USER MOD reduce.3.24.130724 H: found=0, std=0, add=1283, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1280 hydrogens (30 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 NoAdj-H: A 93 HIS HE2 : A 93 HIS NE2 : A 154 HEMFE :(H bumps) USER MOD Set 1.1: A 132 ASN : amide:sc= 0.864 K(o=1.9,f=-3.9) USER MOD Set 1.2: A 133 LYS NZ :NH3+ -175:sc= 0.997 (180deg=-0.0428) USER MOD Set 2.1: A 24 HIS : +bothHN:sc= -1.8! C(o=-1.3!,f=-14!) USER MOD Set 2.2: A 119 HIS : no HE2:sc= 0.464 K(o=-1.3,f=-11!) USER MOD Set 3.1: A 91 GLN : amide:sc= 0.636 K(o=1.9,f=-6.5!) USER MOD Set 3.2: A 145 LYS NZ :NH3+ -157:sc= 1.28 (180deg=0.4) USER MOD Set 4.1: A 63 LYS NZ :NH3+ -170:sc= 1.06 (180deg=-0.0244) USER MOD Set 4.2: A 67 THR OG1 : rot 80:sc= 2.02 USER MOD Set 5.1: A 26 GLN : amide:sc= 2.62 K(o=3.6,f=-4.7) USER MOD Set 5.2: A 62 LYS NZ :NH3+ 150:sc= 0.977 (180deg=-0.187) USER MOD Set 6.1: A 48 HIS : no HD1:sc= -2.71! C(o=-1.6!,f=-2.9!) USER MOD Set 6.2: A 58 SER OG : rot 67:sc= 1.08 USER MOD Single : A 1 VAL N :NH3+ -141:sc= -0.0305 (180deg=-1.4) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.105 X(o=0.1,f=0) USER MOD Single : A 12 HIS : no HE2:sc= 0.03 K(o=0.03,f=-0.68) USER MOD Single : A 16 LYS NZ :NH3+ -171:sc=-0.000468 (180deg=-0.104) USER MOD Single : A 34 LYS NZ :NH3+ -177:sc= 0.439 (180deg=0.409) USER MOD Single : A 35 SER OG : rot 81:sc= 2.19 USER MOD Single : A 36 HIS : no HD1:sc= 0.938 K(o=0.94,f=-3.6!) USER MOD Single : A 39 THR OG1 : rot -75:sc= 1.27 USER MOD Single : A 42 LYS NZ :NH3+ -174:sc= 1.11 (180deg=1.03) USER MOD Single : A 47 LYS NZ :NH3+ -178:sc= 1.06 (180deg=1.05) USER MOD Single : A 50 LYS NZ :NH3+ 160:sc= -0.346 (180deg=-0.745) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.254 USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.059) USER MOD Single : A 64 HIS : no HD1:sc= -0.523 K(o=-0.52,f=-1.9) USER MOD Single : A 70 THR OG1 : rot 77:sc= 1.21 USER MOD Single : A 77 LYS NZ :NH3+ -175:sc= 0.157 (180deg=0.15) USER MOD Single : A 78 LYS NZ :NH3+ 172:sc= -0.0315 (180deg=-0.101) USER MOD Single : A 79 LYS NZ :NH3+ -173:sc= 0.631 (180deg=0.53) USER MOD Single : A 81 HIS : no HD1:sc= -0.0343 X(o=-0.034,f=0) USER MOD Single : A 82 HIS : no HE2:sc= -0.0567 K(o=-0.057,f=-5.4!) USER MOD Single : A 87 LYS NZ :NH3+ 177:sc= 0.58 (180deg=0.573) USER MOD Single : A 92 SER OG : rot 174:sc= 0.981 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -150:sc= 0.402 (180deg=0.0919) USER MOD Single : A 97 HIS : no HD1:sc= 1.02 K(o=1,f=-3.9!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ -126:sc= 0.0761 (180deg=0.0102) USER MOD Single : A 103 TYR OH : rot -151:sc= 0.938 USER MOD Single : A 108 SER OG : rot 67:sc= 1.25 USER MOD Single : A 113 HIS : no HD1:sc= -0.559 X(o=-0.56,f=-0.077) USER MOD Single : A 116 HIS : no HE2:sc= 0.031 K(o=0.031,f=-2.9!) USER MOD Single : A 117 SER OG : rot 130:sc= 0.115 USER MOD Single : A 128 GLN : amide:sc= 0.0189 X(o=0.019,f=0) USER MOD Single : A 131 MET CE :methyl 165:sc= -0.0744 (180deg=-0.389) USER MOD Single : A 140 LYS NZ :NH3+ -178:sc= 0.212 (180deg=0.207) USER MOD Single : A 146 TYR OH : rot -177:sc= 1.21 USER MOD Single : A 147 LYS NZ :NH3+ 131:sc= 0.0103 (180deg=-0.056) USER MOD Single : A 151 TYR OH : rot 100:sc= 0 USER MOD Single : A 152 GLN : amide:sc= 0.629 K(o=0.63,f=-0.093) USER MOD Single : A 154 HEM CMA :methyl 150:sc= -0.589 (180deg=-0.589) USER MOD Single : A 154 HEM CMB :methyl 150:sc= -0.0178 (180deg=-0.0178) USER MOD Single : A 154 HEM CMC :methyl 150:sc= -2.76 (180deg=-2.76) USER MOD Single : A 154 HEM CMD :methyl -30:sc= -0.22 (180deg=-3.46!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 21.041 1.510 2.407 1.00 0.00 N ATOM 2 CA VAL A 1 21.162 0.578 1.302 1.00 0.00 C ATOM 3 C VAL A 1 20.735 -0.805 1.796 1.00 0.00 C ATOM 4 O VAL A 1 21.327 -1.339 2.735 1.00 0.00 O ATOM 5 CB VAL A 1 22.608 0.572 0.774 1.00 0.00 C ATOM 6 CG1 VAL A 1 22.785 -0.462 -0.347 1.00 0.00 C ATOM 7 CG2 VAL A 1 22.996 1.958 0.240 1.00 0.00 C ATOM 0 H1 VAL A 1 20.675 2.418 2.057 1.00 0.00 H new ATOM 0 H2 VAL A 1 20.387 1.123 3.117 1.00 0.00 H new ATOM 0 H3 VAL A 1 21.975 1.658 2.841 1.00 0.00 H new ATOM 0 HA VAL A 1 20.518 0.875 0.474 1.00 0.00 H new ATOM 0 HB VAL A 1 23.257 0.307 1.609 1.00 0.00 H new ATOM 0 HG11 VAL A 1 23.816 -0.443 -0.700 1.00 0.00 H new ATOM 0 HG12 VAL A 1 22.550 -1.456 0.034 1.00 0.00 H new ATOM 0 HG13 VAL A 1 22.115 -0.222 -1.172 1.00 0.00 H new ATOM 0 HG21 VAL A 1 24.022 1.932 -0.128 1.00 0.00 H new ATOM 0 HG22 VAL A 1 22.325 2.235 -0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 1 22.917 2.692 1.042 1.00 0.00 H new ATOM 19 N LEU A 2 19.689 -1.374 1.192 1.00 0.00 N ATOM 20 CA LEU A 2 19.239 -2.711 1.530 1.00 0.00 C ATOM 21 C LEU A 2 20.052 -3.693 0.686 1.00 0.00 C ATOM 22 O LEU A 2 20.376 -3.394 -0.464 1.00 0.00 O ATOM 23 CB LEU A 2 17.731 -2.826 1.278 1.00 0.00 C ATOM 24 CG LEU A 2 17.124 -4.114 1.854 1.00 0.00 C ATOM 25 CD1 LEU A 2 16.846 -3.971 3.351 1.00 0.00 C ATOM 26 CD2 LEU A 2 15.864 -4.520 1.079 1.00 0.00 C ATOM 0 H LEU A 2 19.140 -0.920 0.463 1.00 0.00 H new ATOM 0 HA LEU A 2 19.396 -2.938 2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 2 17.228 -1.965 1.718 1.00 0.00 H new ATOM 0 HB3 LEU A 2 17.544 -2.791 0.205 1.00 0.00 H new ATOM 0 HG LEU A 2 17.854 -4.915 1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 2 16.417 -4.898 3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 2 17.778 -3.761 3.876 1.00 0.00 H new ATOM 0 HD13 LEU A 2 16.145 -3.153 3.514 1.00 0.00 H new ATOM 0 HD21 LEU A 2 15.453 -5.435 1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 2 15.123 -3.723 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 2 16.119 -4.691 0.033 1.00 0.00 H new ATOM 38 N SER A 3 20.428 -4.842 1.255 1.00 0.00 N ATOM 39 CA SER A 3 21.236 -5.814 0.545 1.00 0.00 C ATOM 40 C SER A 3 20.413 -6.572 -0.494 1.00 0.00 C ATOM 41 O SER A 3 19.190 -6.693 -0.386 1.00 0.00 O ATOM 42 CB SER A 3 21.891 -6.764 1.553 1.00 0.00 C ATOM 43 OG SER A 3 20.890 -7.438 2.290 1.00 0.00 O ATOM 0 H SER A 3 20.181 -5.114 2.207 1.00 0.00 H new ATOM 0 HA SER A 3 22.020 -5.291 -0.003 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.521 -7.485 1.032 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.539 -6.204 2.228 1.00 0.00 H new ATOM 0 HG SER A 3 21.311 -8.046 2.933 1.00 0.00 H new ATOM 49 N GLU A 4 21.114 -7.094 -1.503 1.00 0.00 N ATOM 50 CA GLU A 4 20.556 -7.885 -2.582 1.00 0.00 C ATOM 51 C GLU A 4 19.791 -9.087 -2.027 1.00 0.00 C ATOM 52 O GLU A 4 18.768 -9.480 -2.578 1.00 0.00 O ATOM 53 CB GLU A 4 21.672 -8.347 -3.533 1.00 0.00 C ATOM 54 CG GLU A 4 22.534 -7.190 -4.077 1.00 0.00 C ATOM 55 CD GLU A 4 23.843 -6.986 -3.307 1.00 0.00 C ATOM 56 OE1 GLU A 4 23.780 -6.962 -2.057 1.00 0.00 O ATOM 57 OE2 GLU A 4 24.886 -6.861 -3.982 1.00 0.00 O ATOM 0 H GLU A 4 22.123 -6.968 -1.586 1.00 0.00 H new ATOM 0 HA GLU A 4 19.856 -7.265 -3.142 1.00 0.00 H new ATOM 0 HB2 GLU A 4 22.315 -9.054 -3.009 1.00 0.00 H new ATOM 0 HB3 GLU A 4 21.226 -8.883 -4.371 1.00 0.00 H new ATOM 0 HG2 GLU A 4 22.765 -7.381 -5.125 1.00 0.00 H new ATOM 0 HG3 GLU A 4 21.954 -6.268 -4.042 1.00 0.00 H new ATOM 64 N GLY A 5 20.287 -9.686 -0.941 1.00 0.00 N ATOM 65 CA GLY A 5 19.639 -10.824 -0.305 1.00 0.00 C ATOM 66 C GLY A 5 18.256 -10.419 0.205 1.00 0.00 C ATOM 67 O GLY A 5 17.248 -11.049 -0.112 1.00 0.00 O ATOM 0 H GLY A 5 21.149 -9.392 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY A 5 19.548 -11.645 -1.016 1.00 0.00 H new ATOM 0 HA3 GLY A 5 20.250 -11.185 0.522 1.00 0.00 H new ATOM 71 N GLU A 6 18.211 -9.342 0.990 1.00 0.00 N ATOM 72 CA GLU A 6 16.973 -8.823 1.545 1.00 0.00 C ATOM 73 C GLU A 6 16.027 -8.391 0.414 1.00 0.00 C ATOM 74 O GLU A 6 14.831 -8.679 0.477 1.00 0.00 O ATOM 75 CB GLU A 6 17.313 -7.680 2.502 1.00 0.00 C ATOM 76 CG GLU A 6 18.102 -8.123 3.744 1.00 0.00 C ATOM 77 CD GLU A 6 17.259 -8.936 4.721 1.00 0.00 C ATOM 78 OE1 GLU A 6 16.549 -8.296 5.525 1.00 0.00 O ATOM 79 OE2 GLU A 6 17.349 -10.181 4.651 1.00 0.00 O ATOM 0 H GLU A 6 19.038 -8.808 1.256 1.00 0.00 H new ATOM 0 HA GLU A 6 16.447 -9.593 2.109 1.00 0.00 H new ATOM 0 HB2 GLU A 6 17.892 -6.929 1.964 1.00 0.00 H new ATOM 0 HB3 GLU A 6 16.388 -7.200 2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 6 18.961 -8.717 3.431 1.00 0.00 H new ATOM 0 HG3 GLU A 6 18.493 -7.242 4.254 1.00 0.00 H new ATOM 86 N TRP A 7 16.544 -7.722 -0.627 1.00 0.00 N ATOM 87 CA TRP A 7 15.716 -7.393 -1.778 1.00 0.00 C ATOM 88 C TRP A 7 15.135 -8.671 -2.382 1.00 0.00 C ATOM 89 O TRP A 7 13.936 -8.728 -2.633 1.00 0.00 O ATOM 90 CB TRP A 7 16.466 -6.562 -2.833 1.00 0.00 C ATOM 91 CG TRP A 7 16.489 -5.076 -2.623 1.00 0.00 C ATOM 92 CD1 TRP A 7 17.599 -4.315 -2.492 1.00 0.00 C ATOM 93 CD2 TRP A 7 15.359 -4.149 -2.516 1.00 0.00 C ATOM 94 NE1 TRP A 7 17.238 -2.995 -2.319 1.00 0.00 N ATOM 95 CE2 TRP A 7 15.870 -2.838 -2.274 1.00 0.00 C ATOM 96 CE3 TRP A 7 13.952 -4.283 -2.578 1.00 0.00 C ATOM 97 CZ2 TRP A 7 15.037 -1.723 -2.085 1.00 0.00 C ATOM 98 CZ3 TRP A 7 13.107 -3.176 -2.370 1.00 0.00 C ATOM 99 CH2 TRP A 7 13.644 -1.899 -2.124 1.00 0.00 C ATOM 0 H TRP A 7 17.512 -7.407 -0.689 1.00 0.00 H new ATOM 0 HA TRP A 7 14.899 -6.762 -1.427 1.00 0.00 H new ATOM 0 HB2 TRP A 7 17.496 -6.916 -2.877 1.00 0.00 H new ATOM 0 HB3 TRP A 7 16.018 -6.762 -3.806 1.00 0.00 H new ATOM 0 HD1 TRP A 7 18.614 -4.684 -2.519 1.00 0.00 H new ATOM 0 HE1 TRP A 7 17.904 -2.227 -2.235 1.00 0.00 H new ATOM 0 HE3 TRP A 7 13.519 -5.250 -2.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 15.461 -0.745 -1.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 12.036 -3.309 -2.400 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.987 -1.057 -1.966 1.00 0.00 H new ATOM 110 N GLN A 8 15.956 -9.696 -2.625 1.00 0.00 N ATOM 111 CA GLN A 8 15.467 -10.956 -3.172 1.00 0.00 C ATOM 112 C GLN A 8 14.362 -11.539 -2.287 1.00 0.00 C ATOM 113 O GLN A 8 13.351 -11.993 -2.819 1.00 0.00 O ATOM 114 CB GLN A 8 16.613 -11.948 -3.387 1.00 0.00 C ATOM 115 CG GLN A 8 17.396 -11.576 -4.652 1.00 0.00 C ATOM 116 CD GLN A 8 18.734 -12.298 -4.706 1.00 0.00 C ATOM 117 OE1 GLN A 8 18.926 -13.233 -5.475 1.00 0.00 O ATOM 118 NE2 GLN A 8 19.671 -11.857 -3.877 1.00 0.00 N ATOM 0 H GLN A 8 16.961 -9.674 -2.450 1.00 0.00 H new ATOM 0 HA GLN A 8 15.031 -10.758 -4.151 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.277 -11.942 -2.523 1.00 0.00 H new ATOM 0 HB3 GLN A 8 16.217 -12.960 -3.478 1.00 0.00 H new ATOM 0 HG2 GLN A 8 16.808 -11.829 -5.534 1.00 0.00 H new ATOM 0 HG3 GLN A 8 17.560 -10.499 -4.677 1.00 0.00 H new ATOM 0 HE21 GLN A 8 19.472 -11.076 -3.252 1.00 0.00 H new ATOM 0 HE22 GLN A 8 20.590 -12.299 -3.865 1.00 0.00 H new ATOM 127 N LEU A 9 14.523 -11.533 -0.956 1.00 0.00 N ATOM 128 CA LEU A 9 13.458 -12.010 -0.074 1.00 0.00 C ATOM 129 C LEU A 9 12.187 -11.202 -0.349 1.00 0.00 C ATOM 130 O LEU A 9 11.158 -11.773 -0.710 1.00 0.00 O ATOM 131 CB LEU A 9 13.840 -11.917 1.410 1.00 0.00 C ATOM 132 CG LEU A 9 15.003 -12.831 1.829 1.00 0.00 C ATOM 133 CD1 LEU A 9 15.268 -12.631 3.325 1.00 0.00 C ATOM 134 CD2 LEU A 9 14.718 -14.314 1.558 1.00 0.00 C ATOM 0 H LEU A 9 15.364 -11.209 -0.478 1.00 0.00 H new ATOM 0 HA LEU A 9 13.289 -13.066 -0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.105 -10.885 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 9 12.966 -12.163 2.013 1.00 0.00 H new ATOM 0 HG LEU A 9 15.873 -12.558 1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 9 16.091 -13.273 3.638 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.529 -11.589 3.512 1.00 0.00 H new ATOM 0 HD13 LEU A 9 14.372 -12.888 3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 9 15.573 -14.912 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 9 13.834 -14.622 2.116 1.00 0.00 H new ATOM 0 HD23 LEU A 9 14.545 -14.462 0.492 1.00 0.00 H new ATOM 146 N VAL A 10 12.288 -9.869 -0.304 1.00 0.00 N ATOM 147 CA VAL A 10 11.146 -8.989 -0.529 1.00 0.00 C ATOM 148 C VAL A 10 10.463 -9.322 -1.865 1.00 0.00 C ATOM 149 O VAL A 10 9.284 -9.664 -1.901 1.00 0.00 O ATOM 150 CB VAL A 10 11.600 -7.520 -0.424 1.00 0.00 C ATOM 151 CG1 VAL A 10 10.559 -6.523 -0.942 1.00 0.00 C ATOM 152 CG2 VAL A 10 11.897 -7.170 1.035 1.00 0.00 C ATOM 0 H VAL A 10 13.160 -9.376 -0.111 1.00 0.00 H new ATOM 0 HA VAL A 10 10.392 -9.148 0.242 1.00 0.00 H new ATOM 0 HB VAL A 10 12.489 -7.436 -1.048 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.944 -5.508 -0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.351 -6.727 -1.992 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.640 -6.623 -0.364 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.217 -6.130 1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 10 10.997 -7.312 1.634 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.688 -7.818 1.411 1.00 0.00 H new ATOM 162 N LEU A 11 11.204 -9.263 -2.973 1.00 0.00 N ATOM 163 CA LEU A 11 10.666 -9.577 -4.289 1.00 0.00 C ATOM 164 C LEU A 11 10.092 -10.995 -4.355 1.00 0.00 C ATOM 165 O LEU A 11 9.085 -11.212 -5.028 1.00 0.00 O ATOM 166 CB LEU A 11 11.706 -9.320 -5.388 1.00 0.00 C ATOM 167 CG LEU A 11 12.238 -7.875 -5.414 1.00 0.00 C ATOM 168 CD1 LEU A 11 13.137 -7.689 -6.640 1.00 0.00 C ATOM 169 CD2 LEU A 11 11.125 -6.823 -5.432 1.00 0.00 C ATOM 0 H LEU A 11 12.189 -8.997 -2.979 1.00 0.00 H new ATOM 0 HA LEU A 11 9.830 -8.902 -4.469 1.00 0.00 H new ATOM 0 HB2 LEU A 11 12.544 -10.003 -5.249 1.00 0.00 H new ATOM 0 HB3 LEU A 11 11.263 -9.552 -6.356 1.00 0.00 H new ATOM 0 HG LEU A 11 12.800 -7.724 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.516 -6.667 -6.662 1.00 0.00 H new ATOM 0 HD12 LEU A 11 13.974 -8.385 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 11 12.562 -7.882 -7.546 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.566 -5.827 -5.450 1.00 0.00 H new ATOM 0 HD22 LEU A 11 10.507 -6.962 -6.319 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.508 -6.931 -4.540 1.00 0.00 H new ATOM 181 N HIS A 12 10.707 -11.966 -3.673 1.00 0.00 N ATOM 182 CA HIS A 12 10.170 -13.318 -3.637 1.00 0.00 C ATOM 183 C HIS A 12 8.782 -13.303 -2.998 1.00 0.00 C ATOM 184 O HIS A 12 7.816 -13.747 -3.615 1.00 0.00 O ATOM 185 CB HIS A 12 11.132 -14.280 -2.932 1.00 0.00 C ATOM 186 CG HIS A 12 10.594 -15.684 -2.857 1.00 0.00 C ATOM 187 ND1 HIS A 12 10.143 -16.325 -1.717 1.00 0.00 N ATOM 188 CD2 HIS A 12 10.371 -16.509 -3.926 1.00 0.00 C ATOM 189 CE1 HIS A 12 9.671 -17.528 -2.090 1.00 0.00 C ATOM 190 NE2 HIS A 12 9.789 -17.658 -3.425 1.00 0.00 N ATOM 0 H HIS A 12 11.570 -11.837 -3.144 1.00 0.00 H new ATOM 0 HA HIS A 12 10.064 -13.689 -4.656 1.00 0.00 H new ATOM 0 HB2 HIS A 12 12.085 -14.288 -3.461 1.00 0.00 H new ATOM 0 HB3 HIS A 12 11.330 -13.916 -1.924 1.00 0.00 H new ATOM 0 HD1 HIS A 12 10.164 -15.953 -0.767 1.00 0.00 H new ATOM 0 HD2 HIS A 12 10.604 -16.302 -4.960 1.00 0.00 H new ATOM 0 HE1 HIS A 12 9.262 -18.273 -1.423 1.00 0.00 H new ATOM 199 N VAL A 13 8.656 -12.735 -1.794 1.00 0.00 N ATOM 200 CA VAL A 13 7.353 -12.621 -1.142 1.00 0.00 C ATOM 201 C VAL A 13 6.399 -11.874 -2.092 1.00 0.00 C ATOM 202 O VAL A 13 5.285 -12.315 -2.373 1.00 0.00 O ATOM 203 CB VAL A 13 7.476 -11.911 0.222 1.00 0.00 C ATOM 204 CG1 VAL A 13 6.110 -11.832 0.907 1.00 0.00 C ATOM 205 CG2 VAL A 13 8.436 -12.630 1.178 1.00 0.00 C ATOM 0 H VAL A 13 9.434 -12.351 -1.258 1.00 0.00 H new ATOM 0 HA VAL A 13 6.951 -13.613 -0.937 1.00 0.00 H new ATOM 0 HB VAL A 13 7.869 -10.917 0.010 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.214 -11.328 1.868 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.419 -11.272 0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.723 -12.839 1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.484 -12.087 2.122 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.077 -13.643 1.360 1.00 0.00 H new ATOM 0 HG23 VAL A 13 9.430 -12.672 0.732 1.00 0.00 H new ATOM 215 N TRP A 14 6.889 -10.811 -2.736 1.00 0.00 N ATOM 216 CA TRP A 14 6.065 -9.990 -3.602 1.00 0.00 C ATOM 217 C TRP A 14 5.567 -10.770 -4.814 1.00 0.00 C ATOM 218 O TRP A 14 4.480 -10.496 -5.318 1.00 0.00 O ATOM 219 CB TRP A 14 6.762 -8.696 -4.027 1.00 0.00 C ATOM 220 CG TRP A 14 5.769 -7.658 -4.435 1.00 0.00 C ATOM 221 CD1 TRP A 14 5.339 -7.413 -5.691 1.00 0.00 C ATOM 222 CD2 TRP A 14 4.976 -6.803 -3.567 1.00 0.00 C ATOM 223 NE1 TRP A 14 4.332 -6.468 -5.660 1.00 0.00 N ATOM 224 CE2 TRP A 14 4.070 -6.050 -4.370 1.00 0.00 C ATOM 225 CE3 TRP A 14 4.933 -6.598 -2.173 1.00 0.00 C ATOM 226 CZ2 TRP A 14 3.160 -5.139 -3.811 1.00 0.00 C ATOM 227 CZ3 TRP A 14 4.081 -5.631 -1.614 1.00 0.00 C ATOM 228 CH2 TRP A 14 3.177 -4.922 -2.423 1.00 0.00 C ATOM 0 H TRP A 14 7.859 -10.504 -2.668 1.00 0.00 H new ATOM 0 HA TRP A 14 5.197 -9.701 -3.010 1.00 0.00 H new ATOM 0 HB2 TRP A 14 7.369 -8.319 -3.204 1.00 0.00 H new ATOM 0 HB3 TRP A 14 7.440 -8.900 -4.856 1.00 0.00 H new ATOM 0 HD1 TRP A 14 5.724 -7.884 -6.584 1.00 0.00 H new ATOM 0 HE1 TRP A 14 3.843 -6.122 -6.486 1.00 0.00 H new ATOM 0 HE3 TRP A 14 5.563 -7.192 -1.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 2.457 -4.612 -4.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 4.121 -5.431 -0.553 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.496 -4.211 -1.978 1.00 0.00 H new ATOM 239 N ALA A 15 6.362 -11.709 -5.327 1.00 0.00 N ATOM 240 CA ALA A 15 5.892 -12.559 -6.405 1.00 0.00 C ATOM 241 C ALA A 15 4.622 -13.299 -5.973 1.00 0.00 C ATOM 242 O ALA A 15 3.724 -13.511 -6.785 1.00 0.00 O ATOM 243 CB ALA A 15 6.983 -13.530 -6.864 1.00 0.00 C ATOM 0 H ALA A 15 7.316 -11.894 -5.016 1.00 0.00 H new ATOM 0 HA ALA A 15 5.647 -11.931 -7.262 1.00 0.00 H new ATOM 0 HB1 ALA A 15 6.599 -14.153 -7.672 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.846 -12.966 -7.218 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.281 -14.163 -6.029 1.00 0.00 H new ATOM 249 N LYS A 16 4.524 -13.665 -4.689 1.00 0.00 N ATOM 250 CA LYS A 16 3.324 -14.332 -4.190 1.00 0.00 C ATOM 251 C LYS A 16 2.139 -13.361 -4.183 1.00 0.00 C ATOM 252 O LYS A 16 1.023 -13.749 -4.521 1.00 0.00 O ATOM 253 CB LYS A 16 3.565 -14.997 -2.832 1.00 0.00 C ATOM 254 CG LYS A 16 4.764 -15.950 -2.911 1.00 0.00 C ATOM 255 CD LYS A 16 4.749 -16.928 -1.732 1.00 0.00 C ATOM 256 CE LYS A 16 5.983 -17.836 -1.751 1.00 0.00 C ATOM 257 NZ LYS A 16 6.020 -18.695 -2.948 1.00 0.00 N ATOM 0 H LYS A 16 5.251 -13.512 -3.990 1.00 0.00 H new ATOM 0 HA LYS A 16 3.070 -15.144 -4.871 1.00 0.00 H new ATOM 0 HB2 LYS A 16 3.747 -14.235 -2.074 1.00 0.00 H new ATOM 0 HB3 LYS A 16 2.675 -15.546 -2.525 1.00 0.00 H new ATOM 0 HG2 LYS A 16 4.736 -16.503 -3.850 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.692 -15.378 -2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.718 -16.372 -0.795 1.00 0.00 H new ATOM 0 HD3 LYS A 16 3.846 -17.537 -1.772 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.884 -17.223 -1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.987 -18.460 -0.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 6.782 -19.396 -2.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.109 -19.186 -3.