USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 659 hydrogens (20 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 64 ILE H : A 64 ILE N : A 168 RCY C1X :(H bumps) USER MOD NoAdj-H: A 110 RCYH1SA : A 110 RCY C1S : A 10 CYS SG :(H bumps) USER MOD NoAdj-H: A 121 RCYH1YB : A 121 RCY C1Y : A 70 TRP CE3 :(H bumps) USER MOD NoAdj-H: A 121 RCYH1YA : A 121 RCY C1Y : A 70 TRP CE3 :(H bumps) USER MOD NoAdj-H: A 121 RCYH1SA : A 121 RCY C1S : A 21 CYS SG :(H bumps) USER MOD NoAdj-H: A 121 RCY H1M : A 121 RCY C1M : A 70 TRP CE3 :(H bumps) USER MOD NoAdj-H: A 121 RCY H1L : A 121 RCY C1L : A 121 RCY C1U :(H bumps) USER MOD NoAdj-H: A 130 RCYH1ZB : A 130 RCY C1Z : A 173 RCY O1G :(H bumps) USER MOD NoAdj-H: A 130 RCYH1ZA : A 130 RCY C1Z : A 173 RCY O1G :(H bumps) USER MOD NoAdj-H: A 130 RCYH1SA : A 130 RCY C1S : A 30 CYS SG :(H bumps) USER MOD NoAdj-H: A 130 RCY H1Z : A 130 RCY C1Z : A 173 RCY O1G :(H bumps) USER MOD NoAdj-H: A 138 RCYH1SA : A 138 RCY C1S : A 38 CYS SG :(H bumps) USER MOD NoAdj-H: A 150 RCYH1SA : A 150 RCY C1S : A 50 CYS SG :(H bumps) USER MOD NoAdj-H: A 160 RCYH1ZA : A 160 RCY C1Z : A 168 RCY N1R :(H bumps) USER MOD NoAdj-H: A 160 RCYH1YB : A 160 RCY C1Y : A 168 RCY N1R :(H bumps) USER MOD NoAdj-H: A 160 RCYH1SA : A 160 RCY C1S : A 60 CYS SG :(H bumps) USER MOD NoAdj-H: A 160 RCYH1MA : A 160 RCY C1M : A 63 ASP CA :(H bumps) USER MOD NoAdj-H: A 160 RCYH1CB : A 160 RCY C1C : A 63 ASP OD1 :(H bumps) USER MOD NoAdj-H: A 160 RCY H1Z : A 160 RCY C1Z : A 168 RCY C1P :(H bumps) USER MOD NoAdj-H: A 160 RCY H1Y : A 160 RCY C1Y : A 168 RCY C1P :(H bumps) USER MOD NoAdj-H: A 160 RCY H1U : A 160 RCY C1U : A 63 ASP CA :(H bumps) USER MOD NoAdj-H: A 160 RCY H1M : A 160 RCY C1M : A 63 ASP CA :(H bumps) USER MOD NoAdj-H: A 168 RCYH1YA : A 168 RCY C1Y : A 61 GLY C :(H bumps) USER MOD NoAdj-H: A 168 RCYH1VB : A 168 RCY C1V : A 160 RCY C1U :(H bumps) USER MOD NoAdj-H: A 168 RCYH1VA : A 168 RCY C1V : A 62 THR C :(H bumps) USER MOD NoAdj-H: A 168 RCYH1SA : A 168 RCY C1S : A 68 CYS SG :(H bumps) USER MOD NoAdj-H: A 168 RCYH1MA : A 168 RCY C1M : A 160 RCY C1P :(H bumps) USER MOD NoAdj-H: A 168 RCYH1CA : A 168 RCY C1C : A 63 ASP C :(H bumps) USER MOD NoAdj-H: A 168 RCY H1Y : A 168 RCY C1Y : A 61 GLY C :(H bumps) USER MOD NoAdj-H: A 168 RCY H1V : A 168 RCY C1V : A 62 THR C :(H bumps) USER MOD NoAdj-H: A 168 RCY H1U : A 168 RCY C1U : A 160 RCY C1U :(H bumps) USER MOD NoAdj-H: A 168 RCY H1M : A 168 RCY C1M : A 160 RCY C1P :(H bumps) USER MOD NoAdj-H: A 173 RCYH1SA : A 173 RCY C1S : A 73 CYS SG :(H bumps) USER MOD NoAdj-H: A 176 RCYH1SA : A 176 RCY C1S : A 76 CYS SG :(H bumps) USER MOD NoAdj-H: A 187 RCYH1SA : A 187 RCY C1S : A 87 CYS SG :(H bumps) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= -0.0989 (180deg=-0.187) USER MOD Single : A 2 ASN :FLIP amide:sc= -2.42 F(o=-3.6!,f=-2.4) USER MOD Single : A 7 LYS NZ :NH3+ 140:sc= -0.123 (180deg=-0.827) USER MOD Single : A 12 SER OG : rot 180:sc= 0.139 USER MOD Single : A 14 THR OG1 : rot -39:sc= 0.173! USER MOD Single : A 17 MET CE :methyl 148:sc= -0.35 (180deg=-1.61!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0387 USER MOD Single : A 25 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.222) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= -1.8 (180deg=-1.92) USER MOD Single : A 31 LYS NZ :NH3+ 160:sc= -1.18 (180deg=-1.7) USER MOD Single : A 32 GLN : amide:sc= -3.22! C(o=-3.2!,f=-7.9!) USER MOD Single : A 34 GLN :FLIP amide:sc= -0.272 F(o=-1.1,f=-0.27) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.011 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 156:sc= -0.0927 (180deg=-0.611) USER MOD Single : A 44 LYS NZ :NH3+ -126:sc= -1.05 (180deg=-4.5!) USER MOD Single : A 45 LYS NZ :NH3+ 163:sc= -0.0661 (180deg=-0.619) USER MOD Single : A 48 GLN : amide:sc= -0.379! C(o=-0.38!,f=-1.6!) USER MOD Single : A 57 MET CE :methyl 152:sc= -0.297 (180deg=-1.63!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.022 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.956! C(o=-0.96!,f=-8.9!) USER MOD Single : A 75 HIS : no HD1:sc= -0.0105 X(o=-0.01,f=-0.01) USER MOD Single : A 79 HIS : no HD1:sc= -0.432 X(o=-0.43,f=-0.46) USER MOD Single : A 83 GLN : amide:sc= -0.987! X(o=-0.99!,f=-0.95) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 56.640 0.348 13.346 1.00 1.00 N ATOM 2 CA MET A 1 56.657 -1.108 13.032 1.00 1.00 C ATOM 3 C MET A 1 55.849 -1.361 11.755 1.00 1.00 C ATOM 4 O MET A 1 55.436 -2.470 11.480 1.00 1.00 O ATOM 5 CB MET A 1 56.038 -1.888 14.197 1.00 1.00 C ATOM 6 CG MET A 1 56.535 -3.335 14.166 1.00 1.00 C ATOM 7 SD MET A 1 55.593 -4.321 15.356 1.00 1.00 S ATOM 8 CE MET A 1 56.657 -5.785 15.328 1.00 1.00 C ATOM 0 H1 MET A 1 57.054 0.505 14.287 1.00 1.00 H new ATOM 0 H2 MET A 1 57.195 0.863 12.633 1.00 1.00 H new ATOM 0 H3 MET A 1 55.659 0.694 13.338 1.00 1.00 H new ATOM 0 HA MET A 1 57.685 -1.439 12.882 1.00 1.00 H new ATOM 0 HB2 MET A 1 56.306 -1.421 15.144 1.00 1.00 H new ATOM 0 HB3 MET A 1 54.951 -1.865 14.127 1.00 1.00 H new ATOM 0 HG2 MET A 1 56.421 -3.749 13.164 1.00 1.00 H new ATOM 0 HG3 MET A 1 57.597 -3.371 14.407 1.00 1.00 H new ATOM 0 HE1 MET A 1 56.256 -6.539 16.005 1.00 1.00 H new ATOM 0 HE2 MET A 1 56.694 -6.189 14.316 1.00 1.00 H new ATOM 0 HE3 MET A 1 57.663 -5.510 15.646 1.00 1.00 H new ATOM 17 N ASN A 2 55.621 -0.340 10.974 1.00 1.00 N ATOM 18 CA ASN A 2 54.841 -0.521 9.716 1.00 1.00 C ATOM 19 C ASN A 2 55.306 0.499 8.675 1.00 1.00 C ATOM 20 O ASN A 2 54.735 0.616 7.609 1.00 1.00 O ATOM 21 CB ASN A 2 53.352 -0.312 10.005 1.00 1.00 C ATOM 22 CG ASN A 2 52.929 -1.199 11.178 1.00 1.00 C ATOM 23 OD1 ASN A 2 53.052 -2.494 11.078 1.00 1.00 O flip ATOM 24 ND2 ASN A 2 52.483 -0.708 12.196 1.00 1.00 N flip ATOM 0 H ASN A 2 55.941 0.612 11.153 1.00 1.00 H new ATOM 0 HA ASN A 2 55.000 -1.529 9.332 1.00 1.00 H new ATOM 0 HB2 ASN A 2 53.160 0.735 10.240 1.00 1.00 H new ATOM 0 HB3 ASN A 2 52.762 -0.554 9.121 1.00 1.00 H new ATOM 0 HD21 ASN A 2 52.387 0.304 12.274 1.00 1.00 H new ATOM 0 HD22 ASN A 2 52.205 -1.308 12.972 1.00 1.00 H new ATOM 31 N LEU A 3 56.339 1.238 8.974 1.00 1.00 N ATOM 32 CA LEU A 3 56.839 2.248 7.999 1.00 1.00 C ATOM 33 C LEU A 3 57.129 1.562 6.661 1.00 1.00 C ATOM 34 O LEU A 3 56.454 1.789 5.677 1.00 1.00 O ATOM 35 CB LEU A 3 58.124 2.886 8.537 1.00 1.00 C ATOM 36 CG LEU A 3 57.769 3.971 9.555 1.00 1.00 C ATOM 37 CD1 LEU A 3 57.041 3.338 10.743 1.00 1.00 C ATOM 38 CD2 LEU A 3 59.050 4.647 10.046 1.00 1.00 C ATOM 0 H LEU A 3 56.858 1.186 9.851 1.00 1.00 H new ATOM 0 HA LEU A 3 56.084 3.021 7.856 1.00 1.00 H new ATOM 0 HB2 LEU A 3 58.752 2.127 9.003 1.00 1.00 H new ATOM 0 HB3 LEU A 3 58.700 3.316 7.717 1.00 1.00 H new ATOM 0 HG LEU A 3 57.123 4.712 9.085 1.00 1.00 H new ATOM 0 HD11 LEU A 3 56.788 4.111 11.469 1.00 1.00 H new ATOM 0 HD12 LEU A 3 56.128 2.854 10.395 1.00 1.00 H new ATOM 0 HD13 LEU A 3 57.688 2.597 11.213 1.00 1.00 H new ATOM 0 HD21 LEU A 3 58.798 5.420 10.772 1.00 1.00 H new ATOM 0 HD22 LEU A 3 59.696 3.905 10.516 1.00 1.00 H new ATOM 0 HD23 LEU A 3 59.570 5.098 9.201 1.00 1.00 H new ATOM 50 N GLU A 4 58.129 0.725 6.618 1.00 1.00 N ATOM 51 CA GLU A 4 58.463 0.026 5.345 1.00 1.00 C ATOM 52 C GLU A 4 57.271 -0.836 4.912 1.00 1.00 C ATOM 53 O GLU A 4 56.482 -1.268 5.730 1.00 1.00 O ATOM 54 CB GLU A 4 59.693 -0.863 5.565 1.00 1.00 C ATOM 55 CG GLU A 4 60.964 -0.031 5.386 1.00 1.00 C ATOM 56 CD GLU A 4 60.900 1.201 6.291 1.00 1.00 C ATOM 57 OE1 GLU A 4 60.089 2.071 6.019 1.00 1.00 O ATOM 58 OE2 GLU A 4 61.664 1.254 7.241 1.00 1.00 O ATOM 0 H GLU A 4 58.729 0.495 7.410 1.00 1.00 H new ATOM 0 HA GLU A 4 58.680 0.758 4.567 1.00 1.00 H new ATOM 0 HB2 GLU A 4 59.667 -1.296 6.565 1.00 1.00 H new ATOM 0 HB3 GLU A 4 59.686 -1.692 4.858 1.00 1.00 H new ATOM 0 HG2 GLU A 4 61.841 -0.630 5.631 1.00 1.00 H new ATOM 0 HG3 GLU A 4 61.068 0.275 4.345 1.00 1.00 H new ATOM 65 N PRO A 5 57.140 -1.084 3.633 1.00 1.00 N ATOM 66 CA PRO A 5 56.022 -1.908 3.082 1.00 1.00 C ATOM 67 C PRO A 5 56.042 -3.345 3.620 1.00 1.00 C ATOM 68 O PRO A 5 57.031 -3.802 4.157 1.00 1.00 O ATOM 69 CB PRO A 5 56.256 -1.895 1.562 1.00 1.00 C ATOM 70 CG PRO A 5 57.680 -1.484 1.375 1.00 1.00 C ATOM 71 CD PRO A 5 58.044 -0.610 2.575 1.00 1.00 C ATOM 0 HA PRO A 5 55.050 -1.507 3.368 1.00 1.00 H new ATOM 0 HB2 PRO A 5 56.072 -2.878 1.129 1.00 1.00 H new ATOM 0 HB3 PRO A 5 55.579 -1.198 1.068 1.00 1.00 H new ATOM 0 HG2 PRO A 5 58.331 -2.357 1.320 1.00 1.00 H new ATOM 0 HG3 PRO A 5 57.805 -0.933 0.443 1.00 1.00 H new ATOM 0 HD2 PRO A 5 59.090 -0.731 2.857 1.00 1.00 H new ATOM 0 HD3 PRO A 5 57.892 0.448 2.362 1.00 1.00 H new ATOM 79 N PRO A 6 54.949 -4.049 3.472 1.00 1.00 N ATOM 80 CA PRO A 6 54.824 -5.460 3.946 1.00 1.00 C ATOM 81 C PRO A 6 55.758 -6.410 3.188 1.00 1.00 C ATOM 82 O PRO A 6 56.288 -6.077 2.147 1.00 1.00 O ATOM 83 CB PRO A 6 53.354 -5.814 3.677 1.00 1.00 C ATOM 84 CG PRO A 6 52.896 -4.852 2.632 1.00 1.00 C ATOM 85 CD PRO A 6 53.713 -3.575 2.831 1.00 1.00 C ATOM 0 HA PRO A 6 55.105 -5.560 4.994 1.00 1.00 H new ATOM 0 HB2 PRO A 6 53.255 -6.843 3.333 1.00 1.00 H new ATOM 0 HB3 PRO A 6 52.756 -5.722 4.584 1.00 1.00 H new ATOM 0 HG2 PRO A 6 53.051 -5.261 1.633 1.00 1.00 H new ATOM 0 HG3 PRO A 6 51.830 -4.650 2.731 1.00 1.00 H new ATOM 0 HD2 PRO A 6 53.919 -3.079 1.882 1.00 1.00 H new ATOM 0 HD3 PRO A 6 53.186 -2.856 3.459 1.00 1.00 H new ATOM 93 N LYS A 7 55.962 -7.592 3.706 1.00 1.00 N ATOM 94 CA LYS A 7 56.861 -8.565 3.021 1.00 1.00 C ATOM 95 C LYS A 7 56.385 -9.990 3.319 1.00 1.00 C ATOM 96 O LYS A 7 56.566 -10.500 4.406 1.00 1.00 O ATOM 97 CB LYS A 7 58.291 -8.384 3.539 1.00 1.00 C ATOM 98 CG LYS A 7 58.253 -8.022 5.025 1.00 1.00 C ATOM 99 CD LYS A 7 59.668 -8.085 5.603 1.00 1.00 C ATOM 100 CE LYS A 7 59.621 -7.794 7.104 1.00 1.00 C ATOM 101 NZ LYS A 7 58.740 -8.792 7.775 1.00 1.00 N ATOM 0 H LYS A 7 55.544 -7.926 4.575 1.00 1.00 H new ATOM 0 HA LYS A 7 56.839 -8.392 1.945 1.00 1.00 H new ATOM 0 HB2 LYS A 7 58.861 -9.301 3.392 1.00 1.00 H new ATOM 0 HB3 LYS A 7 58.797 -7.600 2.976 1.00 1.00 H new ATOM 0 HG2 LYS A 7 57.840 -7.022 5.156 1.00 1.00 H new ATOM 0 HG3 LYS A 7 57.599 -8.710 5.561 1.00 1.00 H new ATOM 0 HD2 LYS A 7 60.101 -9.070 5.426 1.00 1.00 H new ATOM 0 HD3 LYS A 7 60.309 -7.360 5.101 1.00 1.00 H new ATOM 0 HE2 LYS A 7 60.625 -7.838 7.526 1.00 1.00 H new ATOM 0 HE3 LYS A 7 59.246 -6.786 7.278 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 59.163 -9.074 8.682 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 57.805 -8.370 7.945 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 58.637 -9.629 7.166 1.00 1.00 H new ATOM 115 N ALA A 8 55.777 -10.636 2.361 1.00 1.00 N ATOM 116 CA ALA A 8 55.291 -12.025 2.593 1.00 1.00 C ATOM 117 C ALA A 8 56.467 -13.000 2.510 1.00 1.00 C ATOM 118 O ALA A 8 56.537 -13.966 3.243 1.00 1.00 O ATOM 119 CB ALA A 8 54.253 -12.387 1.529 1.00 1.00 C ATOM 0 H ALA A 8 55.596 -10.262 1.429 1.00 1.00 H new ATOM 0 HA ALA A 8 54.836 -12.089 3.582 1.00 1.00 H new ATOM 0 HB1 ALA A 8 53.897 -13.403 1.699 1.00 1.00 H new ATOM 0 HB2 ALA A 8 53.414 -11.694 1.589 1.00 1.00 H new ATOM 0 HB3 ALA A 8 54.707 -12.322 0.540 1.00 1.00 H new ATOM 125 N GLU A 9 57.392 -12.756 1.621 1.00 1.00 N ATOM 126 CA GLU A 9 58.561 -13.671 1.494 1.00 1.00 C ATOM 127 C GLU A 9 59.592 -13.055 0.545 1.00 1.00 C ATOM 128 O GLU A 9 60.531 -12.411 0.968 1.00 1.00 O ATOM 129 CB GLU A 9 58.096 -15.019 0.938 1.00 1.00 C ATOM 130 CG GLU A 9 59.286 -15.978 0.863 1.00 1.00 C ATOM 131 CD GLU A 9 58.778 -17.407 0.659 1.00 1.00 C ATOM 132 OE1 GLU A 9 58.109 -17.909 1.548 1.00 1.00 O ATOM 133 OE2 GLU A 9 59.066 -17.975 -0.381 1.00 1.00 O ATOM 0 H GLU A 9 57.388 -11.964 0.979 1.00 1.00 H new ATOM 0 HA GLU A 9 59.014 -13.819 2.474 1.00 1.00 H new ATOM 0 HB2 GLU A 9 57.317 -15.438 1.575 1.00 1.00 H new ATOM 0 HB3 GLU A 9 57.660 -14.885 -0.052 1.00 1.00 H new ATOM 0 HG2 GLU A 9 59.944 -15.694 0.042 1.00 1.00 H new ATOM 0 HG3 GLU A 9 59.874 -15.917 1.779 1.00 1.00 H new ATOM 140 N CYS A 10 59.425 -13.248 -0.735 1.00 1.00 N ATOM 141 CA CYS A 10 60.398 -12.675 -1.708 1.00 1.00 C ATOM 142 C CYS A 10 60.149 -11.172 -1.852 1.00 1.00 C ATOM 143 O CYS A 10 60.264 -10.615 -2.926 1.00 1.00 O ATOM 144 CB CYS A 10 60.220 -13.355 -3.067 1.00 1.00 C ATOM 145 SG CYS A 10 60.955 -15.008 -3.015 1.00 1.00 S ATOM 0 H CYS A 10 58.657 -13.777 -1.149 1.00 1.00 H new ATOM 0 HA CYS A 10 61.413 -12.842 -1.349 1.00 1.00 H new ATOM 0 HB2 CYS A 10 59.161 -13.424 -3.315 1.00 1.00 H new ATOM 0 HB3 CYS A 10 60.692 -12.760 -3.848 1.00 1.00 H new ATOM 150 N ARG A 11 59.811 -10.511 -0.779 1.00 1.00 N ATOM 151 CA ARG A 11 59.557 -9.044 -0.853 1.00 1.00 C ATOM 152 C ARG A 11 58.542 -8.754 -1.962 1.00 1.00 C ATOM 153 O ARG A 11 58.876 -8.721 -3.130 1.00 1.00 O ATOM 154 CB ARG A 11 60.867 -8.313 -1.157 1.00 1.00 C ATOM 155 CG ARG A 11 60.609 -6.806 -1.221 1.00 1.00 C ATOM 156 CD ARG A 11 61.940 -6.056 -1.143 1.00 1.00 C ATOM 157 NE ARG A 11 62.927 -6.699 -2.056 1.00 1.00 N ATOM 158 CZ ARG A 11 62.865 -6.482 -3.341 1.00 1.00 C ATOM 159 NH1 ARG A 11 61.940 -5.701 -3.827 1.00 1.00 N ATOM 160 NH2 ARG A 11 63.730 -7.045 -4.140 1.00 1.00 N ATOM 0 H ARG A 11 59.700 -10.924 0.147 1.00 1.00 H new ATOM 0 HA ARG A 11 59.160 -8.697 0.101 1.00 1.00 H new ATOM 0 HB2 ARG A 11 61.606 -8.534 -0.387 1.00 1.00 H new ATOM 0 HB3 ARG A 11 61.279 -8.662 -2.104 1.00 1.00 H new ATOM 0 HG2 ARG A 11 60.091 -6.554 -2.147 1.00 1.00 H new ATOM 0 HG3 ARG A 11 59.960 -6.502 -0.400 1.00 1.00 H new ATOM 0 HD2 ARG A 11 61.798 -5.012 -1.421 1.00 1.00 H new ATOM 0 HD3 ARG A 11 62.315 -6.065 -0.120 1.00 1.00 H new ATOM 0 HE ARG A 11 63.651 -7.309 -1.676 1.00 1.00 H new ATOM 0 HH11 ARG A 11 61.265 -5.260 -3.202 1.00 1.00 H new ATOM 0 HH12 ARG A 11 61.892 -5.531 -4.832 1.00 1.00 H new ATOM 0 HH21 ARG A 11 64.454 -7.654 -3.760 1.00 1.00 H new ATOM 0 HH22 ARG A 11 63.682 -6.876 -5.145 1.00 1.00 H new ATOM 174 N SER A 12 57.305 -8.540 -1.605 1.00 1.00 N ATOM 175 CA SER A 12 56.270 -8.250 -2.638 1.00 1.00 C ATOM 176 C SER A 12 56.357 -9.290 -3.757 1.00 1.00 C ATOM 177 O SER A 12 56.496 -10.471 -3.509 1.00 1.00 O ATOM 178 CB SER A 12 56.507 -6.855 -3.218 1.00 1.00 C ATOM 179 OG SER A 12 55.353 -6.444 -3.938 1.00 1.00 O ATOM 0 H SER A 12 56.966 -8.553 -0.643 1.00 1.00 H new ATOM 0 HA SER A 12 55.281 -8.291 -2.182 1.00 1.00 H new ATOM 0 HB2 SER A 12 56.721 -6.147 -2.417 1.00 1.00 H new ATOM 0 HB3 SER A 12 57.376 -6.865 -3.876 1.00 1.00 H new ATOM 0 HG SER A 12 55.501 -5.549 -4.310 1.00 1.00 H new ATOM 185 N ALA A 13 56.275 -8.860 -4.987 1.00 1.00 N ATOM 186 CA ALA A 13 56.352 -9.826 -6.120 1.00 1.00 C ATOM 187 C ALA A 13 56.776 -9.089 -7.392 1.00 1.00 C ATOM 188 O ALA A 13 56.854 -9.667 -8.458 1.00 1.00 O ATOM 189 CB ALA A 13 54.980 -10.467 -6.337 1.00 1.00 C ATOM 0 H ALA A 13 56.158 -7.883 -5.256 1.00 1.00 H new ATOM 0 HA ALA A 13 57.083 -10.600 -5.888 1.00 1.00 H new ATOM 0 HB1 ALA A 13 55.035 -11.173 -7.165 1.00 1.00 H new ATOM 0 HB2 ALA A 13 54.677 -10.992 -5.432 1.00 1.00 H new ATOM 0 HB3 ALA A 13 54.249 -9.692 -6.569 1.00 1.00 H new ATOM 195 N THR A 14 57.050 -7.817 -7.291 1.00 1.00 N ATOM 196 CA THR A 14 57.468 -7.048 -8.497 1.00 1.00 C ATOM 197 C THR A 14 58.226 -5.791 -8.064 1.00 1.00 C ATOM 198 O THR A 14 58.071 -4.733 -8.640 1.00 1.00 O ATOM 199 CB THR A 14 56.227 -6.648 -9.302 1.00 1.00 C ATOM 200 OG1 THR A 14 55.301 -7.725 -9.308 1.00 1.00 O ATOM 201 CG2 THR A 14 56.634 -6.314 -10.738 1.00 1.00 C ATOM 0 H THR A 14 57.003 -7.278 -6.427 1.00 1.00 H new ATOM 0 HA THR A 14 58.118 -7.666 -9.116 1.00 1.00 H new ATOM 0 HB THR A 14 55.764 -5.773 -8.846 1.00 1.00 H new ATOM 0 HG1 THR A 14 55.786 -8.573 -9.388 1.00 1.00 H new ATOM 0 HG21 THR A 14 55.751 -6.030 -11.310 1.00 1.00 H new ATOM 0 HG22 THR A 14 57.344 -5.487 -10.732 1.00 1.00 H new ATOM 0 HG23 THR A 14 57.098 -7.187 -11.197 1.00 1.00 H new ATOM 209 N ARG A 15 59.045 -5.898 -7.054 1.00 1.00 N ATOM 210 CA ARG A 15 59.811 -4.709 -6.586 1.00 1.00 C ATOM 211 C ARG A 15 58.857 -3.526 -6.406 1.00 1.00 C ATOM 212 O ARG A 15 58.530 -2.829 -7.345 1.00 1.00 O ATOM 213 CB ARG A 15 60.880 -4.354 -7.622 1.00 1.00 C ATOM 214 CG ARG A 15 61.877 -5.508 -7.742 1.00 1.00 C ATOM 215 CD ARG A 15 62.754 -5.300 -8.978 1.00 1.00 C ATOM 216 NE ARG A 15 63.758 -6.398 -9.066 1.00 1.00 N ATOM 217 CZ ARG A 15 64.752 -6.442 -8.222 1.00 1.00 C ATOM 218 NH1 ARG A 15 64.868 -5.524 -7.301 1.00 1.00 N ATOM 219 NH2 ARG A 15 65.631 -7.403 -8.299 1.00 1.00 N ATOM 0 H ARG A 15 59.217 -6.758 -6.533 1.00 1.00 H new ATOM 0 HA ARG A 15 60.290 -4.935 -5.633 1.00 1.00 H new ATOM 0 HB2 ARG A 15 60.415 -4.159 -8.588 1.00 1.00 H new ATOM 0 HB3 ARG A 15 61.398 -3.441 -7.328 1.00 1.00 H new ATOM 0 HG2 ARG A 15 62.498 -5.560 -6.848 1.00 1.00 H new ATOM 0 HG3 ARG A 15 61.344 -6.456 -7.817 1.00 1.00 H new ATOM 0 HD2 ARG A 15 62.137 -5.284 -9.876 1.00 1.00 H new ATOM 0 HD3 ARG A 15 63.258 -4.335 -8.921 1.00 1.00 H new ATOM 0 HE ARG A 15 63.668 -7.115 -9.786 1.00 1.00 H new ATOM 0 HH11 ARG A 15 64.181 -4.772 -7.241 1.00 1.00 H new ATOM 0 HH12 ARG A 15 65.645 -5.559 -6.641 1.00 1.00 H new ATOM 0 HH21 ARG A 15 65.541 -8.120 -9.019 1.00 1.00 H new ATOM 0 HH22 ARG A 15 66.408 -7.437 -7.639 1.00 1.00 H new ATOM 233 N VAL A 16 58.405 -3.298 -5.203 1.00 1.00 N ATOM 234 CA VAL A 16 57.468 -2.165 -4.956 1.00 1.00 C ATOM 235 C VAL A 16 57.981 -0.905 -5.657 1.00 1.00 C ATOM 236 O VAL A 16 57.256 0.053 -5.838 1.00 1.00 O ATOM 237 CB VAL A 16 57.369 -1.906 -3.452 1.00 1.00 C ATOM 238 CG1 VAL A 16 56.846 -3.161 -2.750 1.00 1.00 C ATOM 239 CG2 VAL A 16 58.754 -1.557 -2.904 1.00 1.00 C ATOM 0 H VAL A 16 58.645 -3.849 -4.379 1.00 1.00 H new ATOM 0 HA VAL A 16 56.484 -2.420 -5.350 1.00 1.00 H new ATOM 0 HB VAL A 16 56.685 -1.077 -3.271 1.00 1.00 H new ATOM 0 HG11 VAL A 16 56.776 -2.976 -1.678 1.00 1.00 H new ATOM 0 HG12 VAL A 16 55.860 -3.412 -3.140 1.00 1.00 H new ATOM 0 HG13 VAL A 16 57.530 -3.991 -2.931 1.00 1.00 H new ATOM 0 HG21 VAL A 16 58.685 -1.372 -1.832 1.00 1.00 H new ATOM 0 HG22 VAL A 16 59.437 -2.387 -3.086 1.00 1.00 H new ATOM 0 HG23 VAL A 16 59.128 -0.663 -3.403 1.00 1.00 H new ATOM 249 N MET A 17 59.225 -0.895 -6.053 1.00 1.00 N ATOM 250 CA MET A 17 59.776 0.307 -6.740 1.00 1.00 C ATOM 251 C MET A 17 61.118 -0.043 -7.386 1.00 1.00 C ATOM 252 O MET A 17 62.121 -0.190 -6.716 1.00 1.00 O ATOM 253 CB MET A 17 59.978 1.429 -5.719 1.00 1.00 C ATOM 254 CG MET A 17 60.294 2.735 -6.450 1.00 1.00 C ATOM 255 SD MET A 17 58.825 3.293 -7.350 1.00 1.00 S ATOM 256 CE MET A 17 57.800 3.660 -5.905 1.00 1.00 C ATOM 0 H MET A 17 59.882 -1.666 -5.931 1.00 1.00 H new ATOM 0 HA MET A 17 59.079 0.637 -7.510 1.00 1.00 H new ATOM 0 HB2 MET A 17 59.081 1.548 -5.112 1.00 1.00 H new ATOM 0 HB3 MET A 17 60.791 1.174 -5.040 1.00 1.00 H new ATOM 0 HG2 MET A 17 60.608 3.497 -5.737 1.00 1.00 H new ATOM 0 HG3 MET A 17 61.123 2.586 -7.142 1.00 1.00 H new ATOM 0 HE1 MET A 17 57.134 4.492 -6.133 1.00 1.00 H new ATOM 0 HE2 MET A 17 57.208 2.782 -5.646 1.00 1.00 H new ATOM 0 HE3 MET A 17 58.439 3.927 -5.064 1.00 1.00 H new ATOM 266 N GLY A 18 61.146 -0.176 -8.684 1.00 1.00 N ATOM 267 CA GLY A 18 62.424 -0.515 -9.371 1.00 1.00 C ATOM 268 C GLY A 18 62.301 -0.203 -10.864 1.00 1.00 C ATOM 269 O GLY A 18 62.530 -1.048 -11.705 1.00 1.00 O ATOM 0 H GLY A 18 60.339 -0.065 -9.298 1.00 1.00 H new ATOM 0 HA2 GLY A 18 63.245 0.055 -8.936 1.00 1.00 H new ATOM 0 HA3 GLY A 18 62.657 -1.570 -9.227 1.00 1.00 H new ATOM 273 N GLY A 19 61.943 1.007 -11.199 1.00 1.00 N ATOM 274 CA GLY A 19 61.808 1.371 -12.638 1.00 1.00 C ATOM 275 C GLY A 19 63.198 1.488 -13.267 1.00 1.00 C ATOM 276 O GLY A 19 64.196 1.175 -12.649 1.00 1.00 O ATOM 0 H GLY A 19 61.739 1.758 -10.540 1.00 1.00 H new ATOM 0 HA2 GLY A 19 61.222 0.615 -13.162 1.00 1.00 H new ATOM 0 HA3 GLY A 19 61.272 2.315 -12.737 1.00 1.00 H new ATOM 280 N PRO A 20 63.257 1.936 -14.492 1.00 1.00 N ATOM 281 CA PRO A 20 64.542 2.100 -15.230 1.00 1.00 C ATOM 282 C PRO A 20 65.611 2.802 -14.384 1.00 1.00 C ATOM 283 O PRO A 20 65.718 4.012 -14.377 1.00 1.00 O ATOM 284 CB PRO A 20 64.156 2.958 -16.439 1.00 1.00 C ATOM 285 CG PRO A 20 62.711 2.670 -16.675 1.00 1.00 C ATOM 286 CD PRO A 20 62.101 2.335 -15.311 1.00 1.00 C ATOM 0 HA PRO A 20 64.982 1.141 -15.502 1.00 1.00 H new ATOM 0 HB2 PRO A 20 64.319 4.017 -16.239 1.00 1.00 H new ATOM 0 HB3 PRO A 20 64.757 2.702 -17.312 1.00 1.00 H new ATOM 0 HG2 PRO A 20 62.213 3.531 -17.121 1.00 1.00 H new ATOM 0 HG3 PRO A 20 62.590 1.837 -17.368 1.00 1.00 H new ATOM 0 HD2 PRO A 20 61.586 3.195 -14.882 1.00 1.00 H new ATOM 0 HD3 PRO A 20 61.369 1.531 -15.388 1.00 1.00 H new ATOM 294 N CYS A 21 66.403 2.049 -13.669 1.00 1.00 N ATOM 295 CA CYS A 21 67.461 2.671 -12.825 1.00 1.00 C ATOM 296 C CYS A 21 68.445 3.429 -13.718 1.00 1.00 C ATOM 297 O CYS A 21 69.363 2.856 -14.272 1.00 1.00 O ATOM 298 CB CYS A 21 68.208 1.579 -12.055 1.00 1.00 C ATOM 299 SG CYS A 21 67.200 1.030 -10.655 1.00 1.00 S ATOM 0 H CYS A 21 66.362 1.030 -13.634 1.00 1.00 H new ATOM 0 HA CYS A 21 67.002 3.364 -12.119 1.00 1.00 H new ATOM 0 HB2 CYS A 21 68.424 0.738 -12.714 1.00 1.00 H new ATOM 0 HB3 CYS A 21 69.166 1.960 -11.700 1.00 1.00 H new ATOM 304 N THR A 22 68.264 4.715 -13.861 1.00 1.00 N ATOM 305 CA THR A 22 69.190 5.513 -14.716 1.00 1.00 C ATOM 306 C THR A 22 70.255 6.167 -13.827 1.00 1.00 C ATOM 307 O THR A 22 70.013 6.445 -12.669 1.00 1.00 O ATOM 308 CB THR A 22 68.394 6.600 -15.446 1.00 1.00 C ATOM 309 OG1 THR A 22 67.441 7.165 -14.556 1.00 1.00 O ATOM 310 CG2 THR A 22 67.673 5.987 -16.648 1.00 1.00 C ATOM 0 H THR A 22 67.513 5.248 -13.422 1.00 1.00 H new ATOM 0 HA THR A 22 69.672 4.864 -15.447 1.00 1.00 H new ATOM 0 HB THR A 22 69.074 7.378 -15.792 1.00 1.00 H new ATOM 0 HG1 THR A 22 66.932 7.862 -15.021 1.00 1.00 H new ATOM 0 HG21 THR A 22 67.107 6.761 -17.166 1.00 1.00 H new ATOM 0 HG22 THR A 22 68.405 5.555 -17.330 1.00 1.00 H new ATOM 0 HG23 THR A 22 66.992 5.208 -16.305 1.00 1.00 H new ATOM 318 N PRO A 23 71.425 6.416 -14.361 1.00 1.00 N ATOM 319 CA PRO A 23 72.532 7.050 -13.596 1.00 1.00 C ATOM 320 C PRO A 23 72.029 8.161 -12.666 1.00 1.00 C ATOM 321 O PRO A 23 71.947 7.986 -11.467 1.00 1.00 O ATOM 322 CB PRO A 23 73.435 7.618 -14.692 1.00 1.00 C ATOM 323 CG PRO A 23 73.232 6.717 -15.867 1.00 1.00 C ATOM 324 CD PRO A 23 71.822 6.127 -15.748 1.00 1.00 C ATOM 0 HA PRO A 23 73.040 6.345 -12.938 1.00 1.00 H new ATOM 0 HB2 PRO A 23 73.165 8.646 -14.932 1.00 1.00 H new ATOM 0 HB3 PRO A 23 74.479 7.628 -14.378 1.00 1.00 H new ATOM 0 HG2 PRO A 23 73.340 7.271 -16.800 1.00 1.00 H new ATOM 0 HG3 PRO A 23 73.981 5.925 -15.878 1.00 1.00 H new ATOM 0 HD2 PRO A 23 71.137 6.585 -16.462 1.00 1.00 H new ATOM 0 HD3 PRO A 23 71.821 5.055 -15.947 1.00 1.00 H new ATOM 332 N ARG A 24 71.687 9.298 -13.212 1.00 1.00 N ATOM 333 CA ARG A 24 71.183 10.421 -12.368 1.00 1.00 C ATOM 334 C ARG A 24 72.212 10.766 -11.287 1.00 1.00 C ATOM 335 O ARG A 24 72.988 9.934 -10.862 1.00 1.00 O ATOM 336 CB ARG A 24 69.865 10.014 -11.705 1.00 1.00 C ATOM 337 CG ARG A 24 68.868 9.572 -12.778 1.00 1.00 C ATOM 338 CD ARG A 24 68.523 10.761 -13.676 1.00 1.00 C ATOM 339 NE ARG A 24 69.494 10.830 -14.804 1.00 1.00 N ATOM 340 CZ ARG A 24 69.545 11.894 -15.557 1.00 1.00 C ATOM 341 NH1 ARG A 24 68.745 12.898 -15.323 1.00 1.00 N ATOM 342 NH2 ARG A 24 70.395 11.954 -16.545 1.00 1.00 N ATOM 0 H ARG A 24 71.735 9.498 -14.211 1.00 1.00 H new ATOM 0 HA ARG A 24 71.020 11.294 -12.999 1.00 1.00 H new ATOM 0 HB2 ARG A 24 70.037 9.203 -10.997 1.00 1.00 H new ATOM 0 HB3 ARG A 24 69.458 10.851 -11.138 1.00 1.00 H new ATOM 0 HG2 ARG A 24 69.293 8.764 -13.374 1.00 1.00 H new ATOM 0 HG3 ARG A 24 67.964 9.182 -12.311 1.00 1.00 H new ATOM 0 HD2 ARG A 24 67.509 10.657 -14.061 1.00 1.00 H new ATOM 0 HD3 ARG A 24 68.552 11.686 -13.100 1.00 1.00 H new ATOM 0 HE ARG A 24 70.119 10.045 -14.987 1.00 1.00 H new ATOM 0 HH11 ARG A 24 68.080 12.851 -14.551 1.00 1.00 H new ATOM 0 