USER MOD reduce.3.24.130724 H: found=0, std=0, add=791, rem=0, adj=19 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 7 LYS HZ2 : A 7 LYS NZ : A 110 RCY O1J :(NH2R) USER MOD NoAdj-H: A 9 GLU H : A 9 GLU N : A 110 RCY C1C :(H bumps) USER MOD NoAdj-H: A 110 RCYH1VB : A 110 RCY C1V : A 9 GLU N :(H bumps) USER MOD NoAdj-H: A 110 RCYH1VA : A 110 RCY C1V : A 9 GLU N :(H bumps) USER MOD NoAdj-H: A 110 RCYH1SA : A 110 RCY C1S : A 10 CYS SG :(H bumps) USER MOD NoAdj-H: A 110 RCYH1CB : A 110 RCY C1C : A 9 GLU CB :(H bumps) USER MOD NoAdj-H: A 110 RCY H1V : A 110 RCY C1V : A 8 ALA O :(H bumps) USER MOD NoAdj-H: A 110 RCY H1C : A 110 RCY C1C : A 9 GLU N :(H bumps) USER MOD NoAdj-H: A 121 RCYH1SA : A 121 RCY C1S : A 21 CYS SG :(H bumps) USER MOD NoAdj-H: A 130 RCYH1YB : A 130 RCY C1Y : A 160 RCY N1V :(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 H1Y : A 130 RCY C1Y : A 160 RCY N1V :(H bumps) USER MOD NoAdj-H: A 138 RCYH1YA : A 138 RCY C1Y : A 160 RCY C1V :(H bumps) USER MOD NoAdj-H: A 138 RCYH1VB : A 138 RCY C1V : A 160 RCY C1C :(H bumps) USER MOD NoAdj-H: A 138 RCYH1VA : A 138 RCY C1V : A 160 RCY C1U :(H bumps) USER MOD NoAdj-H: A 138 RCYH1SA : A 138 RCY C1S : A 38 CYS SG :(H bumps) USER MOD NoAdj-H: A 138 RCYH1CB : A 138 RCY C1C : A 160 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 138 RCYH1CA : A 138 RCY C1C : A 160 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 138 RCY H1V : A 138 RCY C1V : A 160 RCY C1C :(H bumps) USER MOD NoAdj-H: A 138 RCY H1C : A 138 RCY C1C : A 160 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 150 RCYH1YB : A 150 RCY C1Y : A 187 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 150 RCYH1YA : A 150 RCY C1Y : A 187 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 150 RCYH1SA : A 150 RCY C1S : A 50 CYS SG :(H bumps) USER MOD NoAdj-H: A 150 RCY H1Y : A 150 RCY C1Y : A 187 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 150 RCY H1V : A 150 RCY C1V : A 187 RCY O1J :(H bumps) USER MOD NoAdj-H: A 160 RCYH1VB : A 160 RCY C1V : A 138 RCY C1Y :(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 RCYH1CB : A 160 RCY C1C : A 138 RCY C1V :(H bumps) USER MOD NoAdj-H: A 160 RCYH1CA : A 160 RCY C1C : A 138 RCY C1V :(H bumps) USER MOD NoAdj-H: A 160 RCY H1Y : A 160 RCY C1Y : A 168 RCY O1J :(H bumps) USER MOD NoAdj-H: A 160 RCY H1U : A 160 RCY C1U : A 138 RCY C1X :(H bumps) USER MOD NoAdj-H: A 160 RCY H1C : A 160 RCY C1C : A 138 RCY C1V :(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 RCYH1LA : A 168 RCY C1L : A 64 ILE CA :(H bumps) USER MOD NoAdj-H: A 168 RCY H1L : A 168 RCY C1L : A 64 ILE CA :(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 176 RCY H1Z : A 176 RCY C1Z : A 187 RCY O1H :(H bumps) USER MOD NoAdj-H: A 176 RCY H1Y : A 176 RCY C1Y : A 187 RCY O1H :(H bumps) USER MOD NoAdj-H: A 187 RCYH1SA : A 187 RCY C1S : A 87 CYS SG :(H bumps) USER MOD NoAdj-H: A 187 RCY H1Y : A 187 RCY C1Y : A 150 RCY C1Y :(H bumps) USER MOD Single : A 1 MET CE :methyl 153:sc= -1.47! (180deg=-1.98!) USER MOD Single : A 1 MET N :NH3+ 145:sc= -0.323 (180deg=-3.59!) USER MOD Single : A 2 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.5!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -46:sc= 0.0401 USER MOD Single : A 14 THR OG1 : rot -55:sc= 1.12 USER MOD Single : A 17 MET CE :methyl -165:sc=-0.00405 (180deg=-0.409) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.536 USER MOD Single : A 25 LYS NZ :NH3+ -161:sc= -0.0657 (180deg=-0.59) USER MOD Single : A 29 LYS NZ :NH3+ 149:sc= 1.09 (180deg=-1.59) USER MOD Single : A 31 LYS NZ :NH3+ -112:sc= -2.61! (180deg=-5.26!) USER MOD Single : A 32 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.19) USER MOD Single : A 34 GLN : amide:sc= -0.258 X(o=-0.26,f=-0.25) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0303 USER MOD Single : A 37 GLN : amide:sc= -0.0159 K(o=-0.016,f=-1.8!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot -120:sc= -0.676 USER MOD Single : A 41 LYS NZ :NH3+ 168:sc= -0.596 (180deg=-0.923) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 172:sc= -2.57! (180deg=-2.62) USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 57 MET CE :methyl 141:sc= -0.0324 (180deg=-0.927) USER MOD Single : A 62 THR OG1 : rot -48:sc= 1.1 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN :FLIP amide:sc= -0.122 F(o=-2.9!,f=-0.12) USER MOD Single : A 75 HIS : no HE2:sc= -1.68 K(o=-1.7,f=-3.4!) USER MOD Single : A 79 HIS : no HD1:sc= -0.182 X(o=-0.18,f=-0.43) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 63.959 -20.519 17.592 1.00 1.00 N ATOM 2 CA MET A 1 63.980 -20.514 16.102 1.00 1.00 C ATOM 3 C MET A 1 65.188 -19.714 15.612 1.00 1.00 C ATOM 4 O MET A 1 66.312 -20.173 15.665 1.00 1.00 O ATOM 5 CB MET A 1 62.695 -19.869 15.577 1.00 1.00 C ATOM 6 CG MET A 1 61.513 -20.807 15.828 1.00 1.00 C ATOM 7 SD MET A 1 61.217 -20.941 17.609 1.00 1.00 S ATOM 8 CE MET A 1 61.827 -22.633 17.813 1.00 1.00 C ATOM 0 H1 MET A 1 62.974 -20.496 17.925 1.00 1.00 H new ATOM 0 H2 MET A 1 64.424 -21.381 17.943 1.00 1.00 H new ATOM 0 H3 MET A 1 64.465 -19.683 17.949 1.00 1.00 H new ATOM 0 HA MET A 1 64.049 -21.538 15.736 1.00 1.00 H new ATOM 0 HB2 MET A 1 62.526 -18.913 16.073 1.00 1.00 H new ATOM 0 HB3 MET A 1 62.789 -19.662 14.511 1.00 1.00 H new ATOM 0 HG2 MET A 1 60.622 -20.428 15.328 1.00 1.00 H new ATOM 0 HG3 MET A 1 61.720 -21.791 15.408 1.00 1.00 H new ATOM 0 HE1 MET A 1 62.188 -22.769 18.832 1.00 1.00 H new ATOM 0 HE2 MET A 1 61.018 -23.337 17.618 1.00 1.00 H new ATOM 0 HE3 MET A 1 62.642 -22.813 17.112 1.00 1.00 H new ATOM 17 N ASN A 2 64.966 -18.519 15.135 1.00 1.00 N ATOM 18 CA ASN A 2 66.102 -17.691 14.642 1.00 1.00 C ATOM 19 C ASN A 2 65.602 -16.280 14.325 1.00 1.00 C ATOM 20 O ASN A 2 66.296 -15.487 13.720 1.00 1.00 O ATOM 21 CB ASN A 2 66.683 -18.323 13.376 1.00 1.00 C ATOM 22 CG ASN A 2 67.807 -17.439 12.833 1.00 1.00 C ATOM 23 OD1 ASN A 2 67.575 -16.582 12.003 1.00 1.00 O ATOM 24 ND2 ASN A 2 69.025 -17.611 13.269 1.00 1.00 N ATOM 0 H ASN A 2 64.047 -18.081 15.066 1.00 1.00 H new ATOM 0 HA ASN A 2 66.875 -17.640 15.409 1.00 1.00 H new ATOM 0 HB2 ASN A 2 67.065 -19.320 13.597 1.00 1.00 H new ATOM 0 HB3 ASN A 2 65.903 -18.440 12.624 1.00 1.00 H new ATOM 0 HD21 ASN A 2 69.781 -17.026 12.913 1.00 1.00 H new ATOM 0 HD22 ASN A 2 69.221 -18.330 13.966 1.00 1.00 H new ATOM 31 N LEU A 3 64.403 -15.961 14.730 1.00 1.00 N ATOM 32 CA LEU A 3 63.857 -14.601 14.452 1.00 1.00 C ATOM 33 C LEU A 3 64.001 -14.291 12.960 1.00 1.00 C ATOM 34 O LEU A 3 65.054 -13.901 12.496 1.00 1.00 O ATOM 35 CB LEU A 3 64.633 -13.560 15.267 1.00 1.00 C ATOM 36 CG LEU A 3 64.191 -13.619 16.730 1.00 1.00 C ATOM 37 CD1 LEU A 3 62.736 -13.159 16.844 1.00 1.00 C ATOM 38 CD2 LEU A 3 64.311 -15.056 17.241 1.00 1.00 C ATOM 0 H LEU A 3 63.777 -16.583 15.242 1.00 1.00 H new ATOM 0 HA LEU A 3 62.804 -14.568 14.732 1.00 1.00 H new ATOM 0 HB2 LEU A 3 65.704 -13.750 15.192 1.00 1.00 H new ATOM 0 HB3 LEU A 3 64.457 -12.563 14.864 1.00 1.00 H new ATOM 0 HG LEU A 3 64.827 -12.965 17.327 1.00 1.00 H new ATOM 0 HD11 LEU A 3 62.422 -13.201 17.887 1.00 1.00 H new ATOM 0 HD12 LEU A 3 62.648 -12.135 16.480 1.00 1.00 H new ATOM 0 HD13 LEU A 3 62.100 -13.812 16.247 1.00 1.00 H new ATOM 0 HD21 LEU A 3 63.996 -15.099 18.284 1.00 1.00 H new ATOM 0 HD22 LEU A 3 63.676 -15.709 16.643 1.00 1.00 H new ATOM 0 HD23 LEU A 3 65.347 -15.385 17.161 1.00 1.00 H new ATOM 50 N GLU A 4 62.950 -14.462 12.206 1.00 1.00 N ATOM 51 CA GLU A 4 63.028 -14.177 10.745 1.00 1.00 C ATOM 52 C GLU A 4 62.934 -12.663 10.517 1.00 1.00 C ATOM 53 O GLU A 4 62.376 -11.944 11.321 1.00 1.00 O ATOM 54 CB GLU A 4 61.871 -14.883 10.025 1.00 1.00 C ATOM 55 CG GLU A 4 60.676 -14.999 10.973 1.00 1.00 C ATOM 56 CD GLU A 4 59.433 -15.410 10.180 1.00 1.00 C ATOM 57 OE1 GLU A 4 59.053 -14.671 9.287 1.00 1.00 O ATOM 58 OE2 GLU A 4 58.883 -16.457 10.479 1.00 1.00 O ATOM 0 H GLU A 4 62.042 -14.786 12.538 1.00 1.00 H new ATOM 0 HA GLU A 4 63.975 -14.544 10.349 1.00 1.00 H new ATOM 0 HB2 GLU A 4 61.588 -14.324 9.133 1.00 1.00 H new ATOM 0 HB3 GLU A 4 62.184 -15.873 9.695 1.00 1.00 H new ATOM 0 HG2 GLU A 4 60.885 -15.735 11.750 1.00 1.00 H new ATOM 0 HG3 GLU A 4 60.502 -14.047 11.474 1.00 1.00 H new ATOM 65 N PRO A 5 63.477 -12.182 9.426 1.00 1.00 N ATOM 66 CA PRO A 5 63.453 -10.733 9.087 1.00 1.00 C ATOM 67 C PRO A 5 62.109 -10.072 9.438 1.00 1.00 C ATOM 68 O PRO A 5 61.062 -10.570 9.075 1.00 1.00 O ATOM 69 CB PRO A 5 63.672 -10.727 7.574 1.00 1.00 C ATOM 70 CG PRO A 5 64.490 -11.946 7.294 1.00 1.00 C ATOM 71 CD PRO A 5 64.171 -12.967 8.392 1.00 1.00 C ATOM 0 HA PRO A 5 64.200 -10.168 9.645 1.00 1.00 H new ATOM 0 HB2 PRO A 5 62.723 -10.757 7.038 1.00 1.00 H new ATOM 0 HB3 PRO A 5 64.190 -9.823 7.254 1.00 1.00 H new ATOM 0 HG2 PRO A 5 64.252 -12.351 6.311 1.00 1.00 H new ATOM 0 HG3 PRO A 5 65.553 -11.704 7.291 1.00 1.00 H new ATOM 0 HD2 PRO A 5 63.542 -13.773 8.015 1.00 1.00 H new ATOM 0 HD3 PRO A 5 65.078 -13.427 8.784 1.00 1.00 H new ATOM 79 N PRO A 6 62.131 -8.960 10.135 1.00 1.00 N ATOM 80 CA PRO A 6 60.886 -8.238 10.525 1.00 1.00 C ATOM 81 C PRO A 6 60.302 -7.428 9.361 1.00 1.00 C ATOM 82 O PRO A 6 61.018 -6.790 8.616 1.00 1.00 O ATOM 83 CB PRO A 6 61.351 -7.309 11.646 1.00 1.00 C ATOM 84 CG PRO A 6 62.786 -7.030 11.340 1.00 1.00 C ATOM 85 CD PRO A 6 63.335 -8.270 10.626 1.00 1.00 C ATOM 0 HA PRO A 6 60.091 -8.921 10.826 1.00 1.00 H new ATOM 0 HB2 PRO A 6 60.765 -6.390 11.667 1.00 1.00 H new ATOM 0 HB3 PRO A 6 61.239 -7.780 12.622 1.00 1.00 H new ATOM 0 HG2 PRO A 6 62.882 -6.146 10.709 1.00 1.00 H new ATOM 0 HG3 PRO A 6 63.345 -6.831 12.254 1.00 1.00 H new ATOM 0 HD2 PRO A 6 64.001 -7.997 9.807 1.00 1.00 H new ATOM 0 HD3 PRO A 6 63.908 -8.901 11.306 1.00 1.00 H new ATOM 93 N LYS A 7 59.007 -7.450 9.201 1.00 1.00 N ATOM 94 CA LYS A 7 58.382 -6.681 8.087 1.00 1.00 C ATOM 95 C LYS A 7 58.252 -5.210 8.494 1.00 1.00 C ATOM 96 O LYS A 7 59.224 -4.484 8.543 1.00 1.00 O ATOM 97 CB LYS A 7 56.997 -7.261 7.783 1.00 1.00 C ATOM 98 CG LYS A 7 56.445 -6.626 6.505 1.00 1.00 C ATOM 99 CD LYS A 7 54.950 -6.926 6.390 1.00 1.00 C ATOM 100 CE LYS A 7 54.152 -5.833 7.104 1.00 1.00 C ATOM 101 NZ LYS A 7 54.121 -4.607 6.257 1.00 1.00 N ATOM 0 H LYS A 7 58.355 -7.966 9.792 1.00 1.00 H new ATOM 0 HA LYS A 7 59.005 -6.753 7.196 1.00 1.00 H new ATOM 0 HB2 LYS A 7 57.062 -8.343 7.665 1.00 1.00 H new ATOM 0 HB3 LYS A 7 56.321 -7.072 8.617 1.00 1.00 H new ATOM 0 HG2 LYS A 7 56.610 -5.549 6.521 1.00 1.00 H new ATOM 0 HG3 LYS A 7 56.973 -7.017 5.635 1.00 1.00 H new ATOM 0 HD2 LYS A 7 54.658 -6.977 5.341 1.00 1.00 H new ATOM 0 HD3 LYS A 7 54.729 -7.898 6.830 1.00 1.00 H new ATOM 0 HE2 LYS A 7 53.137 -6.178 7.300 1.00 1.00 H new ATOM 0 HE3 LYS A 7 54.605 -5.609 8.070 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 53.579 -3.864 6.742 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 53.670 -4.826 5.346 1.00 1.00 H new ATOM 115 N ALA A 8 57.059 -4.765 8.786 1.00 1.00 N ATOM 116 CA ALA A 8 56.870 -3.342 9.189 1.00 1.00 C ATOM 117 C ALA A 8 57.119 -2.432 7.984 1.00 1.00 C ATOM 118 O ALA A 8 57.997 -2.676 7.180 1.00 1.00 O ATOM 119 CB ALA A 8 57.851 -2.992 10.315 1.00 1.00 C ATOM 0 H ALA A 8 56.207 -5.326 8.763 1.00 1.00 H new ATOM 0 HA ALA A 8 55.850 -3.197 9.544 1.00 1.00 H new ATOM 0 HB1 ALA A 8 57.712 -1.952 10.609 1.00 1.00 H new ATOM 0 HB2 ALA A 8 57.666 -3.639 11.173 1.00 1.00 H new ATOM 0 HB3 ALA A 8 58.873 -3.137 9.965 1.00 1.00 H new ATOM 125 N GLU A 9 56.353 -1.384 7.852 1.00 1.00 N ATOM 126 CA GLU A 9 56.544 -0.459 6.698 1.00 1.00 C ATOM 127 C GLU A 9 57.698 0.501 6.996 1.00 1.00 C ATOM 128 O GLU A 9 58.653 0.587 6.249 1.00 1.00 O ATOM 129 CB GLU A 9 55.257 0.338 6.461 1.00 1.00 C ATOM 130 CG GLU A 9 54.880 1.097 7.735 1.00 1.00 C ATOM 131 CD GLU A 9 53.377 1.382 7.734 1.00 1.00 C ATOM 132 OE1 GLU A 9 52.871 1.787 6.700 1.00 1.00 O ATOM 133 OE2 GLU A 9 52.757 1.191 8.767 1.00 1.00 O ATOM 0 HA GLU A 9 56.779 -1.038 5.805 