 C ATOM 1708 CG PRO A 104 -9.691 -5.623 9.871 1.00 0.00 C ATOM 1709 CD PRO A 104 -8.543 -4.652 10.027 1.00 0.00 C ATOM 0 HA PRO A 104 -10.183 -4.028 12.736 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -11.230 -6.189 11.269 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.352 -4.534 10.707 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -9.342 -6.654 9.929 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -10.175 -5.504 8.902 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -7.615 -5.056 9.622 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -8.736 -3.713 9.508 1.00 0.00 H new ATOM 1717 N LYS A 105 -9.843 -5.687 14.483 1.00 0.00 N ATOM 1718 CA LYS A 105 -9.635 -6.616 15.612 1.00 0.00 C ATOM 1719 C LYS A 105 -10.480 -7.894 15.419 1.00 0.00 C ATOM 1720 O LYS A 105 -11.703 -7.815 15.261 1.00 0.00 O ATOM 1721 CB LYS A 105 -9.990 -5.921 16.959 1.00 0.00 C ATOM 1722 CG LYS A 105 -9.158 -4.654 17.272 1.00 0.00 C ATOM 1723 CD LYS A 105 -9.526 -3.966 18.621 1.00 0.00 C ATOM 1724 CE LYS A 105 -10.889 -3.226 18.616 1.00 0.00 C ATOM 1725 NZ LYS A 105 -12.062 -4.136 18.637 1.00 0.00 N ATOM 0 H LYS A 105 -10.270 -4.803 14.759 1.00 0.00 H new ATOM 0 HA LYS A 105 -8.583 -6.901 15.640 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -11.046 -5.652 16.946 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -9.854 -6.638 17.769 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -8.102 -4.922 17.290 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -9.291 -3.936 16.463 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -9.540 -4.721 19.407 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -8.741 -3.254 18.877 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -10.937 -2.566 19.482 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -10.946 -2.594 17.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -12.807 -3.729 19.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -12.425 -4.257 17.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -11.777 -5.061 19.018 1.00 0.00 H new ATOM 1739 N ALA A 106 -9.804 -9.052 15.420 1.00 0.00 N ATOM 1740 CA ALA A 106 -10.419 -10.376 15.182 1.00 0.00 C ATOM 1741 C ALA A 106 -10.102 -11.331 16.354 1.00 0.00 C ATOM 1742 O ALA A 106 -10.219 -12.555 16.232 1.00 0.00 O ATOM 1743 CB ALA A 106 -9.907 -10.936 13.841 1.00 0.00 C ATOM 0 H ALA A 106 -8.799 -9.101 15.588 1.00 0.00 H new ATOM 0 HA ALA A 106 -11.503 -10.278 15.126 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -10.356 -11.912 13.659 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -10.179 -10.255 13.035 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -8.822 -11.037 13.879 1.00 0.00 H new ATOM 1749 N ASP A 107 -9.742 -10.736 17.497 1.00 0.00 N ATOM 1750 CA ASP A 107 -9.214 -11.445 18.677 1.00 0.00 C ATOM 1751 C ASP A 107 -10.333 -11.886 19.627 1.00 0.00 C ATOM 1752 O ASP A 107 -11.482 -11.424 19.526 1.00 0.00 O ATOM 1753 CB ASP A 107 -8.220 -10.521 19.433 1.00 0.00 C ATOM 1754 CG ASP A 107 -7.030 -10.073 18.566 1.00 0.00 C ATOM 1755 OD1 ASP A 107 -7.225 -9.218 17.671 1.00 0.00 O ATOM 1756 OD2 ASP A 107 -5.901 -10.591 18.746 1.00 0.00 O ATOM 0 H ASP A 107 -9.809 -9.728 17.634 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.703 -12.343 18.328 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -8.753 -9.640 19.790 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.844 -11.044 20.312 1.00 0.00 H new ATOM 1761 N LYS A 108 -9.980 -12.797 20.546 1.00 0.00 N ATOM 1762 CA LYS A 108 -10.815 -13.139 21.699 1.00 0.00 C ATOM 1763 C LYS A 108 -10.621 -12.054 22.767 1.00 0.00 C ATOM 1764 O LYS A 108 -9.840 -12.212 23.716 1.00 0.00 O ATOM 1765 CB LYS A 108 -10.466 -14.553 22.252 1.00 0.00 C ATOM 1766 CG LYS A 108 -10.846 -15.733 21.327 1.00 0.00 C ATOM 1767 CD LYS A 108 -12.359 -15.753 20.988 1.00 0.00 C ATOM 1768 CE LYS A 108 -12.821 -17.077 