USER MOD reduce.3.24.130724 H: found=0, std=0, add=790, rem=0, adj=15 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 70 TRP H : A 70 TRP N : A 168 RCY O1H :(H bumps) USER MOD NoAdj-H: A 71 GLU H : A 71 GLU N : A 168 RCY C1S :(H bumps) USER MOD NoAdj-H: A 73 CYS H : A 73 CYS N : A 168 RCY C1M :(H bumps) USER MOD NoAdj-H: A 74 ASN H : A 74 ASN N : A 168 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 110 RCYH1VB : A 110 RCY C1V : A 12 SER CA :(H bumps) USER MOD NoAdj-H: A 110 RCYH1VA : A 110 RCY C1V : A 12 SER C :(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 RCYH1LA : A 110 RCY C1L : A 10 CYS C :(H bumps) USER MOD NoAdj-H: A 110 RCY H1V : A 110 RCY C1V : A 12 SER CA :(H bumps) USER MOD NoAdj-H: A 110 RCY H1L : A 110 RCY C1L : A 10 CYS C :(H bumps) USER MOD NoAdj-H: A 121 RCYH1VA : A 121 RCY C1V : A 17 MET CE :(H bumps) USER MOD NoAdj-H: A 121 RCYH1SA : A 121 RCY C1S : A 21 CYS SG :(H bumps) USER MOD NoAdj-H: A 121 RCY H1V : A 121 RCY C1V : A 17 MET SD :(H bumps) USER MOD NoAdj-H: A 130 RCYH1SA : A 130 RCY C1S : A 30 CYS SG :(H bumps) USER MOD NoAdj-H: A 138 RCYH1VB : A 138 RCY C1V : A 150 RCY C1S :(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 RCYH1MA : A 138 RCY C1M : A 49 GLY O :(H bumps) USER MOD NoAdj-H: A 138 RCYH1CB : A 138 RCY C1C : A 150 RCY C1S :(H bumps) USER MOD NoAdj-H: A 138 RCYH1CA : A 138 RCY C1C : A 150 RCY C1P :(H bumps) USER MOD NoAdj-H: A 138 RCY H1C : A 138 RCY C1C : A 150 RCY C1P :(H bumps) USER MOD NoAdj-H: A 150 RCYH1SA : A 150 RCY C1S : A 138 RCY C1V :(H bumps) USER MOD NoAdj-H: A 150 RCYH1LA : A 150 RCY C1L : A 138 RCY N1V :(H bumps) USER MOD NoAdj-H: A 150 RCY H1L : A 150 RCY C1L : A 138 RCY C1U :(H bumps) USER MOD NoAdj-H: A 160 RCYH1SA : A 160 RCY C1S : A 60 CYS SG :(H bumps) USER MOD NoAdj-H: A 168 RCYH1ZB : A 168 RCY C1Z : A 71 GLU O :(H bumps) USER MOD NoAdj-H: A 168 RCYH1ZA : A 168 RCY C1Z : A 72 ALA C :(H bumps) USER MOD NoAdj-H: A 168 RCYH1YB : A 168 RCY C1Y : A 73 CYS CA :(H bumps) USER MOD NoAdj-H: A 168 RCYH1YA : A 168 RCY C1Y : A 73 CYS C :(H bumps) USER MOD NoAdj-H: A 168 RCYH1SA : A 168 RCY C1S : A 68 CYS SG :(H bumps) USER MOD NoAdj-H: A 168 RCYH1MA : A 168 RCY C1M : A 73 CYS N :(H bumps) USER MOD NoAdj-H: A 168 RCYH1LA : A 168 RCY C1L : A 68 CYS O :(H bumps) USER MOD NoAdj-H: A 168 RCY H1Z : A 168 RCY C1Z : A 71 GLU O :(H bumps) USER MOD NoAdj-H: A 168 RCY H1Y : A 168 RCY C1Y : A 73 CYS C :(H bumps) USER MOD NoAdj-H: A 168 RCY H1V : A 168 RCY C1V : A 73 CYS O :(H bumps) USER MOD NoAdj-H: A 168 