1.00 1.00 H new ATOM 0 HB2 GLU A 9 55.397 1.038 5.637 1.00 1.00 H new ATOM 0 HB3 GLU A 9 54.449 -0.335 6.174 1.00 1.00 H new ATOM 0 HG2 GLU A 9 55.149 0.510 8.613 1.00 1.00 H new ATOM 0 HG3 GLU A 9 55.438 2.032 7.793 1.00 1.00 H new ATOM 140 N CYS A 10 57.619 1.223 8.084 1.00 1.00 N ATOM 141 CA CYS A 10 58.710 2.178 8.435 1.00 1.00 C ATOM 142 C CYS A 10 59.454 1.669 9.671 1.00 1.00 C ATOM 143 O CYS A 10 60.516 1.088 9.572 1.00 1.00 O ATOM 144 CB CYS A 10 58.106 3.553 8.732 1.00 1.00 C ATOM 145 SG CYS A 10 57.096 4.084 7.327 1.00 1.00 S ATOM 0 H CYS A 10 56.843 1.191 8.746 1.00 1.00 H new ATOM 0 HA CYS A 10 59.406 2.259 7.600 1.00 1.00 H new ATOM 0 HB2 CYS A 10 57.497 3.507 9.635 1.00 1.00 H new ATOM 0 HB3 CYS A 10 58.899 4.278 8.918 1.00 1.00 H new ATOM 150 N ARG A 11 58.904 1.877 10.837 1.00 1.00 N ATOM 151 CA ARG A 11 59.583 1.400 12.075 1.00 1.00 C ATOM 152 C ARG A 11 58.602 1.461 13.250 1.00 1.00 C ATOM 153 O ARG A 11 58.983 1.705 14.377 1.00 1.00 O ATOM 154 CB ARG A 11 60.795 2.290 12.369 1.00 1.00 C ATOM 155 CG ARG A 11 61.770 1.541 13.280 1.00 1.00 C ATOM 156 CD ARG A 11 62.976 2.432 13.581 1.00 1.00 C ATOM 157 NE ARG A 11 63.802 1.805 14.651 1.00 1.00 N ATOM 158 CZ ARG A 11 64.671 2.522 15.308 1.00 1.00 C ATOM 159 NH1 ARG A 11 64.817 3.789 15.029 1.00 1.00 N ATOM 160 NH2 ARG A 11 65.395 1.973 16.245 1.00 1.00 N ATOM 0 H ARG A 11 58.016 2.356 10.985 1.00 1.00 H new ATOM 0 HA ARG A 11 59.916 0.372 11.935 1.00 1.00 H new ATOM 0 HB2 ARG A 11 61.290 2.567 11.438 1.00 1.00 H new ATOM 0 HB3 ARG A 11 60.473 3.215 12.846 1.00 1.00 H new ATOM 0 HG2 ARG A 11 61.273 1.258 14.208 1.00 1.00 H new ATOM 0 HG3 ARG A 11 62.097 0.619 12.800 1.00 1.00 H new ATOM 0 HD2 ARG A 11 63.573 2.570 12.680 1.00 1.00 H new ATOM 0 HD3 ARG A 11 62.642 3.420 13.897 1.00 1.00 H new ATOM 0 HE ARG A 11 63.688 0.815 14.870 1.00 1.00 H new ATOM 0 HH11 ARG A 11 64.251 4.218 14.297 1.00 1.00 H new ATOM 0 HH12 ARG A 11 65.497 4.349 15.543 1.00 1.00 H new ATOM 0 HH21 ARG A 11 65.281 0.983 16.463 1.00 1.00 H new ATOM 0 HH22 ARG A 11 66.075 2.534 16.759 1.00 1.00 H new ATOM 174 N SER A 12 57.341 1.240 12.993 1.00 1.00 N ATOM 175 CA SER A 12 56.336 1.282 14.093 1.00 1.00 C ATOM 176 C SER A 12 56.335 2.672 14.737 1.00 1.00 C ATOM 177 O SER A 12 55.570 2.946 15.640 1.00 1.00 O ATOM 178 CB SER A 12 56.686 0.229 15.146 1.00 1.00 C ATOM 179 OG SER A 12 55.528 -0.068 15.914 1.00 1.00 O ATOM 0 H SER A 12 56.964 1.032 12.068 1.00 1.00 H new ATOM 0 HA SER A 12 55.347 1.073 13.686 1.00 1.00 H new ATOM 0 HB2 SER A 12 57.059 -0.675 14.664 1.00 1.00 H new ATOM 0 HB3 SER A 12 57.482 0.596 15.794 1.00 1.00 H new ATOM 0 HG SER A 12 55.083 0.766 16.171 1.00 1.00 H new ATOM 185 N ALA A 13 57.186 3.550 14.281 1.00 1.00 N ATOM 186 CA ALA A 13 57.230 4.918 14.870 1.00 1.00 C ATOM 187 C ALA A 13 57.988 5.855 13.926 1.00 1.00 C ATOM 188 O ALA A 13 58.682 5.419 13.029 1.00 1.00 O ATOM 189 CB ALA A 13 57.942 4.867 16.223 1.00 1.00 C ATOM 0 H ALA A 13 57.852 3.379 13.527 1.00 1.00 H new ATOM 0 HA ALA A 13 56.214 5.288 15.009 1.00 1.00 H new ATOM 0 HB1 ALA A 13 57.975 5.867 16.655 1.00 1.00 H new ATOM 0 HB2 ALA A 13 57.401 4.200 16.894 1.00 1.00 H new ATOM 0 HB3 ALA A 13 58.958 4.498 16.086 1.00 1.00 H new ATOM 195 N THR A 14 57.860 7.140 14.119 1.00 1.00 N ATOM 196 CA THR A 14 58.571 8.105 13.231 1.00 1.00 C ATOM 197 C THR A 14 59.913 8.490 13.859 1.00 1.00 C ATOM 198 O THR A 14 60.423 9.571 13.638 1.00 1.00 O ATOM 199 CB THR A 14 57.714 9.362 13.055 1.00 1.00 C ATOM 200 OG1 THR A 14 58.392 10.280 12.209 1.00 1.00 O ATOM 201 CG2 THR A 14 57.467 10.009 14.419 1.00 1.00 C ATOM 0 H THR A 14 57.293 7.564 14.854 1.00 1.00 H new ATOM 0 HA THR A 14 58.745 7.641 12.260 1.00 1.00 H new ATOM 0 HB THR A 14 56.758 9.091 12.606 1.00 1.00 H new ATOM 0 HG1 THR A 14 59.284 10.461 12.572 1.00 1.00 H new ATOM 0 HG21 THR A 14 56.857 10.903 14.292 1.00 1.00 H new ATOM 0 HG22 THR A 14 56.947 9.304 15.067 1.00 1.00 H new ATOM 0 HG23 THR A 14 58.421 10.281 14.871 1.00 1.00 H new ATOM 209 N ARG A 15 60.491 7.613 14.638 1.00 1.00 N ATOM 210 CA ARG A 15 61.802 7.927 15.280 1.00 1.00 C ATOM 211 C ARG A 15 62.925 7.212 14.525 1.00 1.00 C ATOM 212 O ARG A 15 63.452 6.216 14.980 1.00 1.00 O ATOM 213 CB ARG A 15 61.788 7.450 16.736 1.00 1.00 C ATOM 214 CG ARG A 15 61.341 5.988 16.796 1.00 1.00 C ATOM 215 CD ARG A 15 62.277 5.205 17.719 1.00 1.00 C ATOM 216 NE ARG A 15 62.202 5.770 19.096 1.00 1.00 N ATOM 217 CZ ARG A 15 61.174 5.506 19.855 1.00 1.00 C ATOM 218 NH1 ARG A 15 60.211 4.746 19.408 1.00 1.00 N ATOM 219 NH2 ARG A 15 61.109 6.000 21.061 1.00 1.00 N ATOM 0 H ARG A 15 60.111 6.692 14.857 1.00 1.00 H new ATOM 0 HA ARG A 15 61.969 9.004 15.251 1.00 1.00 H new ATOM 0 HB2 ARG A 15 62.781 7.555 17.173 1.00 1.00 H new ATOM 0 HB3 ARG A 15 61.114 8.071 17.326 1.00 1.00 H new ATOM 0 HG2 ARG A 15 60.316 5.925 17.162 1.00 1.00 H new ATOM 0 HG3 ARG A 15 61.350 5.553 15.797 1.00 1.00 H new ATOM 0 HD2 ARG A 15 61.997 4.152 17.731 1.00 1.00 H new ATOM 0 HD3 ARG A 15 63.300 5.258 17.347 1.00 1.00 H new ATOM 0 HE ARG A 15 62.955 6.363 19.445 1.00 1.00 H new ATOM 0 HH11 ARG A 15 60.262 4.359 18.466 1.00 1.00 H new ATOM 0 HH12 ARG A 15 59.407 4.539 20.001 1.00 1.00 H new ATOM 0 HH21 ARG A 15 61.862 6.593 21.411 1.00 1.00 H new ATOM 0 HH22 ARG A 15 60.305 5.793 21.654 1.00 1.00 H new ATOM 233 N VAL A 16 63.294 7.714 13.377 1.00 1.00 N ATOM 234 CA VAL A 16 64.384 7.068 12.586 1.00 1.00 C ATOM 235 C VAL A 16 65.503 8.082 12.343 1.00 1.00 C ATOM 236 O VAL A 16 66.670 7.743 12.339 1.00 1.00 O ATOM 237 CB VAL A 16 63.827 6.597 11.242 1.00 1.00 C ATOM 238 CG1 VAL A 16 64.845 5.681 10.560 1.00 1.00 C ATOM 239 CG2 VAL A 16 62.524 5.828 11.473 1.00 1.00 C ATOM 0 H VAL A 16 62.887 8.546 12.951 1.00 1.00 H new ATOM 0 HA VAL A 16 64.777 6.214 13.137 1.00 1.00 H new ATOM 0 HB VAL A 16 63.633 7.461 10.606 1.00 1.00 H new ATOM 0 HG11 VAL A 16 64.448 5.345 9.602 1.00 1.00 H new ATOM 0 HG12 VAL A 16 65.774 6.227 10.396 1.00 1.00 H new ATOM 0 HG13 VAL A 16 65.040 4.817 11.195 1.00 1.00 H new ATOM 0 HG21 VAL A 16 62.126 5.492 10.516 1.00 1.00 H new ATOM 0 HG22 VAL A 16 62.719 4.964 12.109 1.00 1.00 H new ATOM 0 HG23 VAL A 16 61.798 6.480 11.959 1.00 1.00 H new ATOM 249 N MET A 17 65.158 9.324 12.141 1.00 1.00 N ATOM 250 CA MET A 17 66.203 10.359 11.897 1.00 1.00 C ATOM 251 C MET A 17 66.721 10.885 13.237 1.00 1.00 C ATOM 252 O MET A 17 67.682 11.626 13.294 1.00 1.00 O ATOM 253 CB MET A 17 65.602 11.514 11.093 1.00 1.00 C ATOM 254 CG MET A 17 64.815 10.956 9.905 1.00 1.00 C ATOM 255 SD MET A 17 64.577 12.261 8.673 1.00 1.00 S ATOM 256 CE MET A 17 63.449 13.288 9.646 1.00 1.00 C ATOM 0 H MET A 17 64.198 9.667 12.134 1.00 1.00 H new ATOM 0 HA MET A 17 67.027 9.918 11.336 1.00 1.00 H new ATOM 0 HB2 MET A 17 64.947 12.111 11.728 1.00 1.00 H new ATOM 0 HB3 MET A 17 66.393 12.175 10.740 1.00 1.00 H new ATOM 0 HG2 MET A 17 65.351 10.116 9.462 1.00 1.00 H new ATOM 0 HG3 MET A 17 63.850 10.577 10.240 1.00 1.00 H new ATOM 0 HE1 MET A 17 62.961 14.012 8.993 1.00 1.00 H new ATOM 0 HE2 MET A 17 62.695 12.656 10.115 1.00 1.00 H new ATOM 0 HE3 MET A 17 64.011 13.816 10.417 1.00 1.00 H new ATOM 266 N GLY A 18 66.091 10.510 14.316 1.00 1.00 N ATOM 267 CA GLY A 18 66.547 10.992 15.650 1.00 1.00 C ATOM 268 C GLY A 18 66.716 12.512 15.611 1.00 1.00 C ATOM 269 O GLY A 18 66.377 13.156 14.639 1.00 1.00 O ATOM 0 H GLY A 18 65.281 9.891 14.332 1.00 1.00 H new ATOM 0 HA2 GLY A 18 65.823 10.715 16.416 1.00 1.00 H new ATOM 0 HA3 GLY A 18 67.491 10.517 15.917 1.00 1.00 H new ATOM 273 N GLY A 19 67.237 13.091 16.661 1.00 1.00 N ATOM 274 CA GLY A 19 67.427 14.572 16.685 1.00 1.00 C ATOM 275 C GLY A 19 68.909 14.904 16.474 1.00 1.00 C ATOM 276 O GLY A 19 69.348 15.111 15.360 1.00 1.00 O ATOM 0 H GLY A 19 67.539 12.602 17.504 1.00 1.00 H new ATOM 0 HA2 GLY A 19 66.825 15.039 15.905 1.00 1.00 H new ATOM 0 HA3 GLY A 19 67.085 14.977 17.637 1.00 1.00 H new ATOM 280 N PRO A 20 69.677 14.953 17.534 1.00 1.00 N ATOM 281 CA PRO A 20 71.132 15.264 17.454 1.00 1.00 C ATOM 282 C PRO A 20 71.816 14.563 16.275 1.00 1.00 C ATOM 283 O PRO A 20 72.868 14.971 15.825 1.00 1.00 O ATOM 284 CB PRO A 20 71.678 14.738 18.782 1.00 1.00 C ATOM 285 CG PRO A 20 70.537 14.847 19.741 1.00 1.00 C ATOM 286 CD PRO A 20 69.248 14.716 18.922 1.00 1.00 C ATOM 0 HA PRO A 20 71.314 16.327 17.293 1.00 1.00 H new ATOM 0 HB2 PRO A 20 72.017 13.706 18.688 1.00 1.00 H new ATOM 0 HB3 PRO A 20 72.533 15.325 19.117 1.00 1.00 H new ATOM 0 HG2 PRO A 20 70.594 14.065 20.498 1.00 1.00 H new ATOM 0 HG3 PRO A 20 70.565 15.802 20.266 1.00 1.00 H new ATOM 0 HD2 PRO A 20 68.801 13.729 19.038 1.00 1.00 H new ATOM 0 HD3 PRO A 20 68.500 15.443 19.237 1.00 1.00 H new ATOM 294 N CYS A 21 71.229 13.509 15.775 1.00 1.00 N ATOM 295 CA CYS A 21 71.852 12.785 14.631 1.00 1.00 C ATOM 296 C CYS A 21 71.830 13.675 13.387 1.00 1.00 C ATOM 297 O CYS A 21 70.792 13.922 12.806 1.00 1.00 O ATOM 298 CB CYS A 21 71.070 11.498 14.354 1.00 1.00 C ATOM 299 SG CYS A 21 72.177 10.266 13.623 1.00 1.00 S ATOM 0 H CYS A 21 70.347 13.119 16.109 1.00 1.00 H new ATOM 0 HA CYS A 21 72.884 12.537 14.879 1.00 1.00 H new ATOM 0 HB2 CYS A 21 70.641 11.114 15.280 1.00 1.00 H new ATOM 0 HB3 CYS A 21 70.239 11.703 13.679 1.00 1.00 H new ATOM 304 N THR A 22 72.971 14.156 12.971 1.00 1.00 N ATOM 305 CA THR A 22 73.022 15.027 11.761 1.00 1.00 C ATOM 306 C THR A 22 74.297 14.714 10.969 1.00 1.00 C ATOM 307 O THR A 22 75.328 14.421 11.542 1.00 1.00 O ATOM 308 CB THR A 22 73.036 16.495 12.195 1.00 1.00 C ATOM 309 OG1 THR A 22 73.218 17.322 11.055 1.00 1.00 O ATOM 310 CG2 THR A 22 74.180 16.726 13.184 1.00 1.00 C ATOM 0 H THR A 22 73.871 13.983 13.418 1.00 1.00 H new ATOM 0 HA THR A 22 72.149 14.842 11.135 1.00 1.00 H new ATOM 0 HB THR A 22 72.089 16.741 12.675 1.00 1.00 H new ATOM 0 HG1 THR A 22 73.225 18.262 11.331 1.00 1.00 H new ATOM 0 HG21 THR A 22 74.189 17.771 13.492 1.00 1.00 H new ATOM 0 HG22 THR A 22 74.039 16.091 14.059 1.00 1.00 H new ATOM 0 HG23 THR A 22 75.129 16.480 12.707 1.00 1.00 H new ATOM 318 N PRO A 23 74.234 14.775 9.661 1.00 1.00 N ATOM 319 CA PRO A 23 75.406 14.493 8.789 1.00 1.00 C ATOM 320 C PRO A 23 76.715 15.026 9.381 1.00 1.00 C ATOM 321 O PRO A 23 76.737 16.032 10.061 1.00 1.00 O ATOM 322 CB PRO A 23 75.059 15.227 7.495 1.00 1.00 C ATOM 323 CG PRO A 23 73.566 15.206 7.426 1.00 1.00 C ATOM 324 CD PRO A 23 73.045 15.123 8.867 1.00 1.00 C ATOM 0 HA PRO A 23 75.575 13.424 8.657 1.00 1.00 H new ATOM 0 HB2 PRO A 23 75.439 16.249 7.507 1.00 1.00 H new ATOM 0 HB3 PRO A 23 75.501 14.732 6.630 1.00 1.00 H new ATOM 0 HG2 PRO A 23 73.191 16.103 6.933 1.00 1.00 H new ATOM 0 HG3 PRO A 23 73.220 14.353 6.842 1.00 1.00 H new ATOM 0 HD2 PRO A 23 72.614 16.071 9.190 1.00 1.00 H new ATOM 0 HD3 PRO A 23 72.265 14.368 8.966 1.00 1.00 H new ATOM 332 N ARG A 24 77.806 14.357 9.125 1.00 1.00 N ATOM 333 CA ARG A 24 79.113 14.823 9.671 1.00 1.00 C ATOM 334 C ARG A 24 79.649 15.963 8.800 1.00 1.00 C ATOM 335 O ARG A 24 80.467 15.756 7.926 1.00 1.00 O ATOM 336 CB ARG A 24 80.111 13.656 9.666 1.00 1.00 C ATOM 337 CG ARG A 24 80.042 12.916 11.004 1.00 1.00 C ATOM 338 CD ARG A 24 80.966 13.599 12.013 1.00 1.00 C ATOM 339 NE ARG A 24 82.377 13.207 11.740 1.00 1.00 N ATOM 340 CZ ARG A 24 83.357 13.960 12.159 1.00 1.00 C ATOM 341 NH1 ARG A 24 83.101 15.057 12.818 1.00 1.00 N ATOM 342 NH2 ARG A 24 84.593 13.616 11.919 1.00 1.00 N ATOM 0 H ARG A 24 77.849 13.508 8.561 1.00 1.00 H new ATOM 0 HA ARG A 24 78.979 15.180 10.692 1.00 1.00 H new ATOM 0 HB2 ARG A 24 79.882 12.972 8.849 1.00 1.00 H new ATOM 0 HB3 ARG A 24 81.121 14.029 9.497 1.00 1.00 H new ATOM 0 HG2 ARG A 24 79.018 12.912 11.377 1.00 1.00 H new ATOM 0 HG3 ARG A 24 80.337 11.875 10.872 1.00 1.00 H new ATOM 0 HD2 ARG A 24 80.859 14.682 11.945 1.00 1.00 H new ATOM 0 HD3 ARG A 24 80.688 13.314 13.028 1.00 1.00 H new ATOM 0 HE ARG A 24 82.577 12.349 11.225 1.00 1.00 H new ATOM 0 HH11 ARG A 24 82.135 15.326 13.005 1.00 1.00 