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.195 -18.110 -3.790 1.00 0.00 H new ATOM 271 N VAL A 17 2.396 -12.078 -3.904 1.00 0.00 N ATOM 272 CA VAL A 17 1.375 -11.038 -3.979 1.00 0.00 C ATOM 273 C VAL A 17 0.937 -10.957 -5.447 1.00 0.00 C ATOM 274 O VAL A 17 -0.231 -11.192 -5.753 1.00 0.00 O ATOM 275 CB VAL A 17 1.897 -9.712 -3.390 1.00 0.00 C ATOM 276 CG1 VAL A 17 0.949 -8.523 -3.527 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.439 -9.825 -1.963 1.00 0.00 C ATOM 0 H VAL A 17 3.315 -11.737 -3.621 1.00 0.00 H new ATOM 0 HA VAL A 17 0.501 -11.270 -3.371 1.00 0.00 H new ATOM 0 HB VAL A 17 2.747 -9.494 -4.037 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.407 -7.639 -3.083 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.749 -8.337 -4.582 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.013 -8.743 -3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.785 -8.848 -1.627 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.649 -10.178 -1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.270 -10.530 -1.944 1.00 0.00 H new ATOM 287 N GLU A 18 1.882 -10.690 -6.358 1.00 0.00 N ATOM 288 CA GLU A 18 1.643 -10.583 -7.796 1.00 0.00 C ATOM 289 C GLU A 18 0.813 -11.739 -8.347 1.00 0.00 C ATOM 290 O GLU A 18 -0.089 -11.513 -9.156 1.00 0.00 O ATOM 291 CB GLU A 18 2.954 -10.466 -8.583 1.00 0.00 C ATOM 292 CG GLU A 18 3.636 -9.121 -8.319 1.00 0.00 C ATOM 293 CD GLU A 18 4.970 -9.022 -9.053 1.00 0.00 C ATOM 294 OE1 GLU A 18 5.928 -9.676 -8.587 1.00 0.00 O ATOM 295 OE2 GLU A 18 5.010 -8.286 -10.062 1.00 0.00 O ATOM 0 H GLU A 18 2.858 -10.539 -6.104 1.00 0.00 H new ATOM 0 HA GLU A 18 1.067 -9.667 -7.929 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.624 -11.279 -8.302 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.753 -10.572 -9.649 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.982 -8.310 -8.639 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.798 -8.997 -7.248 1.00 0.00 H new ATOM 302 N ALA A 19 1.171 -12.973 -7.972 1.00 0.00 N ATOM 303 CA ALA A 19 0.451 -14.168 -8.395 1.00 0.00 C ATOM 304 C ALA A 19 -1.065 -13.984 -8.291 1.00 0.00 C ATOM 305 O ALA A 19 -1.799 -14.443 -9.161 1.00 0.00 O ATOM 306 CB ALA A 19 0.930 -15.390 -7.607 1.00 0.00 C ATOM 0 H ALA A 19 1.969 -13.165 -7.367 1.00 0.00 H new ATOM 0 HA ALA A 19 0.673 -14.339 -9.448 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.382 -16.273 -7.936 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.996 -15.539 -7.780 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.754 -15.229 -6.543 1.00 0.00 H new ATOM 312 N ASP A 20 -1.527 -13.243 -7.278 1.00 0.00 N ATOM 313 CA ASP A 20 -2.926 -12.888 -7.134 1.00 0.00 C ATOM 314 C ASP A 20 -3.001 -11.414 -6.728 1.00 0.00 C ATOM 315 O ASP A 20 -3.564 -11.072 -5.683 1.00 0.00 O ATOM 316 CB ASP A 20 -3.614 -13.858 -6.163 1.00 0.00 C ATOM 317 CG ASP A 20 -5.105 -13.565 -5.990 1.00 0.00 C ATOM 318 OD1 ASP A 20 -5.655 -12.807 -6.821 1.00 0.00 O ATOM 319 OD2 ASP A 20 -5.669 -14.100 -5.013 1.00 0.00 O ATOM 0 H ASP A 20 -0.931 -12.875 -6.536 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.474 -12.989 -8.071 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.489 -14.878 -6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.122 -13.802 -5.192 1.00 0.00 H new ATOM 324 N VAL A 21 -2.426 -10.547 -7.574 1.00 0.00 N ATOM 325 CA VAL A 21 -2.344 -9.109 -7.353 1.00 0.00 C ATOM 326 C VAL A 21 -3.717 -8.543 -6.997 1.00 0.00 C ATOM 327 O VAL A 21 -3.870 -7.898 -5.969 1.00 0.00 O ATOM 328 CB VAL A 21 -1.676 -8.399 -8.551 1.00 0.00 C ATOM 329 CG1 VAL A 21 -2.292 -8.716 -9.923 1.00 0.00 C ATOM 330 CG2 VAL A 21 -1.623 -6.884 -8.344 1.00 0.00 C ATOM 0 H VAL A 21 -1.996 -10.841 -8.451 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.699 -8.916 -6.496 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.666 -8.809 -8.574 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -1.754 -8.170 -10.698 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -2.219 -9.786 -10.116 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -3.340 -8.417 -9.929 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.147 -6.416 -9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -2.636 -6.496 -8.234 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.048 -6.659 -7.445 1.00 0.00 H new ATOM 340 N ALA A 22 -4.729 -8.805 -7.823 1.00 0.00 N ATOM 341 CA ALA A 22 -6.086 -8.334 -7.574 1.00 0.00 C ATOM 342 C ALA A 22 -6.623 -8.804 -6.221 1.00 0.00 C ATOM 343 O ALA A 22 -7.241 -8.024 -5.499 1.00 0.00 O ATOM 344 CB ALA A 22 -7.009 -8.787 -8.709 1.00 0.00 C ATOM 0 H ALA A 22 -4.629 -9.348 -8.681 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.059 -7.245 -7.542 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.022 -8.432 -8.518 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.653 -8.376 -9.654 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.010 -9.876 -8.764 1.00 0.00 H new ATOM 350 N GLY A 23 -6.405 -10.077 -5.879 1.00 0.00 N ATOM 351 CA GLY A 23 -6.880 -10.645 -4.627 1.00 0.00 C ATOM 352 C GLY A 23 -6.241 -9.897 -3.469 1.00 0.00 C ATOM 353 O GLY A 23 -6.940 -9.276 -2.668 1.00 0.00 O ATOM 0 H GLY A 23 -5.894 -10.737 -6.466 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.966 -10.572 -4.569 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.629 -11.704 -4.575 1.00 0.00 H new ATOM 357 N HIS A 24 -4.902 -9.841 -3.474 1.00 0.00 N ATOM 358 CA HIS A 24 -4.141 -9.132 -2.452 1.00 0.00 C ATOM 359 C HIS A 24 -4.675 -7.707 -2.371 1.00 0.00 C ATOM 360 O HIS A 24 -5.055 -7.227 -1.317 1.00 0.00 O ATOM 361 CB HIS A 24 -2.631 -9.122 -2.764 1.00 0.00 C ATOM 362 CG HIS A 24 -1.970 -10.457 -2.535 1.00 0.00 C ATOM 363 ND1 HIS A 24 -2.235 -11.609 -3.240 1.00 0.00 N ATOM 364 CD2 HIS A 24 -1.033 -10.756 -1.575 1.00 0.00 C ATOM 365 CE1 HIS A 24 -1.541 -12.608 -2.661 1.00 0.00 C ATOM 366 NE2 HIS A 24 -0.811 -12.143 -1.627 1.00 0.00 N ATOM 0 H HIS A 24 -4.324 -10.286 -4.186 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.261 -9.644 -1.497 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.483 -8.823 -3.802 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.143 -8.371 -2.143 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -2.846 -11.691 -4.053 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.556 -10.056 -0.905 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.566 -13.639 -2.981 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.215 -12.690 -1.005 1.00 0.00 H new ATOM 374 N GLY A 25 -4.726 -7.034 -3.513 1.00 0.00 N ATOM 375 CA GLY A 25 -5.169 -5.660 -3.660 1.00 0.00 C ATOM 376 C GLY A 25 -6.510 -5.432 -2.964 1.00 0.00 C ATOM 377 O GLY A 25 -6.625 -4.569 -2.094 1.00 0.00 O ATOM 0 H GLY A 25 -4.446 -7.453 -4.400 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.420 -4.987 -3.241 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.260 -5.416 -4.718 1.00 0.00 H new ATOM 381 N GLN A 26 -7.510 -6.254 -3.294 1.00 0.00 N ATOM 382 CA GLN A 26 -8.833 -6.111 -2.709 1.00 0.00 C ATOM 383 C GLN A 26 -8.718 -6.370 -1.209 1.00 0.00 C ATOM 384 O GLN A 26 -8.972 -5.474 -0.409 1.00 0.00 O ATOM 385 CB GLN A 26 -9.824 -7.076 -3.377 1.00 0.00 C ATOM 386 CG GLN A 26 -11.266 -6.813 -2.913 1.00 0.00 C ATOM 387 CD GLN A 26 -12.266 -7.789 -3.528 1.00 0.00 C ATOM 388 OE1 GLN A 26 -11.885 -8.801 -4.109 1.00 0.00 O ATOM 389 NE2 GLN A 26 -13.556 -7.496 -3.422 1.00 0.00 N ATOM 0 H GLN A 26 -7.423 -7.021 -3.961 1.00 0.00 H new ATOM 0 HA GLN A 26 -9.216 -5.103 -2.872 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.764 -6.969 -4.460 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.547 -8.104 -3.142 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -11.313 -6.886 -1.826 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.549 -5.794 -3.177 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -13.848 -6.649 -2.934 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -14.255 -8.118 -3.828 1.00 0.00 H new ATOM 398 N ASP A 27 -8.293 -7.585 -0.843 1.00 0.00 N ATOM 399 CA ASP A 27 -8.112 -8.046 0.528 1.00 0.00 C ATOM 400 C ASP A 27 -7.454 -6.978 1.405 1.00 0.00 C ATOM 401 O ASP A 27 -7.967 -6.622 2.458 1.00 0.00 O ATOM 402 CB ASP A 27 -7.303 -9.351 0.507 1.00 0.00 C ATOM 403 CG ASP A 27 -7.042 -9.919 1.896 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.852 -9.653 2.809 1.00 0.00 O ATOM 405 OD2 ASP A 27 -6.026 -10.637 2.017 1.00 0.00 O ATOM 0 H ASP A 27 -8.057 -8.302 -1.529 1.00 0.00 H new ATOM 0 HA ASP A 27 -9.088 -8.238 0.975 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.837 -10.092 -0.087 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.350 -9.172 0.010 1.00 0.00 H new ATOM 410 N ILE A 28 -6.380 -6.363 0.915 1.00 0.00 N ATOM 411 CA ILE A 28 -5.636 -5.350 1.643 1.00 0.00 C ATOM 412 C ILE A 28 -6.516 -4.125 1.902 1.00 0.00 C ATOM 413 O ILE A 28 -6.557 -3.624 3.025 1.00 0.00 O ATOM 414 CB ILE A 28 -4.327 -5.015 0.899 1.00 0.00 C ATOM 415 CG1 ILE A 28 -3.382 -6.226 1.021 1.00 0.00 C ATOM 416 CG2 ILE A 28 -3.644 -3.776 1.490 1.00 0.00 C ATOM 417 CD1 ILE A 28 -2.154 -6.099 0.127 1.00 0.00 C ATOM 0 H ILE A 28 -6.001 -6.560 -0.011 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.349 -5.735 2.622 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.558 -4.800 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -3.063 -6.331 2.058 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.925 -7.135 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.725 -3.570 0.941 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.313 -2.919 1.411 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.407 -3.956 2.539 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.521 -6.978 0.251 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.468 -6.022 -0.914 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.593 -5.206 0.404 1.00 0.00 H new ATOM 429 N LEU A 29 -7.238 -3.635 0.891 1.00 0.00 N ATOM 430 CA LEU A 29 -8.107 -2.507 1.023 1.00 0.00 C ATOM 431 C LEU A 29 -9.261 -2.870 1.957 1.00 0.00 C ATOM 432 O LEU A 29 -9.547 -2.128 2.890 1.00 0.00 O ATOM 433 CB LEU A 29 -8.568 -2.123 -0.382 1.00 0.00 C ATOM 434 CG LEU A 29 -7.543 -1.360 -1.244 1.00 0.00 C ATOM 435 CD1 LEU A 29 -8.201 -0.875 -2.543 1.00 0.00 C ATOM 436 CD2 LEU A 29 -6.947 -0.122 -0.554 1.00 0.00 C ATOM 0 H LEU A 29 -7.221 -4.031 -0.049 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.608 -1.646 1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -8.852 -3.033 -0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.466 -1.511 -0.294 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.739 -2.073 -1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.467 -0.337 -3.144 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.572 -1.732 -3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.031 -0.211 -2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.235 0.360 -1.224 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.746 0.578 -0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.437 -0.425 0.360 1.00 0.00 H new ATOM 448 N ILE A 30 -9.872 -4.050 1.799 1.00 0.00 N ATOM 449 CA ILE A 30 -10.940 -4.515 2.648 1.00 0.00 C ATOM 450 C ILE A 30 -10.449 -4.512 4.099 1.00 0.00 C ATOM 451 O ILE A 30 -11.122 -4.002 4.989 1.00 0.00 O ATOM 452 CB ILE A 30 -11.396 -5.892 2.102 1.00 0.00 C ATOM 453 CG1 ILE A 30 -12.790 -5.736 1.491 1.00 0.00 C ATOM 454 CG2 ILE A 30 -11.287 -7.025 3.112 1.00 0.00 C ATOM 455 CD1 ILE A 30 -13.343 -7.022 0.868 1.00 0.00 C ATOM 0 H ILE A 30 -9.623 -4.709 1.061 1.00 0.00 H new ATOM 0 HA ILE A 30 -11.818 -3.870 2.641 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.704 -6.204 1.320 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.478 -5.393 2.264 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.756 -4.959 0.727 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.625 -7.955 2.654 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.249 -7.132 3.428 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.909 -6.801 3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -14.334 -6.830 0.457 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -12.678 -7.356 0.072 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -13.411 -7.796 1.632 1.00 0.00 H new ATOM 467 N ARG A 31 -9.249 -5.046 4.325 1.00 0.00 N ATOM 468 CA ARG A 31 -8.637 -5.118 5.645 1.00 0.00 C ATOM 469 C ARG A 31 -8.423 -3.723 6.218 1.00 0.00 C ATOM 470 O ARG A 31 -8.840 -3.438 7.339 1.00 0.00 O ATOM 471 CB ARG A 31 -7.311 -5.893 5.583 1.00 0.00 C ATOM 472 CG ARG A 31 -7.534 -7.407 5.701 1.00 0.00 C ATOM 473 CD ARG A 31 -7.312 -7.890 7.144 1.00 0.00 C ATOM 474 NE ARG A 31 -8.064 -7.103 8.136 1.00 0.00 N ATOM 475 CZ ARG A 31 -9.363 -7.250 8.437 1.00 0.00 C ATOM 476 NH1 ARG A 31 -10.109 -8.148 7.787 1.00 0.00 N ATOM 477 NH2 ARG A 31 -9.907 -6.477 9.382 1.00 0.00 N ATOM 0 H ARG A 31 -8.670 -5.445 3.586 1.00 0.00 H new ATOM 0 HA ARG A 31 -9.315 -5.654 6.308 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -6.803 -5.672 4.644 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.655 -5.558 6.387 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -8.547 -7.654 5.384 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -6.853 -7.931 5.030 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -7.606 -8.937 7.220 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -6.249 -7.840 7.379 1.00 0.00 H new ATOM 0 HE ARG A 31 -7.550 -6.380 8.640 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -9.691 -8.726 7.058 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -11.096 -8.255 8.020 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -9.335 -5.784 9.866 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -10.894 -6.580 9.619 1.00 0.00 H new ATOM 491 N LEU A 32 -7.793 -2.845 5.442 1.00 0.00 N ATOM 492 CA LEU A 32 -7.496 -1.477 5.791 1.00 0.00 C ATOM 493 C LEU A 32 -8.788 -0.766 6.222 1.00 0.00 C ATOM 494 O LEU A 32 -8.856 -0.153 7.290 1.00 0.00 O ATOM 495 CB LEU A 32 -6.830 -0.902 4.529 1.00 0.00 C ATOM 496 CG LEU A 32 -6.617 0.600 4.495 1.00 0.00 C ATOM 497 CD1 LEU A 32 -5.572 1.010 5.529 1.00 0.00 C ATOM 498 CD2 LEU A 32 -6.178 1.018 3.087 1.00 0.00 C ATOM 0 H LEU A 32 -7.463 -3.090 4.508 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.827 -1.355 6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.861 -1.386 4.405 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.437 -1.179 3.667 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.551 1.105 4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.429 2.090 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.912 0.721 6.524 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.628 0.512 5.309 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.024 2.097 3.059 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.247 0.512 2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.950 0.743 2.368 1.00 0.00 H new ATOM 510 N PHE A 33 -9.805 -0.828 5.363 1.00 0.00 N ATOM 511 CA PHE A 33 -11.102 -0.227 5.590 1.00 0.00 C ATOM 512 C PHE A 33 -11.798 -0.797 6.823 1.00 0.00 C ATOM 513 O PHE A 33 -12.209 -0.038 7.695 1.00 0.00 O ATOM 514 CB PHE A 33 -11.978 -0.366 4.328 1.00 0.00 C ATOM 515 CG PHE A 33 -11.440 0.218 3.023 1.00 0.00 C ATOM 516 CD1 PHE A 33 -10.290 1.034 2.993 1.00 0.00 C ATOM 517 CD2 PHE A 33 -12.094 -0.089 1.814 1.00 0.00 C ATOM 518 CE1 PHE A 33 -9.782 1.502 1.772 1.00 0.00 C ATOM 519 CE2 PHE A 33 -11.618 0.431 0.596 1.00 0.00 C ATOM 520 CZ PHE A 33 -10.461 1.229 0.575 1.00 0.00 C ATOM 0 H PHE A 33 -9.739 -1.313 4.468 1.00 0.00 H new ATOM 0 HA PHE A 33 -10.948 0.833 5.792 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.169 -1.427 4.167 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -12.940 0.103 4.534 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -9.797 1.300 3.916 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -12.965 -0.727 1.822 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -8.866 2.074 1.753 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -12.142 0.217 -0.324 1.00 0.00 H new ATOM 0 HZ PHE A 33 -10.096 1.630 -0.359 1.00 0.00 H new ATOM 530 N LYS A 34 -11.979 -2.118 6.887 1.00 0.00 N ATOM 531 CA LYS A 34 -12.676 -2.749 8.002 1.00 0.00 C ATOM 532 C LYS A 34 -11.955 -2.488 9.326 1.00 0.00 C ATOM 533 O LYS A 34 -12.602 -2.216 10.334 1.00 0.00 O ATOM 534 CB LYS A 34 -12.846 -4.257 7.756 1.00 0.00 C ATOM 535 CG LYS A 34 -13.786 -4.587 6.581 1.00 0.00 C ATOM 536 CD LYS A 34 -15.262 -4.206 6.791 1.00 0.00 C ATOM 537 CE LYS A 34 -15.926 -4.880 7.998 1.00 0.00 C ATOM 538 NZ LYS A 34 -15.883 -6.349 7.895 1.00 0.00 N ATOM 0 H LYS A 34 -11.650 -2.771 6.175 1.00 0.00 H new ATOM 0 HA LYS A 34 -13.668 -2.302 8.072 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -11.868 -4.698 7.563 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -13.233 -4.723 8.662 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -13.420 -4.077 5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -13.729 -5.657 6.382 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -15.332 -3.125 6.910 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -15.822 -4.464 5.892 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -15.424 -4.565 8.913 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -16.962 -4.551 8.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -16.386 -6.769 8.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -16.339 -6.648 7.