HH12 ARG A 24 68.785 13.730 -15.912 1.00 1.00 H new ATOM 0 HH21 ARG A 24 71.020 11.169 -16.729 1.00 1.00 H new ATOM 0 HH22 ARG A 24 70.435 12.786 -17.134 1.00 1.00 H new ATOM 356 N LYS A 25 72.221 11.992 -10.839 1.00 1.00 N ATOM 357 CA LYS A 25 73.194 12.400 -9.785 1.00 1.00 C ATOM 358 C LYS A 25 72.880 13.828 -9.331 1.00 1.00 C ATOM 359 O LYS A 25 72.819 14.116 -8.152 1.00 1.00 O ATOM 360 CB LYS A 25 74.617 12.341 -10.350 1.00 1.00 C ATOM 361 CG LYS A 25 74.705 13.196 -11.615 1.00 1.00 C ATOM 362 CD LYS A 25 75.681 12.552 -12.601 1.00 1.00 C ATOM 363 CE LYS A 25 75.784 13.418 -13.858 1.00 1.00 C ATOM 364 NZ LYS A 25 74.511 13.329 -14.628 1.00 1.00 N ATOM 0 H LYS A 25 71.595 12.731 -11.158 1.00 1.00 H new ATOM 0 HA LYS A 25 73.116 11.722 -8.935 1.00 1.00 H new ATOM 0 HB2 LYS A 25 75.329 12.700 -9.607 1.00 1.00 H new ATOM 0 HB3 LYS A 25 74.886 11.309 -10.577 1.00 1.00 H new ATOM 0 HG2 LYS A 25 73.720 13.291 -12.072 1.00 1.00 H new ATOM 0 HG3 LYS A 25 75.038 14.203 -11.363 1.00 1.00 H new ATOM 0 HD2 LYS A 25 76.663 12.444 -12.139 1.00 1.00 H new ATOM 0 HD3 LYS A 25 75.341 11.550 -12.864 1.00 1.00 H new ATOM 0 HE2 LYS A 25 75.984 14.454 -13.584 1.00 1.00 H new ATOM 0 HE3 LYS A 25 76.619 13.085 -14.475 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 74.660 13.698 -15.589 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 74.207 12.336 -14.682 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 73.777 13.890 -14.151 1.00 1.00 H new ATOM 378 N GLY A 26 72.673 14.722 -10.259 1.00 1.00 N ATOM 379 CA GLY A 26 72.355 16.130 -9.887 1.00 1.00 C ATOM 380 C GLY A 26 73.430 16.677 -8.944 1.00 1.00 C ATOM 381 O GLY A 26 74.335 15.972 -8.544 1.00 1.00 O ATOM 0 H GLY A 26 72.711 14.537 -11.261 1.00 1.00 H new ATOM 0 HA2 GLY A 26 72.297 16.748 -10.783 1.00 1.00 H new ATOM 0 HA3 GLY A 26 71.379 16.176 -9.405 1.00 1.00 H new ATOM 385 N PRO A 27 73.323 17.932 -8.594 1.00 1.00 N ATOM 386 CA PRO A 27 74.291 18.607 -7.682 1.00 1.00 C ATOM 387 C PRO A 27 74.662 17.731 -6.473 1.00 1.00 C ATOM 388 O PRO A 27 73.800 17.315 -5.724 1.00 1.00 O ATOM 389 CB PRO A 27 73.531 19.854 -7.224 1.00 1.00 C ATOM 390 CG PRO A 27 72.601 20.176 -8.346 1.00 1.00 C ATOM 391 CD PRO A 27 72.259 18.851 -9.033 1.00 1.00 C ATOM 0 HA PRO A 27 75.237 18.824 -8.178 1.00 1.00 H new ATOM 0 HB2 PRO A 27 72.984 19.665 -6.300 1.00 1.00 H new ATOM 0 HB3 PRO A 27 74.213 20.681 -7.027 1.00 1.00 H new ATOM 0 HG2 PRO A 27 71.699 20.662 -7.973 1.00 1.00 H new ATOM 0 HG3 PRO A 27 73.068 20.866 -9.049 1.00 1.00 H new ATOM 0 HD2 PRO A 27 71.274 18.491 -8.736 1.00 1.00 H new ATOM 0 HD3 PRO A 27 72.246 18.956 -10.118 1.00 1.00 H new ATOM 399 N PRO A 28 75.930 17.453 -6.276 1.00 1.00 N ATOM 400 CA PRO A 28 76.392 16.615 -5.132 1.00 1.00 C ATOM 401 C PRO A 28 75.724 17.017 -3.812 1.00 1.00 C ATOM 402 O PRO A 28 75.708 18.173 -3.440 1.00 1.00 O ATOM 403 CB PRO A 28 77.898 16.880 -5.075 1.00 1.00 C ATOM 404 CG PRO A 28 78.281 17.244 -6.472 1.00 1.00 C ATOM 405 CD PRO A 28 77.054 17.902 -7.113 1.00 1.00 C ATOM 0 HA PRO A 28 76.140 15.564 -5.270 1.00 1.00 H new ATOM 0 HB2 PRO A 28 78.131 17.686 -4.379 1.00 1.00 H new ATOM 0 HB3 PRO A 28 78.441 15.998 -4.734 1.00 1.00 H new ATOM 0 HG2 PRO A 28 79.131 17.927 -6.474 1.00 1.00 H new ATOM 0 HG3 PRO A 28 78.582 16.359 -7.033 1.00 1.00 H new ATOM 0 HD2 PRO A 28 77.140 18.989 -7.116 1.00 1.00 H new ATOM 0 HD3 PRO A 28 76.929 17.589 -8.150 1.00 1.00 H new ATOM 413 N LYS A 29 75.176 16.068 -3.102 1.00 1.00 N ATOM 414 CA LYS A 29 74.511 16.389 -1.807 1.00 1.00 C ATOM 415 C LYS A 29 74.096 15.088 -1.116 1.00 1.00 C ATOM 416 O LYS A 29 73.778 14.108 -1.760 1.00 1.00 O ATOM 417 CB LYS A 29 73.268 17.245 -2.065 1.00 1.00 C ATOM 418 CG LYS A 29 72.635 17.643 -0.730 1.00 1.00 C ATOM 419 CD LYS A 29 71.657 18.798 -0.953 1.00 1.00 C ATOM 420 CE LYS A 29 72.361 20.127 -0.669 1.00 1.00 C ATOM 421 NZ LYS A 29 73.661 20.165 -1.395 1.00 1.00 N ATOM 0 H LYS A 29 75.160 15.082 -3.364 1.00 1.00 H new ATOM 0 HA LYS A 29 75.203 16.940 -1.170 1.00 1.00 H new ATOM 0 HB2 LYS A 29 73.539 18.136 -2.631 1.00 1.00 H new ATOM 0 HB3 LYS A 29 72.550 16.690 -2.669 1.00 1.00 H new ATOM 0 HG2 LYS A 29 72.114 16.791 -0.294 1.00 1.00 H new ATOM 0 HG3 LYS A 29 73.409 17.940 -0.022 1.00 1.00 H new ATOM 0 HD2 LYS A 29 71.287 18.782 -1.978 1.00 1.00 H new ATOM 0 HD3 LYS A 29 70.791 18.686 -0.300 1.00 1.00 H new ATOM 0 HE2 LYS A 29 71.732 20.959 -0.985 1.00 1.00 H new ATOM 0 HE3 LYS A 29 72.527 20.241 0.402 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 74.068 21.120 -1.328 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 74.316 19.479 -0.970 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 73.507 19.923 -2.395 1.00 1.00 H new ATOM 435 N CYS A 30 74.094 15.070 0.188 1.00 1.00 N ATOM 436 CA CYS A 30 73.696 13.830 0.913 1.00 1.00 C ATOM 437 C CYS A 30 73.671 14.108 2.418 1.00 1.00 C ATOM 438 O CYS A 30 74.636 14.575 2.990 1.00 1.00 O ATOM 439 CB CYS A 30 74.702 12.713 0.601 1.00 1.00 C ATOM 440 SG CYS A 30 75.568 12.234 2.117 1.00 1.00 S ATOM 0 H CYS A 30 74.350 15.858 0.782 1.00 1.00 H new ATOM 0 HA CYS A 30 72.703 13.516 0.591 1.00 1.00 H new ATOM 0 HB2 CYS A 30 74.185 11.852 0.178 1.00 1.00 H new ATOM 0 HB3 CYS A 30 75.418 13.053 -0.147 1.00 1.00 H new ATOM 445 N LYS A 31 72.574 13.823 3.065 1.00 1.00 N ATOM 446 CA LYS A 31 72.491 14.068 4.531 1.00 1.00 C ATOM 447 C LYS A 31 73.409 13.086 5.260 1.00 1.00 C ATOM 448 O LYS A 31 74.618 13.167 5.168 1.00 1.00 O ATOM 449 CB LYS A 31 71.050 13.865 5.001 1.00 1.00 C ATOM 450 CG LYS A 31 70.160 14.960 4.410 1.00 1.00 C ATOM 451 CD LYS A 31 68.692 14.549 4.535 1.00 1.00 C ATOM 452 CE LYS A 31 68.360 14.277 6.004 1.00 1.00 C ATOM 453 NZ LYS A 31 68.988 15.326 6.857 1.00 1.00 N ATOM 0 H LYS A 31 71.733 13.431 2.641 1.00 1.00 H new ATOM 0 HA LYS A 31 72.802 15.090 4.749 1.00 1.00 H new ATOM 0 HB2 LYS A 31 70.691 12.884 4.692 1.00 1.00 H new ATOM 0 HB3 LYS A 31 71.004 13.893 6.090 1.00 1.00 H new ATOM 0 HG2 LYS A 31 70.330 15.902 4.931 1.00 1.00 H new ATOM 0 HG3 LYS A 31 70.415 15.124 3.363 1.00 1.00 H new ATOM 0 HD2 LYS A 31 68.048 15.338 4.146 1.00 1.00 H new ATOM 0 HD3 LYS A 31 68.501 13.658 3.937 1.00 1.00 H new ATOM 0 HE2 LYS A 31 67.280 14.273 6.149 1.00 1.00 H new ATOM 0 HE3 LYS A 31 68.724 13.291 6.294 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 68.509 15.356 7.780 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 69.994 15.104 6.996 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 68.899 16.251 6.391 1.00 1.00 H new ATOM 467 N GLN A 32 72.844 12.157 5.981 1.00 1.00 N ATOM 468 CA GLN A 32 73.681 11.167 6.715 1.00 1.00 C ATOM 469 C GLN A 32 74.600 11.900 7.694 1.00 1.00 C ATOM 470 O GLN A 32 74.949 13.046 7.495 1.00 1.00 O ATOM 471 CB GLN A 32 74.526 10.372 5.716 1.00 1.00 C ATOM 472 CG GLN A 32 75.033 9.091 6.382 1.00 1.00 C ATOM 473 CD GLN A 32 76.106 8.448 5.502 1.00 1.00 C ATOM 474 OE1 GLN A 32 75.836 7.507 4.784 1.00 1.00 O ATOM 475 NE2 GLN A 32 77.323 8.920 5.529 1.00 1.00 N ATOM 0 H GLN A 32 71.837 12.041 6.094 1.00 1.00 H new ATOM 0 HA GLN A 32 73.035 10.484 7.267 1.00 1.00 H new ATOM 0 HB2 GLN A 32 73.932 10.126 4.836 1.00 1.00 H new ATOM 0 HB3 GLN A 32 75.368 10.975 5.375 1.00 1.00 H new ATOM 0 HG2 GLN A 32 75.443 9.318 7.366 1.00 1.00 H new ATOM 0 HG3 GLN A 32 74.207 8.396 6.533 1.00 1.00 H new ATOM 0 HE21 GLN A 32 77.550 9.711 6.132 1.00 1.00 H new ATOM 0 HE22 GLN A 32 78.047 8.498 4.947 1.00 1.00 H new ATOM 484 N ARG A 33 74.995 11.246 8.751 1.00 1.00 N ATOM 485 CA ARG A 33 75.891 11.903 9.743 1.00 1.00 C ATOM 486 C ARG A 33 76.368 10.864 10.760 1.00 1.00 C ATOM 487 O ARG A 33 76.912 11.197 11.794 1.00 1.00 O ATOM 488 CB ARG A 33 75.124 13.013 10.466 1.00 1.00 C ATOM 489 CG ARG A 33 73.965 12.403 11.256 1.00 1.00 C ATOM 490 CD ARG A 33 73.027 13.516 11.729 1.00 1.00 C ATOM 491 NE ARG A 33 72.196 13.984 10.584 1.00 1.00 N ATOM 492 CZ ARG A 33 71.159 13.290 10.203 1.00 1.00 C ATOM 493 NH1 ARG A 33 70.850 12.185 10.825 1.00 1.00 N ATOM 494 NH2 ARG A 33 70.432 13.700 9.200 1.00 1.00 N ATOM 0 H ARG A 33 74.736 10.284 8.971 1.00 1.00 H new ATOM 0 HA ARG A 33 76.752 12.333 9.231 1.00 1.00 H new ATOM 0 HB2 ARG A 33 75.792 13.552 11.138 1.00 1.00 H new ATOM 0 HB3 ARG A 33 74.745 13.737 9.745 1.00 1.00 H new ATOM 0 HG2 ARG A 33 73.420 11.694 10.633 1.00 1.00 H new ATOM 0 HG3 ARG A 33 74.347 11.847 12.112 1.00 1.00 H new ATOM 0 HD2 ARG A 33 72.387 13.150 12.532 1.00 1.00 H new ATOM 0 HD3 ARG A 33 73.605 14.346 12.136 1.00 1.00 H new ATOM 0 HE ARG A 33 72.438 14.847 10.098 1.00 1.00 H new ATOM 0 HH11 ARG A 33 71.419 11.865 11.608 1.00 1.00 H new ATOM 0 HH12 ARG A 33 70.039 11.642 10.528 1.00 1.00 H new ATOM 0 HH21 ARG A 33 70.674 14.563 8.714 1.00 1.00 H new ATOM 0 HH22 ARG A 33 69.621 13.157 8.902 1.00 1.00 H new ATOM 508 N GLN A 34 76.167 9.607 10.474 1.00 1.00 N ATOM 509 CA GLN A 34 76.608 8.544 11.421 1.00 1.00 C ATOM 510 C GLN A 34 78.128 8.382 11.331 1.00 1.00 C ATOM 511 O GLN A 34 78.751 8.810 10.380 1.00 1.00 O ATOM 512 CB GLN A 34 75.926 7.222 11.053 1.00 1.00 C ATOM 513 CG GLN A 34 75.928 6.289 12.266 1.00 1.00 C ATOM 514 CD GLN A 34 74.939 6.808 13.311 1.00 1.00 C ATOM 515 OE1 GLN A 34 73.779 7.264 12.924 1.00 1.00 O flip ATOM 516 NE2 GLN A 34 75.224 6.797 14.492 1.00 1.00 N flip ATOM 0 H GLN A 34 75.716 9.270 9.624 1.00 1.00 H new ATOM 0 HA GLN A 34 76.334 8.822 12.439 1.00 1.00 H new ATOM 0 HB2 GLN A 34 74.903 7.408 10.726 1.00 1.00 H new ATOM 0 HB3 GLN A 34 76.447 6.752 10.219 1.00 1.00 H new ATOM 0 HG2 GLN A 34 75.655 5.279 11.961 1.00 1.00 H new ATOM 0 HG3 GLN A 34 76.929 6.233 12.693 1.00 1.00 H new ATOM 0 HE21 GLN A 34 76.131 6.441 14.795 1.00 1.00 H new ATOM 0 HE22 GLN A 34 74.557 7.144 15.181 1.00 1.00 H new ATOM 525 N THR A 35 78.729 7.766 12.312 1.00 1.00 N ATOM 526 CA THR A 35 80.206 7.575 12.281 1.00 1.00 C ATOM 527 C THR A 35 80.583 6.725 11.064 1.00 1.00 C ATOM 528 O THR A 35 80.220 7.032 9.946 1.00 1.00 O ATOM 529 CB THR A 35 80.654 6.868 13.564 1.00 1.00 C ATOM 530 OG1 THR A 35 79.966 7.426 14.674 1.00 1.00 O ATOM 531 CG2 THR A 35 82.161 7.051 13.750 1.00 1.00 C ATOM 0 H THR A 35 78.260 7.386 13.134 1.00 1.00 H new ATOM 0 HA THR A 35 80.700 8.544 12.211 1.00 1.00 H new ATOM 0 HB THR A 35 80.426 5.804 13.492 1.00 1.00 H new ATOM 0 HG1 THR A 35 80.250 6.974 15.496 1.00 1.00 H new ATOM 0 HG21 THR A 35 82.479 6.548 14.663 1.00 1.00 H new ATOM 0 HG22 THR A 35 82.688 6.622 12.897 1.00 1.00 H new ATOM 0 HG23 THR A 35 82.392 8.114 13.822 1.00 1.00 H new ATOM 539 N ARG A 36 81.307 5.659 11.268 1.00 1.00 N ATOM 540 CA ARG A 36 81.700 4.795 10.118 1.00 1.00 C ATOM 541 C ARG A 36 82.273 3.476 10.641 1.00 1.00 C ATOM 542 O ARG A 36 83.130 2.872 10.026 1.00 1.00 O ATOM 543 CB ARG A 36 82.755 5.516 9.273 1.00 1.00 C ATOM 544 CG ARG A 36 84.054 5.642 10.072 1.00 1.00 C ATOM 545 CD ARG A 36 84.932 6.731 9.451 1.00 1.00 C ATOM 546 NE ARG A 36 84.977 6.549 7.973 1.00 1.00 N ATOM 547 CZ ARG A 36 85.955 7.067 7.282 1.00 1.00 C ATOM 548 NH1 ARG A 36 86.893 7.745 7.885 1.00 1.00 N ATOM 549 NH2 ARG A 36 85.995 6.909 5.987 1.00 1.00 N ATOM 0 H ARG A 36 81.643 5.349 12.180 1.00 1.00 H new ATOM 0 HA ARG A 36 80.824 4.589 9.503 1.00 1.00 H new ATOM 0 HB2 ARG A 36 82.936 4.964 8.350 1.00 1.00 H new ATOM 0 HB3 ARG A 36 82.394 6.504 8.988 1.00 1.00 H new ATOM 0 HG2 ARG A 36 83.832 5.887 11.111 1.00 1.00 H new ATOM 0 HG3 ARG A 36 84.585 4.690 10.076 1.00 1.00 H new ATOM 0 HD2 ARG A 36 84.535 7.716 9.695 1.00 1.00 H new ATOM 0 HD3 ARG A 36 85.939 6.682 9.865 1.00 1.00 H new ATOM 0 HE ARG A 36 84.244 6.020 7.502 1.00 1.00 H new ATOM 0 HH11 ARG A 36 86.862 7.870 8.897 1.00 1.00 H new ATOM 0 HH12 ARG A 36 87.657 8.150 7.344 1.00 1.00 H new ATOM 0 HH21 ARG A 36 85.261 6.380 5.515 1.00 1.00 H new ATOM 0 HH22 ARG A 36 86.760 7.314 5.447 1.00 1.00 H new ATOM 563 N GLN A 37 81.807 3.023 11.773 1.00 1.00 N ATOM 564 CA GLN A 37 82.324 1.743 12.333 1.00 1.00 C ATOM 565 C GLN A 37 81.687 0.565 