H new ATOM 0 HH12 ARG A 24 83.867 15.646 13.146 1.00 1.00 H new ATOM 0 HH21 ARG A 24 84.793 12.759 11.404 1.00 1.00 H new ATOM 0 HH22 ARG A 24 85.359 14.205 12.246 1.00 1.00 H new ATOM 356 N LYS A 25 79.197 17.165 9.032 1.00 1.00 N ATOM 357 CA LYS A 25 79.685 18.314 8.217 1.00 1.00 C ATOM 358 C LYS A 25 81.214 18.279 8.154 1.00 1.00 C ATOM 359 O LYS A 25 81.892 18.708 9.066 1.00 1.00 O ATOM 360 CB LYS A 25 79.226 19.630 8.855 1.00 1.00 C ATOM 361 CG LYS A 25 79.427 19.567 10.370 1.00 1.00 C ATOM 362 CD LYS A 25 78.077 19.350 11.057 1.00 1.00 C ATOM 363 CE LYS A 25 78.257 19.425 12.574 1.00 1.00 C ATOM 364 NZ LYS A 25 79.281 18.431 13.002 1.00 1.00 N ATOM 0 H LYS A 25 78.512 17.401 9.750 1.00 1.00 H new ATOM 0 HA LYS A 25 79.278 18.243 7.208 1.00 1.00 H new ATOM 0 HB2 LYS A 25 79.791 20.464 8.438 1.00 1.00 H new ATOM 0 HB3 LYS A 25 78.176 19.810 8.625 1.00 1.00 H new ATOM 0 HG2 LYS A 25 80.110 18.756 10.623 1.00 1.00 H new ATOM 0 HG3 LYS A 25 79.883 20.491 10.725 1.00 1.00 H new ATOM 0 HD2 LYS A 25 77.364 20.105 10.727 1.00 1.00 H new ATOM 0 HD3 LYS A 25 77.666 18.380 10.777 1.00 1.00 H new ATOM 0 HE2 LYS A 25 78.565 20.429 12.865 1.00 1.00 H new ATOM 0 HE3 LYS A 25 77.309 19.225 13.074 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 79.181 18.247 14.021 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 79.146 17.545 12.475 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 80.231 18.807 12.810 1.00 1.00 H new ATOM 378 N GLY A 26 81.760 17.767 7.085 1.00 1.00 N ATOM 379 CA GLY A 26 83.244 17.698 6.958 1.00 1.00 C ATOM 380 C GLY A 26 83.630 17.749 5.478 1.00 1.00 C ATOM 381 O GLY A 26 82.778 17.829 4.615 1.00 1.00 O ATOM 0 H GLY A 26 81.241 17.392 6.291 1.00 1.00 H new ATOM 0 HA2 GLY A 26 83.705 18.527 7.494 1.00 1.00 H new ATOM 0 HA3 GLY A 26 83.617 16.779 7.411 1.00 1.00 H new ATOM 385 N PRO A 27 84.904 17.704 5.182 1.00 1.00 N ATOM 386 CA PRO A 27 85.403 17.745 3.781 1.00 1.00 C ATOM 387 C PRO A 27 84.558 16.865 2.853 1.00 1.00 C ATOM 388 O PRO A 27 83.729 16.101 3.301 1.00 1.00 O ATOM 389 CB PRO A 27 86.850 17.220 3.875 1.00 1.00 C ATOM 390 CG PRO A 27 87.111 16.923 5.320 1.00 1.00 C ATOM 391 CD PRO A 27 86.011 17.602 6.138 1.00 1.00 C ATOM 0 HA PRO A 27 85.348 18.748 3.358 1.00 1.00 H new ATOM 0 HB2 PRO A 27 86.976 16.324 3.267 1.00 1.00 H new ATOM 0 HB3 PRO A 27 87.555 17.961 3.499 1.00 1.00 H new ATOM 0 HG2 PRO A 27 87.110 15.847 5.496 1.00 1.00 H new ATOM 0 HG3 PRO A 27 88.092 17.294 5.616 1.00 1.00 H new ATOM 0 HD2 PRO A 27 85.736 17.012 7.012 1.00 1.00 H new ATOM 0 HD3 PRO A 27 86.323 18.582 6.500 1.00 1.00 H new ATOM 399 N PRO A 28 84.767 16.979 1.569 1.00 1.00 N ATOM 400 CA PRO A 28 84.014 16.191 0.556 1.00 1.00 C ATOM 401 C PRO A 28 83.713 14.764 1.030 1.00 1.00 C ATOM 402 O PRO A 28 84.588 14.053 1.483 1.00 1.00 O ATOM 403 CB PRO A 28 84.962 16.183 -0.641 1.00 1.00 C ATOM 404 CG PRO A 28 85.713 17.472 -0.549 1.00 1.00 C ATOM 405 CD PRO A 28 85.750 17.870 0.932 1.00 1.00 C ATOM 0 HA PRO A 28 83.035 16.618 0.339 1.00 1.00 H new ATOM 0 HB2 PRO A 28 85.638 15.329 -0.603 1.00 1.00 H new ATOM 0 HB3 PRO A 28 84.412 16.113 -1.579 1.00 1.00 H new ATOM 0 HG2 PRO A 28 86.723 17.358 -0.942 1.00 1.00 H new ATOM 0 HG3 PRO A 28 85.225 18.245 -1.143 1.00 1.00 H new ATOM 0 HD2 PRO A 28 86.745 17.734 1.356 1.00 1.00 H new ATOM 0 HD3 PRO A 28 85.485 18.918 1.070 1.00 1.00 H new ATOM 413 N LYS A 29 82.480 14.342 0.930 1.00 1.00 N ATOM 414 CA LYS A 29 82.127 12.964 1.378 1.00 1.00 C ATOM 415 C LYS A 29 80.779 12.553 0.777 1.00 1.00 C ATOM 416 O LYS A 29 80.518 11.387 0.557 1.00 1.00 O ATOM 417 CB LYS A 29 82.031 12.933 2.906 1.00 1.00 C ATOM 418 CG LYS A 29 81.150 14.087 3.389 1.00 1.00 C ATOM 419 CD LYS A 29 80.629 13.779 4.794 1.00 1.00 C ATOM 420 CE LYS A 29 79.595 14.832 5.198 1.00 1.00 C ATOM 421 NZ LYS A 29 78.416 14.744 4.291 1.00 1.00 N ATOM 0 H LYS A 29 81.705 14.891 0.558 1.00 1.00 H new ATOM 0 HA LYS A 29 82.898 12.270 1.045 1.00 1.00 H new ATOM 0 HB2 LYS A 29 81.614 11.981 3.235 1.00 1.00 H new ATOM 0 HB3 LYS A 29 83.026 13.013 3.345 1.00 1.00 H new ATOM 0 HG2 LYS A 29 81.721 15.015 3.397 1.00 1.00 H new ATOM 0 HG3 LYS A 29 80.315 14.232 2.704 1.00 1.00 H new ATOM 0 HD2 LYS A 29 80.180 12.786 4.817 1.00 1.00 H new ATOM 0 HD3 LYS A 29 81.454 13.773 5.506 1.00 1.00 H new ATOM 0 HE2 LYS A 29 79.285 14.675 6.231 1.00 1.00 H new ATOM 0 HE3 LYS A 29 80.035 15.828 5.145 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 77.558 15.022 4.809 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 78.553 15.381 3.481 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 78.313 13.767 3.950 1.00 1.00 H new ATOM 435 N CYS A 30 79.919 13.499 0.514 1.00 1.00 N ATOM 436 CA CYS A 30 78.588 13.161 -0.067 1.00 1.00 C ATOM 437 C CYS A 30 78.129 14.301 -0.979 1.00 1.00 C ATOM 438 O CYS A 30 77.482 14.082 -1.984 1.00 1.00 O ATOM 439 CB CYS A 30 77.572 12.967 1.065 1.00 1.00 C ATOM 440 SG CYS A 30 78.422 12.357 2.542 1.00 1.00 S ATOM 0 H CYS A 30 80.081 14.493 0.677 1.00 1.00 H new ATOM 0 HA CYS A 30 78.664 12.241 -0.646 1.00 1.00 H new ATOM 0 HB2 CYS A 30 77.071 13.910 1.284 1.00 1.00 H new ATOM 0 HB3 CYS A 30 76.801 12.260 0.759 1.00 1.00 H new ATOM 445 N LYS A 31 78.474 15.516 -0.630 1.00 1.00 N ATOM 446 CA LYS A 31 78.085 16.710 -1.449 1.00 1.00 C ATOM 447 C LYS A 31 76.778 16.457 -2.210 1.00 1.00 C ATOM 448 O LYS A 31 76.584 16.955 -3.300 1.00 1.00 O ATOM 449 CB LYS A 31 79.206 17.051 -2.438 1.00 1.00 C ATOM 450 CG LYS A 31 79.343 15.929 -3.469 1.00 1.00 C ATOM 451 CD LYS A 31 80.655 16.099 -4.237 1.00 1.00 C ATOM 452 CE LYS A 31 80.629 17.420 -5.008 1.00 1.00 C ATOM 453 NZ LYS A 31 80.961 18.541 -4.085 1.00 1.00 N ATOM 0 H LYS A 31 79.019 15.736 0.204 1.00 1.00 H new ATOM 0 HA LYS A 31 77.928 17.550 -0.773 1.00 1.00 H new ATOM 0 HB2 LYS A 31 78.987 17.994 -2.939 1.00 1.00 H new ATOM 0 HB3 LYS A 31 80.147 17.184 -1.904 1.00 1.00 H new ATOM 0 HG2 LYS A 31 79.323 14.959 -2.972 1.00 1.00 H new ATOM 0 HG3 LYS A 31 78.500 15.950 -4.159 1.00 1.00 H new ATOM 0 HD2 LYS A 31 81.497 16.086 -3.546 1.00 1.00 H new ATOM 0 HD3 LYS A 31 80.796 15.266 -4.926 1.00 1.00 H new ATOM 0 HE2 LYS A 31 81.344 17.388 -5.830 1.00 1.00 H new ATOM 0 HE3 LYS A 31 79.644 17.577 -5.448 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 80.121 19.139 -3.949 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 81.265 18.157 -3.168 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 81.729 19.111 -4.493 1.00 1.00 H new ATOM 467 N GLN A 32 75.879 15.701 -1.631 1.00 1.00 N ATOM 468 CA GLN A 32 74.566 15.414 -2.293 1.00 1.00 C ATOM 469 C GLN A 32 74.712 15.417 -3.821 1.00 1.00 C ATOM 470 O GLN A 32 74.658 16.451 -4.456 1.00 1.00 O ATOM 471 CB GLN A 32 73.551 16.485 -1.879 1.00 1.00 C ATOM 472 CG GLN A 32 72.133 15.930 -2.024 1.00 1.00 C ATOM 473 CD GLN A 32 71.839 14.970 -0.870 1.00 1.00 C ATOM 474 OE1 GLN A 32 71.841 13.768 -1.048 1.00 1.00 O ATOM 475 NE2 GLN A 32 71.585 15.453 0.316 1.00 1.00 N ATOM 0 H GLN A 32 75.999 15.265 -0.717 1.00 1.00 H new ATOM 0 HA GLN A 32 74.224 14.428 -1.980 1.00 1.00 H new ATOM 0 HB2 GLN A 32 73.729 16.790 -0.848 1.00 1.00 H new ATOM 0 HB3 GLN A 32 73.670 17.373 -2.500 1.00 1.00 H new ATOM 0 HG2 GLN A 32 71.410 16.746 -2.025 1.00 1.00 H new ATOM 0 HG3 GLN A 32 72.030 15.412 -2.977 1.00 1.00 H new ATOM 0 HE21 GLN A 32 71.583 16.462 0.466 1.00 1.00 H new ATOM 0 HE22 GLN A 32 71.388 14.821 1.092 1.00 1.00 H new ATOM 484 N ARG A 33 74.885 14.268 -4.419 1.00 1.00 N ATOM 485 CA ARG A 33 75.022 14.218 -5.905 1.00 1.00 C ATOM 486 C ARG A 33 75.267 12.772 -6.349 1.00 1.00 C ATOM 487 O ARG A 33 76.150 12.101 -5.853 1.00 1.00 O ATOM 488 CB ARG A 33 76.203 15.101 -6.343 1.00 1.00 C ATOM 489 CG ARG A 33 75.698 16.208 -7.270 1.00 1.00 C ATOM 490 CD ARG A 33 76.813 17.231 -7.499 1.00 1.00 C ATOM 491 NE ARG A 33 76.903 17.551 -8.951 1.00 1.00 N ATOM 492 CZ ARG A 33 77.905 18.254 -9.403 1.00 1.00 C ATOM 493 NH1 ARG A 33 78.828 18.678 -8.583 1.00 1.00 N ATOM 494 NH2 ARG A 33 77.985 18.534 -10.675 1.00 1.00 N ATOM 0 H ARG A 33 74.937 13.366 -3.946 1.00 1.00 H new ATOM 0 HA ARG A 33 74.106 14.586 -6.366 1.00 1.00 H new ATOM 0 HB2 ARG A 33 76.688 15.537 -5.470 1.00 1.00 H new ATOM 0 HB3 ARG A 33 76.952 14.497 -6.855 1.00 1.00 H new ATOM 0 HG2 ARG A 33 75.379 15.783 -8.222 1.00 1.00 H new ATOM 0 HG3 ARG A 33 74.827 16.695 -6.831 1.00 1.00 H new ATOM 0 HD2 ARG A 33 76.612 18.137 -6.928 1.00 1.00 H new ATOM 0 HD3 ARG A 33 77.764 16.834 -7.144 1.00 1.00 H new ATOM 0 HE ARG A 33 76.181 17.221 -9.592 1.00 1.00 H new ATOM 0 HH11 ARG A 33 78.766 18.460 -7.589 1.00 1.00 H new ATOM 0 HH12 ARG A 33 79.611 19.228 -8.937 1.00 1.00 H new ATOM 0 HH21 ARG A 33 77.264 18.203 -11.316 1.00 1.00 H new ATOM 0 HH22 ARG A 33 78.768 19.084 -11.028 1.00 1.00 H new ATOM 508 N GLN A 34 74.496 12.291 -7.287 1.00 1.00 N ATOM 509 CA GLN A 34 74.691 10.894 -7.768 1.00 1.00 C ATOM 510 C GLN A 34 75.992 10.820 -8.571 1.00 1.00 C ATOM 511 O GLN A 34 76.150 11.483 -9.576 1.00 1.00 O ATOM 512 CB GLN A 34 73.513 10.490 -8.658 1.00 1.00 C ATOM 513 CG GLN A 34 73.506 8.971 -8.840 1.00 1.00 C ATOM 514 CD GLN A 34 72.216 8.546 -9.544 1.00 1.00 C ATOM 515 OE1 GLN A 34 71.132 8.852 -9.088 1.00 1.00 O ATOM 516 NE2 GLN A 34 72.287 7.850 -10.645 1.00 1.00 N ATOM 0 H GLN A 34 73.740 12.805 -7.740 1.00 1.00 H new ATOM 0 HA GLN A 34 74.746 10.215 -6.917 1.00 1.00 H new ATOM 0 HB2 GLN A 34 72.575 10.817 -8.209 1.00 1.00 H new ATOM 0 HB3 GLN A 34 73.591 10.982 -9.627 1.00 1.00 H new ATOM 0 HG2 GLN A 34 74.371 8.661 -9.426 1.00 1.00 H new ATOM 0 HG3 GLN A 34 73.583 8.478 -7.871 1.00 1.00 H new ATOM 0 HE21 GLN A 34 73.197 7.593 -11.028 1.00 1.00 H new ATOM 0 HE22 GLN A 34 71.433 7.563 -11.123 1.00 1.00 H new ATOM 525 N THR A 35 76.927 10.025 -8.129 1.00 1.00 N ATOM 526 CA THR A 35 78.220 9.917 -8.860 1.00 1.00 C ATOM 527 C THR A 35 77.964 9.554 -10.326 1.00 1.00 C ATOM 528 O THR A 35 78.606 10.068 -11.220 1.00 1.00 O ATOM 529 CB THR A 35 79.083 8.834 -8.209 1.00 1.00 C ATOM 530 OG1 THR A 35 78.436 7.576 -8.336 1.00 1.00 O ATOM 531 CG2 THR A 35 79.284 9.160 -6.728 1.00 1.00 C ATOM 0 H THR A 35 76.851 9.446 -7.293 1.00 1.00 H new ATOM 0 HA THR A 35 78.738 10.875 -8.815 1.00 1.00 H new ATOM 0 HB THR A 35 80.053 8.796 -8.704 1.00 1.00 H new ATOM 0 HG1 THR A 35 78.988 6.881 -7.921 1.00 1.00 H new ATOM 0 HG21 THR A 35 79.899 8.388 -6.266 1.00 1.00 H new ATOM 0 HG22 THR A 35 79.781 10.125 -6.632 1.00 1.00 H new ATOM 0 HG23 THR A 35 78.316 9.200 -6.229 1.00 1.00 H new ATOM 539 N ARG A 36 77.040 8.669 -10.582 1.00 1.00 N ATOM 540 CA ARG A 36 76.759 8.275 -11.991 1.00 1.00 C ATOM 541 C ARG A 36 78.072 7.881 -12.670 1.00 1.00 C ATOM 542 O ARG A 36 78.127 7.678 -13.867 1.00 1.00 O ATOM 543 CB ARG A 36 76.126 9.453 -12.743 1.00 1.00 C ATOM 544 CG ARG A 36 74.616 9.468 -12.495 1.00 1.00 C ATOM 545 CD ARG A 36 73.945 10.424 -13.483 1.00 1.00 C ATOM 546 NE ARG A 36 72.470 10.215 -13.452 1.00 1.00 N ATOM 547 CZ ARG A 36 71.748 10.509 -14.499 1.00 1.00 C ATOM 548 NH1 ARG A 36 72.318 10.986 -15.572 1.00 1.00 N ATOM 549 NH2 ARG A 36 70.456 10.326 -14.472 1.00 1.00 N ATOM 0 H ARG A 36 76.468 8.203 -9.878 1.00 1.00 H new ATOM 0 HA ARG A 36 76.069 7.432 -12.004 1.00 1.00 H new ATOM 0 HB2 ARG A 36 76.569 10.391 -12.409 1.00 1.00 H new ATOM 0 HB3 ARG A 36 76.329 9.367 -13.811 1.00 1.00 H new ATOM 0 HG2 ARG A 36 74.208 8.464 -12.610 1.00 1.00 H new ATOM 0 HG3 ARG A 36 74.408 9.781 -11.472 1.00 1.00 H new ATOM 0 HD2 ARG A 36 74.182 11.456 -13.225 1.00 1.00 H new ATOM 0 HD3 ARG A 36 74.327 10.251 -14.489 1.00 1.00 H new ATOM 0 HE ARG A 36 72.025 9.842 -12.613 1.00 1.00 H new ATOM 0 HH11 ARG A 36 73.328 11.129 -15.592 1.00 1.00 H new ATOM 0 HH12 ARG A 36 71.754 11.216 -16.390 1.00 1.00 H new ATOM 0 HH21 ARG A 36 70.011 9.953 -13.633 1.00 1.00 H new ATOM 0 HH22 ARG A 36 69.891 10.556 -15.290 1.00 1.00 H new ATOM 563 N GLN A 37 79.130 7.768 -11.910 1.00 1.00 N ATOM 564 CA GLN A 37 80.445 7.382 -12.498 1.00 1.00 C ATOM 