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -14.893 -6.668 7.899 1.00 0.00 H new ATOM 552 N SER A 35 -10.625 -2.610 9.342 1.00 0.00 N ATOM 553 CA SER A 35 -9.850 -2.398 10.558 1.00 0.00 C ATOM 554 C SER A 35 -9.857 -0.922 10.963 1.00 0.00 C ATOM 555 O SER A 35 -9.990 -0.606 12.146 1.00 0.00 O ATOM 556 CB SER A 35 -8.418 -2.909 10.378 1.00 0.00 C ATOM 557 OG SER A 35 -8.426 -4.240 9.896 1.00 0.00 O ATOM 0 H SER A 35 -10.066 -2.855 8.524 1.00 0.00 H new ATOM 0 HA SER A 35 -10.317 -2.966 11.363 1.00 0.00 H new ATOM 0 HB2 SER A 35 -7.881 -2.266 9.681 1.00 0.00 H new ATOM 0 HB3 SER A 35 -7.886 -2.863 11.328 1.00 0.00 H new ATOM 0 HG SER A 35 -8.571 -4.236 8.927 1.00 0.00 H new ATOM 563 N HIS A 36 -9.698 -0.013 9.996 1.00 0.00 N ATOM 564 CA HIS A 36 -9.633 1.412 10.266 1.00 0.00 C ATOM 565 C HIS A 36 -10.651 2.159 9.396 1.00 0.00 C ATOM 566 O HIS A 36 -10.257 2.682 8.359 1.00 0.00 O ATOM 567 CB HIS A 36 -8.199 1.893 9.978 1.00 0.00 C ATOM 568 CG HIS A 36 -7.130 1.157 10.744 1.00 0.00 C ATOM 569 ND1 HIS A 36 -6.716 1.419 12.036 1.00 0.00 N ATOM 570 CD2 HIS A 36 -6.434 0.073 10.289 1.00 0.00 C ATOM 571 CE1 HIS A 36 -5.800 0.490 12.368 1.00 0.00 C ATOM 572 NE2 HIS A 36 -5.613 -0.335 11.320 1.00 0.00 N ATOM 0 H HIS A 36 -9.612 -0.252 9.008 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.880 1.614 11.308 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -8.001 1.789 8.911 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -8.131 2.955 10.213 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -6.512 -0.378 9.311 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -5.296 0.418 13.321 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -4.972 -1.128 11.293 1.00 0.00 H new ATOM 581 N PRO A 37 -11.939 2.238 9.765 1.00 0.00 N ATOM 582 CA PRO A 37 -12.968 2.918 8.975 1.00 0.00 C ATOM 583 C PRO A 37 -12.556 4.297 8.438 1.00 0.00 C ATOM 584 O PRO A 37 -12.921 4.686 7.325 1.00 0.00 O ATOM 585 CB PRO A 37 -14.185 3.001 9.900 1.00 0.00 C ATOM 586 CG PRO A 37 -14.033 1.745 10.761 1.00 0.00 C ATOM 587 CD PRO A 37 -12.519 1.643 10.958 1.00 0.00 C ATOM 0 HA PRO A 37 -13.170 2.357 8.062 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -14.176 3.909 10.502 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -15.121 2.999 9.341 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -14.558 1.841 11.711 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -14.435 0.863 10.263 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.202 2.173 11.856 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -12.206 0.605 11.073 1.00 0.00 H new ATOM 595 N GLU A 38 -11.833 5.064 9.254 1.00 0.00 N ATOM 596 CA GLU A 38 -11.326 6.370 8.887 1.00 0.00 C ATOM 597 C GLU A 38 -10.507 6.374 7.586 1.00 0.00 C ATOM 598 O GLU A 38 -10.377 7.424 6.956 1.00 0.00 O ATOM 599 CB GLU A 38 -10.612 7.012 10.085 1.00 0.00 C ATOM 600 CG GLU A 38 -9.266 6.372 10.486 1.00 0.00 C ATOM 601 CD GLU A 38 -9.353 5.159 11.414 1.00 0.00 C ATOM 602 OE1 GLU A 38 -10.451 4.571 11.525 1.00 0.00 O ATOM 603 OE2 GLU A 38 -8.296 4.823 11.991 1.00 0.00 O ATOM 0 H GLU A 38 -11.584 4.783 10.202 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.178 7.003 8.640 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.440 8.064 9.860 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.281 6.975 10.945 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.743 6.073 9.578 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.654 7.133 10.971 1.00 0.00 H new ATOM 610 N THR A 39 -9.963 5.226 7.171 1.00 0.00 N ATOM 611 CA THR A 39 -9.230 5.110 5.919 1.00 0.00 C ATOM 612 C THR A 39 -10.198 5.141 4.736 1.00 0.00 C ATOM 613 O THR A 39 -9.883 5.684 3.677 1.00 0.00 O ATOM 614 CB THR A 39 -8.398 3.814 5.883 1.00 0.00 C ATOM 615 OG1 THR A 39 -9.207 2.665 5.924 1.00 0.00 O ATOM 616 CG2 THR A 39 -7.359 3.768 7.005 1.00 0.00 C ATOM 0 H THR A 39 -10.022 4.354 7.698 1.00 0.00 H new ATOM 0 HA THR A 39 -8.548 5.957 5.847 1.00 0.00 H new ATOM 0 HB THR A 39 -7.869 3.821 4.930 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.546 2.536 6.834 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.796 2.837 6.941 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.677 4.612 6.904 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.863 3.822 7.970 1.00 0.00 H new ATOM 624 N LEU A 40 -11.351 4.492 4.901 1.00 0.00 N ATOM 625 CA LEU A 40 -12.370 4.382 3.878 1.00 0.00 C ATOM 626 C LEU A 40 -13.039 5.724 3.672 1.00 0.00 C ATOM 627 O LEU A 40 -13.280 6.112 2.530 1.00 0.00 O ATOM 628 CB LEU A 40 -13.306 3.213 4.223 1.00 0.00 C ATOM 629 CG LEU A 40 -14.427 2.850 3.233 1.00 0.00 C ATOM 630 CD1 LEU A 40 -15.713 3.627 3.525 1.00 0.00 C ATOM 631 CD2 LEU A 40 -14.026 2.986 1.762 1.00 0.00 C ATOM 0 H LEU A 40 -11.600 4.021 5.771 1.00 0.00 H new ATOM 0 HA LEU A 40 -11.945 4.135 2.905 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.689 2.326 4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -13.771 3.434 5.184 1.00 0.00 H new ATOM 0 HG LEU A 40 -14.618 1.789 3.395 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -16.481 3.343 2.805 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -16.057 3.395 4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -15.518 4.696 3.445 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -14.870 2.712 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.738 4.017 1.557 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.185 2.325 1.552 1.00 0.00 H new ATOM 643 N GLU A 41 -13.274 6.458 4.761 1.00 0.00 N ATOM 644 CA GLU A 41 -13.828 7.802 4.674 1.00 0.00 C ATOM 645 C GLU A 41 -13.058 8.625 3.624 1.00 0.00 C ATOM 646 O GLU A 41 -13.660 9.313 2.804 1.00 0.00 O ATOM 647 CB GLU A 41 -13.802 8.476 6.052 1.00 0.00 C ATOM 648 CG GLU A 41 -14.752 7.769 7.033 1.00 0.00 C ATOM 649 CD GLU A 41 -14.720 8.399 8.423 1.00 0.00 C ATOM 650 OE1 GLU A 41 -14.798 9.645 8.485 1.00 0.00 O ATOM 651 OE2 GLU A 41 -14.621 7.624 9.399 1.00 0.00 O ATOM 0 H GLU A 41 -13.088 6.140 5.712 1.00 0.00 H new ATOM 0 HA GLU A 41 -14.868 7.743 4.354 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.787 8.460 6.449 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.089 9.523 5.954 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -15.769 7.807 6.642 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -14.478 6.717 7.107 1.00 0.00 H new ATOM 658 N LYS A 42 -11.732 8.448 3.522 1.00 0.00 N ATOM 659 CA LYS A 42 -10.973 9.252 2.570 1.00 0.00 C ATOM 660 C LYS A 42 -11.287 8.932 1.098 1.00 0.00 C ATOM 661 O LYS A 42 -11.199 9.825 0.262 1.00 0.00 O ATOM 662 CB LYS A 42 -9.476 9.265 2.910 1.00 0.00 C ATOM 663 CG LYS A 42 -9.288 10.152 4.151 1.00 0.00 C ATOM 664 CD LYS A 42 -7.835 10.590 4.341 1.00 0.00 C ATOM 665 CE LYS A 42 -7.729 11.364 5.660 1.00 0.00 C ATOM 666 NZ LYS A 42 -6.330 11.675 5.983 1.00 0.00 N ATOM 0 H LYS A 42 -11.186 7.781 4.067 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.317 10.280 2.683 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.119 8.254 3.105 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.896 9.652 2.072 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -9.922 11.034 4.063 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -9.619 9.609 5.036 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -7.177 9.721 4.357 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -7.516 11.216 3.508 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.303 12.288 5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.169 10.776 6.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -6.280 12.108 6.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.769 10.800 5.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.950 12.338 5.278 1.00 0.00 H new ATOM 680 N PHE A 43 -11.823 7.743 0.791 1.00 0.00 N ATOM 681 CA PHE A 43 -12.294 7.403 -0.557 1.00 0.00 C ATOM 682 C PHE A 43 -13.779 7.768 -0.666 1.00 0.00 C ATOM 683 O PHE A 43 -14.497 7.120 -1.429 1.00 0.00 O ATOM 684 CB PHE A 43 -12.142 5.888 -0.845 1.00 0.00 C ATOM 685 CG PHE A 43 -10.762 5.267 -0.731 1.00 0.00 C ATOM 686 CD1 PHE A 43 -10.232 4.996 0.539 1.00 0.00 C ATOM 687 CD2 PHE A 43 -10.006 4.946 -1.876 1.00 0.00 C ATOM 688 CE1 PHE A 43 -8.928 4.500 0.671 1.00 0.00 C ATOM 689 CE2 PHE A 43 -8.717 4.409 -1.743 1.00 0.00 C ATOM 690 CZ PHE A 43 -8.183 4.159 -0.469 1.00 0.00 C ATOM 0 H PHE A 43 -11.942 6.991 1.470 1.00 0.00 H new ATOM 0 HA PHE A 43 -11.694 7.957 -1.279 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -12.804 5.353 -0.165 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.507 5.704 -1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -10.832 5.171 1.420 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.420 5.114 -2.859 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -8.495 4.380 1.653 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.133 4.187 -2.624 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.207 3.708 -0.367 1.00 0.00 H new ATOM 700 N ASP A 44 -14.276 8.690 0.174 1.00 0.00 N ATOM 701 CA ASP A 44 -15.680 9.060 0.352 1.00 0.00 C ATOM 702 C ASP A 44 -16.396 7.857 0.992 1.00 0.00 C ATOM 703 O ASP A 44 -16.714 7.850 2.178 1.00 0.00 O ATOM 704 CB ASP A 44 -16.272 9.567 -0.973 1.00 0.00 C ATOM 705 CG ASP A 44 -17.766 9.283 -1.094 1.00 0.00 C ATOM 706 OD1 ASP A 44 -18.539 10.017 -0.444 1.00 0.00 O ATOM 707 OD2 ASP A 44 -18.101 8.326 -1.827 1.00 0.00 O ATOM 0 H ASP A 44 -13.663 9.230 0.785 1.00 0.00 H new ATOM 0 HA ASP A 44 -15.811 9.903 1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -16.102 10.640 -1.056 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -15.748 9.096 -1.805 1.00 0.00 H new ATOM 712 N ARG A 45 -16.538 6.786 0.219 1.00 0.00 N ATOM 713 CA ARG A 45 -17.104 5.512 0.622 1.00 0.00 C ATOM 714 C ARG A 45 -16.680 4.477 -0.431 1.00 0.00 C ATOM 715 O ARG A 45 -17.486 3.628 -0.820 1.00 0.00 O ATOM 716 CB ARG A 45 -18.631 5.672 0.653 1.00 0.00 C ATOM 717 CG ARG A 45 -19.293 4.628 1.562 1.00 0.00 C ATOM 718 CD ARG A 45 -20.678 4.194 1.072 1.00 0.00 C ATOM 719 NE ARG A 45 -21.536 5.328 0.686 1.00 0.00 N ATOM 720 CZ ARG A 45 -21.764 5.753 -0.568 1.00 0.00 C ATOM 721 NH1 ARG A 45 -21.151 5.179 -1.609 1.00 0.00 N ATOM 722 NH2 ARG A 45 -22.603 6.770 -0.779 1.00 0.00 N ATOM 0 H ARG A 45 -16.244 6.788 -0.758 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.762 5.190 1.606 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -18.885 6.673 1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -19.027 5.578 -0.358 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -18.647 3.752 1.629 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -19.382 5.036 2.569 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -20.562 3.527 0.218 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -21.172 3.623 1.858 1.00 0.00 H new ATOM 0 HE ARG A 45 -21.999 5.837 1.439 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -20.501 4.408 -1.456 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -21.334 5.512 -2.556 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -23.067 7.220 0.010 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -22.780 7.097 -1.729 1.00 0.00 H new ATOM 736 N PHE A 46 -15.468 4.665 -0.989 1.00 0.00 N ATOM 737 CA PHE A 46 -14.973 3.979 -2.180 1.00 0.00 C ATOM 738 C PHE A 46 -16.131 3.969 -3.152 1.00 0.00 C ATOM 739 O PHE A 46 -16.531 2.928 -3.632 1.00 0.00 O ATOM 740 CB PHE A 46 -14.219 2.682 -1.862 1.00 0.00 C ATOM 741 CG PHE A 46 -13.452 2.074 -3.025 1.00 0.00 C ATOM 742 CD1 PHE A 46 -14.121 1.331 -4.010 1.00 0.00 C ATOM 743 CD2 PHE A 46 -12.108 2.429 -3.227 1.00 0.00 C ATOM 744 CE1 PHE A 46 -13.527 1.132 -5.267 1.00 0.00 C ATOM 745 CE2 PHE A 46 -11.477 2.155 -4.453 1.00 0.00 C ATOM 746 CZ PHE A 46 -12.211 1.558 -5.492 1.00 0.00 C ATOM 0 H PHE A 46 -14.790 5.323 -0.604 1.00 0.00 H new ATOM 0 HA PHE A 46 -14.154 4.490 -2.687 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.519 2.878 -1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -14.934 1.946 -1.496 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.094 0.912 -3.801 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.556 2.915 -2.436 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.083 0.652 -6.058 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -10.435 2.402 -4.595 1.00 0.00 H new ATOM 0 HZ PHE A 46 -11.761 1.427 -6.465 1.00 0.00 H new ATOM 756 N LYS A 47 -16.694 5.172 -3.348 1.00 0.00 N ATOM 757 CA LYS A 47 -17.803 5.554 -4.212 1.00 0.00 C ATOM 758 C LYS A 47 -19.148 4.809 -4.016 1.00 0.00 C ATOM 759 O LYS A 47 -20.206 5.413 -4.193 1.00 0.00 O ATOM 760 CB LYS A 47 -17.286 5.542 -5.661 1.00 0.00 C ATOM 761 CG LYS A 47 -16.174 6.586 -5.875 1.00 0.00 C ATOM 762 CD LYS A 47 -15.380 6.377 -7.177 1.00 0.00 C ATOM 763 CE LYS A 47 -14.598 5.054 -7.262 1.00 0.00 C ATOM 764 NZ LYS A 47 -13.726 4.835 -6.093 1.00 0.00 N ATOM 0 H LYS A 47 -16.337 5.985 -2.845 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.110 6.557 -3.915 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.906 4.550 -5.904 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -18.111 5.743 -6.344 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -16.618 7.581 -5.885 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -15.487 6.552 -5.030 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -16.072 6.426 -8.018 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -14.679 7.203 -7.293 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -15.301 4.225 -7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -13.992 5.052 -8.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.197 3.948 -6.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -13.058 5.627 -6.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.307 4.775 -5.233 1.00 0.00 H new ATOM 778 N HIS A 48 -19.154 3.517 -3.672 1.00 0.00 N ATOM 779 CA HIS A 48 -20.327 2.649 -3.636 1.00 0.00 C ATOM 780 C HIS A 48 -20.239 1.556 -2.555 1.00 0.00 C ATOM 781 O HIS A 48 -21.122 0.698 -2.502 1.00 0.00 O ATOM 782 CB HIS A 48 -20.472 2.028 -5.049 1.00 0.00 C ATOM 783 CG HIS A 48 -19.164 1.517 -5.620 1.00 0.00 C ATOM 784 ND1 HIS A 48 -18.155 2.350 -6.056 1.00 0.00 N ATOM 785 CD2 HIS A 48 -18.599 0.305 -5.343 1.00 0.00 C ATOM 786 CE1 HIS A 48 -16.983 1.701 -5.967 1.00 0.00 C ATOM 787 NE2 HIS A 48 -17.241 0.436 -5.574 1.00 0.00 N ATOM 0 H HIS A 48 -18.301 3.029 -3.399 1.00 0.00 H new ATOM 0 HA HIS A 48 -21.204 3.239 -3.368 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -21.186 1.206 -5.005 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -20.888 2.775 -5.725 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -19.113 -0.584 -5.008 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -16.008 2.117 -6.173 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -16.547 -0.304 -5.465 1.00 0.00 H new ATOM 796 N LEU A 49 -19.238 1.565 -1.662 1.00 0.00 N ATOM 797 CA LEU A 49 -19.125 0.510 -0.654 1.00 0.00 C ATOM 798 C LEU A 49 -20.105 0.695 0.497 1.00 0.00 C ATOM 799 O LEU A 49 -19.732 1.145 1.577 1.00 0.00 O ATOM 800 CB LEU A 49 -17.684 0.331 -0.151 1.00 0.00 C ATOM 801 CG LEU A 49 -16.726 -0.078 -1.275 1.00 0.00 C ATOM 802 CD1 LEU A 49 -15.346 -0.413 -0.691 1.00 0.00 C ATOM 803 CD2 LEU A 49 -17.221 -1.295 -2.054 1.00 0.00 C ATOM 0 H LEU A 49 -18.510 2.278 -1.619 1.00 0.00 H new ATOM 0 HA LEU A 49 -19.402 -0.416 -1.157 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -17.339 1.263 0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -17.666 -0.426 0.633 1.00 0.00 H new ATOM 0 HG LEU A 49 -16.669 0.769 -1.959 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -14.671 -0.703 -1.496 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -14.946 0.462 -0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -15.441 -1.236 0.017 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -16.505 -1.541 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -17.324 -2.143 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -18.188 -1.070 -2.504 1.00 0.00 H new ATOM 815 N LYS A 50 -21.363 0.315 0.266 1.00 0.00 N ATOM 816 CA LYS A 50 -22.390 0.377 1.291 1.00 0.00 C ATOM 817 C LYS A 50 -22.106 -0.658 2.386 1.00 0.00 C ATOM 818 O LYS A 50 -22.010 -0.298 3.556 1.00 0.00 O ATOM 819 CB LYS A 50 -23.787 0.212 0.676 1.00 0.00 C ATOM 820 CG LYS A 50 -24.105 1.217 -0.442 1.00 0.00 C ATOM 821 CD LYS A 50 -23.911 2.706 -0.108 1.00 0.00 C ATOM 822 CE LYS A 50 -24.854 3.256 0.973 1.00 0.00 C ATOM 823 NZ LYS A 50 -24.403 2.946 2.341 1.00 0.00 N ATOM 0 H LYS A 50 -21.690 -0.041 -0.632 1.00 0.00 H new ATOM 0 HA LYS A 50 -22.369 1.361 1.759 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -23.880 -0.799 0.278 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -24.533 0.314 1.464 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -23.481 0.977 -1.303 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -25.141 1.069 -0.748 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -22.882 2.859 0.217 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -24.048 3.288 -1.019 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -24.937 4.337 0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -25.851 2.842 0.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -24.855 3.599 3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -24.665 1.968 2.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -23.370 3.051 2.398 1.00 0.00 H new ATOM 837 N THR A 51 -21.954 -1.936 2.022 1.00 0.00 N ATOM 838 CA THR A 51 -21.678 -3.001 2.976 1.00 0.00 C ATOM 839 C THR A 51 -20.830 -4.115 2.345 1.00 0.00 C ATOM 840 O THR A 51 -20.348 -4.003 1.212 1.00 0.00 O ATOM 841 CB THR A 51 -22.992 -3.480 3.627 1.00 0.00 C ATOM 842 OG1 THR A 51 -22.734 -4.433 4.642 1.00 0.00 O ATOM 843 CG2 THR A 51 -23.989 -4.070 2.624 1.00 0.00 C ATOM 0 H THR A 51 -22.020 -2.255 1.055 1.00 0.00 H new ATOM 0 HA THR A 51 -21.061 -2.617 3.788 1.00 0.00 H new ATOM 0 HB THR A 51 -23.449 -2.588 4.056 1.00 0.00 H new ATOM 0 HG1 THR A 51 -23.581 -4.722 5.042 1.00 0.00 H new ATOM 0 HG21 THR A 51 -24.890 -4.386 3.150 1.00 0.00 H new ATOM 0 HG22 THR A 51 -24.248 -3.315 1.882 1.00 0.00 H new ATOM 0 HG23 THR A 51 -23.539 -4.929 2.126 1.00 0.00 H new ATOM 851 N GLU A 52 -20.620 -5.176 3.129 1.00 0.00 N ATOM 852 CA GLU A 52 -19.814 -6.350 2.820 1.00 0.00 C ATOM 853 C GLU A 52 -20.027 -6.822 1.381 1.00 0.00 C ATOM 854 O GLU A 52 -19.067 -7.058 0.653 1.00 0.00 O ATOM 855 CB GLU A 52 -20.122 -7.476 3.822 1.00 0.00 C ATOM 856 CG GLU A 52 -19.935 -7.070 5.293 1.00 0.00 C ATOM 857 CD GLU A 52 -18.536 -6.537 5.585 1.00 0.00 C ATOM 858 OE1 GLU A 52 -17.598 -7.364 5.582 1.00 0.00 O ATOM 859 OE2 GLU A 52 -18.429 -5.313 5.808 1.00 0.00 O ATOM 0 H GLU A 52 -21.038 -5.237 4.057 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.764 -6.074 2.911 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -21.150 -7.809 3.675 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -19.477 -8.328 3.606 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -20.670 -6.308 5.551 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -20.131 -7.932 5.931 1.00 0.00 H new ATOM 866 N ALA A 53 -21.291 -6.937 0.967 1.00 0.00 N ATOM 867 CA ALA A 53 -21.657 -7.374 -0.375 1.00 0.00 C ATOM 868 C ALA A 53 -20.917 -6.567 -1.444 1.00 0.00 C ATOM 869 O ALA A 53 -20.282 -7.134 -2.333 1.00 0.00 O ATOM 870 CB ALA A 53 -23.173 -7.245 -0.560 1.00 0.00 C ATOM 0 H ALA A 53 -22.093 -6.727 1.561 1.00 0.00 H new ATOM 0 HA ALA A 53 -21.365 -8.418 -0.491 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -23.446 -7.572 -1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -23.684 -7.867 0.176 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -23.469 -6.205 -0.424 1.00 0.00 H new ATOM 876 N GLU A 54 -20.953 -5.234 -1.336 1.00 0.00 N ATOM 877 CA GLU A 54 -20.299 -4.374 -2.305 1.00 0.00 C ATOM 878 C GLU A 54 -18.800 -4.558 -2.141 1.00 0.00 C ATOM 879 O GLU A 54 -18.095 -4.754 -3.124 1.00 0.00 O ATOM 880 CB GLU A 54 -20.702 -2.898 -2.135 1.00 0.00 C ATOM 881 CG GLU A 54 -22.181 -2.652 -2.485 1.00 0.00 C ATOM 882 CD GLU A 54 -23.149 -3.264 -1.477 1.00 0.00 C ATOM 883 OE1 GLU A 54 -22.800 -3.247 -0.277 1.00 0.00 O ATOM 884 OE2 GLU A 54 -24.210 -3.750 -1.921 1.00 0.00 O ATOM 0 H GLU A 54 -21.430 -4.736 -0.585 1.00 0.00 H new ATOM 0 HA GLU A 54 -20.611 -4.652 -3.312 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -20.518 -2.590 -1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -20.072 -2.276 -2.771 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -22.360 -1.578 -2.544 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -22.387 -3.064 -3.473 1.00 0.00 H new ATOM 891 N MET A 55 -18.313 -4.563 -0.895 1.00 0.00 N ATOM 892 CA MET A 55 -16.884 -4.669 -0.619 1.00 0.00 C ATOM 893 C MET A 55 -16.294 -5.889 -1.341 1.00 0.00 C ATOM 894 O MET A 55 -15.324 -5.782 -2.091 1.00 0.00 O ATOM 895 CB MET A 55 -16.639 -4.665 0.899 1.00 0.00 C ATOM 896 CG MET A 55 -17.089 -3.334 1.527 1.00 0.00 C ATOM 897 SD MET A 55 -17.434 -3.361 3.301 1.00 0.00 S ATOM 898 CE MET A 55 -18.095 -1.690 3.496 1.00 0.00 C ATOM 0 H MET A 55 -18.895 -4.494 -0.060 1.00 0.00 H new ATOM 0 HA MET A 55 -16.358 -3.800 -1.015 1.00 0.00 H new ATOM 0 HB2 MET A 55 -17.181 -5.491 1.361 1.00 0.00 H new ATOM 0 HB3 MET A 55 -15.580 -4.827 1.100 1.00 0.00 H new ATOM 0 HG2 MET A 55 -16.316 -2.589 1.340 1.00 0.00 H new ATOM 0 HG3 MET A 55 -17.987 -2.998 1.009 1.00 0.00 H new ATOM 0 HE1 MET A 55 -18.365 -1.525 4.539 1.00 0.00 H new ATOM 0 HE2 MET A 55 -17.340 -0.963 3.197 1.00 0.00 H new ATOM 0 HE3 MET A 55 -18.979 -1.573 2.869 1.00 0.00 H new ATOM 908 N LYS A 56 -16.996 -7.020 -1.254 1.00 0.00 N ATOM 909 CA LYS A 56 -16.593 -8.267 -1.879 1.00 0.00 C ATOM 910 C LYS A 56 -16.781 -8.229 -3.403 1.00 0.00 C ATOM 911 O LYS A 56 -15.920 -8.712 -4.137 1.00 0.00 O ATOM 912 CB LYS A 56 -17.394 -9.421 -1.259 1.00 0.00 C ATOM 913 CG LYS A 56 -17.004 -9.615 0.214 1.00 0.00 C ATOM 914 CD LYS A 56 -17.911 -10.650 0.888 1.00 0.00 C ATOM 915 CE LYS A 56 -17.584 -10.789 2.382 1.00 0.00 C ATOM 916 NZ LYS A 56 -16.226 -11.314 2.605 1.00 0.00 N ATOM 0 H LYS A 56 -17.873 -7.090 -0.738 1.00 0.00 H new ATOM 0 HA LYS A 56 -15.529 -8.419 -1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -18.461 -9.213 -1.334 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -17.209 -10.340 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.965 -9.938 0.280 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.076 -8.664 0.742 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -18.954 -10.356 0.767 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -17.793 -11.616 0.396 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -17.680 -9.817 2.866 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -18.310 -11.452 2.