11.592 1.00 1.00 C ATOM 566 O GLN A 37 80.761 0.732 10.824 1.00 1.00 O ATOM 567 CB GLN A 37 81.977 1.661 13.821 1.00 1.00 C ATOM 568 CG GLN A 37 82.860 2.633 14.606 1.00 1.00 C ATOM 569 CD GLN A 37 82.600 2.463 16.104 1.00 1.00 C ATOM 570 OE1 GLN A 37 82.971 1.464 16.687 1.00 1.00 O ATOM 571 NE2 GLN A 37 81.973 3.404 16.756 1.00 1.00 N ATOM 0 H GLN A 37 81.091 3.484 12.334 1.00 1.00 H new ATOM 0 HA GLN A 37 83.406 1.704 12.210 1.00 1.00 H new ATOM 0 HB2 GLN A 37 80.925 1.904 13.974 1.00 1.00 H new ATOM 0 HB3 GLN A 37 82.125 0.644 14.184 1.00 1.00 H new ATOM 0 HG2 GLN A 37 83.911 2.446 14.385 1.00 1.00 H new ATOM 0 HG3 GLN A 37 82.648 3.659 14.303 1.00 1.00 H new ATOM 0 HE21 GLN A 37 81.661 4.243 16.267 1.00 1.00 H new ATOM 0 HE22 GLN A 37 81.795 3.300 17.755 1.00 1.00 H new ATOM 580 N CYS A 38 82.176 -0.625 11.817 1.00 1.00 N ATOM 581 CA CYS A 38 81.601 -1.813 11.125 1.00 1.00 C ATOM 582 C CYS A 38 82.341 -3.074 11.579 1.00 1.00 C ATOM 583 O CYS A 38 83.449 -3.340 11.157 1.00 1.00 O ATOM 584 CB CYS A 38 81.757 -1.646 9.611 1.00 1.00 C ATOM 585 SG CYS A 38 81.508 -3.244 8.798 1.00 1.00 S ATOM 0 H CYS A 38 82.950 -0.825 12.451 1.00 1.00 H new ATOM 0 HA CYS A 38 80.543 -1.903 11.373 1.00 1.00 H new ATOM 0 HB2 CYS A 38 81.035 -0.920 9.238 1.00 1.00 H new ATOM 0 HB3 CYS A 38 82.748 -1.258 9.378 1.00 1.00 H new ATOM 590 N LYS A 39 81.737 -3.853 12.435 1.00 1.00 N ATOM 591 CA LYS A 39 82.405 -5.098 12.915 1.00 1.00 C ATOM 592 C LYS A 39 81.964 -6.279 12.047 1.00 1.00 C ATOM 593 O LYS A 39 82.573 -7.330 12.057 1.00 1.00 O ATOM 594 CB LYS A 39 82.010 -5.358 14.374 1.00 1.00 C ATOM 595 CG LYS A 39 82.786 -6.561 14.913 1.00 1.00 C ATOM 596 CD LYS A 39 81.902 -7.808 14.854 1.00 1.00 C ATOM 597 CE LYS A 39 81.023 -7.871 16.105 1.00 1.00 C ATOM 598 NZ LYS A 39 80.252 -9.146 16.106 1.00 1.00 N ATOM 0 H LYS A 39 80.809 -3.682 12.823 1.00 1.00 H new ATOM 0 HA LYS A 39 83.487 -4.982 12.847 1.00 1.00 H new ATOM 0 HB2 LYS A 39 82.220 -4.477 14.980 1.00 1.00 H new ATOM 0 HB3 LYS A 39 80.938 -5.544 14.443 1.00 1.00 H new ATOM 0 HG2 LYS A 39 83.691 -6.716 14.326 1.00 1.00 H new ATOM 0 HG3 LYS A 39 83.101 -6.374 15.940 1.00 1.00 H new ATOM 0 HD2 LYS A 39 81.279 -7.783 13.960 1.00 1.00 H new ATOM 0 HD3 LYS A 39 82.521 -8.703 14.786 1.00 1.00 H new ATOM 0 HE2 LYS A 39 81.641 -7.807 17.000 1.00 1.00 H new ATOM 0 HE3 LYS A 39 80.341 -7.021 16.127 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 79.654 -9.190 16.956 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 79.652 -9.189 15.258 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 80.911 -9.950 16.105 1.00 1.00 H new ATOM 612 N SER A 40 80.908 -6.115 11.298 1.00 1.00 N ATOM 613 CA SER A 40 80.427 -7.229 10.433 1.00 1.00 C ATOM 614 C SER A 40 81.538 -7.648 9.467 1.00 1.00 C ATOM 615 O SER A 40 82.236 -6.824 8.912 1.00 1.00 O ATOM 616 CB SER A 40 79.207 -6.764 9.636 1.00 1.00 C ATOM 617 OG SER A 40 79.134 -7.497 8.421 1.00 1.00 O ATOM 0 H SER A 40 80.358 -5.258 11.248 1.00 1.00 H new ATOM 0 HA SER A 40 80.153 -8.079 11.058 1.00 1.00 H new ATOM 0 HB2 SER A 40 78.298 -6.913 10.219 1.00 1.00 H new ATOM 0 HB3 SER A 40 79.280 -5.697 9.427 1.00 1.00 H new ATOM 0 HG SER A 40 78.352 -7.203 7.908 1.00 1.00 H new ATOM 623 N LYS A 41 81.706 -8.929 9.267 1.00 1.00 N ATOM 624 CA LYS A 41 82.769 -9.417 8.341 1.00 1.00 C ATOM 625 C LYS A 41 82.215 -10.575 7.500 1.00 1.00 C ATOM 626 O LYS A 41 82.225 -11.712 7.926 1.00 1.00 O ATOM 627 CB LYS A 41 83.961 -9.916 9.164 1.00 1.00 C ATOM 628 CG LYS A 41 83.495 -10.991 10.148 1.00 1.00 C ATOM 629 CD LYS A 41 84.071 -10.700 11.534 1.00 1.00 C ATOM 630 CE LYS A 41 83.749 -11.862 12.476 1.00 1.00 C ATOM 631 NZ LYS A 41 84.473 -13.083 12.023 1.00 1.00 N ATOM 0 H LYS A 41 81.149 -9.661 9.708 1.00 1.00 H new ATOM 0 HA LYS A 41 83.087 -8.607 7.685 1.00 1.00 H new ATOM 0 HB2 LYS A 41 84.727 -10.322 8.503 1.00 1.00 H new ATOM 0 HB3 LYS A 41 84.414 -9.086 9.705 1.00 1.00 H new ATOM 0 HG2 LYS A 41 82.406 -11.011 10.192 1.00 1.00 H new ATOM 0 HG3 LYS A 41 83.818 -11.975 9.808 1.00 1.00 H new ATOM 0 HD2 LYS A 41 85.150 -10.559 11.469 1.00 1.00 H new ATOM 0 HD3 LYS A 41 83.652 -9.773 11.926 1.00 1.00 H new ATOM 0 HE2 LYS A 41 84.041 -11.610 13.495 1.00 1.00 H new ATOM 0 HE3 LYS A 41 82.675 -12.047 12.489 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 84.599 -13.730 12.827 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 83.922 -13.558 11.280 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 85.404 -12.814 11.645 1.00 1.00 H new ATOM 645 N PRO A 42 81.727 -10.293 6.315 1.00 1.00 N ATOM 646 CA PRO A 42 81.157 -11.336 5.418 1.00 1.00 C ATOM 647 C PRO A 42 82.246 -12.123 4.676 1.00 1.00 C ATOM 648 O PRO A 42 83.369 -11.676 4.556 1.00 1.00 O ATOM 649 CB PRO A 42 80.302 -10.532 4.437 1.00 1.00 C ATOM 650 CG PRO A 42 80.947 -9.185 4.368 1.00 1.00 C ATOM 651 CD PRO A 42 81.662 -8.955 5.704 1.00 1.00 C ATOM 0 HA PRO A 42 80.594 -12.089 5.969 1.00 1.00 H new ATOM 0 HB2 PRO A 42 80.276 -11.007 3.456 1.00 1.00 H new ATOM 0 HB3 PRO A 42 79.271 -10.458 4.782 1.00 1.00 H new ATOM 0 HG2 PRO A 42 81.655 -9.139 3.540 1.00 1.00 H new ATOM 0 HG3 PRO A 42 80.201 -8.410 4.193 1.00 1.00 H new ATOM 0 HD2 PRO A 42 82.657 -8.536 5.556 1.00 1.00 H new ATOM 0 HD3 PRO A 42 81.113 -8.256 6.334 1.00 1.00 H new ATOM 659 N PRO A 43 81.912 -13.288 4.183 1.00 1.00 N ATOM 660 CA PRO A 43 82.875 -14.157 3.442 1.00 1.00 C ATOM 661 C PRO A 43 83.186 -13.619 2.040 1.00 1.00 C ATOM 662 O PRO A 43 82.303 -13.422 1.230 1.00 1.00 O ATOM 663 CB PRO A 43 82.149 -15.502 3.352 1.00 1.00 C ATOM 664 CG PRO A 43 80.697 -15.163 3.411 1.00 1.00 C ATOM 665 CD PRO A 43 80.578 -13.905 4.274 1.00 1.00 C ATOM 0 HA PRO A 43 83.840 -14.214 3.945 1.00 1.00 H new ATOM 0 HB2 PRO A 43 82.395 -16.022 2.426 1.00 1.00 H new ATOM 0 HB3 PRO A 43 82.434 -16.160 4.173 1.00 1.00 H new ATOM 0 HG2 PRO A 43 80.299 -14.987 2.412 1.00 1.00 H new ATOM 0 HG3 PRO A 43 80.124 -15.984 3.842 1.00 1.00 H new ATOM 0 HD2 PRO A 43 79.802 -13.236 3.901 1.00 1.00 H new ATOM 0 HD3 PRO A 43 80.320 -14.150 5.304 1.00 1.00 H new ATOM 673 N LYS A 44 84.438 -13.386 1.750 1.00 1.00 N ATOM 674 CA LYS A 44 84.812 -12.867 0.403 1.00 1.00 C ATOM 675 C LYS A 44 86.286 -13.191 0.134 1.00 1.00 C ATOM 676 O LYS A 44 86.610 -14.200 -0.461 1.00 1.00 O ATOM 677 CB LYS A 44 84.592 -11.344 0.361 1.00 1.00 C ATOM 678 CG LYS A 44 83.380 -11.026 -0.516 1.00 1.00 C ATOM 679 CD LYS A 44 83.787 -11.081 -1.990 1.00 1.00 C ATOM 680 CE LYS A 44 82.533 -11.134 -2.865 1.00 1.00 C ATOM 681 NZ LYS A 44 82.917 -10.961 -4.294 1.00 1.00 N ATOM 0 H LYS A 44 85.219 -13.533 2.389 1.00 1.00 H new ATOM 0 HA LYS A 44 84.192 -13.336 -0.361 1.00 1.00 H new ATOM 0 HB2 LYS A 44 84.435 -10.961 1.369 1.00 1.00 H new ATOM 0 HB3 LYS A 44 85.479 -10.849 -0.033 1.00 1.00 H new ATOM 0 HG2 LYS A 44 82.580 -11.740 -0.322 1.00 1.00 H new ATOM 0 HG3 LYS A 44 82.991 -10.038 -0.272 1.00 1.00 H new ATOM 0 HD2 LYS A 44 84.385 -10.206 -2.246 1.00 1.00 H new ATOM 0 HD3 LYS A 44 84.409 -11.957 -2.174 1.00 1.00 H new ATOM 0 HE2 LYS A 44 82.021 -12.086 -2.728 1.00 1.00 H new ATOM 0 HE3 LYS A 44 81.836 -10.351 -2.567 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 82.369 -10.180 -4.709 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 83.932 -10.744 -4.357 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 82.718 -11.838 -4.816 1.00 1.00 H new ATOM 695 N LYS A 45 87.181 -12.345 0.568 1.00 1.00 N ATOM 696 CA LYS A 45 88.628 -12.607 0.338 1.00 1.00 C ATOM 697 C LYS A 45 89.457 -11.729 1.281 1.00 1.00 C ATOM 698 O LYS A 45 90.114 -12.215 2.180 1.00 1.00 O ATOM 699 CB LYS A 45 88.977 -12.279 -1.121 1.00 1.00 C ATOM 700 CG LYS A 45 89.910 -13.355 -1.680 1.00 1.00 C ATOM 701 CD LYS A 45 91.259 -13.285 -0.960 1.00 1.00 C ATOM 702 CE LYS A 45 92.130 -14.466 -1.393 1.00 1.00 C ATOM 703 NZ LYS A 45 92.188 -14.522 -2.881 1.00 1.00 N ATOM 0 H LYS A 45 86.971 -11.484 1.072 1.00 1.00 H new ATOM 0 HA LYS A 45 88.850 -13.656 0.534 1.00 1.00 H new ATOM 0 HB2 LYS A 45 88.068 -12.225 -1.720 1.00 1.00 H new ATOM 0 HB3 LYS A 45 89.456 -11.302 -1.180 1.00 1.00 H new ATOM 0 HG2 LYS A 45 89.466 -14.341 -1.547 1.00 1.00 H new ATOM 0 HG3 LYS A 45 90.049 -13.210 -2.751 1.00 1.00 H new ATOM 0 HD2 LYS A 45 91.760 -12.345 -1.193 1.00 1.00 H new ATOM 0 HD3 LYS A 45 91.109 -13.307 0.119 1.00 1.00 H new ATOM 0 HE2 LYS A 45 93.134 -14.360 -0.983 1.00 1.00 H new ATOM 0 HE3 LYS A 45 91.721 -15.397 -0.999 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 92.986 -15.121 -3.175 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 91.301 -14.922 -3.248 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 92.318 -13.562 -3.260 1.00 1.00 H new ATOM 717 N GLY A 46 89.430 -10.439 1.082 1.00 1.00 N ATOM 718 CA GLY A 46 90.216 -9.531 1.966 1.00 1.00 C ATOM 719 C GLY A 46 89.440 -9.281 3.260 1.00 1.00 C ATOM 720 O GLY A 46 88.235 -9.131 3.254 1.00 1.00 O ATOM 0 H GLY A 46 88.898 -9.975 0.346 1.00 1.00 H new ATOM 0 HA2 GLY A 46 91.186 -9.975 2.191 1.00 1.00 H new ATOM 0 HA3 GLY A 46 90.408 -8.587 1.457 1.00 1.00 H new ATOM 724 N VAL A 47 90.123 -9.233 4.372 1.00 1.00 N ATOM 725 CA VAL A 47 89.423 -8.992 5.665 1.00 1.00 C ATOM 726 C VAL A 47 89.089 -7.503 5.791 1.00 1.00 C ATOM 727 O VAL A 47 88.597 -6.888 4.866 1.00 1.00 O ATOM 728 CB VAL A 47 90.331 -9.416 6.823 1.00 1.00 C ATOM 729 CG1 VAL A 47 89.484 -9.667 8.072 1.00 1.00 C ATOM 730 CG2 VAL A 47 91.072 -10.700 6.445 1.00 1.00 C ATOM 0 H VAL A 47 91.134 -9.350 4.440 1.00 1.00 H new ATOM 0 HA VAL A 47 88.502 -9.574 5.697 1.00 1.00 H new ATOM 0 HB VAL A 47 91.052 -8.625 7.027 1.00 1.00 H new ATOM 0 HG11 VAL A 47 90.131 -9.969 8.896 1.00 1.00 H new ATOM 0 HG12 VAL A 47 88.955 -8.753 8.342 1.00 1.00 H new ATOM 0 HG13 VAL A 47 88.762 -10.458 7.869 1.00 1.00 H new ATOM 0 HG21 VAL A 47 91.719 -11.003 7.269 1.00 1.00 H new ATOM 0 HG22 VAL A 47 90.350 -11.490 6.241 1.00 1.00 H new ATOM 0 HG23 VAL A 47 91.676 -10.523 5.555 1.00 1.00 H new ATOM 740 N GLN A 48 89.351 -6.918 6.928 1.00 1.00 N ATOM 741 CA GLN A 48 89.046 -5.470 7.107 1.00 1.00 C ATOM 742 C GLN A 48 89.590 -4.995 8.457 1.00 1.00 C ATOM 743 O GLN A 48 90.773 -4.762 8.612 1.00 1.00 O ATOM 744 CB GLN A 48 87.530 -5.258 7.059 1.00 1.00 C ATOM 745 CG GLN A 48 86.828 -6.428 7.752 1.00 1.00 C ATOM 746 CD GLN A 48 85.372 -6.054 8.037 1.00 1.00 C ATOM 747 OE1 GLN A 48 84.907 -6.183 9.152 1.00 1.00 O ATOM 748 NE2 GLN A 48 84.629 -5.593 7.069 1.00 1.00 N ATOM 0 H GLN A 48 89.762 -7.379 7.739 1.00 1.00 H new ATOM 0 HA GLN A 48 89.517 -4.898 6.308 1.00 1.00 H new ATOM 0 HB2 GLN A 48 87.268 -4.321 7.550 1.00 1.00 H new ATOM 0 HB3 GLN A 48 87.196 -5.181 6.024 1.00 1.00 H new ATOM 0 HG2 GLN A 48 86.870 -7.316 7.121 1.00 1.00 H new ATOM 0 HG3 GLN A 48 87.340 -6.674 8.682 1.00 1.00 H new ATOM 0 HE21 GLN A 48 85.020 -5.485 6.133 1.00 1.00 H new ATOM 0 HE22 GLN A 48 83.657 -5.341 7.248 1.00 1.00 H new ATOM 757 N GLY A 49 88.735 -4.844 9.433 1.00 1.00 N ATOM 758 CA GLY A 49 89.198 -4.379 10.773 1.00 1.00 C ATOM 759 C GLY A 49 88.941 -2.877 10.903 1.00 1.00 C ATOM 760 O GLY A 49 89.381 -2.239 11.839 1.00 1.00 O ATOM 0 H GLY A 49 87.734 -5.023 9.360 1.00 1.00 H new ATOM 0 HA2 GLY A 49 88.672 -4.919 11.560 1.00 1.00 H new ATOM 0 HA3 GLY A 49 90.260 -4.590 10.897 1.00 1.00 H new ATOM 764 N CYS A 50 88.229 -2.308 9.969 1.00 1.00 N ATOM 765 CA CYS A 50 87.938 -0.848 10.031 1.00 1.00 C ATOM 766 C CYS A 50 86.666 -0.617 10.850 1.00 1.00 C ATOM 767 O CYS A 50 85.611 -0.344 10.313 1.00 1.00 O ATOM 768 CB CYS A 50 87.740 -0.310 8.612 1.00 1.00 C ATOM 769 SG CYS A 50 86.958 1.320 8.687 1.00 1.00 S ATOM 0 H CYS A 50 87.835 -2.793 9.163 1.00 1.00 H new ATOM 0 HA CYS A 50 88.771 -0.328 10.503 1.00 1.00 H new ATOM 0 HB2 CYS A 50 88.700 -0.241 8.101 1.00 1.00 H new ATOM 0 HB3 CYS A 50 87.120 -0.996 8.035 1.00 1.00 H new ATOM 774 N GLY A 51 86.758 -0.728 12.149 1.00 1.00 N ATOM 775 CA GLY A 51 85.557 -0.517 13.009 1.00 1.00 C ATOM 776 C