565 C GLN A 37 80.906 6.064 -11.871 1.00 1.00 C ATOM 566 O GLN A 37 80.205 5.072 -11.915 1.00 1.00 O ATOM 567 CB GLN A 37 81.474 8.481 -12.214 1.00 1.00 C ATOM 568 CG GLN A 37 81.158 9.708 -13.071 1.00 1.00 C ATOM 569 CD GLN A 37 81.939 10.914 -12.545 1.00 1.00 C ATOM 570 OE1 GLN A 37 82.709 10.794 -11.612 1.00 1.00 O ATOM 571 NE2 GLN A 37 81.774 12.079 -13.108 1.00 1.00 N ATOM 0 H GLN A 37 79.139 7.927 -10.903 1.00 1.00 H new ATOM 0 HA GLN A 37 80.346 7.257 -13.576 1.00 1.00 H new ATOM 0 HB2 GLN A 37 81.455 8.747 -11.157 1.00 1.00 H new ATOM 0 HB3 GLN A 37 82.478 8.119 -12.434 1.00 1.00 H new ATOM 0 HG2 GLN A 37 81.422 9.516 -14.111 1.00 1.00 H new ATOM 0 HG3 GLN A 37 80.088 9.916 -13.047 1.00 1.00 H new ATOM 0 HE21 GLN A 37 81.128 12.180 -13.891 1.00 1.00 H new ATOM 0 HE22 GLN A 37 82.291 12.889 -12.765 1.00 1.00 H new ATOM 580 N CYS A 38 82.076 6.037 -11.291 1.00 1.00 N ATOM 581 CA CYS A 38 82.568 4.774 -10.671 1.00 1.00 C ATOM 582 C CYS A 38 82.445 3.629 -11.680 1.00 1.00 C ATOM 583 O CYS A 38 82.652 2.478 -11.351 1.00 1.00 O ATOM 584 CB CYS A 38 81.724 4.443 -9.436 1.00 1.00 C ATOM 585 SG CYS A 38 82.205 5.522 -8.064 1.00 1.00 S ATOM 0 H CYS A 38 82.710 6.833 -11.220 1.00 1.00 H new ATOM 0 HA CYS A 38 83.611 4.900 -10.379 1.00 1.00 H new ATOM 0 HB2 CYS A 38 80.665 4.574 -9.661 1.00 1.00 H new ATOM 0 HB3 CYS A 38 81.864 3.399 -9.157 1.00 1.00 H new ATOM 590 N LYS A 39 82.092 3.927 -12.902 1.00 1.00 N ATOM 591 CA LYS A 39 81.938 2.842 -13.913 1.00 1.00 C ATOM 592 C LYS A 39 83.255 2.612 -14.654 1.00 1.00 C ATOM 593 O LYS A 39 83.367 2.871 -15.836 1.00 1.00 O ATOM 594 CB LYS A 39 80.850 3.228 -14.920 1.00 1.00 C ATOM 595 CG LYS A 39 81.134 4.624 -15.477 1.00 1.00 C ATOM 596 CD LYS A 39 80.640 4.707 -16.923 1.00 1.00 C ATOM 597 CE LYS A 39 80.957 6.092 -17.492 1.00 1.00 C ATOM 598 NZ LYS A 39 80.468 6.174 -18.898 1.00 1.00 N ATOM 0 H LYS A 39 81.905 4.870 -13.242 1.00 1.00 H new ATOM 0 HA LYS A 39 81.656 1.923 -13.399 1.00 1.00 H new ATOM 0 HB2 LYS A 39 80.818 2.502 -15.732 1.00 1.00 H new ATOM 0 HB3 LYS A 39 79.872 3.210 -14.438 1.00 1.00 H new ATOM 0 HG2 LYS A 39 80.636 5.378 -14.868 1.00 1.00 H new ATOM 0 HG3 LYS A 39 82.203 4.834 -15.434 1.00 1.00 H new ATOM 0 HD2 LYS A 39 81.118 3.936 -17.527 1.00 1.00 H new ATOM 0 HD3 LYS A 39 79.566 4.523 -16.963 1.00 1.00 H new ATOM 0 HE2 LYS A 39 80.483 6.864 -16.885 1.00 1.00 H new ATOM 0 HE3 LYS A 39 82.031 6.274 -17.458 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 80.683 7.115 -19.286 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 80.940 5.447 -19.473 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 79.440 6.018 -18.918 1.00 1.00 H new ATOM 612 N SER A 40 84.249 2.108 -13.978 1.00 1.00 N ATOM 613 CA SER A 40 85.545 1.844 -14.658 1.00 1.00 C ATOM 614 C SER A 40 85.425 0.535 -15.441 1.00 1.00 C ATOM 615 O SER A 40 85.764 0.460 -16.605 1.00 1.00 O ATOM 616 CB SER A 40 86.655 1.724 -13.614 1.00 1.00 C ATOM 617 OG SER A 40 86.750 2.943 -12.890 1.00 1.00 O ATOM 0 H SER A 40 84.220 1.868 -12.987 1.00 1.00 H new ATOM 0 HA SER A 40 85.787 2.662 -15.337 1.00 1.00 H new ATOM 0 HB2 SER A 40 86.443 0.899 -12.934 1.00 1.00 H new ATOM 0 HB3 SER A 40 87.605 1.501 -14.100 1.00 1.00 H new ATOM 0 HG SER A 40 87.647 3.321 -13.002 1.00 1.00 H new ATOM 623 N LYS A 41 84.928 -0.496 -14.807 1.00 1.00 N ATOM 624 CA LYS A 41 84.762 -1.806 -15.502 1.00 1.00 C ATOM 625 C LYS A 41 83.459 -2.456 -15.019 1.00 1.00 C ATOM 626 O LYS A 41 83.067 -2.288 -13.881 1.00 1.00 O ATOM 627 CB LYS A 41 85.943 -2.735 -15.172 1.00 1.00 C ATOM 628 CG LYS A 41 87.226 -1.912 -15.038 1.00 1.00 C ATOM 629 CD LYS A 41 87.670 -1.429 -16.420 1.00 1.00 C ATOM 630 CE LYS A 41 88.877 -2.247 -16.884 1.00 1.00 C ATOM 631 NZ LYS A 41 88.583 -3.700 -16.725 1.00 1.00 N ATOM 0 H LYS A 41 84.629 -0.486 -13.832 1.00 1.00 H new ATOM 0 HA LYS A 41 84.730 -1.644 -16.579 1.00 1.00 H new ATOM 0 HB2 LYS A 41 85.746 -3.273 -14.245 1.00 1.00 H new ATOM 0 HB3 LYS A 41 86.060 -3.483 -15.956 1.00 1.00 H new ATOM 0 HG2 LYS A 41 87.057 -1.059 -14.380 1.00 1.00 H new ATOM 0 HG3 LYS A 41 88.011 -2.515 -14.582 1.00 1.00 H new ATOM 0 HD2 LYS A 41 86.852 -1.532 -17.133 1.00 1.00 H new ATOM 0 HD3 LYS A 41 87.928 -0.371 -16.381 1.00 1.00 H new ATOM 0 HE2 LYS A 41 89.103 -2.023 -17.926 1.00 1.00 H new ATOM 0 HE3 LYS A 41 89.758 -1.977 -16.302 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 89.307 -4.257 -17.221 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 88.589 -3.947 -15.715 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 87.648 -3.911 -17.128 1.00 1.00 H new ATOM 645 N PRO A 42 82.792 -3.194 -15.870 1.00 1.00 N ATOM 646 CA PRO A 42 81.514 -3.874 -15.504 1.00 1.00 C ATOM 647 C PRO A 42 81.743 -5.022 -14.509 1.00 1.00 C ATOM 648 O PRO A 42 82.803 -5.615 -14.476 1.00 1.00 O ATOM 649 CB PRO A 42 80.988 -4.411 -16.841 1.00 1.00 C ATOM 650 CG PRO A 42 82.194 -4.546 -17.711 1.00 1.00 C ATOM 651 CD PRO A 42 83.179 -3.464 -17.264 1.00 1.00 C ATOM 0 HA PRO A 42 80.817 -3.198 -15.010 1.00 1.00 H new ATOM 0 HB2 PRO A 42 80.487 -5.370 -16.710 1.00 1.00 H new ATOM 0 HB3 PRO A 42 80.260 -3.729 -17.280 1.00 1.00 H new ATOM 0 HG2 PRO A 42 82.636 -5.537 -17.610 1.00 1.00 H new ATOM 0 HG3 PRO A 42 81.930 -4.420 -18.761 1.00 1.00 H new ATOM 0 HD2 PRO A 42 84.211 -3.808 -17.334 1.00 1.00 H new ATOM 0 HD3 PRO A 42 83.099 -2.570 -17.882 1.00 1.00 H new ATOM 659 N PRO A 43 80.759 -5.331 -13.701 1.00 1.00 N ATOM 660 CA PRO A 43 80.864 -6.424 -12.689 1.00 1.00 C ATOM 661 C PRO A 43 80.775 -7.816 -13.323 1.00 1.00 C ATOM 662 O PRO A 43 79.815 -8.144 -13.992 1.00 1.00 O ATOM 663 CB PRO A 43 79.665 -6.175 -11.771 1.00 1.00 C ATOM 664 CG PRO A 43 78.654 -5.497 -12.635 1.00 1.00 C ATOM 665 CD PRO A 43 79.440 -4.678 -13.664 1.00 1.00 C ATOM 0 HA PRO A 43 81.823 -6.409 -12.172 1.00 1.00 H new ATOM 0 HB2 PRO A 43 79.276 -7.110 -11.367 1.00 1.00 H new ATOM 0 HB3 PRO A 43 79.941 -5.551 -10.921 1.00 1.00 H new ATOM 0 HG2 PRO A 43 78.013 -6.228 -13.129 1.00 1.00 H new ATOM 0 HG3 PRO A 43 78.005 -4.854 -12.041 1.00 1.00 H new ATOM 0 HD2 PRO A 43 78.958 -4.695 -14.641 1.00 1.00 H new ATOM 0 HD3 PRO A 43 79.520 -3.632 -13.366 1.00 1.00 H new ATOM 673 N LYS A 44 81.767 -8.638 -13.114 1.00 1.00 N ATOM 674 CA LYS A 44 81.738 -10.009 -13.698 1.00 1.00 C ATOM 675 C LYS A 44 80.946 -10.932 -12.768 1.00 1.00 C ATOM 676 O LYS A 44 79.989 -11.564 -13.169 1.00 1.00 O ATOM 677 CB LYS A 44 83.172 -10.542 -13.857 1.00 1.00 C ATOM 678 CG LYS A 44 84.152 -9.369 -13.922 1.00 1.00 C ATOM 679 CD LYS A 44 84.567 -8.971 -12.504 1.00 1.00 C ATOM 680 CE LYS A 44 85.796 -9.780 -12.085 1.00 1.00 C ATOM 681 NZ LYS A 44 85.884 -9.815 -10.598 1.00 1.00 N ATOM 0 H LYS A 44 82.597 -8.419 -12.563 1.00 1.00 H new ATOM 0 HA LYS A 44 81.263 -9.977 -14.678 1.00 1.00 H new ATOM 0 HB2 LYS A 44 83.424 -11.193 -13.020 1.00 1.00 H new ATOM 0 HB3 LYS A 44 83.249 -11.144 -14.763 1.00 1.00 H new ATOM 0 HG2 LYS A 44 85.030 -9.647 -14.505 1.00 1.00 H new ATOM 0 HG3 LYS A 44 83.689 -8.522 -14.428 1.00 1.00 H new ATOM 0 HD2 LYS A 44 84.790 -7.905 -12.465 1.00 1.00 H new ATOM 0 HD3 LYS A 44 83.746 -9.151 -11.810 1.00 1.00 H new ATOM 0 HE2 LYS A 44 85.729 -10.794 -12.480 1.00 1.00 H new ATOM 0 HE3 LYS A 44 86.698 -9.334 -12.503 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 86.719 -10.365 -10.313 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 85.966 -8.845 -10.232 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 85.028 -10.260 -10.210 1.00 1.00 H new ATOM 695 N LYS A 45 81.338 -11.010 -11.525 1.00 1.00 N ATOM 696 CA LYS A 45 80.610 -11.887 -10.565 1.00 1.00 C ATOM 697 C LYS A 45 80.943 -11.460 -9.134 1.00 1.00 C ATOM 698 O LYS A 45 80.167 -11.658 -8.220 1.00 1.00 O ATOM 699 CB LYS A 45 81.039 -13.342 -10.772 1.00 1.00 C ATOM 700 CG LYS A 45 80.427 -14.217 -9.677 1.00 1.00 C ATOM 701 CD LYS A 45 80.500 -15.687 -10.096 1.00 1.00 C ATOM 702 CE LYS A 45 79.185 -16.093 -10.765 1.00 1.00 C ATOM 703 NZ LYS A 45 78.718 -14.991 -11.652 1.00 1.00 N ATOM 0 H LYS A 45 82.132 -10.504 -11.133 1.00 1.00 H new ATOM 0 HA LYS A 45 79.537 -11.797 -10.735 1.00 1.00 H new ATOM 0 HB2 LYS A 45 80.717 -13.691 -11.753 1.00 1.00 H new ATOM 0 HB3 LYS A 45 82.126 -13.418 -10.748 1.00 1.00 H new ATOM 0 HG2 LYS A 45 80.960 -14.069 -8.738 1.00 1.00 H new ATOM 0 HG3 LYS A 45 79.390 -13.929 -9.504 1.00 1.00 H new ATOM 0 HD2 LYS A 45 81.332 -15.839 -10.783 1.00 1.00 H new ATOM 0 HD3 LYS A 45 80.687 -16.316 -9.225 1.00 1.00 H new ATOM 0 HE2 LYS A 45 79.326 -17.006 -11.344 1.00 1.00 H new ATOM 0 HE3 LYS A 45 78.431 -16.309 -10.008 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 77.902 -15.316 -12.208 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 78.439 -14.174 -11.073 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 79.487 -14.713 -12.295 1.00 1.00 H new ATOM 717 N GLY A 46 82.092 -10.877 -8.932 1.00 1.00 N ATOM 718 CA GLY A 46 82.473 -10.441 -7.559 1.00 1.00 C ATOM 719 C GLY A 46 82.554 -11.663 -6.642 1.00 1.00 C ATOM 720 O GLY A 46 82.470 -11.548 -5.436 1.00 1.00 O ATOM 0 H GLY A 46 82.783 -10.684 -9.657 1.00 1.00 H new ATOM 0 HA2 GLY A 46 83.433 -9.926 -7.582 1.00 1.00 H new ATOM 0 HA3 GLY A 46 81.740 -9.732 -7.174 1.00 1.00 H new ATOM 724 N VAL A 47 82.717 -12.832 -7.212 1.00 1.00 N ATOM 725 CA VAL A 47 82.808 -14.083 -6.395 1.00 1.00 C ATOM 726 C VAL A 47 82.074 -13.913 -5.067 1.00 1.00 C ATOM 727 O VAL A 47 82.673 -13.819 -4.014 1.00 1.00 O ATOM 728 CB VAL A 47 84.276 -14.416 -6.138 1.00 1.00 C ATOM 729 CG1 VAL A 47 84.371 -15.684 -5.287 1.00 1.00 C ATOM 730 CG2 VAL A 47 84.987 -14.645 -7.473 1.00 1.00 C ATOM 0 H VAL A 47 82.792 -12.974 -8.219 1.00 1.00 H new ATOM 0 HA VAL A 47 82.339 -14.898 -6.946 1.00 1.00 H new ATOM 0 HB VAL A 47 84.749 -13.588 -5.610 1.00 1.00 H new ATOM 0 HG11 VAL A 47 85.419 -15.922 -5.104 1.00 1.00 H new ATOM 0 HG12 VAL A 47 83.864 -15.523 -4.336 1.00 1.00 H new ATOM 0 HG13 VAL A 47 83.898 -16.512 -5.814 1.00 1.00 H new ATOM 0 HG21 VAL A 47 86.035 -14.883 -7.291 1.00 1.00 H new ATOM 0 HG22 VAL A 47 84.513 -15.473 -8.000 1.00 1.00 H new ATOM 0 HG23 VAL A 47 84.920 -13.742 -8.080 1.00 1.00 H new ATOM 740 N GLN A 48 80.778 -13.880 -5.117 1.00 1.00 N ATOM 741 CA GLN A 48 79.977 -13.725 -3.870 1.00 1.00 C ATOM 742 C GLN A 48 80.571 -12.615 -2.994 1.00 1.00 C ATOM 743 O GLN A 48 80.184 -11.467 -3.086 1.00 1.00 O ATOM 744 CB GLN A 48 79.984 -15.048 -3.099 1.00 1.00 C ATOM 745 CG GLN A 48 79.056 -14.940 -1.887 1.00 1.00 C ATOM 746 CD GLN A 48 79.082 -16.254 -1.105 1.00 1.00 C ATOM 747 OE1 GLN A 48 80.043 -16.995 -1.170 1.00 1.00 O ATOM 748 NE2 GLN A 48 78.059 -16.578 -0.362 1.00 1.00 N ATOM 0 H GLN A 48 80.230 -13.954 -5.974 1.00 1.00 H new ATOM 0 HA GLN A 48 78.954 -13.456 -4.132 1.00 1.00 H new ATOM 0 HB2 GLN A 48 79.658 -15.861 -3.748 1.00 1.00 H new ATOM 0 HB3 GLN A 48 80.997 -15.286 -2.774 1.00 1.00 H new ATOM 0 HG2 GLN A 48 79.372 -14.117 -1.246 1.00 1.00 H new ATOM 0 HG3 GLN A 48 78.040 -14.718 -2.213 1.00 1.00 H new ATOM 0 HE21 GLN A 48 77.252 -15.957 -0.307 1.00 1.00 H new ATOM 0 HE22 GLN A 48 78.067 -17.452 0.163 1.00 1.00 H new ATOM 757 N GLY A 49 81.500 -12.948 -2.137 1.00 1.00 N ATOM 758 CA GLY A 49 82.105 -11.912 -1.249 1.00 1.00 C ATOM 759 C GLY A 49 83.188 -11.133 -2.001 1.00 1.00 C ATOM 760 O GLY A 49 83.771 -10.206 -1.476 1.00 1.00 O ATOM 0 H GLY A 49 81.866 -13.892 -2.014 1.00 1.00 H new ATOM 0 HA2 GLY A 49 81.332 -11.228 -0.899 1.00 1.00 H new ATOM 0 HA3 GLY A 49 82.535 -12.386 -0.367 1.00 1.00 H new ATOM 764 N CYS A 50 83.461 -11.494 -3.225 1.00 1.00 N ATOM 765 CA CYS A 50 84.503 -10.763 -3.999 1.00 1.00 C ATOM 766 C CYS A 50 85.795 -10.702 -3.185 1.00 1.00 C ATOM 767 O CYS A 50 86.531 -11.665 -3.093 1.00 1.00 O ATOM 768 CB CYS A 50 84.014 -9.342 -4.288 1.00 1.00 C ATOM 769 SG CYS A 50 85.309 -8.420 -5.153 1.00 1.00 S ATOM 0 H CYS A 50 83.009 -12.262 -3.721 1.00 1.00 H new ATOM 0 HA CYS A 50 84.692 -11.283 -4.938 1.00 1.00 H new ATOM 0 HB2 CYS A 50 