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.095 -11.520 3.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.097 -12.187 2.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -15.526 -10.607 2.302 1.00 0.00 H new ATOM 930 N ALA A 57 -17.915 -7.708 -3.888 1.00 0.00 N ATOM 931 CA ALA A 57 -18.233 -7.714 -5.315 1.00 0.00 C ATOM 932 C ALA A 57 -17.649 -6.548 -6.125 1.00 0.00 C ATOM 933 O ALA A 57 -17.842 -6.504 -7.338 1.00 0.00 O ATOM 934 CB ALA A 57 -19.756 -7.762 -5.478 1.00 0.00 C ATOM 0 H ALA A 57 -18.631 -7.274 -3.305 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.754 -8.601 -5.729 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -20.008 -7.767 -6.538 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -20.144 -8.666 -5.008 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -20.200 -6.887 -5.003 1.00 0.00 H new ATOM 940 N SER A 58 -17.050 -5.542 -5.485 1.00 0.00 N ATOM 941 CA SER A 58 -16.533 -4.386 -6.202 1.00 0.00 C ATOM 942 C SER A 58 -15.316 -4.680 -7.077 1.00 0.00 C ATOM 943 O SER A 58 -14.176 -4.620 -6.621 1.00 0.00 O ATOM 944 CB SER A 58 -16.240 -3.234 -5.243 1.00 0.00 C ATOM 945 OG SER A 58 -17.453 -2.695 -4.773 1.00 0.00 O ATOM 0 H SER A 58 -16.914 -5.509 -4.475 1.00 0.00 H new ATOM 0 HA SER A 58 -17.327 -4.094 -6.889 1.00 0.00 H new ATOM 0 HB2 SER A 58 -15.638 -3.588 -4.406 1.00 0.00 H new ATOM 0 HB3 SER A 58 -15.659 -2.463 -5.750 1.00 0.00 H new ATOM 0 HG SER A 58 -17.909 -3.356 -4.211 1.00 0.00 H new ATOM 951 N GLU A 59 -15.555 -4.931 -8.363 1.00 0.00 N ATOM 952 CA GLU A 59 -14.505 -5.102 -9.349 1.00 0.00 C ATOM 953 C GLU A 59 -13.623 -3.853 -9.383 1.00 0.00 C ATOM 954 O GLU A 59 -12.410 -3.951 -9.527 1.00 0.00 O ATOM 955 CB GLU A 59 -15.093 -5.423 -10.730 1.00 0.00 C ATOM 956 CG GLU A 59 -16.109 -6.581 -10.711 1.00 0.00 C ATOM 957 CD GLU A 59 -17.559 -6.143 -10.486 1.00 0.00 C ATOM 958 OE1 GLU A 59 -17.756 -5.003 -10.005 1.00 0.00 O ATOM 959 OE2 GLU A 59 -18.448 -6.956 -10.816 1.00 0.00 O ATOM 0 H GLU A 59 -16.495 -5.021 -8.748 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.884 -5.952 -9.065 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -15.578 -4.531 -11.126 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.281 -5.674 -11.413 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -16.047 -7.119 -11.657 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -15.828 -7.283 -9.926 1.00 0.00 H new ATOM 966 N ASP A 60 -14.228 -2.678 -9.190 1.00 0.00 N ATOM 967 CA ASP A 60 -13.503 -1.418 -9.127 1.00 0.00 C ATOM 968 C ASP A 60 -12.562 -1.410 -7.920 1.00 0.00 C ATOM 969 O ASP A 60 -11.449 -0.898 -8.003 1.00 0.00 O ATOM 970 CB ASP A 60 -14.488 -0.245 -9.076 1.00 0.00 C ATOM 971 CG ASP A 60 -13.770 1.104 -9.087 1.00 0.00 C ATOM 972 OD1 ASP A 60 -12.869 1.270 -9.937 1.00 0.00 O ATOM 973 OD2 ASP A 60 -14.148 1.947 -8.247 1.00 0.00 O ATOM 0 H ASP A 60 -15.237 -2.579 -9.073 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.896 -1.308 -10.026 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.165 -0.303 -9.928 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.099 -0.323 -8.177 1.00 0.00 H new ATOM 978 N LEU A 61 -12.988 -2.000 -6.796 1.00 0.00 N ATOM 979 CA LEU A 61 -12.123 -2.105 -5.623 1.00 0.00 C ATOM 980 C LEU A 61 -10.949 -3.000 -5.997 1.00 0.00 C ATOM 981 O LEU A 61 -9.800 -2.615 -5.799 1.00 0.00 O ATOM 982 CB LEU A 61 -12.881 -2.612 -4.388 1.00 0.00 C ATOM 983 CG LEU A 61 -12.020 -2.707 -3.120 1.00 0.00 C ATOM 984 CD1 LEU A 61 -11.598 -1.322 -2.639 1.00 0.00 C ATOM 985 CD2 LEU A 61 -12.834 -3.380 -2.008 1.00 0.00 C ATOM 0 H LEU A 61 -13.916 -2.406 -6.678 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.756 -1.119 -5.339 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.723 -1.948 -4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.295 -3.596 -4.608 1.00 0.00 H new ATOM 0 HG LEU A 61 -11.128 -3.288 -3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -10.989 -1.419 -1.740 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -11.018 -0.827 -3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -12.485 -0.729 -2.415 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.228 -3.450 -1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -13.726 -2.789 -1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -13.128 -4.380 -2.327 1.00 0.00 H new ATOM 997 N LYS A 62 -11.224 -4.112 -6.696 1.00 0.00 N ATOM 998 CA LYS A 62 -10.147 -5.002 -7.118 1.00 0.00 C ATOM 999 C LYS A 62 -9.164 -4.228 -8.005 1.00 0.00 C ATOM 1000 O LYS A 62 -7.961 -4.209 -7.750 1.00 0.00 O ATOM 1001 CB LYS A 62 -10.679 -6.254 -7.835 1.00 0.00 C ATOM 1002 CG LYS A 62 -11.712 -7.013 -6.994 1.00 0.00 C ATOM 1003 CD LYS A 62 -12.076 -8.401 -7.545 1.00 0.00 C ATOM 1004 CE LYS A 62 -10.902 -9.389 -7.591 1.00 0.00 C ATOM 1005 NZ LYS A 62 -10.150 -9.414 -6.323 1.00 0.00 N ATOM 0 H LYS A 62 -12.161 -4.406 -6.972 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.626 -5.356 -6.229 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -11.130 -5.962 -8.784 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.846 -6.917 -8.069 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.326 -7.126 -5.981 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -12.619 -6.413 -6.925 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -12.870 -8.826 -6.931 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -12.478 -8.286 -8.551 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.278 -10.389 -7.809 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.231 -9.116 -8.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -9.741 -10.359 -6.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -9.387 -8.708 -6.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -10.791 -9.192 -5.535 1.00 0.00 H new ATOM 1019 N LYS A 63 -9.692 -3.533 -9.018 1.00 0.00 N ATOM 1020 CA LYS A 63 -8.925 -2.696 -9.929 1.00 0.00 C ATOM 1021 C LYS A 63 -8.084 -1.686 -9.148 1.00 0.00 C ATOM 1022 O LYS A 63 -6.944 -1.397 -9.534 1.00 0.00 O ATOM 1023 CB LYS A 63 -9.878 -2.020 -10.929 1.00 0.00 C ATOM 1024 CG LYS A 63 -9.173 -1.141 -11.973 1.00 0.00 C ATOM 1025 CD LYS A 63 -9.108 0.336 -11.541 1.00 0.00 C ATOM 1026 CE LYS A 63 -8.445 1.220 -12.606 1.00 0.00 C ATOM 1027 NZ LYS A 63 -7.020 0.892 -12.801 1.00 0.00 N ATOM 0 H LYS A 63 -10.690 -3.541 -9.227 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.227 -3.310 -10.498 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -10.451 -2.790 -11.446 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.592 -1.408 -10.377 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.162 -1.515 -12.137 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -9.699 -1.217 -12.924 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -10.116 0.700 -11.344 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -8.552 0.416 -10.607 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.974 1.104 -13.552 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.538 2.266 -12.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -6.575 1.618 -13.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.541 0.862 -11.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.937 -0.036 -13.264 1.00 0.00 H new ATOM 1041 N HIS A 64 -8.652 -1.067 -8.105 1.00 0.00 N ATOM 1042 CA HIS A 64 -7.837 -0.166 -7.320 1.00 0.00 C ATOM 1043 C HIS A 64 -6.712 -0.924 -6.666 1.00 0.00 C ATOM 1044 O HIS A 64 -5.565 -0.527 -6.796 1.00 0.00 O ATOM 1045 CB HIS A 64 -8.583 0.593 -6.224 1.00 0.00 C ATOM 1046 CG HIS A 64 -7.989 1.957 -6.046 1.00 0.00 C ATOM 1047 ND1 HIS A 64 -7.534 2.760 -7.064 1.00 0.00 N ATOM 1048 CD2 HIS A 64 -7.661 2.553 -4.860 1.00 0.00 C ATOM 1049 CE1 HIS A 64 -6.905 3.799 -6.508 1.00 0.00 C ATOM 1050 NE2 HIS A 64 -6.978 3.735 -5.168 1.00 0.00 N ATOM 0 H HIS A 64 -9.621 -1.171 -7.805 1.00 0.00 H new ATOM 0 HA HIS A 64 -7.479 0.574 -8.036 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -9.638 0.679 -6.484 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -8.529 0.039 -5.287 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -7.887 2.181 -3.871 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -6.407 4.582 -7.060 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -6.608 4.415 -4.504 1.00 0.00 H new ATOM 1058 N GLY A 65 -7.047 -2.015 -5.985 1.00 0.00 N ATOM 1059 CA GLY A 65 -6.083 -2.861 -5.320 1.00 0.00 C ATOM 1060 C GLY A 65 -4.935 -3.180 -6.283 1.00 0.00 C ATOM 1061 O GLY A 65 -3.769 -3.070 -5.910 1.00 0.00 O ATOM 0 H GLY A 65 -8.010 -2.334 -5.883 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.698 -2.363 -4.430 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.560 -3.783 -4.988 1.00 0.00 H new ATOM 1065 N VAL A 66 -5.260 -3.463 -7.553 1.00 0.00 N ATOM 1066 CA VAL A 66 -4.277 -3.743 -8.593 1.00 0.00 C ATOM 1067 C VAL A 66 -3.443 -2.477 -8.818 1.00 0.00 C ATOM 1068 O VAL A 66 -2.228 -2.524 -8.680 1.00 0.00 O ATOM 1069 CB VAL A 66 -4.927 -4.245 -9.899 1.00 0.00 C ATOM 1070 CG1 VAL A 66 -3.889 -4.369 -11.026 1.00 0.00 C ATOM 1071 CG2 VAL A 66 -5.595 -5.610 -9.720 1.00 0.00 C ATOM 0 H VAL A 66 -6.224 -3.503 -7.883 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.630 -4.556 -8.264 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.682 -3.504 -10.163 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.378 -4.725 -11.933 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.439 -3.394 -11.215 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.114 -5.076 -10.730 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.039 -5.924 -10.664 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.850 -6.342 -9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.373 -5.538 -8.960 1.00 0.00 H new ATOM 1081 N THR A 67 -4.085 -1.337 -9.099 1.00 0.00 N ATOM 1082 CA THR A 67 -3.432 -0.037 -9.299 1.00 0.00 C ATOM 1083 C THR A 67 -2.407 0.244 -8.188 1.00 0.00 C ATOM 1084 O THR A 67 -1.242 0.568 -8.426 1.00 0.00 O ATOM 1085 CB THR A 67 -4.532 1.044 -9.377 1.00 0.00 C ATOM 1086 OG1 THR A 67 -5.432 0.751 -10.430 1.00 0.00 O ATOM 1087 CG2 THR A 67 -4.025 2.478 -9.551 1.00 0.00 C ATOM 0 H THR A 67 -5.099 -1.291 -9.196 1.00 0.00 H new ATOM 0 HA THR A 67 -2.867 -0.034 -10.231 1.00 0.00 H new ATOM 0 HB THR A 67 -5.023 1.008 -8.405 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.071 0.070 -10.134 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.873 3.161 -9.595 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.388 2.744 -8.707 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.452 2.552 -10.475 1.00 0.00 H new ATOM 1095 N VAL A 68 -2.871 0.071 -6.959 1.00 0.00 N ATOM 1096 CA VAL A 68 -2.172 0.306 -5.710 1.00 0.00 C ATOM 1097 C VAL A 68 -0.965 -0.632 -5.590 1.00 0.00 C ATOM 1098 O VAL A 68 0.180 -0.173 -5.563 1.00 0.00 O ATOM 1099 CB VAL A 68 -3.275 0.227 -4.633 1.00 0.00 C ATOM 1100 CG1 VAL A 68 -2.932 -0.054 -3.178 1.00 0.00 C ATOM 1101 CG2 VAL A 68 -4.028 1.560 -4.664 1.00 0.00 C ATOM 0 H VAL A 68 -3.821 -0.264 -6.800 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.690 1.278 -5.610 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.821 -0.671 -4.924 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.846 -0.068 -2.585 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.435 -1.021 -3.102 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.269 0.726 -2.803 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.820 1.548 -3.915 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.336 2.374 -4.447 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.465 1.708 -5.652 1.00 0.00 H new ATOM 1111 N LEU A 69 -1.187 -1.946 -5.588 1.00 0.00 N ATOM 1112 CA LEU A 69 -0.090 -2.904 -5.515 1.00 0.00 C ATOM 1113 C LEU A 69 0.851 -2.808 -6.710 1.00 0.00 C ATOM 1114 O LEU A 69 2.042 -3.043 -6.548 1.00 0.00 O ATOM 1115 CB LEU A 69 -0.610 -4.333 -5.349 1.00 0.00 C ATOM 1116 CG LEU A 69 -1.433 -4.500 -4.068 1.00 0.00 C ATOM 1117 CD1 LEU A 69 -1.710 -5.993 -3.913 1.00 0.00 C ATOM 1118 CD2 LEU A 69 -0.743 -3.976 -2.802 1.00 0.00 C ATOM 0 H LEU A 69 -2.114 -2.368 -5.636 1.00 0.00 H new ATOM 0 HA LEU A 69 0.489 -2.643 -4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.223 -4.598 -6.211 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.232 -5.025 -5.332 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.341 -3.905 -4.170 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.296 -6.162 -3.010 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.266 -6.352 -4.779 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.766 -6.532 -3.839 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.394 -4.133 -1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.194 -4.511 -2.651 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.539 -2.911 -2.913 1.00 0.00 H new ATOM 1130 N THR A 70 0.371 -2.446 -7.899 1.00 0.00 N ATOM 1131 CA THR A 70 1.247 -2.301 -9.056 1.00 0.00 C ATOM 1132 C THR A 70 2.214 -1.144 -8.787 1.00 0.00 C ATOM 1133 O THR A 70 3.391 -1.223 -9.139 1.00 0.00 O ATOM 1134 CB THR A 70 0.436 -2.117 -10.349 1.00 0.00 C ATOM 1135 OG1 THR A 70 -0.395 -3.244 -10.529 1.00 0.00 O ATOM 1136 CG2 THR A 70 1.346 -2.022 -11.578 1.00 0.00 C ATOM 0 H THR A 70 -0.613 -2.249 -8.084 1.00 0.00 H new ATOM 0 HA THR A 70 1.829 -3.210 -9.206 1.00 0.00 H new ATOM 0 HB THR A 70 -0.138 -1.195 -10.254 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.162 -3.185 -9.922 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.737 -1.892 -12.473 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.017 -1.170 -11.469 1.00 0.00 H new ATOM 0 HG23 THR A 70 1.933 -2.936 -11.668 1.00 0.00 H new ATOM 1144 N ALA A 71 1.724 -0.051 -8.191 1.00 0.00 N ATOM 1145 CA ALA A 71 2.591 1.060 -7.848 1.00 0.00 C ATOM 1146 C ALA A 71 3.623 0.650 -6.796 1.00 0.00 C ATOM 1147 O ALA A 71 4.824 0.697 -7.071 1.00 0.00 O ATOM 1148 CB ALA A 71 1.765 2.275 -7.422 1.00 0.00 C ATOM 0 H ALA A 71 0.743 0.079 -7.943 1.00 0.00 H new ATOM 0 HA ALA A 71 3.154 1.351 -8.735 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.433 3.098 -7.169 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.112 2.576 -8.241 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.161 2.017 -6.552 1.00 0.00 H new ATOM 1154 N LEU A 72 3.184 0.229 -5.602 1.00 0.00 N ATOM 1155 CA LEU A 72 4.138 -0.175 -4.564 1.00 0.00 C ATOM 1156 C LEU A 72 5.042 -1.309 -5.078 1.00 0.00 C ATOM 1157 O LEU A 72 6.227 -1.379 -4.764 1.00 0.00 O ATOM 1158 CB LEU A 72 3.428 -0.561 -3.253 1.00 0.00 C ATOM 1159 CG LEU A 72 4.406 -0.915 -2.116 1.00 0.00 C ATOM 1160 CD1 LEU A 72 5.387 0.219 -1.791 1.00 0.00 C ATOM 1161 CD2 LEU A 72 3.625 -1.260 -0.844 1.00 0.00 C ATOM 0 H LEU A 72 2.202 0.161 -5.336 1.00 0.00 H new ATOM 0 HA LEU A 72 4.769 0.683 -4.334 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.793 0.266 -2.934 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.773 -1.412 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 72 4.986 -1.769 -2.465 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.048 -0.093 -0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.980 0.452 -2.676 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.831 1.105 -1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.323 -1.509 -0.045 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.021 -0.404 -0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.974 -2.113 -1.037 1.00 0.00 H new ATOM 1173 N GLY A 73 4.484 -2.208 -5.886 1.00 0.00 N ATOM 1174 CA GLY A 73 5.181 -3.337 -6.470 1.00 0.00 C ATOM 1175 C GLY A 73 6.303 -2.850 -7.373 1.00 0.00 C ATOM 1176 O GLY A 73 7.441 -3.260 -7.196 1.00 0.00 O ATOM 0 H GLY A 73 3.502 -2.163 -6.157 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.588 -3.970 -5.682 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.483 -3.948 -7.042 1.00 0.00 H new ATOM 1180 N ALA A 74 6.004 -1.969 -8.328 1.00 0.00 N ATOM 1181 CA ALA A 74 7.004 -1.410 -9.232 1.00 0.00 C ATOM 1182 C ALA A 74 8.092 -0.699 -8.423 1.00 0.00 C ATOM 1183 O ALA A 74 9.286 -0.920 -8.620 1.00 0.00 O ATOM 1184 CB ALA A 74 6.337 -0.457 -10.228 1.00 0.00 C ATOM 0 H ALA A 74 5.059 -1.624 -8.495 1.00 0.00 H new ATOM 0 HA ALA A 74 7.472 -2.214 -9.800 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.091 -0.045 -10.898 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.593 -1.001 -10.810 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.851 0.354 -9.686 1.00 0.00 H new ATOM 1190 N ILE A 75 7.666 0.067 -7.415 1.00 0.00 N ATOM 1191 CA ILE A 75 8.558 0.799 -6.523 1.00 0.00 C ATOM 1192 C ILE A 75 9.539 -0.204 -5.898 1.00 0.00 C ATOM 1193 O ILE A 75 10.756 -0.057 -6.020 1.00 0.00 O ATOM 1194 CB ILE A 75 7.689 1.585 -5.521 1.00 0.00 C ATOM 1195 CG1 ILE A 75 7.138 2.826 -6.247 1.00 0.00 C ATOM 1196 CG2 ILE A 75 8.413 1.986 -4.230 1.00 0.00 C ATOM 1197 CD1 ILE A 75 5.975 3.489 -5.505 1.00 0.00 C ATOM 0 H ILE A 75 6.678 0.195 -7.196 1.00 0.00 H new ATOM 0 HA ILE A 75 9.174 1.539 -7.034 1.00 0.00 H new ATOM 0 HB ILE A 75 6.887 0.925 -5.190 1.00 0.00 H new ATOM 0 HG12 ILE A 75 7.941 3.552 -6.374 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.808 2.539 -7.245 1.00 0.00 H new ATOM 0 HG21 ILE A 75 7.728 2.534 -3.584 1.00 0.00 H new ATOM 0 HG22 ILE A 75 8.760 1.091 -3.714 1.00 0.00 H new ATOM 0 HG23 ILE A 75 9.267 2.618 -4.473 1.00 0.00 H new ATOM 0 HD11 ILE A 75 5.632 4.357 -6.068 1.00 0.00 H new ATOM 0 HD12 ILE A 75 5.156 2.777 -5.401 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.307 3.806 -4.516 1.00 0.00 H new ATOM 1209 N LEU A 76 9.010 -1.273 -5.301 1.00 0.00 N ATOM 1210 CA LEU A 76 9.807 -2.344 -4.727 1.00 0.00 C ATOM 1211 C LEU A 76 10.711 -2.999 -5.782 1.00 0.00 C ATOM 1212 O LEU A 76 11.892 -3.227 -5.527 1.00 0.00 O ATOM 1213 CB LEU A 76 8.867 -3.383 -4.103 1.00 0.00 C ATOM 1214 CG LEU A 76 8.194 -2.916 -2.798 1.00 0.00 C ATOM 1215 CD1 LEU A 76 7.094 -3.916 -2.425 1.00 0.00 C ATOM 1216 CD2 LEU A 76 9.184 -2.809 -1.635 1.00 0.00 C ATOM 0 H LEU A 76 8.005 -1.416 -5.204 1.00 0.00 H new ATOM 0 HA LEU A 76 10.459 -1.927 -3.959 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.094 -3.639 -4.827 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.431 -4.294 -3.903 1.00 0.00 H new ATOM 0 HG LEU A 76 7.783 -1.922 -2.973 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.610 -3.597 -1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.356 -3.960 -3.226 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.533 -4.903 -2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 76 8.659 -2.476 -0.740 1.00 0.00 H new ATOM 0 HD22 LEU A 76 9.635 -3.784 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.964 -2.090 -1.886 1.00 0.00 H new ATOM 1228 N LYS A 77 10.174 -3.303 -6.970 1.00 0.00 N ATOM 1229 CA LYS A 77 10.929 -3.939 -8.050 1.00 0.00 C ATOM 1230 C LYS A 77 12.147 -3.095 -8.421 1.00 0.00 C ATOM 1231 O LYS A 77 13.198 -3.642 -8.745 1.00 0.00 O ATOM 1232 CB LYS A 77 10.048 -4.207 -9.282 1.00 0.00 C ATOM 1233 CG LYS A 77 8.994 -5.297 -9.033 1.00 0.00 C ATOM 1234 CD LYS A 77 9.541 -6.712 -9.265 1.00 0.00 C ATOM 1235 CE LYS A 77 8.431 -7.724 -8.966 1.00 0.00 C ATOM 1236 NZ LYS A 77 8.873 -9.115 -9.160 1.00 0.00 N ATOM 0 H LYS A 77 9.200 -3.113 -7.207 1.00 0.00 H new ATOM 0 HA LYS A 77 11.276 -4.906 -7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.548 -3.284 -9.573 1.00 0.00 H new ATOM 0 HB3 LYS A 77 10.681 -4.504 -10.118 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.628 -5.216 -8.009 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.141 -5.129 -9.690 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.884 -6.820 -10.294 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.402 -6.894 -8.622 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.091 -7.594 -7.939 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.576 -7.524 -9.