GLY A 51 85.563 -1.536 14.151 1.00 1.00 C ATOM 777 O GLY A 51 86.497 -2.297 14.310 1.00 1.00 O ATOM 0 H GLY A 51 87.615 -0.956 12.652 1.00 1.00 H new ATOM 0 HA2 GLY A 51 85.558 0.496 13.411 1.00 1.00 H new ATOM 0 HA3 GLY A 51 84.649 -0.624 12.416 1.00 1.00 H new ATOM 781 N ASP A 52 84.529 -1.559 14.948 1.00 1.00 N ATOM 782 CA ASP A 52 84.482 -2.532 16.076 1.00 1.00 C ATOM 783 C ASP A 52 83.061 -2.599 16.640 1.00 1.00 C ATOM 784 O ASP A 52 82.841 -3.071 17.738 1.00 1.00 O ATOM 785 CB ASP A 52 85.445 -2.082 17.177 1.00 1.00 C ATOM 786 CG ASP A 52 85.577 -3.189 18.224 1.00 1.00 C ATOM 787 OD1 ASP A 52 86.439 -4.036 18.058 1.00 1.00 O ATOM 788 OD2 ASP A 52 84.812 -3.172 19.175 1.00 1.00 O ATOM 0 H ASP A 52 83.717 -0.947 14.867 1.00 1.00 H new ATOM 0 HA ASP A 52 84.774 -3.518 15.715 1.00 1.00 H new ATOM 0 HB2 ASP A 52 86.421 -1.853 16.750 1.00 1.00 H new ATOM 0 HB3 ASP A 52 85.079 -1.167 17.644 1.00 1.00 H new ATOM 793 N ASP A 53 82.093 -2.132 15.899 1.00 1.00 N ATOM 794 CA ASP A 53 80.689 -2.171 16.396 1.00 1.00 C ATOM 795 C ASP A 53 79.734 -1.792 15.263 1.00 1.00 C ATOM 796 O ASP A 53 80.152 -1.399 14.193 1.00 1.00 O ATOM 797 CB ASP A 53 80.528 -1.180 17.551 1.00 1.00 C ATOM 798 CG ASP A 53 79.215 -1.460 18.285 1.00 1.00 C ATOM 799 OD1 ASP A 53 79.097 -2.530 18.858 1.00 1.00 O ATOM 800 OD2 ASP A 53 78.351 -0.599 18.262 1.00 1.00 O ATOM 0 H ASP A 53 82.214 -1.725 14.971 1.00 1.00 H new ATOM 0 HA ASP A 53 80.457 -3.177 16.745 1.00 1.00 H new ATOM 0 HB2 ASP A 53 81.368 -1.269 18.240 1.00 1.00 H new ATOM 0 HB3 ASP A 53 80.534 -0.158 17.171 1.00 1.00 H new ATOM 805 N ILE A 54 78.452 -1.906 15.492 1.00 1.00 N ATOM 806 CA ILE A 54 77.463 -1.552 14.433 1.00 1.00 C ATOM 807 C ILE A 54 76.907 -0.147 14.713 1.00 1.00 C ATOM 808 O ILE A 54 76.154 0.043 15.648 1.00 1.00 O ATOM 809 CB ILE A 54 76.313 -2.565 14.455 1.00 1.00 C ATOM 810 CG1 ILE A 54 76.882 -3.982 14.354 1.00 1.00 C ATOM 811 CG2 ILE A 54 75.381 -2.306 13.270 1.00 1.00 C ATOM 812 CD1 ILE A 54 77.527 -4.370 15.686 1.00 1.00 C ATOM 0 H ILE A 54 78.047 -2.230 16.370 1.00 1.00 H new ATOM 0 HA ILE A 54 77.947 -1.569 13.456 1.00 1.00 H new ATOM 0 HB ILE A 54 75.755 -2.461 15.385 1.00 1.00 H new ATOM 0 HG12 ILE A 54 76.089 -4.687 14.103 1.00 1.00 H new ATOM 0 HG13 ILE A 54 77.619 -4.033 13.553 1.00 1.00 H new ATOM 0 HG21 ILE A 54 74.563 -3.027 13.286 1.00 1.00 H new ATOM 0 HG22 ILE A 54 74.976 -1.296 13.339 1.00 1.00 H new ATOM 0 HG23 ILE A 54 75.938 -2.410 12.339 1.00 1.00 H new ATOM 0 HD11 ILE A 54 77.932 -5.379 15.614 1.00 1.00 H new ATOM 0 HD12 ILE A 54 78.331 -3.672 15.918 1.00 1.00 H new ATOM 0 HD13 ILE A 54 76.778 -4.336 16.477 1.00 1.00 H new ATOM 824 N PRO A 55 77.272 0.834 13.921 1.00 1.00 N ATOM 825 CA PRO A 55 76.792 2.232 14.111 1.00 1.00 C ATOM 826 C PRO A 55 75.385 2.443 13.543 1.00 1.00 C ATOM 827 O PRO A 55 74.584 3.170 14.096 1.00 1.00 O ATOM 828 CB PRO A 55 77.817 3.064 13.341 1.00 1.00 C ATOM 829 CG PRO A 55 78.298 2.164 12.249 1.00 1.00 C ATOM 830 CD PRO A 55 78.178 0.725 12.766 1.00 1.00 C ATOM 0 HA PRO A 55 76.714 2.501 15.164 1.00 1.00 H new ATOM 0 HB2 PRO A 55 77.367 3.971 12.937 1.00 1.00 H new ATOM 0 HB3 PRO A 55 78.638 3.376 13.986 1.00 1.00 H new ATOM 0 HG2 PRO A 55 77.702 2.300 11.347 1.00 1.00 H new ATOM 0 HG3 PRO A 55 79.331 2.394 11.987 1.00 1.00 H new ATOM 0 HD2 PRO A 55 77.774 0.060 12.003 1.00 1.00 H new ATOM 0 HD3 PRO A 55 79.149 0.324 13.057 1.00 1.00 H new ATOM 838 N GLY A 56 75.080 1.813 12.442 1.00 1.00 N ATOM 839 CA GLY A 56 73.726 1.978 11.840 1.00 1.00 C ATOM 840 C GLY A 56 72.686 1.287 12.723 1.00 1.00 C ATOM 841 O GLY A 56 71.707 1.883 13.127 1.00 1.00 O ATOM 0 H GLY A 56 75.709 1.192 11.933 1.00 1.00 H new ATOM 0 HA2 GLY A 56 73.488 3.037 11.740 1.00 1.00 H new ATOM 0 HA3 GLY A 56 73.708 1.551 10.837 1.00 1.00 H new ATOM 845 N MET A 57 72.888 0.034 13.025 1.00 1.00 N ATOM 846 CA MET A 57 71.909 -0.694 13.880 1.00 1.00 C ATOM 847 C MET A 57 70.498 -0.470 13.337 1.00 1.00 C ATOM 848 O MET A 57 69.692 0.213 13.939 1.00 1.00 O ATOM 849 CB MET A 57 71.993 -0.167 15.315 1.00 1.00 C ATOM 850 CG MET A 57 73.461 -0.039 15.727 1.00 1.00 C ATOM 851 SD MET A 57 73.559 0.373 17.487 1.00 1.00 S ATOM 852 CE MET A 57 72.915 -1.194 18.123 1.00 1.00 C ATOM 0 H MET A 57 73.689 -0.517 12.716 1.00 1.00 H new ATOM 0 HA MET A 57 72.139 -1.759 13.871 1.00 1.00 H new ATOM 0 HB2 MET A 57 71.498 0.802 15.387 1.00 1.00 H new ATOM 0 HB3 MET A 57 71.472 -0.843 15.993 1.00 1.00 H new ATOM 0 HG2 MET A 57 73.988 -0.973 15.531 1.00 1.00 H new ATOM 0 HG3 MET A 57 73.950 0.733 15.134 1.00 1.00 H new ATOM 0 HE1 MET A 57 73.324 -1.379 19.116 1.00 1.00 H new ATOM 0 HE2 MET A 57 71.828 -1.143 18.182 1.00 1.00 H new ATOM 0 HE3 MET A 57 73.205 -2.005 17.454 1.00 1.00 H new ATOM 862 N GLU A 58 70.192 -1.036 12.202 1.00 1.00 N ATOM 863 CA GLU A 58 68.833 -0.852 11.620 1.00 1.00 C ATOM 864 C GLU A 58 68.455 0.630 11.673 1.00 1.00 C ATOM 865 O GLU A 58 67.325 0.985 11.943 1.00 1.00 O ATOM 866 CB GLU A 58 67.818 -1.671 12.423 1.00 1.00 C ATOM 867 CG GLU A 58 66.556 -1.886 11.585 1.00 1.00 C ATOM 868 CD GLU A 58 65.461 -2.499 12.459 1.00 1.00 C ATOM 869 OE1 GLU A 58 65.787 -3.339 13.282 1.00 1.00 O ATOM 870 OE2 GLU A 58 64.314 -2.120 12.290 1.00 1.00 O ATOM 0 H GLU A 58 70.824 -1.618 11.653 1.00 1.00 H new ATOM 0 HA GLU A 58 68.830 -1.190 10.584 1.00 1.00 H new ATOM 0 HB2 GLU A 58 68.250 -2.632 12.702 1.00 1.00 H new ATOM 0 HB3 GLU A 58 67.568 -1.153 13.349 1.00 1.00 H new ATOM 0 HG2 GLU A 58 66.216 -0.937 11.170 1.00 1.00 H new ATOM 0 HG3 GLU A 58 66.774 -2.542 10.743 1.00 1.00 H new ATOM 877 N GLY A 59 69.397 1.499 11.419 1.00 1.00 N ATOM 878 CA GLY A 59 69.100 2.960 11.455 1.00 1.00 C ATOM 879 C GLY A 59 69.912 3.672 10.372 1.00 1.00 C ATOM 880 O GLY A 59 70.828 4.417 10.657 1.00 1.00 O ATOM 0 H GLY A 59 70.361 1.259 11.188 1.00 1.00 H new ATOM 0 HA2 GLY A 59 68.035 3.129 11.297 1.00 1.00 H new ATOM 0 HA3 GLY A 59 69.345 3.368 12.436 1.00 1.00 H new ATOM 884 N CYS A 60 69.583 3.448 9.129 1.00 1.00 N ATOM 885 CA CYS A 60 70.336 4.111 8.027 1.00 1.00 C ATOM 886 C CYS A 60 69.586 3.910 6.707 1.00 1.00 C ATOM 887 O CYS A 60 70.172 3.908 5.643 1.00 1.00 O ATOM 888 CB CYS A 60 71.736 3.496 7.925 1.00 1.00 C ATOM 889 SG CYS A 60 72.956 4.810 7.675 1.00 1.00 S ATOM 0 H CYS A 60 68.825 2.835 8.829 1.00 1.00 H new ATOM 0 HA CYS A 60 70.425 5.178 8.233 1.00 1.00 H new ATOM 0 HB2 CYS A 60 71.967 2.939 8.833 1.00 1.00 H new ATOM 0 HB3 CYS A 60 71.774 2.787 7.098 1.00 1.00 H new ATOM 894 N GLY A 61 68.293 3.738 6.769 1.00 1.00 N ATOM 895 CA GLY A 61 67.506 3.534 5.520 1.00 1.00 C ATOM 896 C GLY A 61 67.236 4.884 4.854 1.00 1.00 C ATOM 897 O GLY A 61 66.361 5.011 4.020 1.00 1.00 O ATOM 0 H GLY A 61 67.748 3.730 7.631 1.00 1.00 H new ATOM 0 HA2 GLY A 61 68.052 2.883 4.837 1.00 1.00 H new ATOM 0 HA3 GLY A 61 66.564 3.036 5.750 1.00 1.00 H new ATOM 901 N THR A 62 67.981 5.894 5.212 1.00 1.00 N ATOM 902 CA THR A 62 67.766 7.235 4.597 1.00 1.00 C ATOM 903 C THR A 62 68.651 7.372 3.358 1.00 1.00 C ATOM 904 O THR A 62 68.286 8.008 2.389 1.00 1.00 O ATOM 905 CB THR A 62 68.132 8.323 5.607 1.00 1.00 C ATOM 906 OG1 THR A 62 69.367 7.994 6.227 1.00 1.00 O ATOM 907 CG2 THR A 62 67.036 8.426 6.669 1.00 1.00 C ATOM 0 H THR A 62 68.729 5.849 5.904 1.00 1.00 H new ATOM 0 HA THR A 62 66.720 7.342 4.311 1.00 1.00 H new ATOM 0 HB THR A 62 68.226 9.280 5.093 1.00 1.00 H new ATOM 0 HG1 THR A 62 69.604 8.691 6.874 1.00 1.00 H new ATOM 0 HG21 THR A 62 67.298 9.202 7.388 1.00 1.00 H new ATOM 0 HG22 THR A 62 66.089 8.679 6.192 1.00 1.00 H new ATOM 0 HG23 THR A 62 66.938 7.471 7.185 1.00 1.00 H new ATOM 915 N ASP A 63 69.810 6.777 3.381 1.00 1.00 N ATOM 916 CA ASP A 63 70.720 6.867 2.205 1.00 1.00 C ATOM 917 C ASP A 63 70.136 6.054 1.046 1.00 1.00 C ATOM 918 O ASP A 63 70.851 5.557 0.199 1.00 1.00 O ATOM 919 CB ASP A 63 72.092 6.311 2.588 1.00 1.00 C ATOM 920 CG ASP A 63 72.479 6.823 3.977 1.00 1.00 C ATOM 921 OD1 ASP A 63 72.771 8.002 4.092 1.00 1.00 O ATOM 922 OD2 ASP A 63 72.476 6.027 4.902 1.00 1.00 O ATOM 0 H ASP A 63 70.168 6.231 4.165 1.00 1.00 H new ATOM 0 HA ASP A 63 70.823 7.907 1.897 1.00 1.00 H new ATOM 0 HB2 ASP A 63 72.069 5.221 2.584 1.00 1.00 H new ATOM 0 HB3 ASP A 63 72.838 6.617 1.855 1.00 1.00 H new ATOM 927 N ILE A 64 68.836 5.921 1.005 1.00 1.00 N ATOM 928 CA ILE A 64 68.181 5.147 -0.089 1.00 1.00 C ATOM 929 C ILE A 64 67.345 6.102 -0.933 1.00 1.00 C ATOM 930 O ILE A 64 67.331 6.037 -2.145 1.00 1.00 O ATOM 931 CB ILE A 64 67.287 4.072 0.531 1.00 1.00 C ATOM 932 CG1 ILE A 64 66.854 3.083 -0.553 1.00 1.00 C ATOM 933 CG2 ILE A 64 66.049 4.728 1.145 1.00 1.00 C ATOM 934 CD1 ILE A 64 65.954 2.011 0.063 1.00 1.00 C ATOM 0 HA ILE A 64 68.930 4.669 -0.721 1.00 1.00 H new ATOM 0 HB ILE A 64 67.840 3.543 1.307 1.00 1.00 H new ATOM 0 HG12 ILE A 64 66.322 3.607 -1.347 1.00 1.00 H new ATOM 0 HG13 ILE A 64 67.730 2.620 -1.008 1.00 1.00 H new ATOM 0 HG21 ILE A 64 65.412 3.961 1.587 1.00 1.00 H new ATOM 0 HG22 ILE A 64 66.356 5.434 1.917 1.00 1.00 H new ATOM 0 HG23 ILE A 64 65.495 5.257 0.369 1.00 1.00 H new ATOM 0 HD11 ILE A 64 65.646 1.307 -0.710 1.00 1.00 H new ATOM 0 HD12 ILE A 64 66.502 1.479 0.841 1.00 1.00 H new ATOM 0 HD13 ILE A 64 65.072 2.482 0.497 1.00 1.00 H new ATOM 946 N THR A 65 66.661 6.999 -0.294 1.00 1.00 N ATOM 947 CA THR A 65 65.834 7.980 -1.039 1.00 1.00 C ATOM 948 C THR A 65 66.744 9.083 -1.565 1.00 1.00 C ATOM 949 O THR A 65 66.417 9.785 -2.501 1.00 1.00 O ATOM 950 CB THR A 65 64.830 8.600 -0.078 1.00 1.00 C ATOM 951 OG1 THR A 65 64.014 7.577 0.475 1.00 1.00 O ATOM 952 CG2 THR A 65 63.955 9.605 -0.829 1.00 1.00 C ATOM 0 H THR A 65 66.638 7.097 0.721 1.00 1.00 H new ATOM 0 HA THR A 65 65.317 7.489 -1.863 1.00 1.00 H new ATOM 0 HB THR A 65 65.362 9.114 0.723 1.00 1.00 H new ATOM 0 HG1 THR A 65 63.368 7.974 1.096 1.00 1.00 H new ATOM 0 HG21 THR A 65 63.236 10.048 -0.140 1.00 1.00 H new ATOM 0 HG22 THR A 65 64.583 10.389 -1.252 1.00 1.00 H new ATOM 0 HG23 THR A 65 63.421 9.095 -1.631 1.00 1.00 H new ATOM 960 N VAL A 66 67.878 9.254 -0.945 1.00 1.00 N ATOM 961 CA VAL A 66 68.812 10.328 -1.374 1.00 1.00 C ATOM 962 C VAL A 66 69.908 9.766 -2.282 1.00 1.00 C ATOM 963 O VAL A 66 70.159 10.298 -3.344 1.00 1.00 O ATOM 964 CB VAL A 66 69.454 10.958 -0.134 1.00 1.00 C ATOM 965 CG1 VAL A 66 70.005 12.340 -0.490 1.00 1.00 C ATOM 966 CG2 VAL A 66 68.401 11.099 0.968 1.00 1.00 C ATOM 0 H VAL A 66 68.198 8.693 -0.156 1.00 1.00 H new ATOM 0 HA VAL A 66 68.251 11.078 -1.932 1.00 1.00 H new ATOM 0 HB VAL A 66 70.267 10.322 0.217 1.00 1.00 H new ATOM 0 HG11 VAL A 66 70.462 12.788 0.393 1.00 1.00 H new ATOM 0 HG12 VAL A 66 70.754 12.242 -1.276 1.00 1.00 H new ATOM 0 HG13 VAL A 66 69.192 12.976 -0.841 1.00 1.00 H new ATOM 0 HG21 VAL A 66 68.856 11.547 1.851 1.00 1.00 H new ATOM 0 HG22 VAL A 66 67.589 11.735 0.616 1.00 1.00 H new ATOM 0 HG23 VAL A 66 68.007 10.115 1.223 1.00 1.00 H new ATOM 976 N ILE A 67 70.586 8.717 -1.877 1.00 1.00 N ATOM 977 CA ILE A 67 71.686 8.182 -2.755 1.00 1.00 C ATOM 978 C ILE A 67 71.672 6.650 -2.854 1.00 1.00 C ATOM 979 O ILE A 67 72.344 5.963 -2.110 1.00 1.00 O ATOM 980 CB ILE A 67 73.043 8.627 -2.200 1.00 1.00 C ATOM 981 CG1 ILE A 67 73.147 10.152 -2.272 1.00 1.00 C ATOM 982 CG2 ILE A 67 74.165 8.001 -3.031 1.00 1.00 C ATOM 983 CD1 ILE A 67 73.174 10.594 -3.737 1.00 1.00 C ATOM 0 H ILE A 67 70.434 8.217 -1.001 1.00 1.00 H new ATOM 0 HA ILE A 67 71.520 8.582 -3.755 1.00 1.00 H new ATOM 0 HB ILE A 67 73.135 8.304 -1.163 1.00 1.00 H new ATOM 0 HG12 ILE A 67 72.301 10.609 -1.759 1.00 1.00 H new ATOM 0 HG13 ILE A 67 74.049 10.490 -1.763 1.00 1.00 H new ATOM 0 HG21 ILE A 67 75.130 8.318 -2.636 1.00 1.00 H new ATOM 0 HG22 ILE A 67 74.091 6.915 -2.982 1.00 1.00 H new ATOM 0 HG23 ILE A 67 74.074 8.324 -4.068 1.00 1.00 H new ATOM 0 HD11 ILE A 67 73.248 11.680 -3.788 1.00 1.00 H new ATOM 0 HD12 ILE A 67 74.034 10.148 -4.236 1.00 1.00 H new ATOM 0 HD13 ILE A 67 72.259 