83.109 -9.374 -4.895 1.00 1.00 H new ATOM 0 HB3 CYS A 50 83.755 -8.839 -3.356 1.00 1.00 H new ATOM 774 N GLY A 51 86.075 -9.574 -2.596 1.00 1.00 N ATOM 775 CA GLY A 51 87.320 -9.442 -1.787 1.00 1.00 C ATOM 776 C GLY A 51 87.652 -7.960 -1.595 1.00 1.00 C ATOM 777 O GLY A 51 86.781 -7.147 -1.356 1.00 1.00 O ATOM 0 H GLY A 51 85.495 -8.736 -2.639 1.00 1.00 H new ATOM 0 HA2 GLY A 51 87.189 -9.924 -0.818 1.00 1.00 H new ATOM 0 HA3 GLY A 51 88.146 -9.948 -2.286 1.00 1.00 H new ATOM 781 N ASP A 52 88.904 -7.601 -1.697 1.00 1.00 N ATOM 782 CA ASP A 52 89.290 -6.172 -1.521 1.00 1.00 C ATOM 783 C ASP A 52 90.771 -5.999 -1.860 1.00 1.00 C ATOM 784 O ASP A 52 91.638 -6.519 -1.184 1.00 1.00 O ATOM 785 CB ASP A 52 89.047 -5.751 -0.071 1.00 1.00 C ATOM 786 CG ASP A 52 89.506 -4.305 0.125 1.00 1.00 C ATOM 787 OD1 ASP A 52 89.876 -3.683 -0.857 1.00 1.00 O ATOM 788 OD2 ASP A 52 89.480 -3.844 1.254 1.00 1.00 O ATOM 0 H ASP A 52 89.676 -8.237 -1.895 1.00 1.00 H new ATOM 0 HA ASP A 52 88.689 -5.550 -2.185 1.00 1.00 H new ATOM 0 HB2 ASP A 52 87.989 -5.844 0.173 1.00 1.00 H new ATOM 0 HB3 ASP A 52 89.590 -6.411 0.606 1.00 1.00 H new ATOM 793 N ASP A 53 91.069 -5.274 -2.904 1.00 1.00 N ATOM 794 CA ASP A 53 92.495 -5.070 -3.287 1.00 1.00 C ATOM 795 C ASP A 53 92.587 -4.001 -4.378 1.00 1.00 C ATOM 796 O ASP A 53 93.539 -3.249 -4.444 1.00 1.00 O ATOM 797 CB ASP A 53 93.073 -6.388 -3.812 1.00 1.00 C ATOM 798 CG ASP A 53 94.600 -6.347 -3.730 1.00 1.00 C ATOM 799 OD1 ASP A 53 95.159 -5.293 -3.984 1.00 1.00 O ATOM 800 OD2 ASP A 53 95.185 -7.370 -3.414 1.00 1.00 O ATOM 0 H ASP A 53 90.387 -4.815 -3.508 1.00 1.00 H new ATOM 0 HA ASP A 53 93.062 -4.744 -2.415 1.00 1.00 H new ATOM 0 HB2 ASP A 53 92.690 -7.224 -3.227 1.00 1.00 H new ATOM 0 HB3 ASP A 53 92.758 -6.550 -4.843 1.00 1.00 H new ATOM 805 N ILE A 54 91.610 -3.930 -5.239 1.00 1.00 N ATOM 806 CA ILE A 54 91.653 -2.910 -6.324 1.00 1.00 C ATOM 807 C ILE A 54 91.684 -1.505 -5.699 1.00 1.00 C ATOM 808 O ILE A 54 90.835 -1.164 -4.899 1.00 1.00 O ATOM 809 CB ILE A 54 90.407 -3.048 -7.209 1.00 1.00 C ATOM 810 CG1 ILE A 54 89.178 -3.271 -6.325 1.00 1.00 C ATOM 811 CG2 ILE A 54 90.579 -4.241 -8.151 1.00 1.00 C ATOM 812 CD1 ILE A 54 87.924 -3.334 -7.200 1.00 1.00 C ATOM 0 H ILE A 54 90.786 -4.532 -5.239 1.00 1.00 H new ATOM 0 HA ILE A 54 92.546 -3.061 -6.931 1.00 1.00 H new ATOM 0 HB ILE A 54 90.275 -2.139 -7.795 1.00 1.00 H new ATOM 0 HG12 ILE A 54 89.287 -4.197 -5.760 1.00 1.00 H new ATOM 0 HG13 ILE A 54 89.088 -2.463 -5.599 1.00 1.00 H new ATOM 0 HG21 ILE A 54 89.694 -4.339 -8.780 1.00 1.00 H new ATOM 0 HG22 ILE A 54 91.455 -4.084 -8.780 1.00 1.00 H new ATOM 0 HG23 ILE A 54 90.711 -5.151 -7.565 1.00 1.00 H new ATOM 0 HD11 ILE A 54 87.049 -3.493 -6.570 1.00 1.00 H new ATOM 0 HD12 ILE A 54 87.813 -2.397 -7.745 1.00 1.00 H new ATOM 0 HD13 ILE A 54 88.016 -4.157 -7.908 1.00 1.00 H new ATOM 824 N PRO A 55 92.647 -0.690 -6.057 1.00 1.00 N ATOM 825 CA PRO A 55 92.761 0.694 -5.514 1.00 1.00 C ATOM 826 C PRO A 55 91.740 1.642 -6.157 1.00 1.00 C ATOM 827 O PRO A 55 91.923 2.108 -7.263 1.00 1.00 O ATOM 828 CB PRO A 55 94.189 1.106 -5.878 1.00 1.00 C ATOM 829 CG PRO A 55 94.520 0.315 -7.101 1.00 1.00 C ATOM 830 CD PRO A 55 93.726 -0.993 -7.012 1.00 1.00 C ATOM 0 HA PRO A 55 92.560 0.737 -4.443 1.00 1.00 H new ATOM 0 HB2 PRO A 55 94.254 2.177 -6.071 1.00 1.00 H new ATOM 0 HB3 PRO A 55 94.882 0.886 -5.066 1.00 1.00 H new ATOM 0 HG2 PRO A 55 94.254 0.868 -8.002 1.00 1.00 H new ATOM 0 HG3 PRO A 55 95.590 0.115 -7.154 1.00 1.00 H new ATOM 0 HD2 PRO A 55 93.328 -1.286 -7.984 1.00 1.00 H new ATOM 0 HD3 PRO A 55 94.350 -1.816 -6.662 1.00 1.00 H new ATOM 838 N GLY A 56 90.664 1.923 -5.472 1.00 1.00 N ATOM 839 CA GLY A 56 89.625 2.833 -6.039 1.00 1.00 C ATOM 840 C GLY A 56 88.245 2.218 -5.816 1.00 1.00 C ATOM 841 O GLY A 56 87.243 2.904 -5.794 1.00 1.00 O ATOM 0 H GLY A 56 90.459 1.561 -4.541 1.00 1.00 H new ATOM 0 HA2 GLY A 56 89.682 3.812 -5.562 1.00 1.00 H new ATOM 0 HA3 GLY A 56 89.800 2.987 -7.104 1.00 1.00 H new ATOM 845 N MET A 57 88.184 0.924 -5.648 1.00 1.00 N ATOM 846 CA MET A 57 86.866 0.266 -5.426 1.00 1.00 C ATOM 847 C MET A 57 85.925 0.612 -6.582 1.00 1.00 C ATOM 848 O MET A 57 84.721 0.492 -6.473 1.00 1.00 O ATOM 849 CB MET A 57 86.262 0.762 -4.110 1.00 1.00 C ATOM 850 CG MET A 57 87.327 0.723 -3.012 1.00 1.00 C ATOM 851 SD MET A 57 86.606 1.291 -1.452 1.00 1.00 S ATOM 852 CE MET A 57 87.023 3.043 -1.635 1.00 1.00 C ATOM 0 H MET A 57 88.988 0.296 -5.655 1.00 1.00 H new ATOM 0 HA MET A 57 87.002 -0.814 -5.377 1.00 1.00 H new ATOM 0 HB2 MET A 57 85.886 1.778 -4.230 1.00 1.00 H new ATOM 0 HB3 MET A 57 85.413 0.139 -3.830 1.00 1.00 H new ATOM 0 HG2 MET A 57 87.712 -0.291 -2.899 1.00 1.00 H new ATOM 0 HG3 MET A 57 88.171 1.356 -3.287 1.00 1.00 H new ATOM 0 HE1 MET A 57 86.199 3.654 -1.266 1.00 1.00 H new ATOM 0 HE2 MET A 57 87.923 3.265 -1.062 1.00 1.00 H new ATOM 0 HE3 MET A 57 87.198 3.267 -2.687 1.00 1.00 H new ATOM 862 N GLU A 58 86.464 1.039 -7.691 1.00 1.00 N ATOM 863 CA GLU A 58 85.606 1.387 -8.851 1.00 1.00 C ATOM 864 C GLU A 58 85.109 0.103 -9.511 1.00 1.00 C ATOM 865 O GLU A 58 85.683 -0.955 -9.346 1.00 1.00 O ATOM 866 CB GLU A 58 86.411 2.213 -9.864 1.00 1.00 C ATOM 867 CG GLU A 58 87.562 1.370 -10.416 1.00 1.00 C ATOM 868 CD GLU A 58 88.609 1.155 -9.322 1.00 1.00 C ATOM 869 OE1 GLU A 58 89.503 1.978 -9.216 1.00 1.00 O ATOM 870 OE2 GLU A 58 88.499 0.171 -8.609 1.00 1.00 O ATOM 0 H GLU A 58 87.466 1.161 -7.841 1.00 1.00 H new ATOM 0 HA GLU A 58 84.754 1.976 -8.511 1.00 1.00 H new ATOM 0 HB2 GLU A 58 85.764 2.540 -10.678 1.00 1.00 H new ATOM 0 HB3 GLU A 58 86.802 3.112 -9.387 1.00 1.00 H new ATOM 0 HG2 GLU A 58 87.186 0.409 -10.768 1.00 1.00 H new ATOM 0 HG3 GLU A 58 88.014 1.869 -11.273 1.00 1.00 H new ATOM 877 N GLY A 59 84.050 0.193 -10.258 1.00 1.00 N ATOM 878 CA GLY A 59 83.504 -1.018 -10.941 1.00 1.00 C ATOM 879 C GLY A 59 81.980 -1.042 -10.806 1.00 1.00 C ATOM 880 O GLY A 59 81.403 -2.023 -10.382 1.00 1.00 O ATOM 0 H GLY A 59 83.533 1.055 -10.429 1.00 1.00 H new ATOM 0 HA2 GLY A 59 83.786 -1.012 -11.994 1.00 1.00 H new ATOM 0 HA3 GLY A 59 83.932 -1.919 -10.502 1.00 1.00 H new ATOM 884 N CYS A 60 81.321 0.028 -11.163 1.00 1.00 N ATOM 885 CA CYS A 60 79.834 0.054 -11.050 1.00 1.00 C ATOM 886 C CYS A 60 79.247 0.910 -12.175 1.00 1.00 C ATOM 887 O CYS A 60 79.625 0.790 -13.324 1.00 1.00 O ATOM 888 CB CYS A 60 79.432 0.653 -9.701 1.00 1.00 C ATOM 889 SG CYS A 60 80.371 -0.149 -8.378 1.00 1.00 S ATOM 0 H CYS A 60 81.746 0.881 -11.526 1.00 1.00 H new ATOM 0 HA CYS A 60 79.452 -0.964 -11.128 1.00 1.00 H new ATOM 0 HB2 CYS A 60 79.622 1.726 -9.697 1.00 1.00 H new ATOM 0 HB3 CYS A 60 78.363 0.518 -9.536 1.00 1.00 H new ATOM 894 N GLY A 61 78.320 1.771 -11.849 1.00 1.00 N ATOM 895 CA GLY A 61 77.697 2.640 -12.888 1.00 1.00 C ATOM 896 C GLY A 61 76.214 2.825 -12.568 1.00 1.00 C ATOM 897 O GLY A 61 75.453 1.880 -12.558 1.00 1.00 O ATOM 0 H GLY A 61 77.966 1.910 -10.902 1.00 1.00 H new ATOM 0 HA2 GLY A 61 78.198 3.608 -12.918 1.00 1.00 H new ATOM 0 HA3 GLY A 61 77.815 2.190 -13.874 1.00 1.00 H new ATOM 901 N THR A 62 75.804 4.041 -12.303 1.00 1.00 N ATOM 902 CA THR A 62 74.371 4.314 -11.974 1.00 1.00 C ATOM 903 C THR A 62 73.794 3.175 -11.129 1.00 1.00 C ATOM 904 O THR A 62 72.598 2.965 -11.090 1.00 1.00 O ATOM 905 CB THR A 62 73.556 4.478 -13.265 1.00 1.00 C ATOM 906 OG1 THR A 62 72.186 4.660 -12.938 1.00 1.00 O ATOM 907 CG2 THR A 62 73.714 3.228 -14.133 1.00 1.00 C ATOM 0 H THR A 62 76.407 4.864 -12.301 1.00 1.00 H new ATOM 0 HA THR A 62 74.314 5.239 -11.400 1.00 1.00 H new ATOM 0 HB THR A 62 73.917 5.347 -13.815 1.00 1.00 H new ATOM 0 HG1 THR A 62 71.913 3.983 -12.285 1.00 1.00 H new ATOM 0 HG21 THR A 62 73.135 3.346 -15.049 1.00 1.00 H new ATOM 0 HG22 THR A 62 74.766 3.090 -14.384 1.00 1.00 H new ATOM 0 HG23 THR A 62 73.354 2.357 -13.586 1.00 1.00 H new ATOM 915 N ASP A 63 74.633 2.447 -10.441 1.00 1.00 N ATOM 916 CA ASP A 63 74.124 1.337 -9.588 1.00 1.00 C ATOM 917 C ASP A 63 73.319 1.943 -8.439 1.00 1.00 C ATOM 918 O ASP A 63 73.786 2.039 -7.321 1.00 1.00 O ATOM 919 CB ASP A 63 75.302 0.536 -9.026 1.00 1.00 C ATOM 920 CG ASP A 63 75.803 -0.448 -10.085 1.00 1.00 C ATOM 921 OD1 ASP A 63 75.894 -0.053 -11.236 1.00 1.00 O ATOM 922 OD2 ASP A 63 76.086 -1.579 -9.727 1.00 1.00 O ATOM 0 H ASP A 63 75.645 2.573 -10.433 1.00 1.00 H new ATOM 0 HA ASP A 63 73.494 0.670 -10.177 1.00 1.00 H new ATOM 0 HB2 ASP A 63 76.106 1.210 -8.732 1.00 1.00 H new ATOM 0 HB3 ASP A 63 74.994 -0.003 -8.130 1.00 1.00 H new ATOM 927 N ILE A 64 72.116 2.362 -8.713 1.00 1.00 N ATOM 928 CA ILE A 64 71.275 2.980 -7.652 1.00 1.00 C ATOM 929 C ILE A 64 69.883 3.231 -8.219 1.00 1.00 C ATOM 930 O ILE A 64 68.950 3.563 -7.514 1.00 1.00 O ATOM 931 CB ILE A 64 71.912 4.301 -7.216 1.00 1.00 C ATOM 932 CG1 ILE A 64 71.177 4.839 -5.986 1.00 1.00 C ATOM 933 CG2 ILE A 64 71.810 5.318 -8.354 1.00 1.00 C ATOM 934 CD1 ILE A 64 71.955 6.019 -5.402 1.00 1.00 C ATOM 0 H ILE A 64 71.677 2.302 -9.632 1.00 1.00 H new ATOM 0 HA ILE A 64 71.202 2.319 -6.789 1.00 1.00 H new ATOM 0 HB ILE A 64 72.961 4.134 -6.971 1.00 1.00 H new ATOM 0 HG12 ILE A 64 70.170 5.154 -6.260 1.00 1.00 H new ATOM 0 HG13 ILE A 64 71.073 4.053 -5.238 1.00 1.00 H new ATOM 0 HG21 ILE A 64 72.264 6.259 -8.043 1.00 1.00 H new ATOM 0 HG22 ILE A 64 72.332 4.936 -9.231 1.00 1.00 H new ATOM 0 HG23 ILE A 64 70.761 5.485 -8.600 1.00 1.00 H new ATOM 0 HD11 ILE A 64 71.432 6.402 -4.526 1.00 1.00 H new ATOM 0 HD12 ILE A 64 72.953 5.690 -5.113 1.00 1.00 H new ATOM 0 HD13 ILE A 64 72.036 6.808 -6.150 1.00 1.00 H new ATOM 946 N THR A 65 69.749 3.056 -9.497 1.00 1.00 N ATOM 947 CA THR A 65 68.438 3.257 -10.168 1.00 1.00 C ATOM 948 C THR A 65 68.336 2.223 -11.283 1.00 1.00 C ATOM 949 O THR A 65 67.281 1.697 -11.576 1.00 1.00 O ATOM 950 CB THR A 65 68.372 4.669 -10.757 1.00 1.00 C ATOM 951 OG1 THR A 65 68.309 5.617 -9.702 1.00 1.00 O ATOM 952 CG2 THR A 65 67.129 4.799 -11.638 1.00 1.00 C ATOM 0 H THR A 65 70.507 2.776 -10.120 1.00 1.00 H new ATOM 0 HA THR A 65 67.617 3.142 -9.461 1.00 1.00 H new ATOM 0 HB THR A 65 69.261 4.854 -11.359 1.00 1.00 H new ATOM 0 HG1 THR A 65 68.268 6.522 -10.077 1.00 1.00 H new ATOM 0 HG21 THR A 65 67.083 5.804 -12.057 1.00 1.00 H new ATOM 0 HG22 THR A 65 67.179 4.071 -12.448 1.00 1.00 H new ATOM 0 HG23 THR A 65 66.237 4.615 -11.039 1.00 1.00 H new ATOM 960 N VAL A 66 69.451 1.911 -11.885 1.00 1.00 N ATOM 961 CA VAL A 66 69.468 0.890 -12.963 1.00 1.00 C ATOM 962 C VAL A 66 69.868 -0.447 -12.343 1.00 1.00 C ATOM 963 O VAL A 66 69.291 -1.475 -12.635 1.00 1.00 O ATOM 964 CB VAL A 66 70.488 1.286 -14.030 1.00 1.00 C ATOM 965 CG1 VAL A 66 70.434 0.285 -15.186 1.00 1.00 C ATOM 966 CG2 VAL A 66 70.159 2.686 -14.554 1.00 1.00 C ATOM 0 H VAL A 66 70.358 2.326 -11.672 1.00 1.00 H new ATOM 0 HA VAL A 66 68.485 0.814 -13.428 1.00 1.00 H new ATOM 0 HB VAL A 66 71.487 1.285 -13.595 1.00 1.00 H new ATOM 0 HG11 VAL A 66 71.162 0.568 -15.947 1.00 1.00 H new ATOM 0 HG12 VAL A 66 70.667 -0.713 -14.814 1.00 1.00 H new ATOM 0 HG13 VAL A 66 69.435 0.286 -15.622 1.00 1.00 H new ATOM 0 HG21 VAL A 66 70.886 2.970 -15.315 1.00 1.00 H new ATOM 0 HG22 VAL A 66 69.159 2.686 -14.989 1.00 1.00 H new ATOM 0 HG23 VAL A 66 70.197 3.401 -13.732 1.00 1.00 H new ATOM 976 N ILE A 67 70.843 -0.436 -11.466 1.00 1.00 N ATOM 977 CA ILE A 67 71.267 -1.704 -10.805 1.00 1.00 C ATOM 978 C ILE A 67 71.435 -1.454 -9.314 1.00 1.00 C ATOM 979 O ILE A 67 72.489 -1.065 -8.855 1.00 1.00 O ATOM 980 CB ILE A 67 72.602 -2.197 -11.368 1.00 1.00 C ATOM 981 CG1 ILE A 67 72.405 -2.660 -12.813 1.00 1.00 C ATOM 982 CG2 ILE A 67 73.112 -3.367 -10.524 1.00 1.00 C ATOM 983 CD1 ILE A 67 71.911 -4.108 -12.823 1.00 1.00 C ATOM 0 H ILE A 67 71.361 0.396 -11.182 1.00 1.00 H new ATOM 0 HA ILE A 67 70.504 -2.460 -10.990 1.00 1.00 H new ATOM 0 HB ILE A 67 73.329 -1.386 -11.341 1.00 1.00 H new ATOM 0 HG12 ILE A 67 71.685 -2.016 -13.317 1.00 1.00 H new ATOM 