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.066 -9.757 -9.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 9.252 -9.228 -10.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 9.614 -9.344 -8.467 1.00 0.00 H new ATOM 1250 N LYS A 78 12.018 -1.766 -8.376 1.00 0.00 N ATOM 1251 CA LYS A 78 13.127 -0.860 -8.653 1.00 0.00 C ATOM 1252 C LYS A 78 14.239 -0.945 -7.588 1.00 0.00 C ATOM 1253 O LYS A 78 15.240 -0.247 -7.718 1.00 0.00 O ATOM 1254 CB LYS A 78 12.604 0.572 -8.821 1.00 0.00 C ATOM 1255 CG LYS A 78 11.746 0.756 -10.081 1.00 0.00 C ATOM 1256 CD LYS A 78 12.615 0.997 -11.325 1.00 0.00 C ATOM 1257 CE LYS A 78 11.761 1.081 -12.597 1.00 0.00 C ATOM 1258 NZ LYS A 78 10.756 2.156 -12.522 1.00 0.00 N ATOM 0 H LYS A 78 11.144 -1.293 -8.147 1.00 0.00 H new ATOM 0 HA LYS A 78 13.589 -1.173 -9.590 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.015 0.842 -7.945 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.449 1.259 -8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.128 -0.129 -10.234 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.068 1.598 -9.941 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.180 1.921 -11.203 1.00 0.00 H new ATOM 0 HD3 LYS A 78 13.341 0.190 -11.425 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.409 1.251 -13.457 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.259 0.127 -12.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.295 2.266 -13.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.042 1.914 -11.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.221 3.048 -12.259 1.00 0.00 H new ATOM 1272 N LYS A 79 14.096 -1.795 -6.558 1.00 0.00 N ATOM 1273 CA LYS A 79 15.075 -2.084 -5.513 1.00 0.00 C ATOM 1274 C LYS A 79 15.915 -0.881 -5.055 1.00 0.00 C ATOM 1275 O LYS A 79 17.135 -0.976 -4.923 1.00 0.00 O ATOM 1276 CB LYS A 79 15.916 -3.308 -5.911 1.00 0.00 C ATOM 1277 CG LYS A 79 16.615 -3.146 -7.268 1.00 0.00 C ATOM 1278 CD LYS A 79 17.750 -4.160 -7.480 1.00 0.00 C ATOM 1279 CE LYS A 79 18.866 -4.072 -6.426 1.00 0.00 C ATOM 1280 NZ LYS A 79 19.259 -2.681 -6.133 1.00 0.00 N ATOM 0 H LYS A 79 13.237 -2.329 -6.431 1.00 0.00 H new ATOM 0 HA LYS A 79 14.512 -2.329 -4.613 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.667 -3.490 -5.142 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.273 -4.188 -5.943 1.00 0.00 H new ATOM 0 HG2 LYS A 79 15.880 -3.258 -8.065 1.00 0.00 H new ATOM 0 HG3 LYS A 79 17.018 -2.136 -7.346 1.00 0.00 H new ATOM 0 HD2 LYS A 79 17.332 -5.167 -7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 79 18.183 -4.005 -8.468 1.00 0.00 H new ATOM 0 HE2 LYS A 79 18.532 -4.553 -5.507 1.00 0.00 H new ATOM 0 HE3 LYS A 79 19.737 -4.626 -6.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 20.091 -2.679 -5.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 19.491 -2.192 -7.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 18.472 -2.190 -5.663 1.00 0.00 H new ATOM 1294 N GLY A 80 15.243 0.235 -4.758 1.00 0.00 N ATOM 1295 CA GLY A 80 15.872 1.441 -4.232 1.00 0.00 C ATOM 1296 C GLY A 80 16.250 2.478 -5.290 1.00 0.00 C ATOM 1297 O GLY A 80 16.788 3.527 -4.935 1.00 0.00 O ATOM 0 H GLY A 80 14.234 0.323 -4.879 1.00 0.00 H new ATOM 0 HA2 GLY A 80 15.195 1.904 -3.515 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.770 1.156 -3.684 1.00 0.00 H new ATOM 1301 N HIS A 81 15.977 2.224 -6.575 1.00 0.00 N ATOM 1302 CA HIS A 81 16.299 3.161 -7.638 1.00 0.00 C ATOM 1303 C HIS A 81 15.011 3.701 -8.253 1.00 0.00 C ATOM 1304 O HIS A 81 14.731 3.508 -9.438 1.00 0.00 O ATOM 1305 CB HIS A 81 17.238 2.504 -8.658 1.00 0.00 C ATOM 1306 CG HIS A 81 18.511 1.999 -8.022 1.00 0.00 C ATOM 1307 ND1 HIS A 81 19.655 2.742 -7.803 1.00 0.00 N ATOM 1308 CD2 HIS A 81 18.683 0.776 -7.437 1.00 0.00 C ATOM 1309 CE1 HIS A 81 20.512 1.975 -7.104 1.00 0.00 C ATOM 1310 NE2 HIS A 81 19.941 0.778 -6.871 1.00 0.00 N ATOM 0 H HIS A 81 15.529 1.366 -6.898 1.00 0.00 H new ATOM 0 HA HIS A 81 16.840 4.018 -7.237 1.00 0.00 H new ATOM 0 HB2 HIS A 81 16.722 1.675 -9.142 1.00 0.00 H new ATOM 0 HB3 HIS A 81 17.485 3.224 -9.438 1.00 0.00 H new ATOM 0 HD2 HIS A 81 17.971 -0.036 -7.421 1.00 0.00 H new ATOM 0 HE1 HIS A 81 21.499 2.272 -6.782 1.00 0.00 H new ATOM 0 HE2 HIS A 81 20.367 0.003 -6.362 1.00 0.00 H new ATOM 1319 N HIS A 82 14.228 4.413 -7.441 1.00 0.00 N ATOM 1320 CA HIS A 82 12.988 5.004 -7.833 1.00 0.00 C ATOM 1321 C HIS A 82 12.991 6.416 -7.254 1.00 0.00 C ATOM 1322 O HIS A 82 13.734 6.709 -6.320 1.00 0.00 O ATOM 1323 CB HIS A 82 11.808 4.155 -7.336 1.00 0.00 C ATOM 1324 CG HIS A 82 11.972 3.643 -5.925 1.00 0.00 C ATOM 1325 ND1 HIS A 82 11.977 2.324 -5.538 1.00 0.00 N ATOM 1326 CD2 HIS A 82 12.183 4.397 -4.802 1.00 0.00 C ATOM 1327 CE1 HIS A 82 12.183 2.291 -4.214 1.00 0.00 C ATOM 1328 NE2 HIS A 82 12.331 3.528 -3.722 1.00 0.00 N ATOM 0 H HIS A 82 14.465 4.589 -6.464 1.00 0.00 H new ATOM 0 HA HIS A 82 12.875 5.050 -8.916 1.00 0.00 H new ATOM 0 HB2 HIS A 82 10.896 4.750 -7.392 1.00 0.00 H new ATOM 0 HB3 HIS A 82 11.676 3.306 -8.007 1.00 0.00 H new ATOM 0 HD1 HIS A 82 11.847 1.517 -6.148 1.00 0.00 H new ATOM 0 HD2 HIS A 82 12.227 5.475 -4.760 1.00 0.00 H new ATOM 0 HE1 HIS A 82 12.224 1.388 -3.623 1.00 0.00 H new ATOM 1336 N GLU A 83 12.124 7.256 -7.798 1.00 0.00 N ATOM 1337 CA GLU A 83 11.894 8.653 -7.436 1.00 0.00 C ATOM 1338 C GLU A 83 10.740 9.205 -8.279 1.00 0.00 C ATOM 1339 O GLU A 83 9.689 9.568 -7.750 1.00 0.00 O ATOM 1340 CB GLU A 83 13.179 9.520 -7.539 1.00 0.00 C ATOM 1341 CG GLU A 83 13.858 9.679 -8.912 1.00 0.00 C ATOM 1342 CD GLU A 83 14.166 8.352 -9.598 1.00 0.00 C ATOM 1343 OE1 GLU A 83 15.221 7.765 -9.276 1.00 0.00 O ATOM 1344 OE2 GLU A 83 13.313 7.940 -10.415 1.00 0.00 O ATOM 0 H GLU A 83 11.516 6.960 -8.561 1.00 0.00 H new ATOM 0 HA GLU A 83 11.612 8.699 -6.384 1.00 0.00 H new ATOM 0 HB2 GLU A 83 12.934 10.518 -7.174 1.00 0.00 H new ATOM 0 HB3 GLU A 83 13.915 9.102 -6.853 1.00 0.00 H new ATOM 0 HG2 GLU A 83 13.213 10.273 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU A 83 14.786 10.238 -8.787 1.00 0.00 H new ATOM 1351 N ALA A 84 10.918 9.204 -9.607 1.00 0.00 N ATOM 1352 CA ALA A 84 9.936 9.702 -10.563 1.00 0.00 C ATOM 1353 C ALA A 84 8.661 8.876 -10.410 1.00 0.00 C ATOM 1354 O ALA A 84 7.571 9.412 -10.241 1.00 0.00 O ATOM 1355 CB ALA A 84 10.494 9.592 -11.987 1.00 0.00 C ATOM 0 H ALA A 84 11.766 8.849 -10.049 1.00 0.00 H new ATOM 0 HA ALA A 84 9.713 10.752 -10.373 1.00 0.00 H new ATOM 0 HB1 ALA A 84 9.756 9.965 -12.697 1.00 0.00 H new ATOM 0 HB2 ALA A 84 11.406 10.183 -12.067 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.717 8.549 -12.211 1.00 0.00 H new ATOM 1361 N GLU A 85 8.824 7.552 -10.364 1.00 0.00 N ATOM 1362 CA GLU A 85 7.743 6.596 -10.174 1.00 0.00 C ATOM 1363 C GLU A 85 7.379 6.569 -8.681 1.00 0.00 C ATOM 1364 O GLU A 85 7.493 5.516 -8.059 1.00 0.00 O ATOM 1365 CB GLU A 85 8.245 5.228 -10.672 1.00 0.00 C ATOM 1366 CG GLU A 85 7.134 4.176 -10.806 1.00 0.00 C ATOM 1367 CD GLU A 85 7.721 2.826 -11.202 1.00 0.00 C ATOM 1368 OE1 GLU A 85 8.413 2.232 -10.346 1.00 0.00 O ATOM 1369 OE2 GLU A 85 7.498 2.423 -12.363 1.00 0.00 O ATOM 0 H GLU A 85 9.737 7.109 -10.461 1.00 0.00 H new ATOM 0 HA GLU A 85 6.846 6.865 -10.732 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.729 5.358 -11.640 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.004 4.857 -9.984 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.598 4.083 -9.862 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.409 4.497 -11.554 1.00 0.00 H new ATOM 1376 N LEU A 86 6.998 7.720 -8.108 1.00 0.00 N ATOM 1377 CA LEU A 86 6.620 7.883 -6.704 1.00 0.00 C ATOM 1378 C LEU A 86 6.192 9.325 -6.424 1.00 0.00 C ATOM 1379 O LEU A 86 5.056 9.549 -6.021 1.00 0.00 O ATOM 1380 CB LEU A 86 7.722 7.402 -5.748 1.00 0.00 C ATOM 1381 CG LEU A 86 7.376 7.454 -4.253 1.00 0.00 C ATOM 1382 CD1 LEU A 86 5.960 6.969 -3.927 1.00 0.00 C ATOM 1383 CD2 LEU A 86 8.382 6.569 -3.508 1.00 0.00 C ATOM 0 H LEU A 86 6.944 8.593 -8.633 1.00 0.00 H new ATOM 0 HA LEU A 86 5.759 7.242 -6.513 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.979 6.375 -6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.613 8.006 -5.917 1.00 0.00 H new ATOM 0 HG LEU A 86 7.424 8.498 -3.944 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.791 7.036 -2.852 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.233 7.592 -4.448 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.847 5.934 -4.248 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.161 6.586 -2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.310 5.546 -3.877 1.00 0.00 H new ATOM 0 HD23 LEU A 86 9.391 6.945 -3.676 1.00 0.00 H new ATOM 1395 N LYS A 87 7.051 10.323 -6.667 1.00 0.00 N ATOM 1396 CA LYS A 87 6.698 11.726 -6.413 1.00 0.00 C ATOM 1397 C LYS A 87 5.264 12.128 -6.843 1.00 0.00 C ATOM 1398 O LYS A 87 4.528 12.687 -6.030 1.00 0.00 O ATOM 1399 CB LYS A 87 7.791 12.673 -6.933 1.00 0.00 C ATOM 1400 CG LYS A 87 9.035 12.613 -6.035 1.00 0.00 C ATOM 1401 CD LYS A 87 10.115 13.584 -6.530 1.00 0.00 C ATOM 1402 CE LYS A 87 11.194 13.802 -5.462 1.00 0.00 C ATOM 1403 NZ LYS A 87 11.916 12.560 -5.140 1.00 0.00 N ATOM 0 H LYS A 87 7.991 10.186 -7.038 1.00 0.00 H new ATOM 0 HA LYS A 87 6.662 11.835 -5.329 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.060 12.400 -7.953 1.00 0.00 H new ATOM 0 HB3 LYS A 87 7.409 13.693 -6.966 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.760 12.860 -5.010 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.431 11.598 -6.023 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.572 13.192 -7.438 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.658 14.539 -6.790 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.903 14.552 -5.812 1.00 0.00 H new ATOM 0 HE3 LYS A 87 10.733 14.197 -4.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.669 12.764 -4.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.254 11.869 -4.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 12.337 12.168 -6.007 1.00 0.00 H new ATOM 1417 N PRO A 88 4.806 11.838 -8.075 1.00 0.00 N ATOM 1418 CA PRO A 88 3.445 12.139 -8.511 1.00 0.00 C ATOM 1419 C PRO A 88 2.388 11.490 -7.605 1.00 0.00 C ATOM 1420 O PRO A 88 1.298 12.026 -7.406 1.00 0.00 O ATOM 1421 CB PRO A 88 3.333 11.585 -9.938 1.00 0.00 C ATOM 1422 CG PRO A 88 4.780 11.520 -10.418 1.00 0.00 C ATOM 1423 CD PRO A 88 5.536 11.180 -9.138 1.00 0.00 C ATOM 0 HA PRO A 88 3.260 13.212 -8.466 1.00 0.00 H new ATOM 0 HB2 PRO A 88 2.863 10.602 -9.950 1.00 0.00 H new ATOM 0 HB3 PRO A 88 2.730 12.234 -10.573 1.00 0.00 H new ATOM 0 HG2 PRO A 88 4.919 10.759 -11.186 1.00 0.00 H new ATOM 0 HG3 PRO A 88 5.109 12.467 -10.845 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.575 10.102 -8.979 1.00 0.00 H new ATOM 0 HD3 PRO A 88 6.566 11.533 -9.184 1.00 0.00 H new ATOM 1431 N LEU A 89 2.692 10.291 -7.107 1.00 0.00 N ATOM 1432 CA LEU A 89 1.824 9.569 -6.203 1.00 0.00 C ATOM 1433 C LEU A 89 1.689 10.380 -4.922 1.00 0.00 C ATOM 1434 O LEU A 89 0.581 10.561 -4.416 1.00 0.00 O ATOM 1435 CB LEU A 89 2.409 8.166 -5.957 1.00 0.00 C ATOM 1436 CG LEU A 89 1.384 7.098 -5.559 1.00 0.00 C ATOM 1437 CD1 LEU A 89 1.671 5.825 -6.363 1.00 0.00 C ATOM 1438 CD2 LEU A 89 1.505 6.782 -4.062 1.00 0.00 C ATOM 0 H LEU A 89 3.557 9.797 -7.327 1.00 0.00 H new ATOM 0 HA LEU A 89 0.828 9.434 -6.624 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.920 7.838 -6.862 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.163 8.235 -5.172 1.00 0.00 H new ATOM 0 HG LEU A 89 0.378 7.464 -5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.950 5.053 -6.092 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.588 6.041 -7.428 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.679 5.474 -6.141 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.772 6.022 -3.790 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.508 6.412 -3.848 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.321 7.687 -3.483 1.00 0.00 H new ATOM 1450 N ALA A 90 2.821 10.878 -4.407 1.00 0.00 N ATOM 1451 CA ALA A 90 2.837 11.756 -3.243 1.00 0.00 C ATOM 1452 C ALA A 90 1.914 12.941 -3.516 1.00 0.00 C ATOM 1453 O ALA A 90 0.998 13.204 -2.739 1.00 0.00 O ATOM 1454 CB ALA A 90 4.260 12.224 -2.940 1.00 0.00 C ATOM 0 H ALA A 90 3.746 10.681 -4.789 1.00 0.00 H new ATOM 0 HA ALA A 90 2.482 11.215 -2.366 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.250 12.878 -2.068 1.00 0.00 H new ATOM 0 HB2 ALA A 90 4.892 11.359 -2.738 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.654 12.769 -3.798 1.00 0.00 H new ATOM 1460 N GLN A 91 2.090 13.594 -4.672 1.00 0.00 N ATOM 1461 CA GLN A 91 1.258 14.736 -5.035 1.00 0.00 C ATOM 1462 C GLN A 91 -0.223 14.371 -4.920 1.00 0.00 C ATOM 1463 O GLN A 91 -0.980 15.102 -4.288 1.00 0.00 O ATOM 1464 CB GLN A 91 1.582 15.264 -6.439 1.00 0.00 C ATOM 1465 CG GLN A 91 3.019 15.792 -6.545 1.00 0.00 C ATOM 1466 CD GLN A 91 3.308 16.487 -7.873 1.00 0.00 C ATOM 1467 OE1 GLN A 91 4.021 17.485 -7.907 1.00 0.00 O ATOM 1468 NE2 GLN A 91 2.768 15.981 -8.977 1.00 0.00 N ATOM 0 H GLN A 91 2.798 13.349 -5.364 1.00 0.00 H new ATOM 0 HA GLN A 91 1.480 15.540 -4.333 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.436 14.466 -7.167 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.884 16.061 -6.695 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.204 16.491 -5.729 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.714 14.962 -6.418 1.00 0.00 H new ATOM 0 HE21 GLN A 91 2.179 15.150 -8.922 1.00 0.00 H new ATOM 0 HE22 GLN A 91 2.943 16.423 -9.879 1.00 0.00 H new ATOM 1477 N SER A 92 -0.651 13.252 -5.512 1.00 0.00 N ATOM 1478 CA SER A 92 -2.037 12.816 -5.402 1.00 0.00 C ATOM 1479 C SER A 92 -2.461 12.627 -3.942 1.00 0.00 C ATOM 1480 O SER A 92 -3.423 13.253 -3.484 1.00 0.00 O ATOM 1481 CB SER A 92 -2.218 11.498 -6.147 1.00 0.00 C ATOM 1482 OG SER A 92 -1.901 11.630 -7.513 1.00 0.00 O ATOM 0 H SER A 92 -0.057 12.637 -6.069 1.00 0.00 H new ATOM 0 HA SER A 92 -2.664 13.593 -5.841 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.583 10.734 -5.697 1.00 0.00 H new ATOM 0 HB3 SER A 92 -3.248 11.158 -6.043 1.00 0.00 H new ATOM 0 HG SER A 92 -1.933 10.750 -7.943 1.00 0.00 H new ATOM 1488 N HIS A 93 -1.752 11.746 -3.223 1.00 0.00 N ATOM 1489 CA HIS A 93 -2.038 11.454 -1.821 1.00 0.00 C ATOM 1490 C HIS A 93 -2.044 12.714 -0.942 1.00 0.00 C ATOM 1491 O HIS A 93 -2.712 12.731 0.092 1.00 0.00 O ATOM 1492 CB HIS A 93 -1.204 10.268 -1.302 1.00 0.00 C ATOM 1493 CG HIS A 93 -1.522 8.988 -2.052 1.00 0.00 C ATOM 1494 ND1 HIS A 93 -1.292 8.801 -3.394 1.00 0.00 N ATOM 1495 CD2 HIS A 93 -2.363 7.974 -1.654 1.00 0.00 C ATOM 1496 CE1 HIS A 93 -1.996 7.736 -3.791 1.00 0.00 C ATOM 1497 NE2 HIS A 93 -2.657 7.181 -2.764 1.00 0.00 N ATOM 0 H HIS A 93 -0.965 11.218 -3.601 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.068 11.103 -1.750 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.143 10.496 -1.405 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.397 10.125 -0.239 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.689 9.375 -3.984 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.733 7.818 -0.651 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -2.028 7.370 -4.807 1.00 0.00 H new ATOM 1505 N ALA A 94 -1.345 13.772 -1.361 1.00 0.00 N ATOM 1506 CA ALA A 94 -1.349 15.054 -0.679 1.00 0.00 C ATOM 1507 C ALA A 94 -2.494 15.955 -1.155 1.00 0.00 C ATOM 1508 O ALA A 94 -3.438 16.211 -0.411 1.00 0.00 O ATOM 1509 CB ALA A 94 -0.011 15.772 -0.889 1.00 0.00 C ATOM 0 H ALA A 94 -0.756 13.755 -2.194 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.498 14.853 0.382 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.028 16.732 -0.372 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.797 15.159 -0.490 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.150 15.936 -1.954 1.00 0.00 H new ATOM 1515 N THR A 95 -2.408 16.476 -2.381 1.00 0.00 N ATOM 1516 CA THR A 95 -3.346 17.484 -2.858 1.00 0.00 C ATOM 1517 C THR A 95 -4.763 16.958 -3.067 1.00 0.00 C ATOM 1518 O THR A 95 -5.715 17.693 -2.811 1.00 0.00 O ATOM 1519 CB THR A 95 -2.785 18.236 -4.081 1.00 0.00 C ATOM 1520 OG1 THR A 95 -3.393 19.509 -4.182 1.00 0.00 O ATOM 1521 CG2 THR A 95 -2.982 17.506 -5.412 1.00 0.00 C ATOM 0 H THR A 95 -1.694 16.213 -3.060 1.00 0.00 H new ATOM 0 HA THR A 95 -3.451 18.214 -2.055 1.00 0.00 H new ATOM 0 HB THR A 95 -1.711 18.311 -3.909 1.00 0.00 H new ATOM 0 HG1 THR A 95 -3.032 19.983 -4.960 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.559 18.103 -6.220 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.481 16.539 -5.374 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.047 17.356 -5.590 1.00 0.00 H new ATOM 1529 N LYS A 96 -4.926 15.715 -3.527 1.00 0.00 N ATOM 1530 CA LYS A 96 -6.257 15.175 -3.759 1.00 0.00 C ATOM 1531 C LYS A 96 -6.756 14.460 -2.507 1.00 0.00 C ATOM 1532 O LYS A 96 -7.837 14.763 -2.009 1.00 0.00 O ATOM 1533 CB LYS A 96 -6.258 14.220 -4.960 1.00 0.00 C ATOM 1534 CG LYS A 96 -5.865 14.890 -6.284 1.00 0.00 C ATOM 1535 CD LYS A 96 -6.128 13.957 -7.477 1.00 0.00 C ATOM 1536 CE LYS A 96 -5.171 12.757 -7.488 1.00 0.00 C ATOM 1537 NZ LYS A 96 -5.512 11.773 -8.529 1.00 0.00 N ATOM 0 H LYS A 96 -4.161 15.075 -3.742 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.931 16.001 -3.986 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.569 13.399 -4.760 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -7.251 13.784 -5.065 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -6.430 15.814 -6.409 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.810 15.163 -6.258 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.157 13.600 -7.439 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -6.019 14.516 -8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -4.152 13.110 -7.647 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -5.192 12.271 -6.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -5.229 10.823 -8.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -6.538 11.790 -8.