10.269 -4.232 1.00 1.00 H new ATOM 995 N CYS A 68 70.960 6.122 -3.810 1.00 1.00 N ATOM 996 CA CYS A 68 70.942 4.645 -4.031 1.00 1.00 C ATOM 997 C CYS A 68 71.262 4.379 -5.511 1.00 1.00 C ATOM 998 O CYS A 68 71.485 5.303 -6.266 1.00 1.00 O ATOM 999 CB CYS A 68 69.564 4.086 -3.646 1.00 1.00 C ATOM 1000 SG CYS A 68 69.773 2.562 -2.693 1.00 1.00 S ATOM 0 H CYS A 68 70.381 6.657 -4.457 1.00 1.00 H new ATOM 0 HA CYS A 68 71.687 4.147 -3.410 1.00 1.00 H new ATOM 0 HB2 CYS A 68 69.013 4.821 -3.059 1.00 1.00 H new ATOM 0 HB3 CYS A 68 68.977 3.889 -4.543 1.00 1.00 H new ATOM 1005 N PRO A 69 71.335 3.141 -5.943 1.00 1.00 N ATOM 1006 CA PRO A 69 71.688 2.817 -7.358 1.00 1.00 C ATOM 1007 C PRO A 69 70.992 3.724 -8.381 1.00 1.00 C ATOM 1008 O PRO A 69 71.507 3.957 -9.456 1.00 1.00 O ATOM 1009 CB PRO A 69 71.238 1.367 -7.510 1.00 1.00 C ATOM 1010 CG PRO A 69 71.399 0.786 -6.144 1.00 1.00 C ATOM 1011 CD PRO A 69 71.100 1.920 -5.154 1.00 1.00 C ATOM 0 HA PRO A 69 72.749 2.970 -7.553 1.00 1.00 H new ATOM 0 HB2 PRO A 69 70.204 1.305 -7.849 1.00 1.00 H new ATOM 0 HB3 PRO A 69 71.846 0.836 -8.242 1.00 1.00 H new ATOM 0 HG2 PRO A 69 70.716 -0.050 -5.995 1.00 1.00 H new ATOM 0 HG3 PRO A 69 72.409 0.402 -6.002 1.00 1.00 H new ATOM 0 HD2 PRO A 69 70.075 1.871 -4.787 1.00 1.00 H new ATOM 0 HD3 PRO A 69 71.753 1.874 -4.283 1.00 1.00 H new ATOM 1019 N TRP A 70 69.835 4.243 -8.067 1.00 1.00 N ATOM 1020 CA TRP A 70 69.145 5.130 -9.049 1.00 1.00 C ATOM 1021 C TRP A 70 69.742 6.539 -8.982 1.00 1.00 C ATOM 1022 O TRP A 70 69.300 7.441 -9.664 1.00 1.00 O ATOM 1023 CB TRP A 70 67.641 5.188 -8.753 1.00 1.00 C ATOM 1024 CG TRP A 70 67.417 5.237 -7.276 1.00 1.00 C ATOM 1025 CD1 TRP A 70 68.234 5.848 -6.387 1.00 1.00 C ATOM 1026 CD2 TRP A 70 66.322 4.667 -6.501 1.00 1.00 C ATOM 1027 NE1 TRP A 70 67.711 5.689 -5.116 1.00 1.00 N ATOM 1028 CE2 TRP A 70 66.534 4.968 -5.134 1.00 1.00 C ATOM 1029 CE3 TRP A 70 65.179 3.925 -6.847 1.00 1.00 C ATOM 1030 CZ2 TRP A 70 65.641 4.547 -4.145 1.00 1.00 C ATOM 1031 CZ3 TRP A 70 64.280 3.501 -5.857 1.00 1.00 C ATOM 1032 CH2 TRP A 70 64.509 3.810 -4.510 1.00 1.00 C ATOM 0 H TRP A 70 69.343 4.094 -7.186 1.00 1.00 H new ATOM 0 HA TRP A 70 69.289 4.723 -10.050 1.00 1.00 H new ATOM 0 HB2 TRP A 70 67.202 6.066 -9.226 1.00 1.00 H new ATOM 0 HB3 TRP A 70 67.144 4.315 -9.177 1.00 1.00 H new ATOM 0 HD1 TRP A 70 69.145 6.374 -6.630 1.00 1.00 H new ATOM 0 HE1 TRP A 70 68.142 6.059 -4.269 1.00 1.00 H new ATOM 0 HE3 TRP A 70 64.992 3.680 -7.882 1.00 1.00 H new ATOM 0 HZ2 TRP A 70 65.823 4.788 -3.108 1.00 1.00 H new ATOM 0 HZ3 TRP A 70 63.405 2.932 -6.135 1.00 1.00 H new ATOM 0 HH2 TRP A 70 63.812 3.480 -3.754 1.00 1.00 H new ATOM 1043 N GLU A 71 70.744 6.736 -8.165 1.00 1.00 N ATOM 1044 CA GLU A 71 71.367 8.086 -8.053 1.00 1.00 C ATOM 1045 C GLU A 71 72.859 7.928 -7.751 1.00 1.00 C ATOM 1046 O GLU A 71 73.592 8.893 -7.670 1.00 1.00 O ATOM 1047 CB GLU A 71 70.701 8.863 -6.913 1.00 1.00 C ATOM 1048 CG GLU A 71 69.309 9.322 -7.350 1.00 1.00 C ATOM 1049 CD GLU A 71 68.612 10.025 -6.183 1.00 1.00 C ATOM 1050 OE1 GLU A 71 68.131 9.332 -5.302 1.00 1.00 O ATOM 1051 OE2 GLU A 71 68.573 11.244 -6.190 1.00 1.00 O ATOM 0 H GLU A 71 71.158 6.018 -7.570 1.00 1.00 H new ATOM 0 HA GLU A 71 71.235 8.628 -8.989 1.00 1.00 H new ATOM 0 HB2 GLU A 71 70.626 8.234 -6.026 1.00 1.00 H new ATOM 0 HB3 GLU A 71 71.311 9.725 -6.642 1.00 1.00 H new ATOM 0 HG2 GLU A 71 69.388 9.999 -8.201 1.00 1.00 H new ATOM 0 HG3 GLU A 71 68.719 8.466 -7.677 1.00 1.00 H new ATOM 1058 N ALA A 72 73.310 6.716 -7.578 1.00 1.00 N ATOM 1059 CA ALA A 72 74.751 6.490 -7.274 1.00 1.00 C ATOM 1060 C ALA A 72 75.580 6.640 -8.554 1.00 1.00 C ATOM 1061 O ALA A 72 75.276 7.445 -9.411 1.00 1.00 O ATOM 1062 CB ALA A 72 74.931 5.080 -6.704 1.00 1.00 C ATOM 0 H ALA A 72 72.742 5.871 -7.634 1.00 1.00 H new ATOM 0 HA ALA A 72 75.089 7.225 -6.543 1.00 1.00 H new ATOM 0 HB1 ALA A 72 75.984 4.910 -6.480 1.00 1.00 H new ATOM 0 HB2 ALA A 72 74.345 4.979 -5.791 1.00 1.00 H new ATOM 0 HB3 ALA A 72 74.592 4.346 -7.435 1.00 1.00 H new ATOM 1068 N CYS A 73 76.625 5.868 -8.688 1.00 1.00 N ATOM 1069 CA CYS A 73 77.472 5.965 -9.910 1.00 1.00 C ATOM 1070 C CYS A 73 76.698 5.414 -11.109 1.00 1.00 C ATOM 1071 O CYS A 73 76.637 6.027 -12.157 1.00 1.00 O ATOM 1072 CB CYS A 73 78.753 5.150 -9.710 1.00 1.00 C ATOM 1073 SG CYS A 73 78.325 3.460 -9.222 1.00 1.00 S ATOM 0 H CYS A 73 76.928 5.175 -8.004 1.00 1.00 H new ATOM 0 HA CYS A 73 77.731 7.008 -10.092 1.00 1.00 H new ATOM 0 HB2 CYS A 73 79.336 5.137 -10.631 1.00 1.00 H new ATOM 0 HB3 CYS A 73 79.376 5.614 -8.945 1.00 1.00 H new ATOM 1078 N ASN A 74 76.105 4.262 -10.961 1.00 1.00 N ATOM 1079 CA ASN A 74 75.331 3.667 -12.085 1.00 1.00 C ATOM 1080 C ASN A 74 74.715 2.347 -11.622 1.00 1.00 C ATOM 1081 O ASN A 74 73.753 2.326 -10.880 1.00 1.00 O ATOM 1082 CB ASN A 74 76.264 3.410 -13.271 1.00 1.00 C ATOM 1083 CG ASN A 74 77.583 2.824 -12.765 1.00 1.00 C ATOM 1084 OD1 ASN A 74 77.650 1.663 -12.412 1.00 1.00 O ATOM 1085 ND2 ASN A 74 78.644 3.583 -12.714 1.00 1.00 N ATOM 0 H ASN A 74 76.124 3.705 -10.106 1.00 1.00 H new ATOM 0 HA ASN A 74 74.542 4.353 -12.393 1.00 1.00 H new ATOM 0 HB2 ASN A 74 75.794 2.722 -13.974 1.00 1.00 H new ATOM 0 HB3 ASN A 74 76.450 4.339 -13.809 1.00 1.00 H new ATOM 0 HD21 ASN A 74 79.528 3.201 -12.378 1.00 1.00 H new ATOM 0 HD22 ASN A 74 78.589 4.558 -13.010 1.00 1.00 H new ATOM 1092 N HIS A 75 75.265 1.243 -12.047 1.00 1.00 N ATOM 1093 CA HIS A 75 74.713 -0.073 -11.622 1.00 1.00 C ATOM 1094 C HIS A 75 75.149 -0.357 -10.183 1.00 1.00 C ATOM 1095 O HIS A 75 74.966 0.457 -9.299 1.00 1.00 O ATOM 1096 CB HIS A 75 75.243 -1.172 -12.545 1.00 1.00 C ATOM 1097 CG HIS A 75 74.987 -0.790 -13.977 1.00 1.00 C ATOM 1098 ND1 HIS A 75 73.706 -0.702 -14.501 1.00 1.00 N ATOM 1099 CD2 HIS A 75 75.838 -0.470 -15.008 1.00 1.00 C ATOM 1100 CE1 HIS A 75 73.819 -0.342 -15.792 1.00 1.00 C ATOM 1101 NE2 HIS A 75 75.095 -0.189 -16.150 1.00 1.00 N ATOM 0 H HIS A 75 76.072 1.196 -12.669 1.00 1.00 H new ATOM 0 HA HIS A 75 73.625 -0.051 -11.678 1.00 1.00 H new ATOM 0 HB2 HIS A 75 76.311 -1.316 -12.381 1.00 1.00 H new ATOM 0 HB3 HIS A 75 74.755 -2.120 -12.317 1.00 1.00 H new ATOM 0 HD2 HIS A 75 76.916 -0.441 -14.942 1.00 1.00 H new ATOM 0 HE1 HIS A 75 72.980 -0.195 -16.457 1.00 1.00 H new ATOM 0 HE2 HIS A 75 75.451 0.078 -17.068 1.00 1.00 H new ATOM 1110 N CYS A 76 75.729 -1.500 -9.938 1.00 1.00 N ATOM 1111 CA CYS A 76 76.178 -1.822 -8.554 1.00 1.00 C ATOM 1112 C CYS A 76 76.999 -3.113 -8.571 1.00 1.00 C ATOM 1113 O CYS A 76 76.469 -4.200 -8.459 1.00 1.00 O ATOM 1114 CB CYS A 76 74.956 -1.998 -7.648 1.00 1.00 C ATOM 1115 SG CYS A 76 75.395 -1.548 -5.951 1.00 1.00 S ATOM 0 H CYS A 76 75.911 -2.223 -10.634 1.00 1.00 H new ATOM 0 HA CYS A 76 76.795 -1.008 -8.172 1.00 1.00 H new ATOM 0 HB2 CYS A 76 74.135 -1.373 -8.001 1.00 1.00 H new ATOM 0 HB3 CYS A 76 74.609 -3.031 -7.684 1.00 1.00 H new ATOM 1120 N GLU A 77 78.291 -3.001 -8.711 1.00 1.00 N ATOM 1121 CA GLU A 77 79.146 -4.219 -8.735 1.00 1.00 C ATOM 1122 C GLU A 77 79.224 -4.818 -7.330 1.00 1.00 C ATOM 1123 O GLU A 77 78.237 -4.918 -6.629 1.00 1.00 O ATOM 1124 CB GLU A 77 80.554 -3.847 -9.206 1.00 1.00 C ATOM 1125 CG GLU A 77 80.462 -3.010 -10.483 1.00 1.00 C ATOM 1126 CD GLU A 77 81.865 -2.577 -10.913 1.00 1.00 C ATOM 1127 OE1 GLU A 77 82.795 -3.330 -10.674 1.00 1.00 O ATOM 1128 OE2 GLU A 77 81.986 -1.500 -11.473 1.00 1.00 O ATOM 0 H GLU A 77 78.791 -2.118 -8.810 1.00 1.00 H new ATOM 0 HA GLU A 77 78.714 -4.949 -9.419 1.00 1.00 H new ATOM 0 HB2 GLU A 77 81.073 -3.287 -8.428 1.00 1.00 H new ATOM 0 HB3 GLU A 77 81.137 -4.749 -9.391 1.00 1.00 H new ATOM 0 HG2 GLU A 77 79.990 -3.589 -11.277 1.00 1.00 H new ATOM 0 HG3 GLU A 77 79.836 -2.134 -10.312 1.00 1.00 H new ATOM 1135 N LEU A 78 80.395 -5.216 -6.917 1.00 1.00 N ATOM 1136 CA LEU A 78 80.552 -5.811 -5.560 1.00 1.00 C ATOM 1137 C LEU A 78 82.043 -6.014 -5.282 1.00 1.00 C ATOM 1138 O LEU A 78 82.599 -5.441 -4.367 1.00 1.00 O ATOM 1139 CB LEU A 78 79.823 -7.162 -5.513 1.00 1.00 C ATOM 1140 CG LEU A 78 79.500 -7.524 -4.062 1.00 1.00 C ATOM 1141 CD1 LEU A 78 80.788 -7.529 -3.238 1.00 1.00 C ATOM 1142 CD2 LEU A 78 78.530 -6.491 -3.484 1.00 1.00 C ATOM 0 H LEU A 78 81.254 -5.155 -7.463 1.00 1.00 H new ATOM 0 HA LEU A 78 80.126 -5.149 -4.806 1.00 1.00 H new ATOM 0 HB2 LEU A 78 78.905 -7.111 -6.098 1.00 1.00 H new ATOM 0 HB3 LEU A 78 80.444 -7.937 -5.962 1.00 1.00 H new ATOM 0 HG LEU A 78 79.043 -8.513 -4.027 1.00 1.00 H new ATOM 0 HD11 LEU A 78 80.558 -7.787 -2.204 1.00 1.00 H new ATOM 0 HD12 LEU A 78 81.480 -8.263 -3.650 1.00 1.00 H new ATOM 0 HD13 LEU A 78 81.245 -6.540 -3.272 1.00 1.00 H new ATOM 0 HD21 LEU A 78 78.299 -6.748 -2.450 1.00 1.00 H new ATOM 0 HD22 LEU A 78 78.988 -5.502 -3.519 1.00 1.00 H new ATOM 0 HD23 LEU A 78 77.611 -6.486 -4.071 1.00 1.00 H new ATOM 1154 N HIS A 79 82.693 -6.825 -6.071 1.00 1.00 N ATOM 1155 CA HIS A 79 84.149 -7.069 -5.865 1.00 1.00 C ATOM 1156 C HIS A 79 84.683 -7.918 -7.021 1.00 1.00 C ATOM 1157 O HIS A 79 85.812 -8.367 -7.006 1.00 1.00 O ATOM 1158 CB HIS A 79 84.364 -7.812 -4.544 1.00 1.00 C ATOM 1159 CG HIS A 79 85.838 -7.927 -4.267 1.00 1.00 C ATOM 1160 ND1 HIS A 79 86.445 -9.143 -3.991 1.00 1.00 N ATOM 1161 CD2 HIS A 79 86.839 -6.987 -4.220 1.00 1.00 C ATOM 1162 CE1 HIS A 79 87.755 -8.908 -3.792 1.00 1.00 C ATOM 1163 NE2 HIS A 79 88.046 -7.612 -3.920 1.00 1.00 N ATOM 0 H HIS A 79 82.277 -7.331 -6.853 1.00 1.00 H new ATOM 0 HA HIS A 79 84.679 -6.117 -5.832 1.00 1.00 H new ATOM 0 HB2 HIS A 79 83.871 -7.280 -3.731 1.00 1.00 H new ATOM 0 HB3 HIS A 79 83.914 -8.804 -4.595 1.00 1.00 H new ATOM 0 HD2 HIS A 79 86.710 -5.928 -4.389 1.00 1.00 H new ATOM 0 HE1 HIS A 79 88.480 -9.673 -3.558 1.00 1.00 H new ATOM 0 HE2 HIS A 79 88.961 -7.172 -3.819 1.00 1.00 H new ATOM 1172 N GLU A 80 83.875 -8.142 -8.022 1.00 1.00 N ATOM 1173 CA GLU A 80 84.324 -8.963 -9.184 1.00 1.00 C ATOM 1174 C GLU A 80 84.838 -8.040 -10.295 1.00 1.00 C ATOM 1175 O GLU A 80 85.991 -8.096 -10.675 1.00 1.00 O ATOM 1176 CB GLU A 80 83.145 -9.799 -9.703 1.00 1.00 C ATOM 1177 CG GLU A 80 81.830 -9.094 -9.364 1.00 1.00 C ATOM 1178 CD GLU A 80 80.674 -9.799 -10.077 1.00 1.00 C ATOM 1179 OE1 GLU A 80 80.116 -10.715 -9.496 1.00 1.00 O ATOM 1180 OE2 GLU A 80 80.367 -9.410 -11.192 1.00 1.00 O ATOM 0 H GLU A 80 82.920 -7.790 -8.085 1.00 1.00 H new ATOM 0 HA GLU A 80 85.128 -9.630 -8.873 1.00 1.00 H new ATOM 0 HB2 GLU A 80 83.229 -9.936 -10.781 1.00 1.00 H new ATOM 0 HB3 GLU A 80 83.164 -10.792 -9.254 1.00 1.00 H new ATOM 0 HG2 GLU A 80 81.667 -9.104 -8.286 1.00 1.00 H new ATOM 0 HG3 GLU A 80 81.876 -8.049 -9.669 1.00 1.00 H new ATOM 1187 N LEU A 81 83.995 -7.191 -10.820 1.00 1.00 N ATOM 1188 CA LEU A 81 84.440 -6.269 -11.905 1.00 1.00 C ATOM 1189 C LEU A 81 85.054 -5.012 -11.284 1.00 1.00 C ATOM 1190 O LEU A 81 85.812 -4.303 -11.915 1.00 1.00 O ATOM 1191 CB LEU A 81 83.238 -5.872 -12.769 1.00 1.00 C ATOM 1192 CG LEU A 81 82.894 -7.014 -13.727 1.00 1.00 C ATOM 1193 CD1 LEU A 81 84.013 -7.170 -14.759 1.00 1.00 C ATOM 1194 CD2 LEU A 81 82.747 -8.315 -12.936 1.00 1.00 C ATOM 0 H LEU A 81 83.018 -7.096 -10.544 1.00 1.00 H new ATOM 0 HA LEU A 81 85.182 -6.772 -12.525 1.00 1.00 H new ATOM 0 HB2 LEU A 81 82.381 -5.645 -12.135 1.00 1.00 H new ATOM 0 HB3 LEU A 81 83.466 -4.967 -13.333 1.00 1.00 H new ATOM 0 HG LEU A 81 81.957 -6.790 -14.238 1.00 1.00 H new ATOM 0 HD11 LEU A 81 83.768 -7.984 -15.441 1.00 1.00 H new ATOM 0 HD12 LEU A 81 84.120 -6.243 -15.323 1.00 1.00 H new ATOM 0 HD13 LEU A 81 84.950 -7.394 -14.249 1.00 1.00 H new ATOM 0 HD21 LEU A 81 82.502 -9.130 -13.618 1.00 1.00 H new ATOM 0 HD22 LEU A 81 83.684 -8.538 -12.426 1.00 1.00 H new ATOM 0 HD23 LEU A 81 81.950 -8.205 -12.200 1.00 1.00 H new ATOM 1206 N ALA A 82 84.731 -4.730 -10.052 1.00 1.00 N ATOM 1207 CA ALA A 82 85.295 -3.518 -9.394 1.00 1.00 C ATOM 1208 C ALA A 82 86.821 -3.626 -9.341 1.00 1.00 C ATOM 1209 O ALA A 82 