0 HG13 ILE A 67 73.343 -2.581 -13.362 1.00 1.00 H new ATOM 0 HG21 ILE A 67 74.063 -3.718 -10.925 1.00 1.00 H new ATOM 0 HG22 ILE A 67 73.252 -3.039 -9.494 1.00 1.00 H new ATOM 0 HG23 ILE A 67 72.385 -4.179 -10.551 1.00 1.00 H new ATOM 0 HD11 ILE A 67 71.771 -4.437 -13.852 1.00 1.00 H new ATOM 0 HD12 ILE A 67 72.647 -4.747 -12.335 1.00 1.00 H new ATOM 0 HD13 ILE A 67 70.963 -4.173 -12.289 1.00 1.00 H new ATOM 995 N CYS A 68 70.413 -1.692 -8.554 1.00 1.00 N ATOM 996 CA CYS A 68 70.517 -1.492 -7.085 1.00 1.00 C ATOM 997 C CYS A 68 70.972 -2.810 -6.444 1.00 1.00 C ATOM 998 O CYS A 68 70.255 -3.790 -6.468 1.00 1.00 O ATOM 999 CB CYS A 68 69.146 -1.091 -6.534 1.00 1.00 C ATOM 1000 SG CYS A 68 69.022 0.714 -6.474 1.00 1.00 S ATOM 0 H CYS A 68 69.505 -2.018 -8.885 1.00 1.00 H new ATOM 0 HA CYS A 68 71.236 -0.705 -6.858 1.00 1.00 H new ATOM 0 HB2 CYS A 68 68.356 -1.499 -7.164 1.00 1.00 H new ATOM 0 HB3 CYS A 68 69.007 -1.509 -5.537 1.00 1.00 H new ATOM 1005 N PRO A 69 72.167 -2.855 -5.897 1.00 1.00 N ATOM 1006 CA PRO A 69 72.720 -4.095 -5.270 1.00 1.00 C ATOM 1007 C PRO A 69 71.705 -4.829 -4.387 1.00 1.00 C ATOM 1008 O PRO A 69 72.009 -5.850 -3.802 1.00 1.00 O ATOM 1009 CB PRO A 69 73.890 -3.582 -4.434 1.00 1.00 C ATOM 1010 CG PRO A 69 74.354 -2.350 -5.140 1.00 1.00 C ATOM 1011 CD PRO A 69 73.122 -1.737 -5.815 1.00 1.00 C ATOM 0 HA PRO A 69 73.004 -4.829 -6.024 1.00 1.00 H new ATOM 0 HB2 PRO A 69 73.579 -3.359 -3.413 1.00 1.00 H new ATOM 0 HB3 PRO A 69 74.686 -4.324 -4.370 1.00 1.00 H new ATOM 0 HG2 PRO A 69 74.800 -1.646 -4.437 1.00 1.00 H new ATOM 0 HG3 PRO A 69 75.119 -2.592 -5.878 1.00 1.00 H new ATOM 0 HD2 PRO A 69 72.718 -0.909 -5.232 1.00 1.00 H new ATOM 0 HD3 PRO A 69 73.362 -1.344 -6.803 1.00 1.00 H new ATOM 1019 N TRP A 70 70.505 -4.330 -4.287 1.00 1.00 N ATOM 1020 CA TRP A 70 69.490 -5.018 -3.448 1.00 1.00 C ATOM 1021 C TRP A 70 69.031 -6.291 -4.162 1.00 1.00 C ATOM 1022 O TRP A 70 68.282 -7.080 -3.622 1.00 1.00 O ATOM 1023 CB TRP A 70 68.292 -4.086 -3.224 1.00 1.00 C ATOM 1024 CG TRP A 70 67.540 -4.521 -2.008 1.00 1.00 C ATOM 1025 CD1 TRP A 70 68.085 -4.717 -0.785 1.00 1.00 C ATOM 1026 CD2 TRP A 70 66.119 -4.819 -1.874 1.00 1.00 C ATOM 1027 NE1 TRP A 70 67.091 -5.114 0.090 1.00 1.00 N ATOM 1028 CE2 TRP A 70 65.862 -5.192 -0.532 1.00 1.00 C ATOM 1029 CE3 TRP A 70 65.040 -4.801 -2.775 1.00 1.00 C ATOM 1030 CZ2 TRP A 70 64.577 -5.536 -0.102 1.00 1.00 C ATOM 1031 CZ3 TRP A 70 63.750 -5.145 -2.347 1.00 1.00 C ATOM 1032 CH2 TRP A 70 63.518 -5.512 -1.015 1.00 1.00 C ATOM 0 H TRP A 70 70.186 -3.478 -4.749 1.00 1.00 H new ATOM 0 HA TRP A 70 69.924 -5.278 -2.482 1.00 1.00 H new ATOM 0 HB2 TRP A 70 68.635 -3.058 -3.104 1.00 1.00 H new ATOM 0 HB3 TRP A 70 67.637 -4.103 -4.095 1.00 1.00 H new ATOM 0 HD1 TRP A 70 69.127 -4.585 -0.533 1.00 1.00 H new ATOM 0 HE1 TRP A 70 67.247 -5.324 1.076 1.00 1.00 H new ATOM 0 HE3 TRP A 70 65.206 -4.520 -3.805 1.00 1.00 H new ATOM 0 HZ2 TRP A 70 64.404 -5.818 0.926 1.00 1.00 H new ATOM 0 HZ3 TRP A 70 62.929 -5.127 -3.049 1.00 1.00 H new ATOM 0 HH2 TRP A 70 62.521 -5.776 -0.693 1.00 1.00 H new ATOM 1043 N GLU A 71 69.478 -6.503 -5.375 1.00 1.00 N ATOM 1044 CA GLU A 71 69.065 -7.732 -6.112 1.00 1.00 C ATOM 1045 C GLU A 71 70.185 -8.153 -7.066 1.00 1.00 C ATOM 1046 O GLU A 71 70.137 -9.206 -7.671 1.00 1.00 O ATOM 1047 CB GLU A 71 67.790 -7.448 -6.910 1.00 1.00 C ATOM 1048 CG GLU A 71 66.640 -7.148 -5.946 1.00 1.00 C ATOM 1049 CD GLU A 71 65.317 -7.144 -6.714 1.00 1.00 C ATOM 1050 OE1 GLU A 71 65.308 -6.669 -7.838 1.00 1.00 O ATOM 1051 OE2 GLU A 71 64.336 -7.617 -6.165 1.00 1.00 O ATOM 0 H GLU A 71 70.107 -5.881 -5.882 1.00 1.00 H new ATOM 0 HA GLU A 71 68.873 -8.535 -5.401 1.00 1.00 H new ATOM 0 HB2 GLU A 71 67.948 -6.602 -7.579 1.00 1.00 H new ATOM 0 HB3 GLU A 71 67.541 -8.306 -7.535 1.00 1.00 H new ATOM 0 HG2 GLU A 71 66.611 -7.897 -5.154 1.00 1.00 H new ATOM 0 HG3 GLU A 71 66.797 -6.182 -5.466 1.00 1.00 H new ATOM 1058 N ALA A 72 71.196 -7.339 -7.204 1.00 1.00 N ATOM 1059 CA ALA A 72 72.319 -7.690 -8.118 1.00 1.00 C ATOM 1060 C ALA A 72 73.229 -8.725 -7.447 1.00 1.00 C ATOM 1061 O ALA A 72 73.207 -9.893 -7.783 1.00 1.00 O ATOM 1062 CB ALA A 72 73.124 -6.427 -8.447 1.00 1.00 C ATOM 0 H ALA A 72 71.292 -6.445 -6.722 1.00 1.00 H new ATOM 0 HA ALA A 72 71.917 -8.113 -9.039 1.00 1.00 H new ATOM 0 HB1 ALA A 72 73.946 -6.683 -9.116 1.00 1.00 H new ATOM 0 HB2 ALA A 72 72.475 -5.698 -8.932 1.00 1.00 H new ATOM 0 HB3 ALA A 72 73.524 -6.001 -7.527 1.00 1.00 H new ATOM 1068 N CYS A 73 74.032 -8.309 -6.505 1.00 1.00 N ATOM 1069 CA CYS A 73 74.941 -9.272 -5.823 1.00 1.00 C ATOM 1070 C CYS A 73 74.115 -10.394 -5.189 1.00 1.00 C ATOM 1071 O CYS A 73 74.035 -11.488 -5.711 1.00 1.00 O ATOM 1072 CB CYS A 73 75.736 -8.547 -4.735 1.00 1.00 C ATOM 1073 SG CYS A 73 77.022 -9.648 -4.095 1.00 1.00 S ATOM 0 H CYS A 73 74.097 -7.345 -6.179 1.00 1.00 H new ATOM 0 HA CYS A 73 75.631 -9.696 -6.553 1.00 1.00 H new ATOM 0 HB2 CYS A 73 76.186 -7.641 -5.141 1.00 1.00 H new ATOM 0 HB3 CYS A 73 75.071 -8.239 -3.928 1.00 1.00 H new ATOM 1078 N ASN A 74 73.499 -10.130 -4.067 1.00 1.00 N ATOM 1079 CA ASN A 74 72.674 -11.178 -3.396 1.00 1.00 C ATOM 1080 C ASN A 74 71.375 -10.550 -2.893 1.00 1.00 C ATOM 1081 O ASN A 74 71.376 -9.734 -1.995 1.00 1.00 O ATOM 1082 CB ASN A 74 73.450 -11.758 -2.212 1.00 1.00 C ATOM 1083 CG ASN A 74 72.756 -13.029 -1.719 1.00 1.00 C ATOM 1084 OD1 ASN A 74 71.660 -13.428 -2.305 1.00 1.00 O flip ATOM 1085 ND2 ASN A 74 73.215 -13.665 -0.791 1.00 1.00 N flip ATOM 0 H ASN A 74 73.532 -9.232 -3.585 1.00 1.00 H new ATOM 0 HA ASN A 74 72.447 -11.974 -4.105 1.00 1.00 H new ATOM 0 HB2 ASN A 74 74.474 -11.983 -2.510 1.00 1.00 H new ATOM 0 HB3 ASN A 74 73.506 -11.026 -1.406 1.00 1.00 H new ATOM 0 HD21 ASN A 74 74.071 -13.353 -0.333 1.00 1.00 H new ATOM 0 HD22 ASN A 74 72.744 -14.511 -0.470 1.00 1.00 H new ATOM 1092 N HIS A 75 70.266 -10.919 -3.468 1.00 1.00 N ATOM 1093 CA HIS A 75 68.968 -10.337 -3.027 1.00 1.00 C ATOM 1094 C HIS A 75 68.748 -10.626 -1.540 1.00 1.00 C ATOM 1095 O HIS A 75 68.022 -11.530 -1.178 1.00 1.00 O ATOM 1096 CB HIS A 75 67.833 -10.963 -3.841 1.00 1.00 C ATOM 1097 CG HIS A 75 68.044 -12.449 -3.936 1.00 1.00 C ATOM 1098 ND1 HIS A 75 67.605 -13.322 -2.952 1.00 1.00 N ATOM 1099 CD2 HIS A 75 68.645 -13.232 -4.892 1.00 1.00 C ATOM 1100 CE1 HIS A 75 67.944 -14.567 -3.332 1.00 1.00 C ATOM 1101 NE2 HIS A 75 68.579 -14.567 -4.506 1.00 1.00 N ATOM 0 H HIS A 75 70.202 -11.599 -4.225 1.00 1.00 H new ATOM 0 HA HIS A 75 68.983 -9.258 -3.184 1.00 1.00 H new ATOM 0 HB2 HIS A 75 66.873 -10.751 -3.370 1.00 1.00 H new ATOM 0 HB3 HIS A 75 67.802 -10.525 -4.839 1.00 1.00 H new ATOM 0 HD1 HIS A 75 67.114 -13.066 -2.095 1.00 1.00 H new ATOM 0 HD2 HIS A 75 69.098 -12.868 -5.802 1.00 1.00 H new ATOM 0 HE1 HIS A 75 67.729 -15.456 -2.758 1.00 1.00 H new ATOM 1110 N CYS A 76 69.359 -9.864 -0.670 1.00 1.00 N ATOM 1111 CA CYS A 76 69.166 -10.105 0.788 1.00 1.00 C ATOM 1112 C CYS A 76 67.985 -9.266 1.290 1.00 1.00 C ATOM 1113 O CYS A 76 68.152 -8.251 1.933 1.00 1.00 O ATOM 1114 CB CYS A 76 70.443 -9.725 1.547 1.00 1.00 C ATOM 1115 SG CYS A 76 70.555 -7.924 1.683 1.00 1.00 S ATOM 0 H CYS A 76 69.980 -9.090 -0.906 1.00 1.00 H new ATOM 0 HA CYS A 76 68.954 -11.160 0.960 1.00 1.00 H new ATOM 0 HB2 CYS A 76 70.436 -10.175 2.540 1.00 1.00 H new ATOM 0 HB3 CYS A 76 71.317 -10.116 1.026 1.00 1.00 H new ATOM 1120 N GLU A 77 66.785 -9.681 0.993 1.00 1.00 N ATOM 1121 CA GLU A 77 65.590 -8.911 1.443 1.00 1.00 C ATOM 1122 C GLU A 77 65.576 -8.813 2.975 1.00 1.00 C ATOM 1123 O GLU A 77 64.846 -9.515 3.646 1.00 1.00 O ATOM 1124 CB GLU A 77 64.319 -9.622 0.958 1.00 1.00 C ATOM 1125 CG GLU A 77 63.874 -9.019 -0.376 1.00 1.00 C ATOM 1126 CD GLU A 77 62.695 -9.819 -0.931 1.00 1.00 C ATOM 1127 OE1 GLU A 77 62.608 -10.997 -0.626 1.00 1.00 O ATOM 1128 OE2 GLU A 77 61.898 -9.241 -1.651 1.00 1.00 O ATOM 0 H GLU A 77 66.579 -10.523 0.456 1.00 1.00 H new ATOM 0 HA GLU A 77 65.629 -7.905 1.025 1.00 1.00 H new ATOM 0 HB2 GLU A 77 64.508 -10.689 0.842 1.00 1.00 H new ATOM 0 HB3 GLU A 77 63.526 -9.518 1.699 1.00 1.00 H new ATOM 0 HG2 GLU A 77 63.587 -7.977 -0.238 1.00 1.00 H new ATOM 0 HG3 GLU A 77 64.701 -9.030 -1.086 1.00 1.00 H new ATOM 1135 N LEU A 78 66.367 -7.934 3.528 1.00 1.00 N ATOM 1136 CA LEU A 78 66.393 -7.770 5.011 1.00 1.00 C ATOM 1137 C LEU A 78 67.042 -6.426 5.348 1.00 1.00 C ATOM 1138 O LEU A 78 67.192 -5.574 4.494 1.00 1.00 O ATOM 1139 CB LEU A 78 67.191 -8.912 5.657 1.00 1.00 C ATOM 1140 CG LEU A 78 68.390 -9.265 4.776 1.00 1.00 C ATOM 1141 CD1 LEU A 78 69.309 -8.048 4.650 1.00 1.00 C ATOM 1142 CD2 LEU A 78 69.164 -10.423 5.410 1.00 1.00 C ATOM 0 H LEU A 78 66.999 -7.320 3.015 1.00 1.00 H new ATOM 0 HA LEU A 78 65.375 -7.797 5.399 1.00 1.00 H new ATOM 0 HB2 LEU A 78 67.531 -8.615 6.649 1.00 1.00 H new ATOM 0 HB3 LEU A 78 66.553 -9.786 5.787 1.00 1.00 H new ATOM 0 HG LEU A 78 68.039 -9.559 3.787 1.00 1.00 H new ATOM 0 HD11 LEU A 78 70.163 -8.301 4.022 1.00 1.00 H new ATOM 0 HD12 LEU A 78 68.759 -7.222 4.199 1.00 1.00 H new ATOM 0 HD13 LEU A 78 69.660 -7.753 5.639 1.00 1.00 H new ATOM 0 HD21 LEU A 78 70.019 -10.676 4.783 1.00 1.00 H new ATOM 0 HD22 LEU A 78 69.514 -10.128 6.399 1.00 1.00 H new ATOM 0 HD23 LEU A 78 68.511 -11.291 5.500 1.00 1.00 H new ATOM 1154 N HIS A 79 67.427 -6.220 6.576 1.00 1.00 N ATOM 1155 CA HIS A 79 68.060 -4.921 6.936 1.00 1.00 C ATOM 1156 C HIS A 79 68.750 -5.033 8.298 1.00 1.00 C ATOM 1157 O HIS A 79 69.158 -4.046 8.877 1.00 1.00 O ATOM 1158 CB HIS A 79 66.983 -3.833 6.995 1.00 1.00 C ATOM 1159 CG HIS A 79 67.619 -2.486 6.785 1.00 1.00 C ATOM 1160 ND1 HIS A 79 68.498 -2.238 5.741 1.00 1.00 N ATOM 1161 CD2 HIS A 79 67.513 -1.304 7.477 1.00 1.00 C ATOM 1162 CE1 HIS A 79 68.884 -0.953 5.832 1.00 1.00 C ATOM 1163 NE2 HIS A 79 68.314 -0.340 6.871 1.00 1.00 N ATOM 0 H HIS A 79 67.332 -6.889 7.340 1.00 1.00 H new ATOM 0 HA HIS A 79 68.804 -4.663 6.182 1.00 1.00 H new ATOM 0 HB2 HIS A 79 66.227 -4.013 6.231 1.00 1.00 H new ATOM 0 HB3 HIS A 79 66.475 -3.861 7.959 1.00 1.00 H new ATOM 0 HD2 HIS A 79 66.903 -1.147 8.354 1.00 1.00 H new ATOM 0 HE1 HIS A 79 69.571 -0.476 5.148 1.00 1.00 H new ATOM 0 HE2 HIS A 79 68.439 0.630 7.160 1.00 1.00 H new ATOM 1172 N GLU A 80 68.886 -6.224 8.816 1.00 1.00 N ATOM 1173 CA GLU A 80 69.554 -6.390 10.141 1.00 1.00 C ATOM 1174 C GLU A 80 70.413 -7.657 10.126 1.00 1.00 C ATOM 1175 O GLU A 80 71.227 -7.875 11.001 1.00 1.00 O ATOM 1176 CB GLU A 80 68.495 -6.501 11.243 1.00 1.00 C ATOM 1177 CG GLU A 80 67.829 -5.140 11.453 1.00 1.00 C ATOM 1178 CD GLU A 80 68.859 -4.145 11.991 1.00 1.00 C ATOM 1179 OE1 GLU A 80 69.606 -4.518 12.880 1.00 1.00 O ATOM 1180 OE2 GLU A 80 68.882 -3.026 11.506 1.00 1.00 O ATOM 0 H GLU A 80 68.564 -7.088 8.381 1.00 1.00 H new ATOM 0 HA GLU A 80 70.187 -5.525 10.336 1.00 1.00 H new ATOM 0 HB2 GLU A 80 67.747 -7.245 10.969 1.00 1.00 H new ATOM 0 HB3 GLU A 80 68.956 -6.839 12.171 1.00 1.00 H new ATOM 0 HG2 GLU A 80 67.414 -4.777 10.513 1.00 1.00 H new ATOM 0 HG3 GLU A 80 66.998 -5.234 12.153 1.00 1.00 H new ATOM 1187 N LEU A 81 70.249 -8.487 9.130 1.00 1.00 N ATOM 1188 CA LEU A 81 71.066 -9.733 9.049 1.00 1.00 C ATOM 1189 C LEU A 81 72.212 -9.493 8.064 1.00 1.00 C ATOM 1190 O LEU A 81 72.800 -10.417 7.536 1.00 1.00 O ATOM 1191 CB LEU A 81 70.183 -10.897 8.559 1.00 1.00 C ATOM 1192 CG LEU A 81 69.952 -11.884 9.705 1.00 1.00 C ATOM 1193 CD1 LEU A 81 71.287 -12.502 10.124 1.00 1.00 C ATOM 1194 CD2 LEU A 81 69.338 -11.145 10.896 1.00 1.00 C ATOM 0 H LEU A 81 69.584 -8.356 8.368 1.00 1.00 H new ATOM 0 HA LEU A 81 71.467 -9.989 10.030 1.00 1.00 H new ATOM 0 HB2 LEU A 81 69.229 -10.515 8.197 1.00 1.00 H new ATOM 0 HB3 LEU A 81 70.663 -11.403 7.721 1.00 1.00 H new ATOM 0 HG LEU A 81 69.275 -12.672 9.375 1.00 1.00 H new ATOM 0 HD11 LEU A 81 71.122 -13.205 10.940 1.00 1.00 H new ATOM 0 HD12 LEU A 81 71.727 -13.027 9.276 1.00 1.00 H new ATOM 0 HD13 LEU A 81 71.965 -11.715 10.454 