RCY H1S : A 168 RCY C1S : A 71 GLU N :(H bumps) USER MOD NoAdj-H: A 168 RCY H1M : A 168 RCY C1M : A 73 CYS N :(H bumps) USER MOD NoAdj-H: A 173 RCYH1ZA : A 173 RCY C1Z : A 69 PRO CG :(H bumps) USER MOD NoAdj-H: A 173 RCYH1SA : A 173 RCY C1S : A 73 CYS SG :(H bumps) USER MOD NoAdj-H: A 173 RCY H1Z : A 173 RCY C1Z : A 69 PRO CG :(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 H1L : A 176 RCY C1L : A 176 RCY C1U :(H bumps) USER MOD NoAdj-H: A 187 RCYH1SA : A 187 RCY C1S : A 87 CYS SG :(H bumps) USER MOD Set 1.1: A 62 THR OG1 : rot -57:sc= 0.924! USER MOD Set 1.2: A 65 THR OG1 : rot 160:sc= -1.55! USER MOD Set 2.1: A 1 MET CE :methyl 159:sc= 0 (180deg=0) USER MOD Set 2.2: A 2 ASN : amide:sc= -0.351 K(o=-0.35,f=-3.7!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 171:sc= -9.79! (180deg=-10.1!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -166:sc=-0.00708 (180deg=-0.236) USER MOD Single : A 31 LYS NZ :NH3+ -177:sc= -0.755 (180deg=-0.793) USER MOD Single : A 32 GLN : amide:sc= -3.96! C(o=-4!,f=-8.2!) USER MOD Single : A 34 GLN :FLIP amide:sc= -1.77 F(o=-4.6!,f=-1.8) USER MOD Single : A 35 THR OG1 : rot 18:sc= -5.74! USER MOD Single : A 37 GLN : amide:sc= -5.42! C(o=-5.4!,f=-13!) USER MOD Single : A 39 LYS NZ :NH3+ -107:sc= -4.92! (180deg=-10.4!) USER MOD Single : A 40 SER OG : rot 180:sc= 0.273 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 75 HIS : no HD1:sc= -9.11! C(o=-9.1!,f=-10!) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 GLN :FLIP amide:sc= -0.0381 F(o=-1.6!,f=-0.038) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 69.646 -13.613 -22.842 1.00 1.00 N ATOM 2 CA MET A 1 70.477 -13.753 -24.071 1.00 1.00 C ATOM 3 C MET A 1 71.517 -12.630 -24.111 1.00 1.00 C ATOM 4 O MET A 1 72.696 -12.869 -24.283 1.00 1.00 O ATOM 5 CB MET A 1 69.574 -13.666 -25.308 1.00 1.00 C ATOM 6 CG MET A 1 70.216 -14.433 -26.466 1.00 1.00 C ATOM 7 SD MET A 1 71.879 -13.788 -26.768 1.00 1.00 S ATOM 8 CE MET A 1 71.406 -12.468 -27.913 1.00 1.00 C ATOM 0 H1 MET A 1 68.939 -14.375 -22.813 1.00 1.00 H new ATOM 0 H2 MET A 1 70.256 -13.674 -22.002 1.00 1.00 H new ATOM 0 H3 MET A 1 69.163 -12.692 -22.853 1.00 1.00 H new ATOM 0 HA MET A 1 70.986 -14.717 -24.063 1.00 1.00 H new ATOM 0 HB2 MET A 1 68.591 -14.081 -25.084 1.00 1.00 H new ATOM 0 HB3 MET A 1 69.423 -12.623 -25.588 1.00 1.00 H new ATOM 0 HG2 MET A 1 70.264 -15.496 -26.230 1.00 1.00 H new ATOM 0 HG3 MET A 1 69.607 -14.333 -27.364 1.00 1.00 H new ATOM 0 HE1 MET A 1 72.193 -11.714 -27.945 1.00 1.00 H new ATOM 0 