87.446 -4.164 -10.233 1.00 1.00 O ATOM 1210 CB ALA A 82 84.742 -3.406 -7.973 1.00 1.00 C ATOM 0 H ALA A 82 84.102 -5.286 -9.473 1.00 1.00 H new ATOM 0 HA ALA A 82 85.015 -2.633 -9.965 1.00 1.00 H new ATOM 0 HB1 ALA A 82 85.154 -2.520 -7.491 1.00 1.00 H new ATOM 0 HB2 ALA A 82 83.656 -3.327 -8.011 1.00 1.00 H new ATOM 0 HB3 ALA A 82 85.021 -4.292 -7.403 1.00 1.00 H new ATOM 1216 N GLN A 83 87.425 -3.116 -8.304 1.00 1.00 N ATOM 1217 CA GLN A 83 88.910 -3.187 -8.195 1.00 1.00 C ATOM 1218 C GLN A 83 89.543 -2.504 -9.408 1.00 1.00 C ATOM 1219 O GLN A 83 90.749 -2.452 -9.544 1.00 1.00 O ATOM 1220 CB GLN A 83 89.349 -4.651 -8.141 1.00 1.00 C ATOM 1221 CG GLN A 83 88.445 -5.419 -7.175 1.00 1.00 C ATOM 1222 CD GLN A 83 88.937 -6.863 -7.053 1.00 1.00 C ATOM 1223 OE1 GLN A 83 90.010 -7.110 -6.539 1.00 1.00 O ATOM 1224 NE2 GLN A 83 88.193 -7.834 -7.508 1.00 1.00 N ATOM 0 H GLN A 83 86.955 -2.653 -7.526 1.00 1.00 H new ATOM 0 HA GLN A 83 89.233 -2.680 -7.286 1.00 1.00 H new ATOM 0 HB2 GLN A 83 89.297 -5.094 -9.135 1.00 1.00 H new ATOM 0 HB3 GLN A 83 90.387 -4.719 -7.816 1.00 1.00 H new ATOM 0 HG2 GLN A 83 88.449 -4.938 -6.197 1.00 1.00 H new ATOM 0 HG3 GLN A 83 87.416 -5.403 -7.533 1.00 1.00 H new ATOM 0 HE21 GLN A 83 87.292 -7.627 -7.940 1.00 1.00 H new ATOM 0 HE22 GLN A 83 88.512 -8.800 -7.432 1.00 1.00 H new ATOM 1233 N TYR A 84 88.734 -1.972 -10.286 1.00 1.00 N ATOM 1234 CA TYR A 84 89.273 -1.278 -11.493 1.00 1.00 C ATOM 1235 C TYR A 84 88.662 0.124 -11.562 1.00 1.00 C ATOM 1236 O TYR A 84 89.068 0.954 -12.349 1.00 1.00 O ATOM 1237 CB TYR A 84 88.897 -2.076 -12.753 1.00 1.00 C ATOM 1238 CG TYR A 84 90.154 -2.551 -13.441 1.00 1.00 C ATOM 1239 CD1 TYR A 84 90.725 -3.779 -13.086 1.00 1.00 C ATOM 1240 CD2 TYR A 84 90.748 -1.764 -14.435 1.00 1.00 C ATOM 1241 CE1 TYR A 84 91.891 -4.220 -13.724 1.00 1.00 C ATOM 1242 CE2 TYR A 84 91.914 -2.205 -15.073 1.00 1.00 C ATOM 1243 CZ TYR A 84 92.485 -3.433 -14.718 1.00 1.00 C ATOM 1244 OH TYR A 84 93.634 -3.867 -15.347 1.00 1.00 O ATOM 0 H TYR A 84 87.716 -1.989 -10.218 1.00 1.00 H new ATOM 0 HA TYR A 84 90.359 -1.205 -11.433 1.00 1.00 H new ATOM 0 HB2 TYR A 84 88.273 -2.928 -12.484 1.00 1.00 H new ATOM 0 HB3 TYR A 84 88.312 -1.453 -13.430 1.00 1.00 H new ATOM 0 HD1 TYR A 84 90.266 -4.386 -12.320 1.00 1.00 H new ATOM 0 HD2 TYR A 84 90.307 -0.817 -14.710 1.00 1.00 H new ATOM 0 HE1 TYR A 84 92.332 -5.167 -13.449 1.00 1.00 H new ATOM 0 HE2 TYR A 84 92.373 -1.598 -15.839 1.00 1.00 H new ATOM 0 HH TYR A 84 93.914 -3.203 -16.011 1.00 1.00 H new ATOM 1254 N GLY A 85 87.689 0.388 -10.732 1.00 1.00 N ATOM 1255 CA GLY A 85 87.042 1.731 -10.728 1.00 1.00 C ATOM 1256 C GLY A 85 86.559 2.044 -9.312 1.00 1.00 C ATOM 1257 O GLY A 85 85.755 2.930 -9.097 1.00 1.00 O ATOM 0 H GLY A 85 87.313 -0.273 -10.053 1.00 1.00 H new ATOM 0 HA2 GLY A 85 87.749 2.491 -11.062 1.00 1.00 H new ATOM 0 HA3 GLY A 85 86.204 1.748 -11.424 1.00 1.00 H new ATOM 1261 N ILE A 86 87.047 1.319 -8.343 1.00 1.00 N ATOM 1262 CA ILE A 86 86.626 1.565 -6.936 1.00 1.00 C ATOM 1263 C ILE A 86 87.033 2.984 -6.527 1.00 1.00 C ATOM 1264 O ILE A 86 86.710 3.947 -7.193 1.00 1.00 O ATOM 1265 CB ILE A 86 87.309 0.534 -6.024 1.00 1.00 C ATOM 1266 CG1 ILE A 86 86.759 0.669 -4.602 1.00 1.00 C ATOM 1267 CG2 ILE A 86 88.818 0.783 -6.011 1.00 1.00 C ATOM 1268 CD1 ILE A 86 85.769 -0.464 -4.328 1.00 1.00 C ATOM 0 H ILE A 86 87.722 0.564 -8.466 1.00 1.00 H new ATOM 0 HA ILE A 86 85.544 1.467 -6.844 1.00 1.00 H new ATOM 0 HB ILE A 86 87.110 -0.470 -6.399 1.00 1.00 H new ATOM 0 HG12 ILE A 86 87.575 0.635 -3.880 1.00 1.00 H new ATOM 0 HG13 ILE A 86 86.266 1.634 -4.481 1.00 1.00 H new ATOM 0 HG21 ILE A 86 89.302 0.051 -5.364 1.00 1.00 H new ATOM 0 HG22 ILE A 86 89.211 0.688 -7.023 1.00 1.00 H new ATOM 0 HG23 ILE A 86 89.018 1.787 -5.637 1.00 1.00 H new ATOM 0 HD11 ILE A 86 85.377 -0.368 -3.315 1.00 1.00 H new ATOM 0 HD12 ILE A 86 84.947 -0.409 -5.042 1.00 1.00 H new ATOM 0 HD13 ILE A 86 86.276 -1.423 -4.431 1.00 1.00 H new ATOM 1280 N CYS A 87 87.739 3.124 -5.440 1.00 1.00 N ATOM 1281 CA CYS A 87 88.164 4.481 -4.997 1.00 1.00 C ATOM 1282 C CYS A 87 89.115 5.079 -6.037 1.00 1.00 C ATOM 1283 CB CYS A 87 88.878 4.377 -3.646 1.00 1.00 C ATOM 1284 SG CYS A 87 87.674 4.587 -2.311 1.00 1.00 S ATOM 0 H CYS A 87 88.040 2.357 -4.839 1.00 1.00 H new ATOM 0 HA CYS A 87 87.289 5.123 -4.894 1.00 1.00 H new ATOM 0 HB2 CYS A 87 89.371 3.409 -3.557 1.00 1.00 H new ATOM 0 HB3 CYS A 87 89.655 5.138 -3.573 1.00 1.00 H new TER 1289 CYS A 87 HETATM 1290 C1C RCY A 110 65.420 -10.774 -4.054 1.00 1.00 C HETATM 1291 O1G RCY A 110 65.932 -13.847 -3.547 1.00 1.00 O HETATM 1292 O1H RCY A 110 61.800 -12.412 -1.768 1.00 1.00 O HETATM 1293 O1J RCY A 110 62.845 -9.239 -3.771 1.00 1.00 O HETATM 1294 C1L RCY A 110 63.654 -14.729 -3.681 1.00 1.00 C HETATM 1295 C1M RCY A 110 64.146 -10.928 -0.583 1.00 1.00 C HETATM 1296 C1P RCY A 110 64.750 -13.762 -3.216 1.00 1.00 C HETATM 1297 C1Q RCY A 110 62.740 -13.114 -2.136 1.00 1.00 C HETATM 1298 N1R RCY A 110 64.192 -12.681 -2.292 1.00 1.00 N HETATM 1299 C1S RCY A 110 62.664 -14.581 -2.520 1.00 1.00 C HETATM 1300 C1U RCY A 110 64.899 -11.473 -1.677 1.00 1.00 C HETATM 1301 C1V RCY A 110 65.987 -9.230 -2.125 1.00 1.00 C HETATM 1302 N1V RCY A 110 63.601 -9.784 -2.646 1.00 1.00 N HETATM 1303 C1W RCY A 110 63.131 -9.960 -1.204 1.00 1.00 C HETATM 1304 C1X RCY A 110 65.032 -10.303 -2.651 1.00 1.00 C HETATM 1305 C1Y RCY A 110 63.148 -8.618 -0.467 1.00 1.00 C HETATM 1306 C1Z RCY A 110 61.724 -10.557 -1.204 1.00 1.00 C HETATM 0 H1ZB RCY A 110 61.721 -11.481 -1.782 1.00 1.00 H new HETATM 0 H1ZA RCY A 110 61.419 -10.769 -0.179 1.00 1.00 H new HETATM 0 H1YB RCY A 110 62.891 -8.775 0.581 1.00 1.00 H new HETATM 0 H1YA RCY A 110 64.143 -8.178 -0.535 1.00 1.00 H new HETATM 0 H1VB RCY A 110 66.999 -9.633 -2.082 1.00 1.00 H new HETATM 0 H1VA RCY A 110 65.968 -8.368 -2.792 1.00 1.00 H new HETATM 0 H1MA RCY A 110 63.641 -11.717 -0.026 1.00 1.00 H new HETATM 0 H1LA RCY A 110 63.221 -14.440 -4.638 1.00 1.00 H new HETATM 0 H1CB RCY A 110 66.377 -11.294 -4.011 1.00 1.00 H new HETATM 0 H1CA RCY A 110 64.655 -11.451 -4.435 1.00 1.00 H new HETATM 0 H1Z RCY A 110 61.028 -9.847 -1.650 1.00 1.00 H new HETATM 0 H1Y RCY A 110 62.422 -7.944 -0.921 1.00 1.00 H new HETATM 0 H1V RCY A 110 65.675 -8.924 -1.126 1.00 1.00 H new HETATM 0 H1U RCY A 110 65.874 -11.858 -1.376 1.00 1.00 H new HETATM 0 H1S RCY A 110 62.936 -15.224 -1.683 1.00 1.00 H new HETATM 0 H1M RCY A 110 64.799 -10.410 0.119 1.00 1.00 H new HETATM 0 H1L RCY A 110 64.018 -15.750 -3.792 1.00 1.00 H new HETATM 0 H1C RCY A 110 65.504 -9.913 -4.717 1.00 1.00 H new HETATM 1309 C1C RCY A 121 64.072 5.333 -11.322 1.00 1.00 C HETATM 1310 O1G RCY A 121 66.332 2.496 -12.881 1.00 1.00 O HETATM 1311 O1H RCY A 121 66.151 4.449 -11.670 1.00 1.00 O HETATM 1312 O1J RCY A 121 63.140 6.685 -8.797 1.00 1.00 O HETATM 1313 C1L RCY A 121 65.833 3.649 -10.714 1.00 1.00 C HETATM 1314 C1M RCY A 121 64.720 3.219 -8.355 1.00 1.00 C HETATM 1315 C1P RCY A 121 66.425 2.602 -11.675 1.00 1.00 C HETATM 1316 C1Q RCY A 121 66.311 3.230 -11.631 1.00 1.00 C HETATM 1317 N1R RCY A 121 65.385 2.492 -10.597 1.00 1.00 N HETATM 1318 C1S RCY A 121 65.734 2.102 -10.879 1.00 1.00 C HETATM 1319 C1U RCY A 121 64.466 3.382 -9.758 1.00 1.00 C HETATM 1320 C1V RCY A 121 66.179 5.239 -9.916 1.00 1.00 C HETATM 1321 N1V RCY A 121 63.936 5.461 -8.824 1.00 1.00 N HETATM 1322 C1W RCY A 121 64.192 4.488 -7.675 1.00 1.00 C HETATM 1323 C1X RCY A 121 64.696 4.872 -10.004 1.00 1.00 C HETATM 1324 C1Y RCY A 121 65.237 5.058 -6.713 1.00 1.00 C HETATM 1325 C1Z RCY A 121 62.876 4.220 -6.944 1.00 1.00 C HETATM 0 H1ZB RCY A 121 62.128 3.872 -7.657 1.00 1.00 H new HETATM 0 H1ZA RCY A 121 63.032 3.458 -6.181 1.00 1.00 H new HETATM 0 H1VB RCY A 121 66.720 4.764 -10.734 1.00 1.00 H new HETATM 0 H1VA RCY A 121 66.291 6.321 -9.986 1.00 1.00 H new HETATM 0 H1MA RCY A 121 64.217 2.332 -7.969 1.00 1.00 H new HETATM 0 H1LA RCY A 121 66.408 4.133 -9.925 1.00 1.00 H new HETATM 0 H1CB RCY A 121 64.515 4.778 -12.148 1.00 1.00 H new HETATM 0 H1CA RCY A 121 62.997 5.152 -11.299 1.00 1.00 H new HETATM 0 H1Z RCY A 121 62.528 5.139 -6.473 1.00 1.00 H new HETATM 0 H1Y RCY A 121 64.844 5.958 -6.240 1.00 1.00 H new HETATM 0 H1V RCY A 121 66.583 4.894 -8.965 1.00 1.00 H new HETATM 0 H1U RCY A 121 63.460 3.079 -10.049 1.00 1.00 H new HETATM 0 H1S RCY A 121 64.821 1.584 -11.174 1.00 1.00 H new HETATM 0 H1C RCY A 121 64.258 6.398 -11.460 1.00 1.00 H new HETATM 1328 C1C RCY A 130 79.864 9.604 -2.087 1.00 1.00 C HETATM 1329 O1G RCY A 130 78.204 7.899 1.302 1.00 1.00 O HETATM 1330 O1H RCY A 130 75.710 11.346 -0.747 1.00 1.00 O HETATM 1331 O1J RCY A 130 79.242 8.811 -4.924 1.00 1.00 O HETATM 1332 C1L RCY A 130 76.938 9.801 2.180 1.00 1.00 C HETATM 1333 C1M RCY A 130 76.304 8.668 -2.464 1.00 1.00 C HETATM 1334 C1P RCY A 130 77.534 8.908 1.084 1.00 1.00 C HETATM 1335 C1Q RCY A 130 76.465 10.728 0.002 1.00 1.00 C HETATM 1336 N1R RCY A 130 77.192 9.427 -0.311 1.00 1.00 N HETATM 1337 C1S RCY A 130 76.845 11.126 1.417 1.00 1.00 C HETATM 1338 C1U RCY A 130 77.496 8.807 -1.677 1.00 1.00 C HETATM 1339 C1V RCY A 130 77.906 11.130 -2.598 1.00 1.00 C HETATM 1340 N1V RCY A 130 78.231 9.010 -3.890 1.00 1.00 N HETATM 1341 C1W RCY A 130 76.763 8.587 -3.925 1.00 1.00 C HETATM 1342 C1X RCY A 130 78.404 9.685 -2.537 1.00 1.00 C HETATM 1343 C1Y RCY A 130 75.950 9.545 -4.799 1.00 1.00 C HETATM 1344 C1Z RCY A 130 76.667 7.157 -4.459 1.00 1.00 C HETATM 0 H1YB RCY A 130 74.894 9.279 -4.746 1.00 1.00 H new HETATM 0 H1YA RCY A 130 76.085 10.566 -4.443 1.00 1.00 H new HETATM 0 H1VB RCY A 130 77.984 11.584 -1.610 1.00 1.00 H new HETATM 0 H1VA RCY A 130 78.513 11.694 -3.306 1.00 1.00 H new HETATM 0 H1MA RCY A 130 75.752 7.772 -2.179 1.00 1.00 H new HETATM 0 H1LA RCY A 130 75.966 9.448 2.523 1.00 1.00 H new HETATM 0 H1CB RCY A 130 79.945 9.938 -1.053 1.00 1.00 H new HETATM 0 H1CA RCY A 130 80.212 8.574 -2.164 1.00 1.00 H new HETATM 0 H1Y RCY A 130 76.291 9.473 -5.832 1.00 1.00 H new HETATM 0 H1V RCY A 130 76.865 11.143 -2.922 1.00 1.00 H new HETATM 0 H1U RCY A 130 77.966 7.853 -1.441 1.00 1.00 H new HETATM 0 H1S RCY A 130 77.794 11.662 1.437 1.00 1.00 H new HETATM 0 H1M RCY A 130 75.636 9.516 -2.312 1.00 1.00 H new HETATM 0 H1L RCY A 130 77.580 9.869 3.058 1.00 1.00 H new HETATM 0 H1C RCY A 130 80.477 10.242 -2.724 1.00 1.00 H new HETATM 1347 C1C RCY A 138 81.024 -4.948 3.708 1.00 1.00 C HETATM 1348 O1G RCY A 138 82.366 -0.397 4.608 1.00 1.00 O HETATM 1349 O1H RCY A 138 82.559 -4.751 6.424 1.00 1.00 O HETATM 1350 O1J RCY A 138 79.574 -2.757 2.236 1.00 1.00 O HETATM 1351 C1L RCY A 138 81.962 -1.297 6.847 1.00 1.00 C HETATM 1352 C1M RCY A 138 83.355 -2.272 2.660 1.00 1.00 C HETATM 1353 C1P RCY A 138 82.296 -1.374 5.352 1.00 1.00 C HETATM 1354 C1Q RCY A 138 82.210 -3.600 6.166 1.00 1.00 C HETATM 1355 N1R RCY A 138 82.531 -2.814 4.901 1.00 1.00 N HETATM 1356 C1S RCY A 138 81.376 -2.697 7.057 1.00 1.00 C HETATM 1357 C1U RCY A 138 82.974 -3.343 3.536 1.00 1.00 C HETATM 1358 C1V RCY A 138 82.379 -4.823 1.569 1.00 1.00 C HETATM 1359 N1V RCY A 138 81.028 -2.856 2.331 1.00 1.00 N HETATM 1360 C1W RCY A 138 82.061 -1.781 1.998 1.00 1.00 C HETATM 1361 C1X RCY A 138 81.851 -4.054 2.782 1.00 1.00 C HETATM 1362 C1Y RCY A 138 82.242 -1.663 0.483 1.00 1.00 C HETATM 1363 C1Z RCY A 138 81.604 -0.448 2.592 1.00 1.00 C HETATM 0 H1ZB RCY A 138 81.423 -0.569 3.660 1.00 1.00 H new HETATM 0 H1ZA RCY A 138 82.378 0.303 2.438 1.00 1.00 H new HETATM 0 H1YB RCY A 138 83.040 -0.953 0.266 1.00 1.00 H new HETATM 0 H1YA RCY A 138 82.501 -2.638 0.071 1.00 1.00 H new HETATM 0 H1VB RCY A 138 83.012 -5.644 1.906 1.00 1.00 H new HETATM 0 H1VA RCY A 138 81.541 -5.222 0.998 1.00 1.00 H new HETATM 0 H1MA RCY A 138 83.838 -1.468 3.215 1.00 1.00 H new HETATM 0 H1LA RCY A 138 82.843 -1.117 7.463 1.00 1.00 H new HETATM 0 H1CB RCY A 138 81.669 -5.705 4.155 1.00 1.00 H new HETATM 0 