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.011 12.011 -9.409 1.00 0.00 H new ATOM 1551 N HIS A 97 -5.993 13.474 -2.028 1.00 0.00 N ATOM 1552 CA HIS A 97 -6.459 12.594 -0.959 1.00 0.00 C ATOM 1553 C HIS A 97 -6.174 13.100 0.461 1.00 0.00 C ATOM 1554 O HIS A 97 -6.899 12.721 1.377 1.00 0.00 O ATOM 1555 CB HIS A 97 -5.957 11.170 -1.218 1.00 0.00 C ATOM 1556 CG HIS A 97 -6.088 10.751 -2.670 1.00 0.00 C ATOM 1557 ND1 HIS A 97 -7.110 11.125 -3.520 1.00 0.00 N ATOM 1558 CD2 HIS A 97 -5.134 10.129 -3.425 1.00 0.00 C ATOM 1559 CE1 HIS A 97 -6.774 10.735 -4.762 1.00 0.00 C ATOM 1560 NE2 HIS A 97 -5.587 10.105 -4.729 1.00 0.00 N ATOM 0 H HIS A 97 -5.052 13.267 -2.364 1.00 0.00 H new ATOM 0 HA HIS A 97 -7.549 12.591 -0.991 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.912 11.099 -0.918 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.516 10.474 -0.593 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.197 9.729 -3.067 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.366 10.902 -5.649 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -5.107 9.685 -5.525 1.00 0.00 H new ATOM 1569 N LYS A 98 -5.179 13.980 0.650 1.00 0.00 N ATOM 1570 CA LYS A 98 -4.799 14.554 1.943 1.00 0.00 C ATOM 1571 C LYS A 98 -4.556 13.466 2.999 1.00 0.00 C ATOM 1572 O LYS A 98 -5.256 13.386 4.007 1.00 0.00 O ATOM 1573 CB LYS A 98 -5.855 15.582 2.388 1.00 0.00 C ATOM 1574 CG LYS A 98 -5.379 16.473 3.544 1.00 0.00 C ATOM 1575 CD LYS A 98 -6.382 17.588 3.871 1.00 0.00 C ATOM 1576 CE LYS A 98 -7.681 17.041 4.475 1.00 0.00 C ATOM 1577 NZ LYS A 98 -8.551 18.138 4.935 1.00 0.00 N ATOM 0 H LYS A 98 -4.601 14.320 -0.119 1.00 0.00 H new ATOM 0 HA LYS A 98 -3.849 15.076 1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -6.122 16.211 1.539 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.760 15.056 2.692 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.219 15.859 4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.417 16.917 3.286 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -5.927 18.291 4.569 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -6.612 18.145 2.963 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -8.207 16.441 3.733 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -7.448 16.381 5.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -9.424 17.743 5.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -8.054 18.694 5.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -8.790 18.752 4.131 1.00 0.00 H new ATOM 1591 N ILE A 99 -3.535 12.630 2.789 1.00 0.00 N ATOM 1592 CA ILE A 99 -3.180 11.545 3.702 1.00 0.00 C ATOM 1593 C ILE A 99 -1.891 11.892 4.466 1.00 0.00 C ATOM 1594 O ILE A 99 -0.798 11.645 3.954 1.00 0.00 O ATOM 1595 CB ILE A 99 -3.104 10.226 2.910 1.00 0.00 C ATOM 1596 CG1 ILE A 99 -4.516 9.880 2.396 1.00 0.00 C ATOM 1597 CG2 ILE A 99 -2.599 9.085 3.809 1.00 0.00 C ATOM 1598 CD1 ILE A 99 -4.441 8.977 1.174 1.00 0.00 C ATOM 0 H ILE A 99 -2.927 12.690 1.972 1.00 0.00 H new ATOM 0 HA ILE A 99 -3.947 11.412 4.465 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.411 10.346 2.077 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -5.084 9.386 3.184 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.051 10.796 2.144 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -2.552 8.161 3.232 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.605 9.330 4.184 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -3.282 8.954 4.649 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.449 8.747 0.829 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.893 9.484 0.380 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -3.927 8.052 1.436 1.00 0.00 H new ATOM 1610 N PRO A 100 -1.964 12.410 5.710 1.00 0.00 N ATOM 1611 CA PRO A 100 -0.798 12.885 6.450 1.00 0.00 C ATOM 1612 C PRO A 100 0.027 11.778 7.117 1.00 0.00 C ATOM 1613 O PRO A 100 0.236 11.793 8.324 1.00 0.00 O ATOM 1614 CB PRO A 100 -1.359 13.888 7.459 1.00 0.00 C ATOM 1615 CG PRO A 100 -2.716 13.280 7.805 1.00 0.00 C ATOM 1616 CD PRO A 100 -3.174 12.721 6.457 1.00 0.00 C ATOM 0 HA PRO A 100 -0.074 13.337 5.771 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -0.720 13.982 8.337 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -1.458 14.885 7.029 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.631 12.500 8.562 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -3.409 14.026 8.193 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.786 11.830 6.594 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -3.785 13.448 5.922 1.00 0.00 H new ATOM 1624 N ILE A 101 0.552 10.868 6.298 1.00 0.00 N ATOM 1625 CA ILE A 101 1.487 9.802 6.616 1.00 0.00 C ATOM 1626 C ILE A 101 1.195 9.155 7.963 1.00 0.00 C ATOM 1627 O ILE A 101 1.895 9.317 8.957 1.00 0.00 O ATOM 1628 CB ILE A 101 2.907 10.328 6.390 1.00 0.00 C ATOM 1629 CG1 ILE A 101 2.999 10.721 4.910 1.00 0.00 C ATOM 1630 CG2 ILE A 101 3.989 9.282 6.691 1.00 0.00 C ATOM 1631 CD1 ILE A 101 4.381 11.236 4.496 1.00 0.00 C ATOM 0 H ILE A 101 0.309 10.862 5.307 1.00 0.00 H new ATOM 0 HA ILE A 101 1.367 8.954 5.942 1.00 0.00 H new ATOM 0 HB ILE A 101 3.084 11.165 7.066 1.00 0.00 H new ATOM 0 HG12 ILE A 101 2.744 9.857 4.297 1.00 0.00 H new ATOM 0 HG13 ILE A 101 2.256 11.491 4.700 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.973 9.715 6.512 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.914 8.970 7.733 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.850 8.417 6.042 1.00 0.00 H new ATOM 0 HD11 ILE A 101 4.371 11.494 3.437 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.631 12.120 5.083 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.126 10.461 4.673 1.00 0.00 H new ATOM 1643 N LYS A 102 0.053 8.475 7.943 1.00 0.00 N ATOM 1644 CA LYS A 102 -0.470 7.631 9.023 1.00 0.00 C ATOM 1645 C LYS A 102 -1.186 6.434 8.392 1.00 0.00 C ATOM 1646 O LYS A 102 -0.893 5.283 8.699 1.00 0.00 O ATOM 1647 CB LYS A 102 -1.417 8.404 9.954 1.00 0.00 C ATOM 1648 CG LYS A 102 -0.689 9.507 10.728 1.00 0.00 C ATOM 1649 CD LYS A 102 -1.660 10.313 11.599 1.00 0.00 C ATOM 1650 CE LYS A 102 -0.972 11.558 12.173 1.00 0.00 C ATOM 1651 NZ LYS A 102 -0.660 12.550 11.125 1.00 0.00 N ATOM 0 H LYS A 102 -0.568 8.496 7.134 1.00 0.00 H new ATOM 0 HA LYS A 102 0.361 7.293 9.642 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.222 8.845 9.367 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.878 7.711 10.658 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.084 9.064 11.356 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.186 10.174 10.028 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.525 10.611 11.007 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.030 9.689 12.412 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.617 12.015 12.924 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.052 11.263 12.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.351 12.791 11.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.884 12.151 10.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -1.227 13.408 11.279 1.00 0.00 H new ATOM 1665 N TYR A 103 -2.132 6.692 7.491 1.00 0.00 N ATOM 1666 CA TYR A 103 -2.875 5.632 6.828 1.00 0.00 C ATOM 1667 C TYR A 103 -1.972 4.665 6.056 1.00 0.00 C ATOM 1668 O TYR A 103 -2.263 3.473 5.988 1.00 0.00 O ATOM 1669 CB TYR A 103 -3.981 6.240 5.973 1.00 0.00 C ATOM 1670 CG TYR A 103 -5.008 7.105 6.685 1.00 0.00 C ATOM 1671 CD1 TYR A 103 -5.094 7.189 8.093 1.00 0.00 C ATOM 1672 CD2 TYR A 103 -6.052 7.624 5.906 1.00 0.00 C ATOM 1673 CE1 TYR A 103 -6.228 7.755 8.699 1.00 0.00 C ATOM 1674 CE2 TYR A 103 -7.227 8.079 6.516 1.00 0.00 C ATOM 1675 CZ TYR A 103 -7.307 8.173 7.908 1.00 0.00 C ATOM 1676 OH TYR A 103 -8.444 8.652 8.476 1.00 0.00 O ATOM 0 H TYR A 103 -2.400 7.634 7.205 1.00 0.00 H new ATOM 0 HA TYR A 103 -3.344 5.010 7.591 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -3.514 6.841 5.193 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -4.510 5.427 5.475 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -4.286 6.817 8.705 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -5.949 7.673 4.832 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -6.268 7.868 9.772 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -8.075 8.358 5.908 1.00 0.00 H new ATOM 0 HH TYR A 103 -9.207 8.464 7.890 1.00 0.00 H new ATOM 1686 N LEU A 104 -0.858 5.152 5.503 1.00 0.00 N ATOM 1687 CA LEU A 104 0.094 4.274 4.835 1.00 0.00 C ATOM 1688 C LEU A 104 0.652 3.231 5.832 1.00 0.00 C ATOM 1689 O LEU A 104 1.006 2.119 5.443 1.00 0.00 O ATOM 1690 CB LEU A 104 1.192 5.099 4.143 1.00 0.00 C ATOM 1691 CG LEU A 104 0.651 6.174 3.172 1.00 0.00 C ATOM 1692 CD1 LEU A 104 1.663 7.316 3.022 1.00 0.00 C ATOM 1693 CD2 LEU A 104 0.335 5.645 1.773 1.00 0.00 C ATOM 0 H LEU A 104 -0.599 6.139 5.506 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.413 3.715 4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.802 5.585 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.848 4.424 3.593 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.282 6.518 3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.268 8.065 2.335 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.842 7.774 3.995 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.600 6.922 2.629 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.039 6.459 1.152 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.240 5.234 1.326 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.422 4.864 1.842 1.00 0.00 H new ATOM 1705 N GLU A 105 0.658 3.532 7.138 1.00 0.00 N ATOM 1706 CA GLU A 105 1.063 2.574 8.163 1.00 0.00 C ATOM 1707 C GLU A 105 -0.043 1.529 8.321 1.00 0.00 C ATOM 1708 O GLU A 105 0.219 0.360 8.606 1.00 0.00 O ATOM 1709 CB GLU A 105 1.333 3.274 9.506 1.00 0.00 C ATOM 1710 CG GLU A 105 2.307 4.450 9.351 1.00 0.00 C ATOM 1711 CD GLU A 105 2.516 5.245 10.636 1.00 0.00 C ATOM 1712 OE1 GLU A 105 2.223 4.692 11.718 1.00 0.00 O ATOM 1713 OE2 GLU A 105 2.970 6.402 10.501 1.00 0.00 O ATOM 0 H GLU A 105 0.383 4.442 7.507 1.00 0.00 H new ATOM 0 HA GLU A 105 1.991 2.093 7.854 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.393 3.634 9.924 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.742 2.554 10.215 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.270 4.071 9.008 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.934 5.120 8.576 1.00 0.00 H new ATOM 1720 N PHE A 106 -1.298 1.959 8.186 1.00 0.00 N ATOM 1721 CA PHE A 106 -2.405 1.034 8.239 1.00 0.00 C ATOM 1722 C PHE A 106 -2.393 0.111 7.019 1.00 0.00 C ATOM 1723 O PHE A 106 -2.660 -1.080 7.172 1.00 0.00 O ATOM 1724 CB PHE A 106 -3.740 1.766 8.430 1.00 0.00 C ATOM 1725 CG PHE A 106 -3.898 2.635 9.676 1.00 0.00 C ATOM 1726 CD1 PHE A 106 -3.308 2.269 10.903 1.00 0.00 C ATOM 1727 CD2 PHE A 106 -4.810 3.709 9.651 1.00 0.00 C ATOM 1728 CE1 PHE A 106 -3.605 2.985 12.079 1.00 0.00 C ATOM 1729 CE2 PHE A 106 -5.125 4.410 10.829 1.00 0.00 C ATOM 1730 CZ PHE A 106 -4.522 4.049 12.043 1.00 0.00 C ATOM 0 H PHE A 106 -1.561 2.934 8.041 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.287 0.398 9.116 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.905 2.397 7.557 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.534 1.020 8.438 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -2.624 1.434 10.941 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.272 3.997 8.718 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -3.127 2.716 13.009 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.831 5.226 10.799 1.00 0.00 H new ATOM 0 HZ PHE A 106 -4.762 4.588 12.948 1.00 0.00 H new ATOM 1740 N ILE A 107 -2.069 0.607 5.815 1.00 0.00 N ATOM 1741 CA ILE A 107 -1.962 -0.324 4.691 1.00 0.00 C ATOM 1742 C ILE A 107 -0.741 -1.231 4.887 1.00 0.00 C ATOM 1743 O ILE A 107 -0.744 -2.370 4.418 1.00 0.00 O ATOM 1744 CB ILE A 107 -2.050 0.324 3.293 1.00 0.00 C ATOM 1745 CG1 ILE A 107 -2.577 -0.716 2.291 1.00 0.00 C ATOM 1746 CG2 ILE A 107 -0.695 0.845 2.808 1.00 0.00 C ATOM 1747 CD1 ILE A 107 -2.902 -0.130 0.912 1.00 0.00 C ATOM 0 H ILE A 107 -1.887 1.588 5.604 1.00 0.00 H new ATOM 0 HA ILE A 107 -2.856 -0.948 4.704 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.726 1.176 3.364 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.834 -1.505 2.175 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.474 -1.180 2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.809 1.292 1.820 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.323 1.596 3.505 1.00 0.00 H new ATOM 0 HG23 ILE A 107 0.014 0.019 2.753 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -3.268 -0.921 0.258 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -3.667 0.639 1.015 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -2.002 0.309 0.482 1.00 0.00 H new ATOM 1759 N SER A 108 0.324 -0.723 5.522 1.00 0.00 N ATOM 1760 CA SER A 108 1.462 -1.571 5.842 1.00 0.00 C ATOM 1761 C SER A 108 0.993 -2.702 6.766 1.00 0.00 C ATOM 1762 O SER A 108 1.289 -3.871 6.531 1.00 0.00 O ATOM 1763 CB SER A 108 2.613 -0.769 6.455 1.00 0.00 C ATOM 1764 OG SER A 108 3.032 0.248 5.567 1.00 0.00 O ATOM 0 H SER A 108 0.414 0.250 5.815 1.00 0.00 H new ATOM 0 HA SER A 108 1.857 -2.005 4.923 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.295 -0.328 7.399 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.448 -1.432 6.679 1.00 0.00 H new ATOM 0 HG SER A 108 2.320 0.914 5.473 1.00 0.00 H new ATOM 1770 N GLU A 109 0.247 -2.355 7.818 1.00 0.00 N ATOM 1771 CA GLU A 109 -0.322 -3.332 8.738 1.00 0.00 C ATOM 1772 C GLU A 109 -1.164 -4.348 7.957 1.00 0.00 C ATOM 1773 O GLU A 109 -1.018 -5.555 8.151 1.00 0.00 O ATOM 1774 CB GLU A 109 -1.143 -2.603 9.811 1.00 0.00 C ATOM 1775 CG GLU A 109 -1.708 -3.547 10.877 1.00 0.00 C ATOM 1776 CD GLU A 109 -2.584 -2.783 11.865 1.00 0.00 C ATOM 1777 OE1 GLU A 109 -3.686 -2.370 11.441 1.00 0.00 O ATOM 1778 OE2 GLU A 109 -2.135 -2.614 13.018 1.00 0.00 O ATOM 0 H GLU A 109 0.023 -1.388 8.052 1.00 0.00 H new ATOM 0 HA GLU A 109 0.471 -3.884 9.243 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -0.516 -1.853 10.293 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -1.965 -2.071 9.332 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -2.291 -4.335 10.400 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -0.890 -4.034 11.409 1.00 0.00 H new ATOM 1785 N ALA A 110 -2.058 -3.864 7.090 1.00 0.00 N ATOM 1786 CA ALA A 110 -2.902 -4.719 6.269 1.00 0.00 C ATOM 1787 C ALA A 110 -2.047 -5.689 5.450 1.00 0.00 C ATOM 1788 O ALA A 110 -2.145 -6.901 5.636 1.00 0.00 O ATOM 1789 CB ALA A 110 -3.826 -3.870 5.395 1.00 0.00 C ATOM 0 H ALA A 110 -2.213 -2.867 6.942 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.538 -5.325 6.915 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.452 -4.523 4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.459 -3.250 6.030 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.227 -3.232 4.745 1.00 0.00 H new ATOM 1795 N ILE A 111 -1.090 -5.194 4.653 1.00 0.00 N ATOM 1796 CA ILE A 111 -0.319 -6.123 3.834 1.00 0.00 C ATOM 1797 C ILE A 111 0.477 -7.103 4.703 1.00 0.00 C ATOM 1798 O ILE A 111 0.524 -8.291 4.393 1.00 0.00 O ATOM 1799 CB ILE A 111 0.522 -5.426 2.753 1.00 0.00 C ATOM 1800 CG1 ILE A 111 1.059 -6.488 1.778 1.00 0.00 C ATOM 1801 CG2 ILE A 111 1.677 -4.612 3.339 1.00 0.00 C ATOM 1802 CD1 ILE A 111 1.530 -5.877 0.461 1.00 0.00 C ATOM 0 H ILE A 111 -0.844 -4.208 4.562 1.00 0.00 H new ATOM 0 HA ILE A 111 -1.034 -6.722 3.270 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.122 -4.719 2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 111 1.886 -7.022 2.245 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.279 -7.222 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 111 2.237 -4.142 2.531 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.281 -3.843 4.002 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.337 -5.271 3.903 1.00 0.00 H new ATOM 0 HD11 ILE A 111 1.900 -6.666 -0.194 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.697 -5.366 -0.021 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.330 -5.163 0.657 1.00 0.00 H new ATOM 1814 N ILE A 112 1.044 -6.640 5.824 1.00 0.00 N ATOM 1815 CA ILE A 112 1.753 -7.523 6.746 1.00 0.00 C ATOM 1816 C ILE A 112 0.785 -8.614 7.220 1.00 0.00 C ATOM 1817 O ILE A 112 1.146 -9.790 7.252 1.00 0.00 O ATOM 1818 CB ILE A 112 2.389 -6.709 7.893 1.00 0.00 C ATOM 1819 CG1 ILE A 112 3.585 -5.916 7.332 1.00 0.00 C ATOM 1820 CG2 ILE A 112 2.851 -7.614 9.047 1.00 0.00 C ATOM 1821 CD1 ILE A 112 4.107 -4.841 8.290 1.00 0.00 C ATOM 0 H ILE A 112 1.023 -5.661 6.110 1.00 0.00 H new ATOM 0 HA ILE A 112 2.586 -8.020 6.249 1.00 0.00 H new ATOM 0 HB ILE A 112 1.638 -6.030 8.296 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.394 -6.609 7.100 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.291 -5.444 6.394 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.293 -7.003 9.834 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.996 -8.158 9.447 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.592 -8.323 8.679 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.948 -4.322 7.831 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.312 -4.126 8.503 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.432 -5.309 9.219 1.00 0.00 H new ATOM 1833 N HIS A 113 -0.454 -8.242 7.559 1.00 0.00 N ATOM 1834 CA HIS A 113 -1.467 -9.205 7.965 1.00 0.00 C ATOM 1835 C HIS A 113 -1.703 -10.228 6.850 1.00 0.00 C ATOM 1836 O HIS A 113 -1.684 -11.430 7.117 1.00 0.00 O ATOM 1837 CB HIS A 113 -2.771 -8.514 8.391 1.00 0.00 C ATOM 1838 CG HIS A 113 -3.791 -9.509 8.874 1.00 0.00 C ATOM 1839 ND1 HIS A 113 -3.866 -10.018 10.155 1.00 0.00 N ATOM 1840 CD2 HIS A 113 -4.603 -10.258 8.067 1.00 0.00 C ATOM 1841 CE1 HIS A 113 -4.738 -11.041 10.133 1.00 0.00 C ATOM 1842 NE2 HIS A 113 -5.194 -11.205 8.877 1.00 0.00 N ATOM 0 H HIS A 113 -0.774 -7.274 7.558 1.00 0.00 H new ATOM 0 HA HIS A 113 -1.098 -9.738 8.841 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -2.561 -7.794 9.182 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -3.178 -7.953 7.550 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -4.752 -10.132 7.005 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -5.027 -11.636 10.987 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.865 -11.912 8.575 1.00 0.00 H new ATOM 1851 N VAL A 114 -1.892 -9.771 5.602 1.00 0.00 N ATOM 1852 CA VAL A 114 -2.143 -10.685 4.485 1.00 0.00 C ATOM 1853 C VAL A 114 -0.967 -11.656 4.366 1.00 0.00 C ATOM 1854 O VAL A 114 -1.162 -12.868 4.444 1.00 0.00 O ATOM 1855 CB VAL A 114 -2.448 -9.955 3.158 1.00 0.00 C ATOM 1856 CG1 VAL A 114 -2.776 -10.975 2.059 1.00 0.00 C ATOM 1857 CG2 VAL A 114 -3.661 -9.036 3.354 1.00 0.00 C ATOM 0 H VAL A 114 -1.875 -8.784 5.346 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.051 -11.249 4.698 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.575 -9.372 2.865 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.990 -10.450 1.128 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.925 -11.640 1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.647 -11.560 2.354 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.880 -8.519 2.420 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.525 -9.632 3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.441 -8.304 4.131 1.00 0.00 H new ATOM 1867 N LEU A 115 0.258 -11.128 4.273 1.00 0.00 N ATOM 1868 CA LEU A 115 1.468 -11.932 4.163 1.00 0.00 C ATOM 1869 C LEU A 115 1.546 -12.962 5.289 1.00 0.00 C ATOM 1870 O LEU A 115 1.686 -14.157 5.037 1.00 0.00 O ATOM 1871 CB LEU A 115 2.707 -11.030 4.117 1.00 0.00 C ATOM 1872 CG LEU A 115 2.724 -10.105 