20.362 1.00 0.00 C ATOM 1769 NZ LYS A 108 -11.996 -17.472 19.194 1.00 0.00 N ATOM 0 H LYS A 108 -9.103 -13.317 20.507 1.00 0.00 H new ATOM 0 HA LYS A 108 -11.862 -13.176 21.399 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -9.394 -14.595 22.447 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -10.970 -14.686 23.210 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -10.270 -15.668 20.404 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -10.572 -16.672 21.808 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -12.931 -15.569 21.898 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -12.582 -14.936 20.301 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -12.780 -17.865 21.114 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -13.862 -16.985 20.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -12.409 -18.315 18.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -11.972 -16.692 18.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -11.028 -17.686 19.509 1.00 0.00 H new ATOM 1783 N GLU A 109 -11.279 -10.908 22.537 1.00 0.00 N ATOM 1784 CA GLU A 109 -11.240 -9.755 23.435 1.00 0.00 C ATOM 1785 C GLU A 109 -12.019 -10.023 24.730 1.00 0.00 C ATOM 1786 O GLU A 109 -12.763 -11.006 24.833 1.00 0.00 O ATOM 1787 CB GLU A 109 -11.781 -8.500 22.709 1.00 0.00 C ATOM 1788 CG GLU A 109 -10.919 -8.051 21.509 1.00 0.00 C ATOM 1789 CD GLU A 109 -11.393 -6.737 20.876 1.00 0.00 C ATOM 1790 OE1 GLU A 109 -11.290 -5.671 21.532 1.00 0.00 O ATOM 1791 OE2 GLU A 109 -11.859 -6.753 19.720 1.00 0.00 O ATOM 0 H GLU A 109 -11.859 -10.759 21.711 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.202 -9.576 23.716 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.794 -8.702 22.361 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.847 -7.679 23.423 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -9.886 -7.936 21.836 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.928 -8.835 20.751 1.00 0.00 H new ATOM 1798 N GLU A 110 -11.861 -9.120 25.703 1.00 0.00 N ATOM 1799 CA GLU A 110 -12.387 -9.296 27.072 1.00 0.00 C ATOM 1800 C GLU A 110 -13.844 -8.786 27.188 1.00 0.00 C ATOM 1801 O GLU A 110 -14.214 -8.099 28.141 1.00 0.00 O ATOM 1802 CB GLU A 110 -11.424 -8.603 28.079 1.00 0.00 C ATOM 1803 CG GLU A 110 -11.194 -7.098 27.834 1.00 0.00 C ATOM 1804 CD GLU A 110 -10.158 -6.486 28.791 1.00 0.00 C ATOM 1805 OE1 GLU A 110 -10.524 -6.117 29.927 1.00 0.00 O ATOM 1806 OE2 GLU A 110 -8.968 -6.389 28.418 1.00 0.00 O ATOM 0 H GLU A 110 -11.363 -8.240 25.568 1.00 0.00 H new ATOM 0 HA GLU A 110 -12.427 -10.358 27.315 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -11.820 -8.735 29.086 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -10.461 -9.112 28.046 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -10.864 -6.949 26.806 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -12.140 -6.569 27.945 1.00 0.00 H new ATOM 1813 N LEU A 111 -14.692 -9.215 26.235 1.00 0.00 N ATOM 1814 CA LEU A 111 -16.126 -8.848 26.191 1.00 0.00 C ATOM 1815 C LEU A 111 -16.939 -9.626 27.259 1.00 0.00 C ATOM 1816 O LEU A 111 -18.131 -9.363 27.451 1.00 0.00 O ATOM 1817 CB LEU A 111 -16.690 -9.116 24.763 1.00 0.00 C ATOM 1818 CG LEU A 111 -15.936 -8.416 23.578 1.00 0.00 C ATOM 1819 CD1 LEU A 111 -16.559 -8.792 22.213 1.00 0.00 C ATOM 1820 CD2 LEU A 111 -15.880 -6.879 23.768 1.00 0.00 C ATOM 0 H LEU A 111 -14.405 -9.827 25.471 1.00 0.00 H new ATOM 0 HA LEU A 111 -16.221 -7.786 26.419 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -16.681 -10.192 24.587 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -17.732 -8.798 24.741 1.00 0.00 H new ATOM 0 HG LEU A 111 -14.910 -8.783 23.584 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -16.014 -8.291 21.414 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -16.500 -9.871 22.071 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -17.603 -8.480 22.191 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -15.351 -6.428 22.929 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -16.894 -6.481 23.814 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -15.356 -6.646 24.695 1.00 0.00 H new ATOM 1832 N GLU A 112 -16.270 -10.582 27.941 1.00 0.00 N ATOM 1833 CA GLU A 112 -16.846 -11.405 29.027 1.00 0.00 C ATOM 1834 C GLU A 112 -17.067 -10.574 30.327 1.00 0.00 C ATOM 1835 O GLU A 112 -16.995 -9.339 30.306 1.00 0.00 O ATOM 1836 CB GLU A 112 -15.900 -12.616 29.299 1.00 0.00 C ATOM 1837 CG GLU A 112 -14.475 -12.237 29.777 1.00 0.00 C ATOM 1838 CD GLU A 112 -13.591 -13.464 30.078 1.00 0.00 C ATOM 1839 OE1 GLU A 112 -12.964 -14.005 29.139 1.00 0.00 O ATOM 1840 OE2 GLU A 112 -13.522 -13.897 31.251 1.00 0.00 O ATOM 0 H GLU A 112 -15.294 -10.807 27.748 1.00 0.00 H new ATOM 0 HA GLU A 112 -17.826 -11.765 28.712 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -16.361 -13.257 30.051 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -15.816 -13.205 28.386 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -13.992 -11.628 29.013 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -14.551 -11.623 30.674 1.00 0.00 H new ATOM 1847 N HIS A 113 -17.325 -11.288 31.449 1.00 0.00 N ATOM 1848 CA HIS A 113 -17.639 -10.700 32.773 1.00 0.00 C ATOM 1849 C HIS A 113 -16.635 -9.594 33.221 1.00 0.00 C ATOM 1850 O HIS A 113 -15.463 -9.856 33.495 1.00 0.00 O ATOM 1851 CB HIS A 113 -17.739 -11.828 33.848 1.00 0.00 C ATOM 1852 CG HIS A 113 -16.480 -12.657 34.030 1.00 0.00 C ATOM 1853 ND1 HIS A 113 -15.505 -12.357 34.960 1.00 0.00 N ATOM 1854 CD2 HIS A 113 -16.037 -13.764 33.384 1.00 0.00 C ATOM 1855 CE1 HIS A 113 -14.522 -13.235 34.871 1.00 0.00 C ATOM 1856 NE2 HIS A 113 -14.816 -14.100 33.920 1.00 0.00 N ATOM 0 H HIS A 113 -17.321 -12.308 31.459 1.00 0.00 H new ATOM 0 HA HIS A 113 -18.603 -10.201 32.672 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -17.999 -11.375 34.805 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -18.558 -12.494 33.578 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -16.551 -14.288 32.591 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -13.627 -13.243 35.476 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -14.235 -14.887 33.630 1.00 0.00 H new ATOM 1865 N HIS A 114 -17.123 -8.348 33.217 1.00 0.00 N ATOM 1866 CA HIS A 114 -16.490 -7.189 33.879 1.00 0.00 C ATOM 1867 C HIS A 114 -17.421 -6.716 35.014 1.00 0.00 C ATOM 1868 O HIS A 114 -17.458 -5.520 35.354 1.00 0.00 O ATOM 1869 CB HIS A 114 -16.249 -6.035 32.858 1.00 0.00 C ATOM 1870 CG HIS A 114 -15.120 -6.252 31.892 1.00 0.00 C ATOM 1871 ND1 HIS A 114 -14.999 -5.522 30.730 1.00 0.00 N ATOM 1872 CD2 HIS A 114 -14.022 -7.039 31.951 1.00 0.00 C ATOM 1873 CE1 HIS A 114 -13.886 -5.843 30.120 1.00 0.00 C ATOM 1874 NE2 HIS A 114 -13.273 -6.765 30.837 1.00 0.00 N ATOM 0 H HIS A 114 -17.992 -8.106 32.742 1.00 0.00 H new ATOM 0 HA HIS A 114 -15.520 -7.479 34.284 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -17.166 -5.879 32.289 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -16.058 -5.116 33.413 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -13.781 -7.749 32.729 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -13.531 -5.425 29.190 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -12.383 -7.204 30.600 1.00 0.00 H new ATOM 1883 N HIS A 115 -18.137 -7.696 35.610 1.00 0.00 N ATOM 1884 CA HIS A 115 -19.250 -7.457 36.541 1.00 0.00 C ATOM 1885 C HIS A 115 -18.801 -6.656 37.772 1.00 0.00 C ATOM 1886 O HIS A 115 -18.042 -7.151 38.616 1.00 0.00 O ATOM 1887 CB HIS A 115 -19.894 -8.790 36.982 1.00 0.00 C ATOM 1888 CG HIS A 115 -21.017 -8.622 37.973 1.00 0.00 C ATOM 1889 ND1 HIS A 115 -20.848 -8.814 39.328 1.00 0.00 N ATOM 1890 CD2 HIS A 115 -22.316 -8.274 37.808 1.00 0.00 C ATOM 1891 CE1 HIS A 115 -21.987 -8.602 39.947 1.00 0.00 C ATOM 1892 NE2 HIS A 115 -22.893 -8.270 39.052 1.00 0.00 N ATOM 0 H HIS A 115 -17.951 -8.686 35.452 1.00 0.00 H new ATOM 0 HA HIS A 115 -19.993 -6.865 36.007 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -20.273 -9.309 36.102 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -19.126 -9.427 37.421 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -22.805 -8.043 36.873 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -22.152 -8.686 41.011 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -23.868 -8.046 39.252 1.00 0.00 H new ATOM 1901 N HIS A 116 -19.292 -5.418 37.839 1.00 0.00 N ATOM 1902 CA HIS A 116 -19.090 -4.514 38.973 1.00 0.00 C ATOM 1903 C HIS A 116 -20.078 -4.879 40.088 1.00 0.00 C ATOM 1904 O HIS A 116 -21.133 -5.459 39.821 1.00 0.00 O ATOM 1905 CB HIS A 116 -19.286 -3.049 38.511 1.00 0.00 C ATOM 1906 CG HIS A 116 -18.386 -2.665 37.373 1.00 0.00 C ATOM 1907 ND1 HIS A 116 -18.822 -2.565 36.069 1.00 0.00 N ATOM 1908 CD2 HIS A 116 -17.064 -2.392 37.345 1.00 0.00 C ATOM 1909 CE1 HIS A 116 -17.810 -2.247 35.292 1.00 0.00 C ATOM 1910 NE2 HIS A 116 -16.730 -2.134 36.040 1.00 0.00 N ATOM 0 H HIS A 116 -19.852 -5.007 37.092 1.00 0.00 H new ATOM 0 HA HIS A 116 -18.076 -4.615 39.359 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -20.324 -2.905 38.210 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -19.103 -2.381 39.353 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -16.394 -2.379 38.192 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -17.856 -2.103 34.223 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -15.798 -1.894 35.703 1.00 0.00 H new ATOM 1919 N HIS A 117 -19.740 -4.542 41.335 1.00 0.00 N ATOM 1920 CA HIS A 117 -20.566 -4.900 42.506 1.00 0.00 C ATOM 1921 C HIS A 117 -21.576 -3.781 42.829 1.00 0.00 C ATOM 1922 O HIS A 117 -21.773 -3.401 43.986 1.00 0.00 O ATOM 1923 CB HIS A 117 -19.635 -5.254 43.697 1.00 0.00 C ATOM 1924 CG HIS A 117 -18.783 -6.467 43.416 1.00 0.00 C ATOM 1925 ND1 HIS A 117 -17.485 -6.394 42.958 1.00 0.00 N ATOM 1926 CD2 HIS A 117 -19.081 -7.788 43.480 1.00 0.00 C ATOM 1927 CE1 HIS A 117 -17.023 -7.612 42.744 1.00 0.00 C ATOM 1928 NE2 HIS A 117 -17.970 -8.477 43.052 1.00 0.00 N ATOM 0 H HIS A 117 -18.896 -4.018 41.567 1.00 0.00 H new ATOM 0 HA HIS A 117 -21.167 -5.783 42.287 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -18.990 -4.403 43.917 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -20.239 -5.435 44.586 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.016 -8.219 43.806 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -16.037 -7.858 42.379 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -17.891 -9.492 42.984 1.00 0.00 H new ATOM 1937 N HIS A 118 -22.252 -3.297 41.768 1.00 0.00 N ATOM 1938 CA HIS A 118 -23.269 -2.238 41.843 1.00 0.00 C ATOM 1939 C HIS A 118 -24.660 -2.906 42.007 1.00 0.00 C ATOM 1940 O HIS A 118 -25.159 -2.992 43.146 1.00 0.00 O ATOM 1941 CB HIS A 118 -23.195 -1.345 40.564 1.00 0.00 C ATOM 1942 CG HIS A 118 -24.249 -0.275 40.482 1.00 0.00 C ATOM 1943 ND1 HIS A 118 -25.508 -0.516 39.987 1.00 0.00 N ATOM 1944 CD2 HIS A 118 -24.230 1.033 40.827 1.00 0.00 C ATOM 1945 CE1 HIS A 118 -26.217 0.585 40.025 1.00 0.00 C ATOM 1946 NE2 HIS A 118 -25.471 1.543 40.533 1.00 0.00 N ATOM 1947 OXT HIS A 118 -25.216 -3.395 40.997 1.00 0.00 O ATOM 0 H HIS A 118 -22.101 -3.640 40.819 1.00 0.00 H new ATOM 0 HA HIS A 118 -23.093 -1.589 42.700 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -22.213 -0.873 40.524 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -23.277 -1.985 39.685 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -23.397 1.573 41.253 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -27.240 0.689 39.695 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -25.766 2.508 40.684 1.00 0.00 H new TER 1956 HIS A 118