H1CA RCY A 138 80.577 -4.341 4.496 1.00 1.00 H new HETATM 0 H1Z RCY A 138 80.685 -0.127 2.102 1.00 1.00 H new HETATM 0 H1Y RCY A 138 81.313 -1.313 0.032 1.00 1.00 H new HETATM 0 H1V RCY A 138 82.961 -4.151 0.937 1.00 1.00 H new HETATM 0 H1U RCY A 138 83.796 -4.022 3.765 1.00 1.00 H new HETATM 0 H1S RCY A 138 80.322 -2.731 6.780 1.00 1.00 H new HETATM 0 H1M RCY A 138 84.069 -2.616 1.912 1.00 1.00 H new HETATM 0 H1L RCY A 138 81.247 -0.507 7.075 1.00 1.00 H new HETATM 0 H1C RCY A 138 80.236 -5.436 3.134 1.00 1.00 H new HETATM 1366 C1C RCY A 150 81.484 4.537 7.038 1.00 1.00 C HETATM 1367 O1G RCY A 150 81.840 0.878 8.812 1.00 1.00 O HETATM 1368 O1H RCY A 150 85.506 2.650 6.420 1.00 1.00 O HETATM 1369 O1J RCY A 150 79.311 4.247 4.973 1.00 1.00 O HETATM 1370 C1L RCY A 150 84.246 0.956 9.251 1.00 1.00 C HETATM 1371 C1M RCY A 150 81.709 1.273 5.308 1.00 1.00 C HETATM 1372 C1P RCY A 150 82.968 1.192 8.436 1.00 1.00 C HETATM 1373 C1Q RCY A 150 84.793 1.917 7.104 1.00 1.00 C HETATM 1374 N1R RCY A 150 83.271 1.866 7.098 1.00 1.00 N HETATM 1375 C1S RCY A 150 85.273 0.891 8.115 1.00 1.00 C HETATM 1376 C1U RCY A 150 82.303 2.366 6.024 1.00 1.00 C HETATM 1377 C1V RCY A 150 80.440 2.335 7.739 1.00 1.00 C HETATM 1378 N1V RCY A 150 80.196 3.162 5.387 1.00 1.00 N HETATM 1379 C1W RCY A 150 80.414 1.819 4.694 1.00 1.00 C HETATM 1380 C1X RCY A 150 81.107 3.118 6.606 1.00 1.00 C HETATM 1381 C1Y RCY A 150 79.243 0.873 4.980 1.00 1.00 C HETATM 1382 C1Z RCY A 150 80.565 2.050 3.191 1.00 1.00 C HETATM 0 H1ZB RCY A 150 81.363 2.770 3.012 1.00 1.00 H new HETATM 0 H1ZA RCY A 150 80.810 1.108 2.701 1.00 1.00 H new HETATM 0 H1YB RCY A 150 79.453 -0.106 4.550 1.00 1.00 H new HETATM 0 H1YA RCY A 150 79.109 0.775 6.057 1.00 1.00 H new HETATM 0 H1VB RCY A 150 81.125 2.264 8.584 1.00 1.00 H new HETATM 0 H1VA RCY A 150 79.531 2.849 8.051 1.00 1.00 H new HETATM 0 H1MA RCY A 150 82.381 0.903 4.534 1.00 1.00 H new HETATM 0 H1LA RCY A 150 84.450 1.766 9.952 1.00 1.00 H new HETATM 0 H1CB RCY A 150 82.263 4.491 7.799 1.00 1.00 H new HETATM 0 H1CA RCY A 150 81.852 5.094 6.176 1.00 1.00 H new HETATM 0 H1Z RCY A 150 79.630 2.437 2.787 1.00 1.00 H new HETATM 0 H1Y RCY A 150 78.333 1.277 4.537 1.00 1.00 H new HETATM 0 H1V RCY A 150 80.189 1.333 7.390 1.00 1.00 H new HETATM 0 H1U RCY A 150 82.913 3.011 5.392 1.00 1.00 H new HETATM 0 H1S RCY A 150 85.317 -0.106 7.677 1.00 1.00 H new HETATM 0 H1M RCY A 150 81.501 0.437 5.976 1.00 1.00 H new HETATM 0 H1L RCY A 150 84.207 0.034 9.831 1.00 1.00 H new HETATM 0 H1C RCY A 150 80.606 5.038 7.446 1.00 1.00 H new HETATM 1385 C1C RCY A 160 73.730 7.859 3.220 1.00 1.00 C HETATM 1386 O1G RCY A 160 71.770 3.565 2.833 1.00 1.00 O HETATM 1387 O1H RCY A 160 72.078 7.102 5.947 1.00 1.00 O HETATM 1388 O1J RCY A 160 74.666 5.991 1.051 1.00 1.00 O HETATM 1389 C1L RCY A 160 72.280 3.651 5.225 1.00 1.00 C HETATM 1390 C1M RCY A 160 70.883 6.071 1.672 1.00 1.00 C HETATM 1391 C1P RCY A 160 71.953 4.238 3.846 1.00 1.00 C HETATM 1392 C1Q RCY A 160 72.293 6.063 5.323 1.00 1.00 C HETATM 1393 N1R RCY A 160 71.882 5.764 3.887 1.00 1.00 N HETATM 1394 C1S RCY A 160 73.021 4.839 5.847 1.00 1.00 C HETATM 1395 C1U RCY A 160 71.498 6.746 2.779 1.00 1.00 C HETATM 1396 C1V RCY A 160 72.295 8.619 1.272 1.00 1.00 C HETATM 1397 N1V RCY A 160 73.265 6.310 1.307 1.00 1.00 N HETATM 1398 C1W RCY A 160 72.030 5.582 0.779 1.00 1.00 C HETATM 1399 C1X RCY A 160 72.709 7.443 2.159 1.00 1.00 C HETATM 1400 C1Y RCY A 160 71.771 5.958 -0.683 1.00 1.00 C HETATM 1401 C1Z RCY A 160 72.239 4.075 0.919 1.00 1.00 C HETATM 0 H1ZB RCY A 160 72.480 3.836 1.955 1.00 1.00 H new HETATM 0 H1YA RCY A 160 71.692 7.042 -0.771 1.00 1.00 H new HETATM 0 H1VB RCY A 160 71.848 9.399 1.888 1.00 1.00 H new HETATM 0 H1VA RCY A 160 73.173 9.017 0.763 1.00 1.00 H new HETATM 0 H1LA RCY A 160 71.386 3.378 5.785 1.00 1.00 H new HETATM 0 H1CA RCY A 160 74.080 6.976 3.754 1.00 1.00 H new HETATM 0 H1V RCY A 160 71.569 8.279 0.533 1.00 1.00 H new HETATM 0 H1S RCY A 160 74.071 4.848 5.555 1.00 1.00 H new HETATM 0 H1L RCY A 160 72.902 2.758 5.162 1.00 1.00 H new HETATM 0 H1C RCY A 160 74.575 8.351 2.739 1.00 1.00 H new HETATM 1404 C1C RCY A 168 69.768 7.391 0.491 1.00 1.00 C HETATM 1405 O1G RCY A 168 73.328 5.501 -0.428 1.00 1.00 O HETATM 1406 O1H RCY A 168 68.921 3.832 -0.110 1.00 1.00 O HETATM 1407 O1J RCY A 168 67.330 5.775 1.207 1.00 1.00 O HETATM 1408 C1L RCY A 168 71.933 4.159 -1.925 1.00 1.00 C HETATM 1409 C1M RCY A 168 70.634 4.595 2.755 1.00 1.00 C HETATM 1410 C1P RCY A 168 72.265 4.917 -0.633 1.00 1.00 C HETATM 1411 C1Q RCY A 168 70.126 3.933 -0.339 1.00 1.00 C HETATM 1412 N1R RCY A 168 71.112 4.855 0.367 1.00 1.00 N HETATM 1413 C1S RCY A 168 70.906 3.157 -1.385 1.00 1.00 C HETATM 1414 C1U RCY A 168 70.972 5.539 1.729 1.00 1.00 C HETATM 1415 C1V RCY A 168 69.889 7.427 3.023 1.00 1.00 C HETATM 1416 N1V RCY A 168 68.636 5.610 1.840 1.00 1.00 N HETATM 1417 C1W RCY A 168 69.107 4.455 2.720 1.00 1.00 C HETATM 1418 C1X RCY A 168 69.829 6.552 1.769 1.00 1.00 C HETATM 1419 C1Y RCY A 168 68.523 4.582 4.130 1.00 1.00 C HETATM 1420 C1Z RCY A 168 68.685 3.132 2.080 1.00 1.00 C HETATM 0 H1ZB RCY A 168 69.061 3.086 1.058 1.00 1.00 H new HETATM 0 H1ZA RCY A 168 69.096 2.302 2.655 1.00 1.00 H new HETATM 0 H1YB RCY A 168 68.935 3.799 4.766 1.00 1.00 H new HETATM 0 H1LA RCY A 168 71.517 4.809 -2.695 1.00 1.00 H new HETATM 0 H1CB RCY A 168 70.704 7.936 0.369 1.00 1.00 H new HETATM 0 H1Z RCY A 168 67.597 3.063 2.070 1.00 1.00 H new HETATM 0 H1S RCY A 168 71.394 2.285 -0.949 1.00 1.00 H new HETATM 0 H1L RCY A 168 72.806 3.670 -2.358 1.00 1.00 H new HETATM 0 H1C RCY A 168 68.942 8.099 0.560 1.00 1.00 H new HETATM 1423 C1C RCY A 173 74.833 1.117 -6.426 1.00 1.00 C HETATM 1424 O1G RCY A 173 76.611 5.868 -5.019 1.00 1.00 O HETATM 1425 O1H RCY A 173 76.241 1.970 -7.658 1.00 1.00 O HETATM 1426 O1J RCY A 173 77.037 -0.092 -4.768 1.00 1.00 O HETATM 1427 C1L RCY A 173 77.596 5.192 -7.154 1.00 1.00 C HETATM 1428 C1M RCY A 173 75.596 3.219 -3.478 1.00 1.00 C HETATM 1429 C1P RCY A 173 76.750 5.009 -5.888 1.00 1.00 C HETATM 1430 C1Q RCY A 173 76.690 2.955 -7.074 1.00 1.00 C HETATM 1431 N1R RCY A 173 76.101 3.626 -5.839 1.00 1.00 N HETATM 1432 C1S RCY A 173 77.939 3.728 -7.453 1.00 1.00 C HETATM 1433 C1U RCY A 173 75.115 3.053 -4.820 1.00 1.00 C HETATM 1434 C1V RCY A 173 73.735 1.041 -4.143 1.00 1.00 C HETATM 1435 N1V RCY A 173 76.231 1.051 -4.349 1.00 1.00 N HETATM 1436 C1W RCY A 173 76.509 2.018 -3.200 1.00 1.00 C HETATM 1437 C1X RCY A 173 74.927 1.544 -4.960 1.00 1.00 C HETATM 1438 C1Y RCY A 173 76.155 1.372 -1.858 1.00 1.00 C HETATM 1439 C1Z RCY A 173 77.983 2.422 -3.232 1.00 1.00 C HETATM 0 H1ZB RCY A 173 78.229 2.824 -4.215 1.00 1.00 H new HETATM 0 H1ZA RCY A 173 78.169 3.182 -2.473 1.00 1.00 H new HETATM 0 H1YB RCY A 173 76.279 2.102 -1.059 1.00 1.00 H new HETATM 0 H1YA RCY A 173 75.120 1.031 -1.880 1.00 1.00 H new HETATM 0 H1VB RCY A 173 72.812 1.446 -4.558 1.00 1.00 H new HETATM 0 H1VA RCY A 173 73.702 -0.048 -4.180 1.00 1.00 H new HETATM 0 H1MA RCY A 173 76.143 4.156 -3.373 1.00 1.00 H new HETATM 0 H1LA RCY A 173 77.039 5.664 -7.964 1.00 1.00 H new HETATM 0 H1CB RCY A 173 73.983 1.613 -6.896 1.00 1.00 H new HETATM 0 H1CA RCY A 173 75.749 1.397 -6.946 1.00 1.00 H new HETATM 0 H1Z RCY A 173 78.604 1.549 -3.031 1.00 1.00 H new HETATM 0 H1Y RCY A 173 76.813 0.522 -1.678 1.00 1.00 H new HETATM 0 H1V RCY A 173 73.840 1.366 -3.108 1.00 1.00 H new HETATM 0 H1U RCY A 173 74.187 3.592 -5.012 1.00 1.00 H new HETATM 0 H1S RCY A 173 78.801 3.397 -6.874 1.00 1.00 H new HETATM 0 H1M RCY A 173 74.769 3.252 -2.769 1.00 1.00 H new HETATM 0 H1L RCY A 173 78.483 5.801 -6.979 1.00 1.00 H new HETATM 0 H1C RCY A 173 74.700 0.037 -6.482 1.00 1.00 H new HETATM 1442 C1C RCY A 176 73.103 -6.053 -0.990 1.00 1.00 C HETATM 1443 O1G RCY A 176 73.410 -5.718 -3.698 1.00 1.00 O HETATM 1444 O1H RCY A 176 74.712 -1.226 -3.045 1.00 1.00 O HETATM 1445 O1J RCY A 176 71.355 -5.258 1.329 1.00 1.00 O HETATM 1446 C1L RCY A 176 74.512 -4.069 -5.131 1.00 1.00 C HETATM 1447 C1M RCY A 176 72.377 -2.425 -1.044 1.00 1.00 C HETATM 1448 C1P RCY A 176 73.827 -4.572 -3.854 1.00 1.00 C HETATM 1449 C1Q RCY A 176 74.278 -2.263 -3.545 1.00 1.00 C HETATM 1450 N1R RCY A 176 73.727 -3.471 -2.799 1.00 1.00 N HETATM 1451 C1S RCY A 176 74.192 -2.573 -5.029 1.00 1.00 C HETATM 1452 C1U RCY A 176 73.208 -3.550 -1.362 1.00 1.00 C HETATM 1453 C1V RCY A 176 71.212 -4.868 -2.193 1.00 1.00 C HETATM 1454 N1V RCY A 176 71.688 -4.375 0.216 1.00 1.00 N HETATM 1455 C1W RCY A 176 71.500 -2.861 0.137 1.00 1.00 C HETATM 1456 C1X RCY A 176 72.301 -4.757 -1.124 1.00 1.00 C HETATM 1457 C1Y RCY A 176 70.032 -2.517 -0.128 1.00 1.00 C HETATM 1458 C1Z RCY A 176 71.974 -2.228 1.445 1.00 1.00 C HETATM 0 H1ZB RCY A 176 73.001 -2.533 1.645 1.00 1.00 H new HETATM 0 H1ZA RCY A 176 71.927 -1.142 1.362 1.00 1.00 H new HETATM 0 H1YB RCY A 176 69.930 -1.441 -0.266 1.00 1.00 H new HETATM 0 H1YA RCY A 176 69.694 -3.032 -1.028 1.00 1.00 H new HETATM 0 H1VB RCY A 176 71.670 -5.087 -3.158 1.00 1.00 H new HETATM 0 H1VA RCY A 176 70.523 -5.670 -1.928 1.00 1.00 H new HETATM 0 H1MA RCY A 176 72.981 -1.557 -0.781 1.00 1.00 H new HETATM 0 H1LA RCY A 176 75.584 -4.267 -5.135 1.00 1.00 H new HETATM 0 H1CB RCY A 176 73.670 -6.226 -1.905 1.00 1.00 H new HETATM 0 H1CA RCY A 176 73.790 -5.970 -0.148 1.00 1.00 H new HETATM 0 H1Z RCY A 176 71.332 -2.557 2.262 1.00 1.00 H new HETATM 0 H1Y RCY A 176 69.425 -2.834 0.720 1.00 1.00 H new HETATM 0 H1V RCY A 176 70.666 -3.926 -2.256 1.00 1.00 H new HETATM 0 H1U RCY A 176 74.111 -3.600 -0.753 1.00 1.00 H new HETATM 0 H1S RCY A 176 73.200 -2.352 -5.423 1.00 1.00 H new HETATM 0 H1M RCY A 176 71.764 -2.139 -1.899 1.00 1.00 H new HETATM 0 H1L RCY A 176 74.100 -4.523 -6.032 1.00 1.00 H new HETATM 0 H1C RCY A 176 72.421 -6.887 -0.822 1.00 1.00 H new HETATM 1461 C1C RCY A 187 82.891 1.756 -2.052 1.00 1.00 C HETATM 1462 O1G RCY A 187 84.695 2.826 -6.109 1.00 1.00 O HETATM 1463 O1H RCY A 187 86.398 1.918 -1.799 1.00 1.00 O HETATM 1464 O1J RCY A 187 81.212 2.617 -4.399 1.00 1.00 O HETATM 1465 C1L RCY A 187 86.302 3.977 -4.666 1.00 1.00 C HETATM 1466 C1M RCY A 187 84.009 0.109 -5.171 1.00 1.00 C HETATM 1467 C1P RCY A 187 85.284 2.888 -5.031 1.00 1.00 C HETATM 1468 C1Q RCY A 187 85.955 2.498 -2.789 1.00 1.00 C HETATM 1469 N1R RCY A 187 85.094 1.891 -3.889 1.00 1.00 N HETATM 1470 C1S RCY A 187 86.168 3.960 -3.140 1.00 1.00 C HETATM 1471 C1U RCY A 187 84.257 0.611 -3.850 1.00 1.00 C HETATM 1472 C1V RCY A 187 82.153 -0.489 -2.970 1.00 1.00 C HETATM 1473 N1V RCY A 187 82.190 1.533 -4.446 1.00 1.00 N HETATM 1474 C1W RCY A 187 82.768 0.849 -5.684 1.00 1.00 C HETATM 1475 C1X RCY A 187 82.860 0.833 -3.272 1.00 1.00 C HETATM 1476 C1Y RCY A 187 81.756 -0.138 -6.271 1.00 1.00 C HETATM 1477 C1Z RCY A 187 83.142 1.914 -6.715 1.00 1.00 C HETATM 0 H1ZB RCY A 187 83.815 2.641 -6.260 1.00 1.00 H new HETATM 0 H1ZA RCY A 187 83.638 1.441 -7.563 1.00 1.00 H new HETATM 0 H1YB RCY A 187 82.213 -0.677 -7.101 1.00 1.00 H new HETATM 0 H1YA RCY A 187 81.451 -0.847 -5.501 1.00 1.00 H new HETATM 0 H1VB RCY A 187 82.676 -1.006 -2.165 1.00 1.00 H new HETATM 0 H1VA RCY A 187 81.125 -0.291 -2.666 1.00 1.00 H new HETATM 0 H1MA RCY A 187 84.865 0.287 -5.822 1.00 1.00 H new HETATM 0 H1LA RCY A 187 87.311 3.734 -4.999 1.00 1.00 H new HETATM 0 H1CB RCY A 187 83.516 1.313 -1.276 1.00 1.00 H new HETATM 0 H1CA RCY A 187 83.301 2.725 -2.339 1.00 1.00 H new HETATM 0 H1Z RCY A 187 82.240 2.420 -7.059 1.00 1.00 H new HETATM 0 H1Y RCY A 187 80.883 0.407 -6.630 1.00 1.00 H new HETATM 0 H1V RCY A 187 82.154 -1.114 -3.863 1.00 1.00 H new HETATM 0 H1U RCY A 187 84.842 -0.073 -3.235 1.00 1.00 H new HETATM 0 H1S RCY A 187 85.330 4.573 -2.809 1.00 1.00 H new HETATM 0 H1M RCY A 187 83.840 -0.968 -5.153 1.00 1.00 H new HETATM 0 H1L RCY A 187 86.049 4.946 -5.096 1.00 1.00 H new HETATM 0 H1C RCY A 187 81.879 1.889 -1.670 1.00 1.00 H new