2.888 1.00 0.00 C ATOM 1873 CD1 LEU A 115 3.942 -9.180 2.971 1.00 0.00 C ATOM 1874 CD2 LEU A 115 2.752 -10.895 1.576 1.00 0.00 C ATOM 0 H LEU A 115 0.433 -10.123 4.272 1.00 0.00 H new ATOM 0 HA LEU A 115 1.434 -12.490 3.227 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.744 -10.425 5.023 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.603 -11.651 4.112 1.00 0.00 H new ATOM 0 HG LEU A 115 1.806 -9.518 2.892 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.959 -8.522 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.882 -8.580 3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.853 -9.779 2.991 1.00 0.00 H new ATOM 0 HD21 LEU A 115 2.763 -10.202 0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 115 3.646 -11.518 1.545 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.867 -11.528 1.513 1.00 0.00 H new ATOM 1886 N HIS A 116 1.418 -12.524 6.541 1.00 0.00 N ATOM 1887 CA HIS A 116 1.464 -13.432 7.675 1.00 0.00 C ATOM 1888 C HIS A 116 0.388 -14.519 7.589 1.00 0.00 C ATOM 1889 O HIS A 116 0.689 -15.693 7.794 1.00 0.00 O ATOM 1890 CB HIS A 116 1.353 -12.628 8.975 1.00 0.00 C ATOM 1891 CG HIS A 116 1.641 -13.425 10.222 1.00 0.00 C ATOM 1892 ND1 HIS A 116 1.564 -14.800 10.363 1.00 0.00 N ATOM 1893 CD2 HIS A 116 1.991 -12.894 11.430 1.00 0.00 C ATOM 1894 CE1 HIS A 116 1.851 -15.094 11.644 1.00 0.00 C ATOM 1895 NE2 HIS A 116 2.112 -13.952 12.310 1.00 0.00 N ATOM 0 H HIS A 116 1.282 -11.544 6.791 1.00 0.00 H new ATOM 0 HA HIS A 116 2.421 -13.954 7.661 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.044 -11.786 8.928 1.00 0.00 H new ATOM 0 HB3 HIS A 116 0.348 -12.212 9.047 1.00 0.00 H new ATOM 0 HD1 HIS A 116 1.332 -15.469 9.629 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.144 -11.849 11.654 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.869 -16.086 12.070 1.00 0.00 H new ATOM 1904 N SER A 117 -0.851 -14.144 7.270 1.00 0.00 N ATOM 1905 CA SER A 117 -1.972 -15.071 7.260 1.00 0.00 C ATOM 1906 C SER A 117 -1.905 -16.054 6.086 1.00 0.00 C ATOM 1907 O SER A 117 -1.905 -17.265 6.283 1.00 0.00 O ATOM 1908 CB SER A 117 -3.272 -14.265 7.216 1.00 0.00 C ATOM 1909 OG SER A 117 -4.401 -15.109 7.368 1.00 0.00 O ATOM 0 H SER A 117 -1.101 -13.189 7.012 1.00 0.00 H new ATOM 0 HA SER A 117 -1.931 -15.673 8.168 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.266 -13.515 8.007 1.00 0.00 H new ATOM 0 HB3 SER A 117 -3.339 -13.729 6.269 1.00 0.00 H new ATOM 0 HG SER A 117 -4.989 -14.747 8.063 1.00 0.00 H new ATOM 1915 N ARG A 118 -1.817 -15.525 4.862 1.00 0.00 N ATOM 1916 CA ARG A 118 -1.887 -16.289 3.621 1.00 0.00 C ATOM 1917 C ARG A 118 -0.523 -16.785 3.134 1.00 0.00 C ATOM 1918 O ARG A 118 -0.477 -17.721 2.328 1.00 0.00 O ATOM 1919 CB ARG A 118 -2.605 -15.452 2.544 1.00 0.00 C ATOM 1920 CG ARG A 118 -4.131 -15.650 2.573 1.00 0.00 C ATOM 1921 CD ARG A 118 -4.832 -15.184 3.858 1.00 0.00 C ATOM 1922 NE ARG A 118 -4.965 -13.722 3.907 1.00 0.00 N ATOM 1923 CZ ARG A 118 -5.742 -13.068 4.784 1.00 0.00 C ATOM 1924 NH1 ARG A 118 -6.149 -13.658 5.913 1.00 0.00 N ATOM 1925 NH2 ARG A 118 -6.125 -11.817 4.517 1.00 0.00 N ATOM 0 H ARG A 118 -1.692 -14.525 4.707 1.00 0.00 H new ATOM 0 HA ARG A 118 -2.463 -17.192 3.823 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -2.375 -14.397 2.693 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -2.224 -15.726 1.560 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -4.566 -15.116 1.728 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -4.346 -16.708 2.426 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -5.820 -15.641 3.920 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -4.267 -15.527 4.725 1.00 0.00 H new ATOM 0 HE ARG A 118 -4.434 -13.170 3.233 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -5.869 -14.617 6.117 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -6.739 -13.149 6.570 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -5.827 -11.366 3.652 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -6.716 -11.312 5.178 1.00 0.00 H new ATOM 1939 N HIS A 119 0.595 -16.220 3.613 1.00 0.00 N ATOM 1940 CA HIS A 119 1.902 -16.635 3.143 1.00 0.00 C ATOM 1941 C HIS A 119 2.889 -16.937 4.282 1.00 0.00 C ATOM 1942 O HIS A 119 4.019 -16.450 4.244 1.00 0.00 O ATOM 1943 CB HIS A 119 2.433 -15.596 2.140 1.00 0.00 C ATOM 1944 CG HIS A 119 1.481 -15.341 0.997 1.00 0.00 C ATOM 1945 ND1 HIS A 119 1.344 -16.136 -0.126 1.00 0.00 N ATOM 1946 CD2 HIS A 119 0.567 -14.324 0.908 1.00 0.00 C ATOM 1947 CE1 HIS A 119 0.388 -15.590 -0.901 1.00 0.00 C ATOM 1948 NE2 HIS A 119 -0.092 -14.490 -0.291 1.00 0.00 N ATOM 0 H HIS A 119 0.610 -15.483 4.318 1.00 0.00 H new ATOM 0 HA HIS A 119 1.795 -17.589 2.627 1.00 0.00 H new ATOM 0 HB2 HIS A 119 2.624 -14.659 2.663 1.00 0.00 H new ATOM 0 HB3 HIS A 119 3.388 -15.939 1.741 1.00 0.00 H new ATOM 0 HD1 HIS A 119 1.872 -16.984 -0.331 1.00 0.00 H new ATOM 0 HD2 HIS A 119 0.396 -13.544 1.636 1.00 0.00 H new ATOM 0 HE1 HIS A 119 0.060 -15.972 -1.856 1.00 0.00 H new ATOM 1957 N PRO A 120 2.513 -17.731 5.301 1.00 0.00 N ATOM 1958 CA PRO A 120 3.410 -18.079 6.391 1.00 0.00 C ATOM 1959 C PRO A 120 4.529 -18.979 5.859 1.00 0.00 C ATOM 1960 O PRO A 120 4.430 -19.529 4.761 1.00 0.00 O ATOM 1961 CB PRO A 120 2.538 -18.794 7.425 1.00 0.00 C ATOM 1962 CG PRO A 120 1.452 -19.441 6.566 1.00 0.00 C ATOM 1963 CD PRO A 120 1.231 -18.392 5.477 1.00 0.00 C ATOM 0 HA PRO A 120 3.895 -17.212 6.839 1.00 0.00 H new ATOM 0 HB2 PRO A 120 3.104 -19.536 7.987 1.00 0.00 H new ATOM 0 HB3 PRO A 120 2.118 -18.097 8.150 1.00 0.00 H new ATOM 0 HG2 PRO A 120 1.776 -20.396 6.151 1.00 0.00 H new ATOM 0 HG3 PRO A 120 0.543 -19.633 7.136 1.00 0.00 H new ATOM 0 HD2 PRO A 120 0.899 -18.856 4.548 1.00 0.00 H new ATOM 0 HD3 PRO A 120 0.460 -17.679 5.771 1.00 0.00 H new ATOM 1971 N GLY A 121 5.626 -19.105 6.611 1.00 0.00 N ATOM 1972 CA GLY A 121 6.776 -19.897 6.188 1.00 0.00 C ATOM 1973 C GLY A 121 7.616 -19.078 5.209 1.00 0.00 C ATOM 1974 O GLY A 121 8.802 -18.837 5.435 1.00 0.00 O ATOM 0 H GLY A 121 5.738 -18.663 7.523 1.00 0.00 H new ATOM 0 HA2 GLY A 121 7.376 -20.180 7.053 1.00 0.00 H new ATOM 0 HA3 GLY A 121 6.443 -20.821 5.716 1.00 0.00 H new ATOM 1978 N ASP A 122 6.997 -18.648 4.108 1.00 0.00 N ATOM 1979 CA ASP A 122 7.647 -17.727 3.203 1.00 0.00 C ATOM 1980 C ASP A 122 7.773 -16.381 3.911 1.00 0.00 C ATOM 1981 O ASP A 122 8.820 -15.731 3.848 1.00 0.00 O ATOM 1982 CB ASP A 122 6.875 -17.635 1.881 1.00 0.00 C ATOM 1983 CG ASP A 122 7.299 -16.415 1.071 1.00 0.00 C ATOM 1984 OD1 ASP A 122 8.467 -16.399 0.625 1.00 0.00 O ATOM 1985 OD2 ASP A 122 6.441 -15.521 0.912 1.00 0.00 O ATOM 0 H ASP A 122 6.055 -18.925 3.832 1.00 0.00 H new ATOM 0 HA ASP A 122 8.646 -18.077 2.941 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.045 -18.539 1.296 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.806 -17.584 2.086 1.00 0.00 H new ATOM 1990 N PHE A 123 6.701 -15.927 4.566 1.00 0.00 N ATOM 1991 CA PHE A 123 6.776 -14.718 5.351 1.00 0.00 C ATOM 1992 C PHE A 123 7.322 -15.065 6.736 1.00 0.00 C ATOM 1993 O PHE A 123 6.628 -14.961 7.747 1.00 0.00 O ATOM 1994 CB PHE A 123 5.430 -13.982 5.373 1.00 0.00 C ATOM 1995 CG PHE A 123 5.524 -12.568 5.907 1.00 0.00 C ATOM 1996 CD1 PHE A 123 6.188 -11.581 5.157 1.00 0.00 C ATOM 1997 CD2 PHE A 123 4.873 -12.216 7.102 1.00 0.00 C ATOM 1998 CE1 PHE A 123 6.144 -10.240 5.568 1.00 0.00 C ATOM 1999 CE2 PHE A 123 4.769 -10.865 7.473 1.00 0.00 C ATOM 2000 CZ PHE A 123 5.397 -9.876 6.699 1.00 0.00 C ATOM 0 H PHE A 123 5.787 -16.380 4.562 1.00 0.00 H new ATOM 0 HA PHE A 123 7.468 -14.010 4.895 1.00 0.00 H new ATOM 0 HB2 PHE A 123 5.024 -13.954 4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 123 4.726 -14.547 5.984 1.00 0.00 H new ATOM 0 HD1 PHE A 123 6.732 -11.855 4.265 1.00 0.00 H new ATOM 0 HD2 PHE A 123 4.453 -12.984 7.735 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.685 -9.488 5.014 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.207 -10.587 8.352 1.00 0.00 H new ATOM 0 HZ PHE A 123 5.305 -8.836 6.974 1.00 0.00 H new ATOM 2010 N GLY A 124 8.562 -15.565 6.762 1.00 0.00 N ATOM 2011 CA GLY A 124 9.229 -15.904 8.003 1.00 0.00 C ATOM 2012 C GLY A 124 9.840 -14.648 8.622 1.00 0.00 C ATOM 2013 O GLY A 124 9.778 -13.572 8.033 1.00 0.00 O ATOM 0 H GLY A 124 9.119 -15.741 5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.519 -16.354 8.697 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.007 -16.645 7.818 1.00 0.00 H new ATOM 2017 N ALA A 125 10.453 -14.774 9.804 1.00 0.00 N ATOM 2018 CA ALA A 125 11.025 -13.637 10.527 1.00 0.00 C ATOM 2019 C ALA A 125 11.946 -12.802 9.629 1.00 0.00 C ATOM 2020 O ALA A 125 11.788 -11.589 9.507 1.00 0.00 O ATOM 2021 CB ALA A 125 11.782 -14.143 11.758 1.00 0.00 C ATOM 0 H ALA A 125 10.566 -15.667 10.284 1.00 0.00 H new ATOM 0 HA ALA A 125 10.211 -12.986 10.846 1.00 0.00 H new ATOM 0 HB1 ALA A 125 12.208 -13.296 12.297 1.00 0.00 H new ATOM 0 HB2 ALA A 125 11.095 -14.681 12.412 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.582 -14.813 11.443 1.00 0.00 H new ATOM 2027 N ASP A 126 12.886 -13.468 8.950 1.00 0.00 N ATOM 2028 CA ASP A 126 13.849 -12.821 8.065 1.00 0.00 C ATOM 2029 C ASP A 126 13.123 -11.988 7.008 1.00 0.00 C ATOM 2030 O ASP A 126 13.488 -10.844 6.754 1.00 0.00 O ATOM 2031 CB ASP A 126 14.723 -13.880 7.375 1.00 0.00 C ATOM 2032 CG ASP A 126 15.520 -14.702 8.379 1.00 0.00 C ATOM 2033 OD1 ASP A 126 14.880 -15.559 9.028 1.00 0.00 O ATOM 2034 OD2 ASP A 126 16.741 -14.457 8.484 1.00 0.00 O ATOM 0 H ASP A 126 12.997 -14.481 9.003 1.00 0.00 H new ATOM 0 HA ASP A 126 14.482 -12.164 8.662 1.00 0.00 H new ATOM 0 HB2 ASP A 126 14.091 -14.543 6.784 1.00 0.00 H new ATOM 0 HB3 ASP A 126 15.407 -13.390 6.682 1.00 0.00 H new ATOM 2039 N ALA A 127 12.101 -12.579 6.384 1.00 0.00 N ATOM 2040 CA ALA A 127 11.306 -11.915 5.363 1.00 0.00 C ATOM 2041 C ALA A 127 10.595 -10.708 5.981 1.00 0.00 C ATOM 2042 O ALA A 127 10.678 -9.604 5.454 1.00 0.00 O ATOM 2043 CB ALA A 127 10.320 -12.906 4.750 1.00 0.00 C ATOM 0 H ALA A 127 11.805 -13.536 6.578 1.00 0.00 H new ATOM 0 HA ALA A 127 11.949 -11.553 4.560 1.00 0.00 H new ATOM 0 HB1 ALA A 127 9.727 -12.404 3.986 1.00 0.00 H new ATOM 0 HB2 ALA A 127 10.868 -13.733 4.298 1.00 0.00 H new ATOM 0 HB3 ALA A 127 9.660 -13.290 5.527 1.00 0.00 H new ATOM 2049 N GLN A 128 9.947 -10.911 7.131 1.00 0.00 N ATOM 2050 CA GLN A 128 9.268 -9.859 7.873 1.00 0.00 C ATOM 2051 C GLN A 128 10.203 -8.671 8.095 1.00 0.00 C ATOM 2052 O GLN A 128 9.811 -7.529 7.874 1.00 0.00 O ATOM 2053 CB GLN A 128 8.742 -10.412 9.201 1.00 0.00 C ATOM 2054 CG GLN A 128 7.673 -9.490 9.800 1.00 0.00 C ATOM 2055 CD GLN A 128 6.902 -10.176 10.921 1.00 0.00 C ATOM 2056 OE1 GLN A 128 6.958 -9.759 12.072 1.00 0.00 O ATOM 2057 NE2 GLN A 128 6.167 -11.235 10.593 1.00 0.00 N ATOM 0 H GLN A 128 9.882 -11.827 7.575 1.00 0.00 H new ATOM 0 HA GLN A 128 8.417 -9.504 7.291 1.00 0.00 H new ATOM 0 HB2 GLN A 128 8.323 -11.406 9.044 1.00 0.00 H new ATOM 0 HB3 GLN A 128 9.567 -10.522 9.905 1.00 0.00 H new ATOM 0 HG2 GLN A 128 8.146 -8.586 10.184 1.00 0.00 H new ATOM 0 HG3 GLN A 128 6.980 -9.180 9.018 1.00 0.00 H new ATOM 0 HE21 GLN A 128 6.141 -11.558 9.626 1.00 0.00 H new ATOM 0 HE22 GLN A 128 5.629 -11.724 11.309 1.00 0.00 H new ATOM 2066 N GLY A 129 11.438 -8.940 8.520 1.00 0.00 N ATOM 2067 CA GLY A 129 12.436 -7.903 8.697 1.00 0.00 C ATOM 2068 C GLY A 129 12.796 -7.246 7.365 1.00 0.00 C ATOM 2069 O GLY A 129 12.849 -6.018 7.273 1.00 0.00 O ATOM 0 H GLY A 129 11.766 -9.879 8.748 1.00 0.00 H new ATOM 0 HA2 GLY A 129 12.060 -7.148 9.388 1.00 0.00 H new ATOM 0 HA3 GLY A 129 13.332 -8.330 9.148 1.00 0.00 H new ATOM 2073 N ALA A 130 13.082 -8.064 6.347 1.00 0.00 N ATOM 2074 CA ALA A 130 13.393 -7.589 5.010 1.00 0.00 C ATOM 2075 C ALA A 130 12.308 -6.654 4.482 1.00 0.00 C ATOM 2076 O ALA A 130 12.619 -5.686 3.795 1.00 0.00 O ATOM 2077 CB ALA A 130 13.628 -8.781 4.080 1.00 0.00 C ATOM 0 H ALA A 130 13.102 -9.080 6.436 1.00 0.00 H new ATOM 0 HA ALA A 130 14.310 -7.002 5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 130 13.861 -8.420 3.078 1.00 0.00 H new ATOM 0 HB2 ALA A 130 14.461 -9.376 4.454 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.730 -9.397 4.044 1.00 0.00 H new ATOM 2083 N MET A 131 11.042 -6.932 4.797 1.00 0.00 N ATOM 2084 CA MET A 131 9.921 -6.105 4.399 1.00 0.00 C ATOM 2085 C MET A 131 9.864 -4.854 5.285 1.00 0.00 C ATOM 2086 O MET A 131 9.952 -3.726 4.799 1.00 0.00 O ATOM 2087 CB MET A 131 8.635 -6.946 4.491 1.00 0.00 C ATOM 2088 CG MET A 131 7.455 -6.296 3.753 1.00 0.00 C ATOM 2089 SD MET A 131 7.595 -6.177 1.947 1.00 0.00 S ATOM 2090 CE MET A 131 7.799 -7.918 1.507 1.00 0.00 C ATOM 0 H MET A 131 10.772 -7.750 5.343 1.00 0.00 H new ATOM 0 HA MET A 131 10.033 -5.765 3.370 1.00 0.00 H new ATOM 0 HB2 MET A 131 8.821 -7.935 4.073 1.00 0.00 H new ATOM 0 HB3 MET A 131 8.371 -7.087 5.539 1.00 0.00 H new ATOM 0 HG2 MET A 131 6.553 -6.860 3.989 1.00 0.00 H new ATOM 0 HG3 MET A 131 7.316 -5.291 4.151 1.00 0.00 H new ATOM 0 HE1 MET A 131 7.633 -8.045 0.437 1.00 0.00 H new ATOM 0 HE2 MET A 131 8.809 -8.241 1.758 1.00 0.00 H new ATOM 0 HE3 MET A 131 7.078 -8.520 2.060 1.00 0.00 H new ATOM 2100 N ASN A 132 9.677 -5.066 6.592 1.00 0.00 N ATOM 2101 CA ASN A 132 9.539 -4.036 7.617 1.00 0.00 C ATOM 2102 C ASN A 132 10.623 -2.966 7.517 1.00 0.00 C ATOM 2103 O ASN A 132 10.347 -1.791 7.753 1.00 0.00 O ATOM 2104 CB ASN A 132 9.553 -4.684 9.006 1.00 0.00 C ATOM 2105 CG ASN A 132 9.411 -3.650 10.116 1.00 0.00 C ATOM 2106 OD1 ASN A 132 10.334 -3.435 10.895 1.00 0.00 O ATOM 2107 ND2 ASN A 132 8.255 -3.000 10.211 1.00 0.00 N ATOM 0 H ASN A 132 9.615 -6.008 6.979 1.00 0.00 H new ATOM 0 HA ASN A 132 8.585 -3.535 7.455 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.741 -5.407 9.077 1.00 0.00 H new ATOM 0 HB3 ASN A 132 10.484 -5.235 9.140 1.00 0.00 H new ATOM 0 HD21 ASN A 132 8.120 -2.304 10.944 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.503 -3.197 9.551 1.00 0.00 H new ATOM 2114 N LYS A 133 11.851 -3.371 7.192 1.00 0.00 N ATOM 2115 CA LYS A 133 12.982 -2.472 7.013 1.00 0.00 C ATOM 2116 C LYS A 133 13.599 -2.658 5.634 1.00 0.00 C ATOM 2117 O LYS A 133 14.812 -2.559 5.483 1.00 0.00 O ATOM 2118 CB LYS A 133 13.994 -2.635 8.161 1.00 0.00 C ATOM 2119 CG LYS A 133 13.421 -2.228 9.527 1.00 0.00 C ATOM 2120 CD LYS A 133 13.222 -0.708 9.635 1.00 0.00 C ATOM 2121 CE LYS A 133 12.570 -0.308 10.962 1.00 0.00 C ATOM 2122 NZ LYS A 133 11.154 -0.712 11.013 1.00 0.00 N ATOM 0 H LYS A 133 12.088 -4.352 7.044 1.00 0.00 H new ATOM 0 HA LYS A 133 12.633 -1.440 7.058 1.00 0.00 H new ATOM 0 HB2 LYS A 133 14.321 -3.674 8.205 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.877 -2.032 7.949 1.00 0.00 H new ATOM 0 HG2 LYS A 133 12.467 -2.731 9.685 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.093 -2.563 10.317 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.186 -0.208 9.540 1.00 0.00 H new ATOM 0 HD3 LYS A 133 12.601 -0.364 8.808 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.111 -0.770 11.788 1.00 0.00 H new ATOM 0 HE3 LYS A 133 12.646 0.771 11.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 10.722 -0.352 11.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 10.651 -0.320 10.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 11.088 -1.750 10.996 1.00 0.00 H new ATOM 2136 N ALA A 134 12.741 -2.774 4.612 1.00 0.00 N ATOM 2137 CA ALA A 134 13.150 -2.743 3.213 1.00 0.00 C ATOM 2138 C ALA A 134 13.948 -1.460 2.927 1.00 0.00 C ATOM 2139 O ALA A 134 14.809 -1.457 2.056 1.00 0.00 O ATOM 2140 CB ALA A 134 11.908 -2.841 2.325 1.00 0.00 C ATOM 0 H ALA A 134 11.736 -2.893 4.740 1.00 0.00 H new ATOM 0 HA ALA A 134 13.799 -3.591 2.994 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.207 -2.818 1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.385 -3.774 2.533 1.00 0.00 H new ATOM 0 HB3 ALA A 134 11.246 -2.000 2.531 1.00 0.00 H new ATOM 2146 N LEU A 135 13.694 -0.416 3.730 1.00 0.00 N ATOM 2147 CA LEU A 135 14.317 0.902 3.792 1.00 0.00 C ATOM 2148 C LEU A 135 13.295 1.931 4.262 1.00 0.00 C ATOM 2149 O LEU A 135 13.689 3.006 4.704 1.00 0.00 O ATOM 2150 CB LEU A 135 15.021 1.355 2.496 1.00 0.00 C ATOM 2151 CG LEU A 135 16.531 1.061 2.506 1.00 0.00 C ATOM 2152 CD1 LEU A 135 17.077 1.120 1.076 1.00 0.00 C ATOM 2153 CD2 LEU A 135 17.295 2.074 3.370 1.00 0.00 C ATOM 0 H LEU A 135 12.958 -0.492 4.432 1.00 0.00 H new ATOM 0 HA LEU A 135 15.127 0.820 4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 135 14.563 0.853 1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 135 14.864 2.425 2.357 1.00 0.00 H new ATOM 0 HG LEU A 135 16.673 0.066 2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 135 18.147 0.911 1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 135 16.568 0.377 0.461 1.00 0.00 H new ATOM 0 HD13 LEU A 135 16.905 2.113 0.662 1.00 0.00 H new ATOM 0 HD21 LEU A 135 18.359 1.836 3.354 1.00 0.00 H new ATOM 0 HD22 LEU A 135 17.142 3.078 2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 135 16.928 2.028 4.395 1.00 0.00 H new ATOM 2165 N GLU A 136 11.986 1.659 4.087 1.00 0.00 N ATOM 2166 CA GLU A 136 10.856 2.535 4.439 1.00 0.00 C ATOM 2167 C GLU A 136 10.753 3.774 3.540 1.00 0.00 C ATOM 2168 O GLU A 136 9.767 4.506 3.591 1.00 0.00 O ATOM 2169 CB GLU A 136 10.924 2.952 5.903 1.00 0.00 C ATOM 2170 CG GLU A 136 10.963 1.751 6.861 1.00 0.00 C ATOM 2171 CD GLU A 136 10.996 2.208 8.316 1.00 0.00 C ATOM 2172 OE1 GLU A 136 9.897 2.383 8.884 1.00 0.00 O ATOM 2173 OE2 GLU A 136 12.122 2.384 8.828 1.00 0.00 O ATOM 0 H GLU A 136 11.676 0.779 3.676 1.00 0.00 H new ATOM 0 HA GLU A 136 9.954 1.946 4.275 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.811 3.566 6.061 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.060 3.573 6.140 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.089 1.121 6.695 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.841 1.141 6.648 1.00 0.00 H new ATOM 2180 N LEU A 137 11.777 3.979 2.711 1.00 0.00 N ATOM 2181 CA LEU A 137 12.002 4.995 1.695 1.00 0.00 C ATOM 2182 C LEU A 137 10.731 5.431 0.976 1.00 0.00 C ATOM 2183 O LEU A 137 10.578 6.609 0.667 1.00 0.00 O ATOM 2184 CB LEU A 137 13.081 4.514 0.710 1.00 0.00 C ATOM 2185 CG LEU A 137 12.705 3.388 -0.280 1.00 0.00 C ATOM 2186 CD1 LEU A 137 13.977 2.994 -1.039 1.00 0.00 C ATOM 2187 CD2 LEU A 137 12.114 2.114 0.342 1.00 0.00 C ATOM 0 H LEU A 137 12.575 3.345 2.747 1.00 0.00 H new ATOM 0 HA LEU A 137 12.357 5.890 2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 137 13.411 5.375 0.128 1.00 0.00 H new ATOM 0 HB3 LEU A 137 13.938 4.175 1.292 1.00 0.00 H new ATOM 0 HG LEU A 137 11.916 3.798 -0.911 1.00 0.00 H new ATOM 0 HD11 LEU A 137 13.746 2.199 -1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 137 14.362 3.860 -1.577 1.00 0.00 H new ATOM 0 HD13 LEU A 137 14.728 2.643 -0.332 1.00 0.00 H new ATOM 0 HD21 LEU A 137 11.889 1.395 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 137 12.835 1.679 1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 137 11.199 2.362 0.879 1.00 0.00 H new ATOM 2199 N PHE A 138 9.779 4.507 0.821 1.00 0.00 N ATOM 2200 CA PHE A 138 8.492 4.775 0.214 1.00 0.00 C ATOM 2201 C PHE A 138 7.875 5.998 0.913 1.00 0.00 C ATOM 2202 O PHE A 138 7.604 7.020 0.290 1.00 0.00 O ATOM 2203 CB PHE A 138 7.638 3.507 0.357 1.00 0.00 C ATOM 2204 CG PHE A 138 6.204 3.694 -0.070 1.00 0.00 C ATOM 2205 CD1 PHE A 138 5.922 