HE2 MET A 1 71.263 -12.885 -28.910 1.00 1.00 H new ATOM 0 HE3 MET A 1 70.477 -12.009 -27.575 1.00 1.00 H new ATOM 17 N ASN A 2 71.090 -11.407 -23.954 1.00 1.00 N ATOM 18 CA ASN A 2 72.055 -10.271 -23.983 1.00 1.00 C ATOM 19 C ASN A 2 72.844 -10.238 -22.672 1.00 1.00 C ATOM 20 O ASN A 2 73.874 -10.870 -22.541 1.00 1.00 O ATOM 21 CB ASN A 2 71.289 -8.957 -24.151 1.00 1.00 C ATOM 22 CG ASN A 2 70.656 -8.910 -25.543 1.00 1.00 C ATOM 23 OD1 ASN A 2 70.263 -9.927 -26.079 1.00 1.00 O ATOM 24 ND2 ASN A 2 70.539 -7.763 -26.154 1.00 1.00 N ATOM 0 H ASN A 2 70.115 -11.145 -23.807 1.00 1.00 H new ATOM 0 HA ASN A 2 72.744 -10.400 -24.818 1.00 1.00 H new ATOM 0 HB2 ASN A 2 70.517 -8.873 -23.386 1.00 1.00 H new ATOM 0 HB3 ASN A 2 71.963 -8.111 -24.018 1.00 1.00 H new ATOM 0 HD21 ASN A 2 70.117 -7.720 -27.082 1.00 1.00 H new ATOM 0 HD22 ASN A 2 70.869 -6.909 -25.704 1.00 1.00 H new ATOM 31 N LEU A 3 72.371 -9.507 -21.700 1.00 1.00 N ATOM 32 CA LEU A 3 73.096 -9.437 -20.399 1.00 1.00 C ATOM 33 C LEU A 3 73.358 -10.856 -19.891 1.00 1.00 C ATOM 34 O LEU A 3 73.036 -11.829 -20.544 1.00 1.00 O ATOM 35 CB LEU A 3 72.242 -8.676 -19.377 1.00 1.00 C ATOM 36 CG LEU A 3 72.392 -7.170 -19.601 1.00 1.00 C ATOM 37 CD1 LEU A 3 73.812 -6.737 -19.230 1.00 1.00 C ATOM 38 CD2 LEU A 3 72.130 -6.847 -21.073 1.00 1.00 C ATOM 0 H LEU A 3 71.514 -8.955 -21.750 1.00 1.00 H new ATOM 0 HA LEU A 3 74.044 -8.917 -20.536 1.00 1.00 H new ATOM 0 HB2 LEU A 3 71.196 -8.966 -19.475 1.00 1.00 H new ATOM 0 HB3 LEU A 3 72.551 -8.936 -18.365 1.00 1.00 H new ATOM 0 HG LEU A 3 71.675 -6.636 -18.977 1.00 1.00 H new ATOM 0 HD11 LEU A 3 73.919 -5.664 -19.390 1.00 1.00 H new ATOM 0 HD12 LEU A 3 74.001 -6.968 -18.182 1.00 1.00 H new ATOM 0 HD13 LEU A 3 74.530 -7.270 -19.854 1.00 1.00 H new ATOM 0 HD21 LEU A 3 72.236 -5.774 -21.235 1.00 1.00 H new ATOM 0 HD22 LEU A 3 72.848 -7.381 -21.696 1.00 1.00 H new ATOM 0 HD23 LEU A 3 71.119 -7.155 -21.339 1.00 1.00 H new ATOM 50 N GLU A 4 73.940 -10.985 -18.729 1.00 1.00 N ATOM 51 CA GLU A 4 74.219 -12.345 -18.187 1.00 1.00 C ATOM 52 C GLU A 4 72.896 -13.019 -17.805 1.00 1.00 C ATOM 53 O GLU A 4 71.968 -12.366 -17.371 1.00 1.00 O ATOM 54 CB GLU A 4 75.108 -12.228 -16.945 1.00 1.00 C ATOM 55 CG GLU A 4 76.383 -11.460 -17.298 1.00 1.00 C ATOM 56 CD GLU A 4 76.071 -9.965 -17.385 1.00 1.00 C ATOM 57 OE1 GLU A 4 75.022 -9.569 -16.903 1.00 1.00 O ATOM 58 OE2 GLU A 4 76.887 -9.240 -17.931 1.00 1.00 O ATOM 0 H GLU A 4 74.233 -10.210 -18.134 1.00 1.00 H new ATOM 0 HA GLU A 4 74.729 -12.942 -18.943 