1.00 1.00 H new ATOM 0 HD21 LEU A 81 69.173 -11.847 11.714 1.00 1.00 H new ATOM 0 HD22 LEU A 81 70.017 -10.358 11.225 1.00 1.00 H new ATOM 0 HD23 LEU A 81 68.387 -10.703 10.599 1.00 1.00 H new ATOM 1206 N ALA A 82 72.528 -8.252 7.817 1.00 1.00 N ATOM 1207 CA ALA A 82 73.631 -7.933 6.868 1.00 1.00 C ATOM 1208 C ALA A 82 74.873 -8.748 7.234 1.00 1.00 C ATOM 1209 O ALA A 82 75.698 -8.319 8.016 1.00 1.00 O ATOM 1210 CB ALA A 82 73.956 -6.440 6.954 1.00 1.00 C ATOM 0 H ALA A 82 72.068 -7.442 8.233 1.00 1.00 H new ATOM 0 HA ALA A 82 73.322 -8.182 5.853 1.00 1.00 H new ATOM 0 HB1 ALA A 82 74.763 -6.203 6.261 1.00 1.00 H new ATOM 0 HB2 ALA A 82 73.071 -5.859 6.693 1.00 1.00 H new ATOM 0 HB3 ALA A 82 74.266 -6.193 7.969 1.00 1.00 H new ATOM 1216 N GLN A 83 75.013 -9.919 6.673 1.00 1.00 N ATOM 1217 CA GLN A 83 76.201 -10.759 6.988 1.00 1.00 C ATOM 1218 C GLN A 83 76.306 -10.935 8.506 1.00 1.00 C ATOM 1219 O GLN A 83 75.852 -11.919 9.053 1.00 1.00 O ATOM 1220 CB GLN A 83 77.466 -10.079 6.439 1.00 1.00 C ATOM 1221 CG GLN A 83 78.548 -11.133 6.195 1.00 1.00 C ATOM 1222 CD GLN A 83 79.728 -10.494 5.461 1.00 1.00 C ATOM 1223 OE1 GLN A 83 79.981 -10.799 4.312 1.00 1.00 O ATOM 1224 NE2 GLN A 83 80.465 -9.613 6.079 1.00 1.00 N ATOM 0 H GLN A 83 74.355 -10.329 6.010 1.00 1.00 H new ATOM 0 HA GLN A 83 76.098 -11.740 6.523 1.00 1.00 H new ATOM 0 HB2 GLN A 83 77.237 -9.556 5.510 1.00 1.00 H new ATOM 0 HB3 GLN A 83 77.825 -9.331 7.146 1.00 1.00 H new ATOM 0 HG2 GLN A 83 78.881 -11.554 7.144 1.00 1.00 H new ATOM 0 HG3 GLN A 83 78.143 -11.956 5.606 1.00 1.00 H new ATOM 0 HE21 GLN A 83 80.253 -9.357 7.043 1.00 1.00 H new ATOM 0 HE22 GLN A 83 81.253 -9.180 5.598 1.00 1.00 H new ATOM 1233 N TYR A 84 76.885 -9.989 9.192 1.00 1.00 N ATOM 1234 CA TYR A 84 76.997 -10.110 10.672 1.00 1.00 C ATOM 1235 C TYR A 84 75.796 -9.420 11.318 1.00 1.00 C ATOM 1236 O TYR A 84 75.008 -10.040 12.003 1.00 1.00 O ATOM 1237 CB TYR A 84 78.284 -9.437 11.150 1.00 1.00 C ATOM 1238 CG TYR A 84 79.468 -10.305 10.797 1.00 1.00 C ATOM 1239 CD1 TYR A 84 79.743 -11.453 11.549 1.00 1.00 C ATOM 1240 CD2 TYR A 84 80.291 -9.961 9.718 1.00 1.00 C ATOM 1241 CE1 TYR A 84 80.841 -12.258 11.221 1.00 1.00 C ATOM 1242 CE2 TYR A 84 81.389 -10.765 9.390 1.00 1.00 C ATOM 1243 CZ TYR A 84 81.664 -11.914 10.142 1.00 1.00 C ATOM 1244 OH TYR A 84 82.746 -12.707 9.819 1.00 1.00 O ATOM 0 H TYR A 84 77.284 -9.140 8.793 1.00 1.00 H new ATOM 0 HA TYR A 84 77.018 -11.163 10.952 1.00 1.00 H new ATOM 0 HB2 TYR A 84 78.388 -8.456 10.686 1.00 1.00 H new ATOM 0 HB3 TYR A 84 78.245 -9.278 12.228 1.00 1.00 H new ATOM 0 HD1 TYR A 84 79.109 -11.718 12.382 1.00 1.00 H new ATOM 0 HD2 TYR A 84 80.079 -9.075 9.138 1.00 1.00 H new ATOM 0 HE1 TYR A 84 81.053 -13.144 11.801 1.00 1.00 H new ATOM 0 HE2 TYR A 84 82.024 -10.499 8.558 1.00 1.00 H new ATOM 0 HH TYR A 84 83.211 -12.327 9.044 1.00 1.00 H new ATOM 1254 N GLY A 85 75.644 -8.141 11.098 1.00 1.00 N ATOM 1255 CA GLY A 85 74.487 -7.420 11.696 1.00 1.00 C ATOM 1256 C GLY A 85 74.861 -5.963 11.984 1.00 1.00 C ATOM 1257 O GLY A 85 74.377 -5.369 12.926 1.00 1.00 O ATOM 0 H GLY A 85 76.269 -7.568 10.532 1.00 1.00 H new ATOM 0 HA2 GLY A 85 73.636 -7.457 11.016 1.00 1.00 H new ATOM 0 HA3 GLY A 85 74.180 -7.913 12.618 1.00 1.00 H new ATOM 1261 N ILE A 86 75.715 -5.379 11.185 1.00 1.00 N ATOM 1262 CA ILE A 86 76.111 -3.958 11.422 1.00 1.00 C ATOM 1263 C ILE A 86 75.336 -3.045 10.462 1.00 1.00 C ATOM 1264 O ILE A 86 74.298 -2.512 10.801 1.00 1.00 O ATOM 1265 CB ILE A 86 77.626 -3.811 11.191 1.00 1.00 C ATOM 1266 CG1 ILE A 86 77.971 -2.332 11.004 1.00 1.00 C ATOM 1267 CG2 ILE A 86 78.030 -4.589 9.937 1.00 1.00 C ATOM 1268 CD1 ILE A 86 79.415 -2.084 11.442 1.00 1.00 C ATOM 0 H ILE A 86 76.155 -5.823 10.379 1.00 1.00 H new ATOM 0 HA ILE A 86 75.876 -3.672 12.447 1.00 1.00 H new ATOM 0 HB ILE A 86 78.164 -4.206 12.053 1.00 1.00 H new ATOM 0 HG12 ILE A 86 77.843 -2.047 9.960 1.00 1.00 H new ATOM 0 HG13 ILE A 86 77.291 -1.713 11.589 1.00 1.00 H new ATOM 0 HG21 ILE A 86 79.103 -4.485 9.774 1.00 1.00 H new ATOM 0 HG22 ILE A 86 77.784 -5.643 10.067 1.00 1.00 H new ATOM 0 HG23 ILE A 86 77.492 -4.195 9.075 1.00 1.00 H new ATOM 0 HD11 ILE A 86 79.660 -1.030 11.308 1.00 1.00 H new ATOM 0 HD12 ILE A 86 79.528 -2.352 12.492 1.00 1.00 H new ATOM 0 HD13 ILE A 86 80.088 -2.692 10.838 1.00 1.00 H new ATOM 1280 N CYS A 87 75.833 -2.859 9.270 1.00 1.00 N ATOM 1281 CA CYS A 87 75.128 -1.981 8.295 1.00 1.00 C ATOM 1282 C CYS A 87 73.944 -2.738 7.690 1.00 1.00 C ATOM 1283 CB CYS A 87 76.100 -1.576 7.183 1.00 1.00 C ATOM 1284 SG CYS A 87 75.506 -0.065 6.383 1.00 1.00 S ATOM 0 H CYS A 87 76.698 -3.278 8.929 1.00 1.00 H new ATOM 0 HA CYS A 87 74.764 -1.088 8.804 1.00 1.00 H new ATOM 0 HB2 CYS A 87 77.095 -1.414 7.597 1.00 1.00 H new ATOM 0 HB3 CYS A 87 76.186 -2.378 6.450 1.00 1.00 H new TER 1289 CYS A 87 HETATM 1290 C1C RCY A 110 55.134 -1.302 6.994 1.00 1.00 C HETATM 1291 O1G RCY A 110 59.921 0.469 5.015 1.00 1.00 O HETATM 1292 O1H RCY A 110 55.791 1.389 7.111 1.00 1.00 O HETATM 1293 O1J RCY A 110 55.526 -4.233 6.424 1.00 1.00 O HETATM 1294 C1L RCY A 110 59.028 2.436 6.164 1.00 1.00 C HETATM 1295 C1M RCY A 110 58.265 -1.892 5.112 1.00 1.00 C HETATM 1296 C1P RCY A 110 58.980 1.015 5.588 1.00 1.00 C HETATM 1297 C1Q RCY A 110 56.822 1.496 6.449 1.00 1.00 C HETATM 1298 N1R RCY A 110 57.617 0.362 5.815 1.00 1.00 N HETATM 1299 C1S RCY A 110 57.538 2.791 6.110 1.00 1.00 C HETATM 1300 C1U RCY A 110 57.159 -1.062 5.493 1.00 1.00 C HETATM 1301 C1V RCY A 110 57.460 -1.671 7.932 1.00 1.00 C HETATM 1302 N1V RCY A 110 56.540 -3.210 6.184 1.00 1.00 N HETATM 1303 C1W RCY A 110 57.818 -3.339 5.357 1.00 1.00 C HETATM 1304 C1X RCY A 110 56.558 -1.779 6.701 1.00 1.00 C HETATM 1305 C1Y RCY A 110 58.886 -4.108 6.140 1.00 1.00 C HETATM 1306 C1Z RCY A 110 57.495 -4.051 4.044 1.00 1.00 C HETATM 0 H1ZB RCY A 110 56.691 -3.522 3.532 1.00 1.00 H new HETATM 0 H1ZA RCY A 110 58.382 -4.065 3.410 1.00 1.00 H new HETATM 0 H1YB RCY A 110 59.817 -4.118 5.573 1.00 1.00 H new HETATM 0 H1YA RCY A 110 59.052 -3.623 7.102 1.00 1.00 H new HETATM 0 H1MA RCY A 110 58.526 -1.737 4.065 1.00 1.00 H new HETATM 0 H1LA RCY A 110 59.427 2.462 7.178 1.00 1.00 H new HETATM 0 H1CA RCY A 110 54.500 -1.498 6.130 1.00 1.00 H new HETATM 0 H1Z RCY A 110 57.182 -5.074 4.252 1.00 1.00 H new HETATM 0 H1Y RCY A 110 58.550 -5.132 6.304 1.00 1.00 H new HETATM 0 H1U RCY A 110 56.426 -0.935 4.697 1.00 1.00 H new HETATM 0 H1S RCY A 110 57.253 3.155 5.123 1.00 1.00 H new HETATM 0 H1M RCY A 110 59.151 -1.653 5.700 1.00 1.00 H new HETATM 0 H1L RCY A 110 59.640 3.109 5.564 1.00 1.00 H new HETATM 1309 C1C RCY A 121 73.068 6.516 10.369 1.00 1.00 C HETATM 1310 O1G RCY A 121 69.954 10.544 8.999 1.00 1.00 O HETATM 1311 O1H RCY A 121 72.868 8.034 11.739 1.00 1.00 O HETATM 1312 O1J RCY A 121 70.559 5.113 11.267 1.00 1.00 O HETATM 1313 C1L RCY A 121 70.886 10.912 11.231 1.00 1.00 C HETATM 1314 C1M RCY A 121 70.180 7.456 8.254 1.00 1.00 C HETATM 1315 C1P RCY A 121 70.641 10.133 9.933 1.00 1.00 C HETATM 1316 C1Q RCY A 121 71.942 8.743 11.349 1.00 1.00 C HETATM 1317 N1R RCY A 121 71.356 8.783 9.944 1.00 1.00 N HETATM 1318 C1S RCY A 121 71.170 9.747 12.186 1.00 1.00 C HETATM 1319 C1U RCY A 121 71.463 7.733 8.835 1.00 1.00 C HETATM 1320 C1V RCY A 121 72.316 5.435 8.203 1.00 1.00 C HETATM 1321 N1V RCY A 121 70.667 5.886 10.033 1.00 1.00 N HETATM 1322 C1W RCY A 121 69.532 6.386 9.142 1.00 1.00 C HETATM 1323 C1X RCY A 121 71.936 6.375 9.349 1.00 1.00 C HETATM 1324 C1Y RCY A 121 68.979 5.241 8.288 1.00 1.00 C HETATM 1325 C1Z RCY A 121 68.432 6.983 10.019 1.00 1.00 C HETATM 0 H1ZB RCY A 121 68.857 7.755 10.661 1.00 1.00 H new HETATM 0 H1ZA RCY A 121 67.660 7.422 9.386 1.00 1.00 H new HETATM 0 H1YB RCY A 121 68.229 5.630 7.599 1.00 1.00 H new HETATM 0 H1YA RCY A 121 69.791 4.785 7.721 1.00 1.00 H new HETATM 0 H1VB RCY A 121 73.193 5.826 7.688 1.00 1.00 H new HETATM 0 H1VA RCY A 121 72.541 4.446 8.603 1.00 1.00 H new HETATM 0 H1MA RCY A 121 69.566 8.356 8.218 1.00 1.00 H new HETATM 0 H1LA RCY A 121 71.727 11.601 11.152 1.00 1.00 H new HETATM 0 H1CB RCY A 121 73.916 7.020 9.904 1.00 1.00 H new HETATM 0 H1CA RCY A 121 72.720 7.101 11.220 1.00 1.00 H new HETATM 0 H1Z RCY A 121 67.993 6.199 10.636 1.00 1.00 H new HETATM 0 H1Y RCY A 121 68.523 4.492 8.935 1.00 1.00 H new HETATM 0 H1V RCY A 121 71.485 5.363 7.501 1.00 1.00 H new HETATM 0 H1U RCY A 121 72.170 8.162 8.125 1.00 1.00 H new HETATM 0 H1S RCY A 121 70.246 9.315 12.570 1.00 1.00 H new HETATM 0 H1M RCY A 121 70.285 7.100 7.229 1.00 1.00 H new HETATM 0 H1L RCY A 121 70.020 11.499 11.535 1.00 1.00 H new HETATM 0 H1C RCY A 121 73.376 5.527 10.710 1.00 1.00 H new HETATM 1328 C1C RCY A 130 78.029 10.200 -2.851 1.00 1.00 C HETATM 1329 O1G RCY A 130 79.900 7.565 1.423 1.00 1.00 O HETATM 1330 O1H RCY A 130 78.566 11.717 -0.387 1.00 1.00 O HETATM 1331 O1J RCY A 130 78.554 8.035 -4.877 1.00 1.00 O HETATM 1332 C1L RCY A 130 79.103 9.650 2.425 1.00 1.00 C HETATM 1333 C1M RCY A 130 80.154 7.525 -1.429 1.00 1.00 C HETATM 1334 C1P RCY A 130 79.535 8.730 1.276 1.00 1.00 C HETATM 1335 C1Q RCY A 130 79.070 10.857 0.334 1.00 1.00 C HETATM 1336 N1R RCY A 130 79.457 9.442 -0.074 1.00 1.00 N HETATM 1337 C1S RCY A 130 79.421 11.014 1.802 1.00 1.00 C HETATM 1338 C1U RCY A 130 79.702 8.886 -1.478 1.00 1.00 C HETATM 1339 C1V RCY A 130 77.282 8.145 -1.568 1.00 1.00 C HETATM 1340 N1V RCY A 130 78.906 7.936 -3.464 1.00 1.00 N HETATM 1341 C1W RCY A 130 79.834 6.919 -2.802 1.00 1.00 C HETATM 1342 C1X RCY A 130 78.429 8.822 -2.321 1.00 1.00 C HETATM 1343 C1Y RCY A 130 79.125 5.571 -2.644 1.00 1.00 C HETATM 1344 C1Z RCY A 130 81.097 6.768 -3.650 1.00 1.00 C HETATM 0 H1ZB RCY A 130 81.553 7.746 -3.801 1.00 1.00 H new HETATM 0 H1ZA RCY A 130 81.803 6.114 -3.138 1.00 1.00 H new HETATM 0 H1YA RCY A 130 78.194 5.712 -2.095 1.00 1.00 H new HETATM 0 H1VB RCY A 130 76.988 8.764 -0.720 1.00 1.00 H new HETATM 0 H1VA RCY A 130 76.431 8.019 -2.238 1.00 1.00 H new HETATM 0 H1MA RCY A 130 81.223 7.477 -1.222 1.00 1.00 H new HETATM 0 H1LA RCY A 130 78.047 9.540 2.673 1.00 1.00 H new HETATM 0 H1CB RCY A 130 77.851 10.874 -2.013 1.00 1.00 H new HETATM 0 H1CA RCY A 130 78.831 10.598 -3.473 1.00 1.00 H new HETATM 0 H1Z RCY A 130 80.837 6.336 -4.616 1.00 1.00 H new HETATM 0 H1V RCY A 130 77.609 7.169 -1.209 1.00 1.00 H new HETATM 0 H1U RCY A 130 80.436 9.565 -1.911 1.00 1.00 H new HETATM 0 H1S RCY A 130 80.471 11.274 1.933 1.00 1.00 H new HETATM 0 H1M RCY A 130 79.650 6.976 -0.634 1.00 1.00 H new HETATM 0 H1L RCY A 130 79.666 9.468 3.340 1.00 1.00 H new HETATM 0 H1C RCY A 130 77.119 10.111 -3.445 1.00 1.00 H new HETATM 1347 C1C RCY A 138 80.602 1.237 -4.563 1.00 1.00 C HETATM 1348 O1G RCY A 138 85.420 3.812 -4.439 1.00 1.00 O HETATM 1349 O1H RCY A 138 80.949 3.793 -5.956 1.00 1.00 O HETATM 1350 O1J RCY A 138 80.249 0.405 -1.691 1.00 1.00 O HETATM 1351 C1L RCY A 138 84.264 4.970 -6.259 1.00 1.00 C HETATM 1352 C1M RCY A 138 83.142 2.824 -2.389 1.00 1.00 C HETATM 1353 C1P RCY A 138 84.385 3.999 -5.077 1.00 1.00 C HETATM 1354 C1Q RCY A 138 82.178 3.800 -5.924 1.00 1.00 C HETATM 1355 N1R RCY A 138 83.061 3.293 -4.791 1.00 1.00 N HETATM 1356 C1S RCY A 138 83.099 4.320 -7.013 1.00 1.00 C HETATM 1357 C1U RCY A 138 82.703 2.326 -3.661 1.00 1.00 C HETATM 1358 C1V RCY A 138 80.470 3.495 -3.417 1.00 1.00 C HETATM 1359 N1V RCY A 138 81.158 1.459 -2.131 1.00 1.00 N HETATM 1360 C1W RCY A 138 82.283 2.115 -1.333 1.00 1.00 C HETATM 1361 C1X RCY A 138 81.195 2.150 -3.487 1.00 1.00 C HETATM 1362 C1Y RCY A 138 81.713 3.127 -0.335 1.00 1.00 C HETATM 1363 C1Z RCY A 138 83.079 1.031 -0.607 1.00 1.00 C HETATM 0 H1ZB RCY A 138 83.425 0.290 -1.327 1.00 1.00 H new HETATM 0 H1ZA RCY A 138 83.938 1.482 -0.110 1.00 1.00 H new HETATM 0 H1YB RCY A 138 82.531 3.645 0.165 1.00 1.00 H new HETATM 0 H1MA RCY A 138 84.201 2.616 -2.234 1.00 1.00 H new HETATM 0 H1LA RCY A 138 84.040 5.988 -5.942 1.00 1.00 H new HETATM 0 