3.927 -1.425 1.00 0.00 C ATOM 2206 CD2 PHE A 138 5.227 3.956 0.904 1.00 0.00 C ATOM 2207 CE1 PHE A 138 4.648 4.388 -1.811 1.00 0.00 C ATOM 2208 CE2 PHE A 138 3.973 4.470 0.526 1.00 0.00 C ATOM 2209 CZ PHE A 138 3.683 4.700 -0.833 1.00 0.00 C ATOM 0 H PHE A 138 9.892 3.539 1.122 1.00 0.00 H new ATOM 0 HA PHE A 138 8.567 5.012 -0.847 1.00 0.00 H new ATOM 0 HB2 PHE A 138 8.084 2.710 -0.237 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.659 3.180 1.397 1.00 0.00 H new ATOM 0 HD1 PHE A 138 6.682 3.753 -2.172 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.439 3.763 1.945 1.00 0.00 H new ATOM 0 HE1 PHE A 138 4.411 4.502 -2.858 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.231 4.689 1.280 1.00 0.00 H new ATOM 0 HZ PHE A 138 2.728 5.112 -1.123 1.00 0.00 H new ATOM 2219 N ARG A 139 7.806 5.945 2.247 1.00 0.00 N ATOM 2220 CA ARG A 139 7.277 7.023 3.072 1.00 0.00 C ATOM 2221 C ARG A 139 8.175 8.260 3.001 1.00 0.00 C ATOM 2222 O ARG A 139 7.693 9.389 3.027 1.00 0.00 O ATOM 2223 CB ARG A 139 7.187 6.544 4.528 1.00 0.00 C ATOM 2224 CG ARG A 139 6.239 5.349 4.695 1.00 0.00 C ATOM 2225 CD ARG A 139 6.424 4.680 6.062 1.00 0.00 C ATOM 2226 NE ARG A 139 6.323 5.623 7.184 1.00 0.00 N ATOM 2227 CZ ARG A 139 5.178 6.087 7.700 1.00 0.00 C ATOM 2228 NH1 ARG A 139 4.017 5.868 7.075 1.00 0.00 N ATOM 2229 NH2 ARG A 139 5.198 6.762 8.853 1.00 0.00 N ATOM 0 H ARG A 139 8.122 5.139 2.786 1.00 0.00 H new ATOM 0 HA ARG A 139 6.289 7.293 2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 139 8.181 6.267 4.878 1.00 0.00 H new ATOM 0 HB3 ARG A 139 6.845 7.366 5.157 1.00 0.00 H new ATOM 0 HG2 ARG A 139 5.207 5.683 4.587 1.00 0.00 H new ATOM 0 HG3 ARG A 139 6.423 4.622 3.904 1.00 0.00 H new ATOM 0 HD2 ARG A 139 5.673 3.900 6.182 1.00 0.00 H new ATOM 0 HD3 ARG A 139 7.398 4.192 6.092 1.00 0.00 H new ATOM 0 HE ARG A 139 7.194 5.950 7.603 1.00 0.00 H new ATOM 0 HH11 ARG A 139 4.000 5.345 6.200 1.00 0.00 H new ATOM 0 HH12 ARG A 139 3.148 6.224 7.473 1.00 0.00 H new ATOM 0 HH21 ARG A 139 6.082 6.921 9.335 1.00 0.00 H new ATOM 0 HH22 ARG A 139 4.329 7.118 9.251 1.00 0.00 H new ATOM 2243 N LYS A 140 9.494 8.060 2.928 1.00 0.00 N ATOM 2244 CA LYS A 140 10.441 9.163 2.897 1.00 0.00 C ATOM 2245 C LYS A 140 10.282 10.018 1.639 1.00 0.00 C ATOM 2246 O LYS A 140 10.309 11.243 1.735 1.00 0.00 O ATOM 2247 CB LYS A 140 11.884 8.660 3.023 1.00 0.00 C ATOM 2248 CG LYS A 140 12.140 7.872 4.315 1.00 0.00 C ATOM 2249 CD LYS A 140 13.641 7.568 4.450 1.00 0.00 C ATOM 2250 CE LYS A 140 13.991 6.954 5.811 1.00 0.00 C ATOM 2251 NZ LYS A 140 13.342 5.648 6.018 1.00 0.00 N ATOM 0 H LYS A 140 9.926 7.137 2.889 1.00 0.00 H new ATOM 0 HA LYS A 140 10.219 9.794 3.757 1.00 0.00 H new ATOM 0 HB2 LYS A 140 12.117 8.027 2.167 1.00 0.00 H new ATOM 0 HB3 LYS A 140 12.563 9.512 2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 140 11.797 8.446 5.176 1.00 0.00 H new ATOM 0 HG3 LYS A 140 11.571 6.943 4.304 1.00 0.00 H new ATOM 0 HD2 LYS A 140 13.944 6.884 3.657 1.00 0.00 H new ATOM 0 HD3 LYS A 140 14.209 8.488 4.312 1.00 0.00 H new ATOM 0 HE2 LYS A 140 15.072 6.836 5.887 1.00 0.00 H new ATOM 0 HE3 LYS A 140 13.688 7.638 6.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 13.580 5.288 6.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 12.311 5.756 5.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 13.676 4.976 5.298 1.00 0.00 H new ATOM 2265 N ASP A 141 10.075 9.402 0.468 1.00 0.00 N ATOM 2266 CA ASP A 141 9.929 10.169 -0.762 1.00 0.00 C ATOM 2267 C ASP A 141 8.663 11.002 -0.654 1.00 0.00 C ATOM 2268 O ASP A 141 8.662 12.199 -0.932 1.00 0.00 O ATOM 2269 CB ASP A 141 9.864 9.245 -1.981 1.00 0.00 C ATOM 2270 CG ASP A 141 9.839 10.046 -3.282 1.00 0.00 C ATOM 2271 OD1 ASP A 141 8.761 10.593 -3.598 1.00 0.00 O ATOM 2272 OD2 ASP A 141 10.899 10.098 -3.943 1.00 0.00 O ATOM 0 H ASP A 141 10.007 8.391 0.353 1.00 0.00 H new ATOM 0 HA ASP A 141 10.794 10.818 -0.895 1.00 0.00 H new ATOM 0 HB2 ASP A 141 10.724 8.576 -1.980 1.00 0.00 H new ATOM 0 HB3 ASP A 141 8.974 8.619 -1.919 1.00 0.00 H new ATOM 2277 N ILE A 142 7.582 10.339 -0.244 1.00 0.00 N ATOM 2278 CA ILE A 142 6.292 10.972 -0.070 1.00 0.00 C ATOM 2279 C ILE A 142 6.415 12.134 0.925 1.00 0.00 C ATOM 2280 O ILE A 142 5.953 13.236 0.652 1.00 0.00 O ATOM 2281 CB ILE A 142 5.237 9.896 0.265 1.00 0.00 C ATOM 2282 CG1 ILE A 142 5.149 8.929 -0.930 1.00 0.00 C ATOM 2283 CG2 ILE A 142 3.874 10.515 0.564 1.00 0.00 C ATOM 2284 CD1 ILE A 142 3.899 8.043 -0.908 1.00 0.00 C ATOM 0 H ILE A 142 7.585 9.343 -0.024 1.00 0.00 H new ATOM 0 HA ILE A 142 5.937 11.437 -0.989 1.00 0.00 H new ATOM 0 HB ILE A 142 5.538 9.360 1.165 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.160 9.505 -1.855 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.035 8.294 -0.939 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.159 9.726 0.795 1.00 0.00 H new ATOM 0 HG22 ILE A 142 3.959 11.188 1.417 1.00 0.00 H new ATOM 0 HG23 ILE A 142 3.529 11.074 -0.306 1.00 0.00 H new ATOM 0 HD11 ILE A 142 3.902 7.387 -1.779 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.896 7.440 0.000 1.00 0.00 H new ATOM 0 HD13 ILE A 142 3.008 8.670 -0.930 1.00 0.00 H new ATOM 2296 N ALA A 143 7.096 11.924 2.050 1.00 0.00 N ATOM 2297 CA ALA A 143 7.302 12.937 3.076 1.00 0.00 C ATOM 2298 C ALA A 143 8.080 14.128 2.511 1.00 0.00 C ATOM 2299 O ALA A 143 7.714 15.283 2.726 1.00 0.00 O ATOM 2300 CB ALA A 143 8.041 12.325 4.267 1.00 0.00 C ATOM 0 H ALA A 143 7.527 11.027 2.275 1.00 0.00 H new ATOM 0 HA ALA A 143 6.331 13.300 3.413 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.193 13.087 5.032 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.450 11.508 4.681 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.008 11.943 3.938 1.00 0.00 H new ATOM 2306 N ALA A 144 9.176 13.847 1.809 1.00 0.00 N ATOM 2307 CA ALA A 144 9.974 14.883 1.184 1.00 0.00 C ATOM 2308 C ALA A 144 9.145 15.669 0.167 1.00 0.00 C ATOM 2309 O ALA A 144 9.237 16.896 0.110 1.00 0.00 O ATOM 2310 CB ALA A 144 11.208 14.253 0.538 1.00 0.00 C ATOM 0 H ALA A 144 9.528 12.901 1.662 1.00 0.00 H new ATOM 0 HA ALA A 144 10.304 15.592 1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 144 11.809 15.031 0.067 1.00 0.00 H new ATOM 0 HB2 ALA A 144 11.800 13.748 1.301 1.00 0.00 H new ATOM 0 HB3 ALA A 144 10.895 13.530 -0.216 1.00 0.00 H new ATOM 2316 N LYS A 145 8.343 14.975 -0.643 1.00 0.00 N ATOM 2317 CA LYS A 145 7.527 15.661 -1.635 1.00 0.00 C ATOM 2318 C LYS A 145 6.466 16.506 -0.934 1.00 0.00 C ATOM 2319 O LYS A 145 6.277 17.673 -1.270 1.00 0.00 O ATOM 2320 CB LYS A 145 6.939 14.664 -2.633 1.00 0.00 C ATOM 2321 CG LYS A 145 6.325 15.352 -3.866 1.00 0.00 C ATOM 2322 CD LYS A 145 7.376 16.048 -4.744 1.00 0.00 C ATOM 2323 CE LYS A 145 6.749 16.588 -6.034 1.00 0.00 C ATOM 2324 NZ LYS A 145 5.904 17.765 -5.770 1.00 0.00 N ATOM 0 H LYS A 145 8.244 13.960 -0.630 1.00 0.00 H new ATOM 0 HA LYS A 145 8.148 16.342 -2.217 1.00 0.00 H new ATOM 0 HB2 LYS A 145 7.720 13.976 -2.957 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.174 14.067 -2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 145 5.793 14.611 -4.463 1.00 0.00 H new ATOM 0 HG3 LYS A 145 5.589 16.086 -3.538 1.00 0.00 H new ATOM 0 HD2 LYS A 145 7.834 16.866 -4.188 1.00 0.00 H new ATOM 0 HD3 LYS A 145 8.172 15.345 -4.990 1.00 0.00 H new ATOM 0 HE2 LYS A 145 7.536 16.855 -6.739 1.00 0.00 H new ATOM 0 HE3 LYS A 145 6.151 15.807 -6.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 5.209 17.872 -6.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 5.406 17.639 -4.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 6.500 18.616 -5.722 1.00 0.00 H new ATOM 2338 N TYR A 146 5.845 15.958 0.110 1.00 0.00 N ATOM 2339 CA TYR A 146 4.865 16.673 0.910 1.00 0.00 C ATOM 2340 C TYR A 146 5.505 17.978 1.393 1.00 0.00 C ATOM 2341 O TYR A 146 5.004 19.066 1.121 1.00 0.00 O ATOM 2342 CB TYR A 146 4.458 15.808 2.104 1.00 0.00 C ATOM 2343 CG TYR A 146 3.414 14.732 1.877 1.00 0.00 C ATOM 2344 CD1 TYR A 146 3.123 14.181 0.609 1.00 0.00 C ATOM 2345 CD2 TYR A 146 2.719 14.264 3.002 1.00 0.00 C ATOM 2346 CE1 TYR A 146 2.108 13.219 0.484 1.00 0.00 C ATOM 2347 CE2 TYR A 146 1.677 13.343 2.860 1.00 0.00 C ATOM 2348 CZ TYR A 146 1.358 12.828 1.598 1.00 0.00 C ATOM 2349 OH TYR A 146 0.342 11.932 1.454 1.00 0.00 O ATOM 0 H TYR A 146 6.012 15.001 0.422 1.00 0.00 H new ATOM 0 HA TYR A 146 3.974 16.895 0.322 1.00 0.00 H new ATOM 0 HB2 TYR A 146 5.356 15.326 2.490 1.00 0.00 H new ATOM 0 HB3 TYR A 146 4.090 16.471 2.887 1.00 0.00 H new ATOM 0 HD1 TYR A 146 3.679 14.499 -0.261 1.00 0.00 H new ATOM 0 HD2 TYR A 146 2.991 14.618 3.985 1.00 0.00 H new ATOM 0 HE1 TYR A 146 1.905 12.777 -0.480 1.00 0.00 H new ATOM 0 HE2 TYR A 146 1.116 13.028 3.727 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.106 11.805 2.316 1.00 0.00 H new ATOM 2359 N LYS A 147 6.659 17.880 2.059 1.00 0.00 N ATOM 2360 CA LYS A 147 7.373 19.055 2.538 1.00 0.00 C ATOM 2361 C LYS A 147 7.687 20.014 1.384 1.00 0.00 C ATOM 2362 O LYS A 147 7.538 21.222 1.554 1.00 0.00 O ATOM 2363 CB LYS A 147 8.609 18.635 3.343 1.00 0.00 C ATOM 2364 CG LYS A 147 8.161 18.000 4.669 1.00 0.00 C ATOM 2365 CD LYS A 147 9.359 17.486 5.476 1.00 0.00 C ATOM 2366 CE LYS A 147 8.934 17.031 6.880 1.00 0.00 C ATOM 2367 NZ LYS A 147 7.942 15.939 6.834 1.00 0.00 N ATOM 0 H LYS A 147 7.115 16.994 2.277 1.00 0.00 H new ATOM 0 HA LYS A 147 6.734 19.614 3.222 1.00 0.00 H new ATOM 0 HB2 LYS A 147 9.206 17.925 2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.242 19.501 3.537 1.00 0.00 H new ATOM 0 HG2 LYS A 147 7.611 18.734 5.258 1.00 0.00 H new ATOM 0 HG3 LYS A 147 7.476 17.176 4.467 1.00 0.00 H new ATOM 0 HD2 LYS A 147 9.826 16.654 4.948 1.00 0.00 H new ATOM 0 HD3 LYS A 147 10.109 18.273 5.558 1.00 0.00 H new ATOM 0 HE2 LYS A 147 9.812 16.699 7.434 1.00 0.00 H new ATOM 0 HE3 LYS A 147 8.515 17.878 7.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 8.240 15.172 7.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 7.015 16.300 7.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 7.872 15.575 5.862 1.00 0.00 H new ATOM 2381 N GLU A 148 8.062 19.508 0.202 1.00 0.00 N ATOM 2382 CA GLU A 148 8.256 20.356 -0.972 1.00 0.00 C ATOM 2383 C GLU A 148 6.972 21.149 -1.273 1.00 0.00 C ATOM 2384 O GLU A 148 7.038 22.341 -1.566 1.00 0.00 O ATOM 2385 CB GLU A 148 8.703 19.515 -2.178 1.00 0.00 C ATOM 2386 CG GLU A 148 9.192 20.372 -3.352 1.00 0.00 C ATOM 2387 CD GLU A 148 9.355 19.517 -4.605 1.00 0.00 C ATOM 2388 OE1 GLU A 148 8.347 19.377 -5.330 1.00 0.00 O ATOM 2389 OE2 GLU A 148 10.476 18.999 -4.803 1.00 0.00 O ATOM 0 H GLU A 148 8.236 18.516 0.038 1.00 0.00 H new ATOM 0 HA GLU A 148 9.049 21.074 -0.764 1.00 0.00 H new ATOM 0 HB2 GLU A 148 9.502 18.841 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.871 18.893 -2.510 1.00 0.00 H new ATOM 0 HG2 GLU A 148 8.482 21.177 -3.543 1.00 0.00 H new ATOM 0 HG3 GLU A 148 10.143 20.840 -3.097 1.00 0.00 H new ATOM 2396 N LEU A 149 5.802 20.506 -1.174 1.00 0.00 N ATOM 2397 CA LEU A 149 4.507 21.163 -1.359 1.00 0.00 C ATOM 2398 C LEU A 149 4.127 22.033 -0.151 1.00 0.00 C ATOM 2399 O LEU A 149 3.047 22.619 -0.140 1.00 0.00 O ATOM 2400 CB LEU A 149 3.391 20.119 -1.592 1.00 0.00 C ATOM 2401 CG LEU A 149 3.622 19.207 -2.807 1.00 0.00 C ATOM 2402 CD1 LEU A 149 2.584 18.081 -2.776 1.00 0.00 C ATOM 2403 CD2 LEU A 149 3.502 19.976 -4.128 1.00 0.00 C ATOM 0 H LEU A 149 5.729 19.511 -0.962 1.00 0.00 H new ATOM 0 HA LEU A 149 4.604 21.804 -2.235 1.00 0.00 H new ATOM 0 HB2 LEU A 149 3.297 19.500 -0.700 1.00 0.00 H new ATOM 0 HB3 LEU A 149 2.442 20.641 -1.719 1.00 0.00 H new ATOM 0 HG LEU A 149 4.634 18.805 -2.750 1.00 0.00 H new ATOM 0 HD11 LEU A 149 2.734 17.424 -3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 149 2.696 17.508 -1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 149 1.582 18.508 -2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.672 19.295 -4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 149 2.504 20.407 -4.209 1.00 0.00 H new ATOM 0 HD23 LEU A 149 4.244 20.774 -4.153 1.00 0.00 H new ATOM 2415 N GLY A 150 4.952 22.075 0.900 1.00 0.00 N ATOM 2416 CA GLY A 150 4.632 22.781 2.132 1.00 0.00 C ATOM 2417 C GLY A 150 3.489 22.070 2.855 1.00 0.00 C ATOM 2418 O GLY A 150 2.719 22.685 3.598 1.00 0.00 O ATOM 0 H GLY A 150 5.863 21.616 0.914 1.00 0.00 H new ATOM 0 HA2 GLY A 150 5.511 22.824 2.776 1.00 0.00 H new ATOM 0 HA3 GLY A 150 4.349 23.810 1.909 1.00 0.00 H new ATOM 2422 N TYR A 151 3.353 20.763 2.625 1.00 0.00 N ATOM 2423 CA TYR A 151 2.329 19.960 3.220 1.00 0.00 C ATOM 2424 C TYR A 151 2.883 19.442 4.541 1.00 0.00 C ATOM 2425 O TYR A 151 3.999 18.924 4.602 1.00 0.00 O ATOM 2426 CB TYR A 151 1.951 18.867 2.221 1.00 0.00 C ATOM 2427 CG TYR A 151 0.811 18.008 2.676 1.00 0.00 C ATOM 2428 CD1 TYR A 151 1.046 17.037 3.655 1.00 0.00 C ATOM 2429 CD2 TYR A 151 -0.469 18.179 2.133 1.00 0.00 C ATOM 2430 CE1 TYR A 151 -0.011 16.251 4.130 1.00 0.00 C ATOM 2431 CE2 TYR A 151 -1.528 17.380 2.595 1.00 0.00 C ATOM 2432 CZ TYR A 151 -1.300 16.418 3.596 1.00 0.00 C ATOM 2433 OH TYR A 151 -2.317 15.620 4.024 1.00 0.00 O ATOM 0 H TYR A 151 3.972 20.240 2.006 1.00 0.00 H new ATOM 0 HA TYR A 151 1.412 20.505 3.443 1.00 0.00 H new ATOM 0 HB2 TYR A 151 1.689 19.330 1.270 1.00 0.00 H new ATOM 0 HB3 TYR A 151 2.821 18.236 2.039 1.00 0.00 H new ATOM 0 HD1 TYR A 151 2.043 16.893 4.045 1.00 0.00 H new ATOM 0 HD2 TYR A 151 -0.640 18.919 1.365 1.00 0.00 H new ATOM 0 HE1 TYR A 151 0.164 15.519 4.904 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -2.518 17.504 2.181 1.00 0.00 H new ATOM 0 HH TYR A 151 -2.856 16.103 4.685 1.00 0.00 H new ATOM 2443 N GLN A 152 2.108 19.613 5.612 1.00 0.00 N ATOM 2444 CA GLN A 152 2.508 19.259 6.960 1.00 0.00 C ATOM 2445 C GLN A 152 2.485 17.745 7.190 1.00 0.00 C ATOM 2446 O GLN A 152 1.703 17.228 7.985 1.00 0.00 O ATOM 2447 CB GLN A 152 1.647 20.055 7.953 1.00 0.00 C ATOM 2448 CG GLN A 152 1.633 21.563 7.632 1.00 0.00 C ATOM 2449 CD GLN A 152 3.039 22.150 7.511 1.00 0.00 C ATOM 2450 OE1 GLN A 152 3.772 22.200 8.493 1.00 0.00 O ATOM 2451 NE2 GLN A 152 3.446 22.589 6.322 1.00 0.00 N ATOM 0 H GLN A 152 1.169 20.009 5.559 1.00 0.00 H new ATOM 0 HA GLN A 152 3.550 19.536 7.123 1.00 0.00 H new ATOM 0 HB2 GLN A 152 0.627 19.672 7.935 1.00 0.00 H new ATOM 0 HB3 GLN A 152 2.027 19.904 8.963 1.00 0.00 H new ATOM 0 HG2 GLN A 152 1.093 21.727 6.700 1.00 0.00 H new ATOM 0 HG3 GLN A 152 1.088 22.092 8.414 1.00 0.00 H new ATOM 0 HE21 GLN A 152 2.820 22.538 5.518 1.00 0.00 H new ATOM 0 HE22 GLN A 152 4.384 22.976 6.215 1.00 0.00 H new ATOM 2460 N GLY A 153 3.375 17.028 6.503 1.00 0.00 N ATOM 2461 CA GLY A 153 3.514 15.588 6.637 1.00 0.00 C ATOM 2462 C GLY A 153 4.043 15.244 8.025 1.00 0.00 C ATOM 2463 O GLY A 153 5.257 15.210 8.226 1.00 0.00 O ATOM 0 H GLY A 153 4.024 17.440 5.832 1.00 0.00 H new ATOM 0 HA2 GLY A 153 2.551 15.104 6.475 1.00 0.00 H new ATOM 0 HA3 GLY A 153 4.194 15.207 5.875 1.00 0.00 H new TER 2467 GLY A 153 HETATM 2468 FE HEM A 154 -3.816 5.512 -2.808 1.00 0.00 FE HETATM 2469 CHA HEM A 154 -5.575 6.658 -5.521 1.00 0.00 C HETATM 2470 CHB HEM A 154 -1.437 4.163 -4.936 1.00 0.00 C HETATM 2471 CHC HEM A 154 -2.173 4.160 -0.151 1.00 0.00 C HETATM 2472 CHD HEM A 154 -6.289 6.668 -0.733 1.00 0.00 C HETATM 2473 NA HEM A 154 -3.600 5.356 -4.828 1.00 0.00 N HETATM 2474 C1A HEM A 154 -4.393 5.963 -5.786 1.00 0.00 C HETATM 2475 C2A HEM A 154 -3.816 5.775 -7.104 1.00 0.00 C HETATM 2476 C3A HEM A 154 -2.674 5.059 -6.937 1.00 0.00 C HETATM 2477 C4A HEM A 154 -2.533 4.802 -5.520 1.00 0.00 C HETATM 2478 CMA HEM A 154 -1.654 4.683 -7.982 1.00 0.00 C HETATM 2479 CAA HEM A 154 -4.354 6.371 -8.388 1.00 0.00 C HETATM 2480 CBA HEM A 154 -3.679 7.684 -8.801 1.00 0.00 C HETATM 2481 CGA HEM A 154 -3.475 8.642 -7.631 1.00 0.00 C HETATM 2482 O1A HEM A 154 -2.295 9.010 -7.447 1.00 0.00 O HETATM 2483 O2A HEM A 154 -4.484 9.221 -7.171 1.00 0.00 O HETATM 2484 NB HEM A 154 -2.115 4.430 -2.586 1.00 0.00 N HETATM 2485 C1B HEM A 154 -1.240 3.993 -3.567 1.00 0.00 C HETATM 2486 C2B HEM A 154 -0.125 3.290 -2.959 1.00 0.00 C HETATM 2487 C3B HEM A 154 -0.393 3.202 -1.631 1.00 0.00 C HETATM 2488 C4B HEM A 154 -1.609 3.947 -1.401 1.00 0.00 C HETATM 2489 CMB HEM A 154 1.070 2.742 -3.691 1.00 0.00 C HETATM 2490 CAB HEM A 154 0.418 2.530 -0.555 1.00 0.00 C HETATM 2491 CBB HEM A 154 0.713 1.228 -0.650 1.00 0.00 C HETATM 2492 NC HEM A 154 -4.087 5.552 -0.821 1.00 0.00 N HETATM 2493 C1C HEM A 154 -3.295 4.941 0.132 1.00 0.00 C HETATM 2494 C2C HEM A 154 -3.891 5.092 1.438 1.00 0.00 C HETATM 2495 C3C HEM A 154 -5.109 5.674 1.254 1.00 0.00 C HETATM 2496 C4C HEM A 154 -5.210 6.003 -0.148 1.00 0.00 C HETATM 2497 CMC HEM A 154 -3.263 4.604 2.714 1.00 0.00 C HETATM 2498 CAC HEM A 154 -6.182 5.999 2.262 1.00 0.00 C HETATM 2499 CBC HEM A 154 -6.364 5.269 3.364 1.00 0.00 C HETATM 2500 ND HEM A 154 -5.526 6.570 -3.065 1.00 0.00 N HETATM 2501 C1D HEM A 154 -6.428 6.950 -2.088 1.00 0.00 C HETATM 2502 C2D HEM A 154 -7.605 7.542 -2.692 1.00 0.00 C HETATM 2503 C3D HEM A 154 -7.454 7.435 -4.035 1.00 0.00 C HETATM 2504 C4D HEM A 154 -6.140 6.869 -4.267 1.00 0.00 C HETATM 2505 CMD HEM A 154 -8.797 8.079 -1.939 1.00 0.00 C HETATM 2506 CAD HEM A 154 -8.468 7.774 -5.101 1.00 0.00 C HETATM 2507 CBD HEM A 154 -9.229 6.547 -5.615 1.00 0.00 C HETATM 2508 CGD HEM A 154 -10.539 6.928 -6.291 1.00 0.00 C HETATM 2509 O1D HEM A 154 -11.592 6.674 -5.664 1.00 0.00 O HETATM 2510 O2D HEM A 154 -10.471 7.327 -7.471 1.00 0.00 O HETATM 0 HMA1 HEM A 154 -2.158 4.482 -8.927 1.00 0.00 H new HETATM 0 HMA2 HEM A 154 -1.116 3.791 -7.661 1.00 0.00 H new HETATM 0 HMA3 HEM A 154 -0.949 5.504 -8.114 1.00 0.00 H new HETATM 0 HMB1 HEM A 154 1.939 2.758 -3.033 1.00 0.00 H new HETATM 0 HMB2 HEM A 154 1.270 3.354 -4.571 1.00 0.00 H new HETATM 0 HMB3 HEM A 154 0.868 1.717 -4.001 1.00 0.00 H new HETATM 0 HMC1 HEM A 154 -3.570 5.246 3.539 1.00 0.00 H new HETATM 0 HMC2 HEM A 154 -2.178 4.630 2.618 1.00 0.00 H new HETATM 0 HMC3 HEM A 154 -3.586 3.582 2.911 1.00 0.00 H new HETATM 0 HMD1 HEM A 154 -8.919 7.525 -1.008 1.00 0.00 H new HETATM 0 HMD2 HEM A 154 -9.693 7.966 -2.549 1.00 0.00 H new HETATM 0 HMD3 HEM A 154 -8.641 9.134 -1.715 1.00 0.00 H new HETATM 0 HBB1 HEM A 154 1.300 0.744 0.130 1.00 0.00 H new HETATM 0 HBB2 HEM A 154 0.366 0.652 -1.508 1.00 0.00 H new HETATM 0 HBC1 HEM A 154 -7.151 5.535 4.070 1.00 0.00 H new HETATM 0 HBC2 HEM A 154 -5.726 4.407 3.558 1.00 0.00 H new HETATM 0 HBA1 HEM A 154 -4.285 8.174 -9.563 1.00 0.00 H new HETATM 0 HBA2 HEM A 154 -2.713 7.463 -9.255 1.00 0.00 H new HETATM 0 HAA1 HEM A 154 -5.424 6.545 -8.274 1.00 0.00 H new HETATM 0 HAA2 HEM A 154 -4.233 5.645 -9.192 1.00 0.00 H new HETATM 0 HBD1 HEM A 154 -9.433 5.873 -4.783 1.00 0.00 H new HETATM 0 HBD2 HEM A 154 -8.602 6.002 -6.321 1.00 0.00 H new HETATM 0 HAD1 HEM A 154 -7.961 8.257 -5.937 1.00 0.00 H new HETATM 0 HAD2 HEM A 154 -9.181 8.495 -4.701 1.00 0.00 H new HETATM 0 HHA HEM A 154 -6.100 7.071 -6.370 1.00 0.00 H new HETATM 0 HHB HEM A 154 -0.681 3.769 -5.599 1.00 0.00 H new HETATM 0 HHC HEM A 154 -1.696 3.673 0.687 1.00 0.00 H new HETATM 0 HHD HEM A 154 -7.084 6.991 -0.077 1.00 0.00 H new HETATM 0 HAB HEM A 154 0.766 3.105 0.303 1.00 0.00 H new HETATM 0 HAC HEM A 154 -6.830 6.858 2.085 1.00 0.00 H new HETATM 2541 C CMO A 155 -4.809 4.085 -2.700 1.00 0.00 C HETATM 2542 O CMO A 155 -5.471 3.193 -2.559 1.00 0.00 O