1.00 1.00 H new ATOM 0 HB2 GLU A 4 74.571 -11.714 -16.148 1.00 1.00 H new ATOM 0 HB3 GLU A 4 75.361 -13.220 -16.571 1.00 1.00 H new ATOM 0 HG2 GLU A 4 77.149 -11.639 -16.543 1.00 1.00 H new ATOM 0 HG3 GLU A 4 76.783 -11.815 -18.248 1.00 1.00 H new ATOM 65 N PRO A 5 72.809 -14.317 -17.961 1.00 1.00 N ATOM 66 CA PRO A 5 71.581 -15.088 -17.626 1.00 1.00 C ATOM 67 C PRO A 5 70.873 -14.549 -16.373 1.00 1.00 C ATOM 68 O PRO A 5 71.278 -14.828 -15.262 1.00 1.00 O ATOM 69 CB PRO A 5 72.120 -16.496 -17.375 1.00 1.00 C ATOM 70 CG PRO A 5 73.321 -16.614 -18.258 1.00 1.00 C ATOM 71 CD PRO A 5 73.872 -15.199 -18.469 1.00 1.00 C ATOM 0 HA PRO A 5 70.831 -15.033 -18.415 1.00 1.00 H new ATOM 0 HB2 PRO A 5 72.385 -16.636 -16.327 1.00 1.00 H new ATOM 0 HB3 PRO A 5 71.375 -17.253 -17.619 1.00 1.00 H new ATOM 0 HG2 PRO A 5 74.074 -17.255 -17.799 1.00 1.00 H new ATOM 0 HG3 PRO A 5 73.054 -17.069 -19.212 1.00 1.00 H new ATOM 0 HD2 PRO A 5 74.806 -15.050 -17.926 1.00 1.00 H new ATOM 0 HD3 PRO A 5 74.081 -15.006 -19.521 1.00 1.00 H new ATOM 79 N PRO A 6 69.824 -13.784 -16.549 1.00 1.00 N ATOM 80 CA PRO A 6 69.056 -13.203 -15.415 1.00 1.00 C ATOM 81 C PRO A 6 68.010 -14.179 -14.866 1.00 1.00 C ATOM 82 O PRO A 6 67.679 -15.165 -15.493 1.00 1.00 O ATOM 83 CB PRO A 6 68.382 -11.984 -16.044 1.00 1.00 C ATOM 84 CG PRO A 6 68.177 -12.352 -17.479 1.00 1.00 C ATOM 85 CD PRO A 6 69.254 -13.381 -17.845 1.00 1.00 C ATOM 0 HA PRO A 6 69.691 -12.963 -14.562 1.00 1.00 H new ATOM 0 HB2 PRO A 6 67.434 -11.761 -15.555 1.00 1.00 H new ATOM 0 HB3 PRO A 6 69.006 -11.095 -15.950 1.00 1.00 H new ATOM 0 HG2 PRO A 6 67.181 -12.768 -17.630 1.00 1.00 H new ATOM 0 HG3 PRO A 6 68.255 -11.471 -18.116 1.00 1.00 H new ATOM 0 HD2 PRO A 6 68.827 -14.233 -18.375 1.00 1.00 H new ATOM 0 HD3 PRO A 6 70.013 -12.948 -18.497 1.00 1.00 H new ATOM 93 N LYS A 7 67.489 -13.913 -13.699 1.00 1.00 N ATOM 94 CA LYS A 7 66.468 -14.827 -13.113 1.00 1.00 C ATOM 95 C LYS A 7 65.571 -14.043 -12.151 1.00 1.00 C ATOM 96 O LYS A 7 65.251 -12.894 -12.384 1.00 1.00 O ATOM 97 CB LYS A 7 67.171 -15.958 -12.358 1.00 1.00 C ATOM 98 CG LYS A 7 68.067 -15.366 -11.268 1.00 1.00 C ATOM 99 CD LYS A 7 68.977 -16.459 -10.705 1.00 1.00 C ATOM 100 CE LYS A 7 69.955 -15.844 -9.702 1.00 1.00 C ATOM 101 NZ LYS A 7 70.732 -16.928 -9.037 1.00 1.00 N ATOM 0 H LYS A 7 67.726 -13.103 -13.127 1.00 1.00 H new ATOM 0 HA LYS A 7 65.857 -15.250 -13.910 1.00 1.00 H new ATOM 0 HB2 LYS A 7 66.433 -16.626 -11.914 1.00 1.00 H new ATOM 0 HB3 LYS A 7 67.767 -16.555 -13.049 