H1Z RCY A 138 82.443 0.547 0.134 1.00 1.00 H new HETATM 0 H1Y RCY A 138 81.107 2.606 0.406 1.00 1.00 H new HETATM 0 H1U RCY A 138 83.186 1.391 -3.944 1.00 1.00 H new HETATM 0 H1S RCY A 138 83.446 3.512 -7.658 1.00 1.00 H new HETATM 0 H1M RCY A 138 83.018 3.905 -2.330 1.00 1.00 H new HETATM 0 H1L RCY A 138 85.174 5.016 -6.857 1.00 1.00 H new HETATM 1366 C1C RCY A 150 85.308 -3.850 -1.138 1.00 1.00 C HETATM 1367 O1G RCY A 150 83.664 -3.621 -4.337 1.00 1.00 O HETATM 1368 O1H RCY A 150 84.011 -7.952 -2.487 1.00 1.00 O HETATM 1369 O1J RCY A 150 83.939 -1.567 -2.545 1.00 1.00 O HETATM 1370 C1L RCY A 150 84.452 -5.762 -5.222 1.00 1.00 C HETATM 1371 C1M RCY A 150 81.726 -4.585 -1.707 1.00 1.00 C HETATM 1372 C1P RCY A 150 83.904 -4.812 -4.149 1.00 1.00 C HETATM 1373 C1Q RCY A 150 84.247 -6.919 -3.113 1.00 1.00 C HETATM 1374 N1R RCY A 150 83.693 -5.531 -2.817 1.00 1.00 N HETATM 1375 C1S RCY A 150 85.147 -6.794 -4.328 1.00 1.00 C HETATM 1376 C1U RCY A 150 83.085 -5.003 -1.516 1.00 1.00 C HETATM 1377 C1V RCY A 150 83.366 -3.409 0.431 1.00 1.00 C HETATM 1378 N1V RCY A 150 83.238 -2.712 -1.971 1.00 1.00 N HETATM 1379 C1W RCY A 150 81.791 -3.137 -2.211 1.00 1.00 C HETATM 1380 C1X RCY A 150 83.788 -3.748 -1.000 1.00 1.00 C HETATM 1381 C1Y RCY A 150 80.832 -2.247 -1.415 1.00 1.00 C HETATM 1382 C1Z RCY A 150 81.487 -3.055 -3.707 1.00 1.00 C HETATM 0 H1ZB RCY A 150 82.217 -3.647 -4.260 1.00 1.00 H new HETATM 0 H1ZA RCY A 150 80.486 -3.443 -3.897 1.00 1.00 H new HETATM 0 H1VB RCY A 150 83.718 -4.187 1.108 1.00 1.00 H new HETATM 0 H1VA RCY A 150 83.800 -2.452 0.721 1.00 1.00 H new HETATM 0 H1MA RCY A 150 81.219 -5.226 -2.428 1.00 1.00 H new HETATM 0 H1LA RCY A 150 83.663 -6.202 -5.832 1.00 1.00 H new HETATM 0 H1CB RCY A 150 85.669 -4.704 -0.565 1.00 1.00 H new HETATM 0 H1CA RCY A 150 85.570 -3.981 -2.188 1.00 1.00 H new HETATM 0 H1Z RCY A 150 81.541 -2.016 -4.033 1.00 1.00 H new HETATM 0 H1U RCY A 150 83.182 -5.834 -0.817 1.00 1.00 H new HETATM 0 H1S RCY A 150 86.148 -6.465 -4.048 1.00 1.00 H new HETATM 0 H1M RCY A 150 81.165 -4.648 -0.775 1.00 1.00 H new HETATM 0 H1L RCY A 150 85.144 -5.267 -5.904 1.00 1.00 H new HETATM 0 H1C RCY A 150 85.770 -2.938 -0.760 1.00 1.00 H new HETATM 1385 C1C RCY A 160 81.248 3.997 -3.744 1.00 1.00 C HETATM 1386 O1G RCY A 160 78.761 3.890 -5.639 1.00 1.00 O HETATM 1387 O1H RCY A 160 80.519 -0.487 -5.399 1.00 1.00 O HETATM 1388 O1J RCY A 160 78.581 5.389 -3.626 1.00 1.00 O HETATM 1389 C1L RCY A 160 79.267 2.193 -7.328 1.00 1.00 C HETATM 1390 C1M RCY A 160 78.559 1.653 -2.761 1.00 1.00 C HETATM 1391 C1P RCY A 160 79.209 2.777 -5.911 1.00 1.00 C HETATM 1392 C1Q RCY A 160 80.282 0.666 -5.756 1.00 1.00 C HETATM 1393 N1R RCY A 160 79.779 1.805 -4.878 1.00 1.00 N HETATM 1394 C1S RCY A 160 80.437 1.217 -7.162 1.00 1.00 C HETATM 1395 C1U RCY A 160 79.835 1.933 -3.355 1.00 1.00 C HETATM 1396 C1V RCY A 160 80.494 3.400 -1.399 1.00 1.00 C HETATM 1397 N1V RCY A 160 78.816 4.030 -3.148 1.00 1.00 N HETATM 1398 C1W RCY A 160 77.773 2.971 -2.796 1.00 1.00 C HETATM 1399 C1X RCY A 160 80.155 3.353 -2.890 1.00 1.00 C HETATM 1400 C1Y RCY A 160 77.153 3.264 -1.427 1.00 1.00 C HETATM 1401 C1Z RCY A 160 76.698 2.947 -3.882 1.00 1.00 C HETATM 0 H1ZB RCY A 160 77.167 2.797 -4.855 1.00 1.00 H new HETATM 0 H1ZA RCY A 160 76.001 2.133 -3.686 1.00 1.00 H new HETATM 0 H1YB RCY A 160 76.475 2.455 -1.154 1.00 1.00 H new HETATM 0 H1YA RCY A 160 77.942 3.343 -0.680 1.00 1.00 H new HETATM 0 H1VA RCY A 160 80.606 4.437 -1.084 1.00 1.00 H new HETATM 0 H1MA RCY A 160 78.035 0.873 -3.313 1.00 1.00 H new HETATM 0 H1LA RCY A 160 78.342 1.691 -7.611 1.00 1.00 H new HETATM 0 H1Z RCY A 160 76.159 3.894 -3.881 1.00 1.00 H new HETATM 0 H1V RCY A 160 79.692 2.932 -0.829 1.00 1.00 H new HETATM 0 H1S RCY A 160 81.395 1.722 -7.286 1.00 1.00 H new HETATM 0 H1M RCY A 160 78.676 1.296 -1.738 1.00 1.00 H new HETATM 0 H1L RCY A 160 79.462 2.953 -8.085 1.00 1.00 H new HETATM 1404 C1C RCY A 168 75.111 3.786 -4.529 1.00 1.00 C HETATM 1405 O1G RCY A 168 73.537 3.159 -6.675 1.00 1.00 O HETATM 1406 O1H RCY A 168 69.895 1.995 -3.904 1.00 1.00 O HETATM 1407 O1J RCY A 168 75.840 4.125 -1.627 1.00 1.00 O HETATM 1408 C1L RCY A 168 71.406 2.030 -7.095 1.00 1.00 C HETATM 1409 C1M RCY A 168 72.257 2.949 -2.327 1.00 1.00 C HETATM 1410 C1P RCY A 168 72.482 2.706 -6.234 1.00 1.00 C HETATM 1411 C1Q RCY A 168 70.771 1.965 -4.766 1.00 1.00 C HETATM 1412 N1R RCY A 168 72.079 2.747 -4.761 1.00 1.00 N HETATM 1413 C1S RCY A 168 70.748 1.137 -6.038 1.00 1.00 C HETATM 1414 C1U RCY A 168 72.796 3.400 -3.578 1.00 1.00 C HETATM 1415 C1V RCY A 168 74.482 1.511 -3.603 1.00 1.00 C HETATM 1416 N1V RCY A 168 74.602 3.506 -2.093 1.00 1.00 N HETATM 1417 C1W RCY A 168 73.348 3.197 -1.277 1.00 1.00 C HETATM 1418 C1X RCY A 168 74.275 3.024 -3.499 1.00 1.00 C HETATM 1419 C1Y RCY A 168 73.562 1.948 -0.418 1.00 1.00 C HETATM 1420 C1Z RCY A 168 73.012 4.403 -0.401 1.00 1.00 C HETATM 0 H1ZB RCY A 168 72.923 5.292 -1.025 1.00 1.00 H new HETATM 0 H1ZA RCY A 168 72.068 4.226 0.115 1.00 1.00 H new HETATM 0 H1YB RCY A 168 72.633 1.693 0.092 1.00 1.00 H new HETATM 0 H1YA RCY A 168 73.867 1.117 -1.054 1.00 1.00 H new HETATM 0 H1VB RCY A 168 74.191 1.171 -4.597 1.00 1.00 H new HETATM 0 H1VA RCY A 168 75.532 1.275 -3.432 1.00 1.00 H new HETATM 0 H1MA RCY A 168 71.346 3.492 -2.077 1.00 1.00 H new HETATM 0 H1CB RCY A 168 74.752 3.554 -5.532 1.00 1.00 H new HETATM 0 H1CA RCY A 168 75.021 4.857 -4.350 1.00 1.00 H new HETATM 0 H1Z RCY A 168 73.804 4.552 0.333 1.00 1.00 H new HETATM 0 H1Y RCY A 168 74.339 2.143 0.321 1.00 1.00 H new HETATM 0 H1V RCY A 168 73.870 1.008 -2.854 1.00 1.00 H new HETATM 0 H1U RCY A 168 72.662 4.469 -3.741 1.00 1.00 H new HETATM 0 H1S RCY A 168 71.295 0.203 -5.912 1.00 1.00 H new HETATM 0 H1M RCY A 168 71.995 1.892 -2.374 1.00 1.00 H new HETATM 0 H1C RCY A 168 76.156 3.490 -4.440 1.00 1.00 H new HETATM 1423 C1C RCY A 173 76.649 -6.024 1.374 1.00 1.00 C HETATM 1424 O1G RCY A 173 77.893 -7.530 0.505 1.00 1.00 O HETATM 1425 O1H RCY A 173 74.623 -8.404 -2.788 1.00 1.00 O HETATM 1426 O1J RCY A 173 76.005 -3.844 -0.601 1.00 1.00 O HETATM 1427 C1L RCY A 173 77.992 -8.510 -1.735 1.00 1.00 C HETATM 1428 C1M RCY A 173 73.567 -6.803 -0.520 1.00 1.00 C HETATM 1429 C1P RCY A 173 77.302 -7.902 -0.507 1.00 1.00 C HETATM 1430 C1Q RCY A 173 75.597 -8.505 -2.043 1.00 1.00 C HETATM 1431 N1R RCY A 173 75.788 -7.818 -0.697 1.00 1.00 N HETATM 1432 C1S RCY A 173 76.837 -9.343 -2.300 1.00 1.00 C HETATM 1433 C1U RCY A 173 74.729 -7.204 0.220 1.00 1.00 C HETATM 1434 C1V RCY A 173 74.257 -5.481 2.015 1.00 1.00 C HETATM 1435 N1V RCY A 173 75.106 -4.949 -0.281 1.00 1.00 N HETATM 1436 C1W RCY A 173 73.862 -5.393 -1.047 1.00 1.00 C HETATM 1437 C1X RCY A 173 75.201 -5.915 0.892 1.00 1.00 C HETATM 1438 C1Y RCY A 173 72.689 -4.452 -0.754 1.00 1.00 C HETATM 1439 C1Z RCY A 173 74.176 -5.413 -2.543 1.00 1.00 C HETATM 0 H1ZB RCY A 173 75.049 -6.040 -2.723 1.00 1.00 H new HETATM 0 H1ZA RCY A 173 73.322 -5.815 -3.089 1.00 1.00 H new HETATM 0 H1YB RCY A 173 71.789 -4.830 -1.240 1.00 1.00 H new HETATM 0 H1YA RCY A 173 72.525 -4.399 0.322 1.00 1.00 H new HETATM 0 H1VB RCY A 173 74.293 -6.211 2.823 1.00 1.00 H new HETATM 0 H1VA RCY A 173 74.565 -4.506 2.393 1.00 1.00 H new HETATM 0 H1MA RCY A 173 73.371 -7.493 -1.341 1.00 1.00 H new HETATM 0 H1LA RCY A 173 78.341 -7.752 -2.436 1.00 1.00 H new HETATM 0 H1CB RCY A 173 76.732 -6.837 2.096 1.00 1.00 H new HETATM 0 H1CA RCY A 173 77.301 -6.226 0.524 1.00 1.00 H new HETATM 0 H1Z RCY A 173 74.380 -4.399 -2.885 1.00 1.00 H new HETATM 0 H1Y RCY A 173 72.917 -3.457 -1.135 1.00 1.00 H new HETATM 0 H1V RCY A 173 73.239 -5.416 1.630 1.00 1.00 H new HETATM 0 H1U RCY A 173 74.522 -7.985 0.951 1.00 1.00 H new HETATM 0 H1S RCY A 173 76.769 -10.313 -1.806 1.00 1.00 H new HETATM 0 H1M RCY A 173 72.681 -6.804 0.115 1.00 1.00 H new HETATM 0 H1L RCY A 173 78.855 -9.120 -1.469 1.00 1.00 H new HETATM 0 H1C RCY A 173 76.947 -5.088 1.846 1.00 1.00 H new HETATM 1442 C1C RCY A 176 72.500 -4.122 5.831 1.00 1.00 C HETATM 1443 O1G RCY A 176 74.963 -8.425 4.275 1.00 1.00 O HETATM 1444 O1H RCY A 176 71.736 -5.358 2.700 1.00 1.00 O HETATM 1445 O1J RCY A 176 74.536 -1.912 6.029 1.00 1.00 O HETATM 1446 C1L RCY A 176 72.975 -8.660 2.868 1.00 1.00 C HETATM 1447 C1M RCY A 176 75.519 -4.902 3.838 1.00 1.00 C HETATM 1448 C1P RCY A 176 73.980 -7.906 3.749 1.00 1.00 C HETATM 1449 C1Q RCY A 176 72.276 -6.366 3.152 1.00 1.00 C HETATM 1450 N1R RCY A 176 73.607 -6.432 3.891 1.00 1.00 N HETATM 1451 C1S RCY A 176 71.736 -7.783 3.074 1.00 1.00 C HETATM 1452 C1U RCY A 176 74.366 -5.303 4.592 1.00 1.00 C HETATM 1453 C1V RCY A 176 72.911 -3.621 3.380 1.00 1.00 C HETATM 1454 N1V RCY A 176 74.635 -3.034 5.100 1.00 1.00 N HETATM 1455 C1W RCY A 176 75.856 -3.479 4.299 1.00 1.00 C HETATM 1456 C1X RCY A 176 73.542 -4.022 4.716 1.00 1.00 C HETATM 1457 C1Y RCY A 176 76.069 -2.559 3.093 1.00 1.00 C HETATM 1458 C1Z RCY A 176 77.084 -3.466 5.209 1.00 1.00 C HETATM 0 H1ZB RCY A 176 76.891 -4.079 6.090 1.00 1.00 H new HETATM 0 H1ZA RCY A 176 77.941 -3.867 4.669 1.00 1.00 H new HETATM 0 H1YB RCY A 176 76.892 -2.938 2.487 1.00 1.00 H new HETATM 0 H1YA RCY A 176 75.160 -2.530 2.493 1.00 1.00 H new HETATM 0 H1VB RCY A 176 72.170 -4.366 3.089 1.00 1.00 H new HETATM 0 H1VA RCY A 176 72.427 -2.650 3.483 1.00 1.00 H new HETATM 0 H1MA RCY A 176 76.355 -5.578 4.017 1.00 1.00 H new HETATM 0 H1LA RCY A 176 73.286 -8.704 1.824 1.00 1.00 H new HETATM 0 H1CB RCY A 176 71.820 -4.947 5.620 1.00 1.00 H new HETATM 0 H1CA RCY A 176 73.001 -4.299 6.783 1.00 1.00 H new HETATM 0 H1V RCY A 176 73.685 -3.561 2.615 1.00 1.00 H new HETATM 0 H1U RCY A 176 74.617 -5.715 5.570 1.00 1.00 H new HETATM 0 H1S RCY A 176 71.205 -8.055 3.986 1.00 1.00 H new HETATM 0 H1M RCY A 176 75.312 -4.926 2.768 1.00 1.00 H new HETATM 0 H1L RCY A 176 72.819 -9.687 3.198 1.00 1.00 H new HETATM 0 H1C RCY A 176 71.936 -3.191 5.886 1.00 1.00 H new HETATM 1461 C1C RCY A 187 81.531 -2.169 3.731 1.00 1.00 C HETATM 1462 O1G RCY A 187 80.025 0.688 4.055 1.00 1.00 O HETATM 1463 O1H RCY A 187 76.472 -2.356 4.701 1.00 1.00 O HETATM 1464 O1J RCY A 187 82.091 -3.350 1.018 1.00 1.00 O HETATM 1465 C1L RCY A 187 78.023 0.724 5.462 1.00 1.00 C HETATM 1466 C1M RCY A 187 78.508 -2.112 1.597 1.00 1.00 C HETATM 1467 C1P RCY A 187 78.980 0.146 4.412 1.00 1.00 C HETATM 1468 C1Q RCY A 187 77.120 -1.321 4.550 1.00 1.00 C HETATM 1469 N1R RCY A 187 78.474 -1.188 3.865 1.00 1.00 N HETATM 1470 C1S RCY A 187 76.713 0.066 5.014 1.00 1.00 C HETATM 1471 C1U RCY A 187 79.146 -2.150 2.882 1.00 1.00 C HETATM 1472 C1V RCY A 187 80.739 -0.298 2.215 1.00 1.00 C HETATM 1473 N1V RCY A 187 80.858 -2.651 1.367 1.00 1.00 N HETATM 1474 C1W RCY A 187 79.542 -2.637 0.592 1.00 1.00 C HETATM 1475 C1X RCY A 187 80.597 -1.776 2.585 1.00 1.00 C HETATM 1476 C1Y RCY A 187 79.642 -1.700 -0.615 1.00 1.00 C HETATM 1477 C1Z RCY A 187 79.208 -4.060 0.144 1.00 1.00 C HETATM 0 H1ZB RCY A 187 79.200 -4.722 1.010 1.00 1.00 H new HETATM 0 H1ZA RCY A 187 78.227 -4.071 -0.331 1.00 1.00 H new HETATM 0 H1YB RCY A 187 78.672 -1.636 -1.107 1.00 1.00 H new HETATM 0 H1YA RCY A 187 79.946 -0.708 -0.281 1.00 1.00 H new HETATM 0 H1VB RCY A 187 80.496 0.319 3.080 1.00 1.00 H new HETATM 0 H1VA RCY A 187 81.764 -0.098 1.904 1.00 1.00 H new HETATM 0 H1MA RCY A 187 77.609 -2.729 1.590 1.00 1.00 H new HETATM 0 H1LA RCY A 187 78.303 0.447 6.479 1.00 1.00 H new HETATM 0 H1CB RCY A 187 81.225 -1.655 4.642 1.00 1.00 H new HETATM 0 H1CA RCY A 187 81.481 -3.246 3.888 1.00 1.00 H new HETATM 0 H1Z RCY A 187 79.959 -4.403 -0.568 1.00 1.00 H new HETATM 0 H1V RCY A 187 80.058 -0.061 1.397 1.00 1.00 H new HETATM 0 H1U RCY A 187 79.074 -3.124 3.366 1.00 1.00 H new HETATM 0 H1S RCY A 187 76.241 0.630 4.210 1.00 1.00 H new HETATM 0 H1M RCY A 187 78.200 -1.097 1.345 1.00 1.00 H new HETATM 0 H1L RCY A 187 77.976 1.812 5.429 1.00 1.00 H new HETATM 0 H1C RCY A 187 82.553 -1.886 3.480 1.00 1.00 H new