1.00 1.00 H new ATOM 0 HG2 LYS A 7 68.667 -14.554 -11.678 1.00 1.00 H new ATOM 0 HG3 LYS A 7 67.456 -14.941 -10.472 1.00 1.00 H new ATOM 0 HD2 LYS A 7 68.379 -17.230 -10.220 1.00 1.00 H new ATOM 0 HD3 LYS A 7 69.525 -16.943 -11.514 1.00 1.00 H new ATOM 0 HE2 LYS A 7 70.631 -15.157 -10.211 1.00 1.00 H new ATOM 0 HE3 LYS A 7 69.411 -15.262 -8.958 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 71.397 -16.510 -8.355 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 70.080 -17.567 -8.538 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 71.262 -17.465 -9.753 1.00 1.00 H new ATOM 115 N ALA A 8 65.160 -14.654 -11.073 1.00 1.00 N ATOM 116 CA ALA A 8 64.282 -13.944 -10.099 1.00 1.00 C ATOM 117 C ALA A 8 64.845 -12.549 -9.817 1.00 1.00 C ATOM 118 O ALA A 8 64.171 -11.697 -9.272 1.00 1.00 O ATOM 119 CB ALA A 8 64.220 -14.742 -8.795 1.00 1.00 C ATOM 0 H ALA A 8 65.394 -15.615 -10.824 1.00 1.00 H new ATOM 0 HA ALA A 8 63.280 -13.850 -10.518 1.00 1.00 H new ATOM 0 HB1 ALA A 8 63.579 -14.224 -8.082 1.00 1.00 H new ATOM 0 HB2 ALA A 8 63.814 -15.734 -8.994 1.00 1.00 H new ATOM 0 HB3 ALA A 8 65.223 -14.837 -8.379 1.00 1.00 H new ATOM 125 N GLU A 9 66.074 -12.308 -10.181 1.00 1.00 N ATOM 126 CA GLU A 9 66.676 -10.968 -9.932 1.00 1.00 C ATOM 127 C GLU A 9 66.003 -9.929 -10.832 1.00 1.00 C ATOM 128 O GLU A 9 66.621 -9.363 -11.712 1.00 1.00 O ATOM 129 CB GLU A 9 68.174 -11.015 -10.241 1.00 1.00 C ATOM 130 CG GLU A 9 68.890 -11.843 -9.172 1.00 1.00 C ATOM 131 CD GLU A 9 70.379 -11.939 -9.512 1.00 1.00 C ATOM 132 OE1 GLU A 9 70.906 -10.979 -10.049 1.00 1.00 O ATOM 133 OE2 GLU A 9 70.965 -12.971 -9.230 1.00 1.00 O ATOM 0 H GLU A 9 66.688 -12.981 -10.640 1.00 1.00 H new ATOM 0 HA GLU A 9 66.528 -10.694 -8.887 1.00 1.00 H new ATOM 0 HB2 GLU A 9 68.339 -11.452 -11.226 1.00 1.00 H new ATOM 0 HB3 GLU A 9 68.582 -10.005 -10.268 1.00 1.00 H new ATOM 0 HG2 GLU A 9 68.759 -11.383 -8.193 1.00 1.00 H new ATOM 0 HG3 GLU A 9 68.454 -12.840 -9.117 1.00 1.00 H new ATOM 140 N CYS A 10 64.740 -9.673 -10.620 1.00 1.00 N ATOM 141 CA CYS A 10 64.028 -8.671 -11.465 1.00 1.00 C ATOM 142 C CYS A 10 64.105 -7.295 -10.797 1.00 1.00 C ATOM 143 O CYS A 10 65.169 -6.728 -10.647 1.00 1.00 O ATOM 144 CB CYS A 10 62.563 -9.087 -11.622 1.00 1.00 C ATOM 145 SG CYS A 10 61.929 -9.676 -10.032 1.00 1.00 S ATOM 0 H CYS A 10 64.170 -10.114 -9.898 1.00 1.00 H new ATOM 0 HA CYS A 10 64.497 -8.622 -12.448 1.00 1.00 H new ATOM 0 HB2 CYS A 10 61.970 -8.242 -11.972 1.00 1.00 H new ATOM 0 HB3 CYS A 10 62.475 -9.871 -12.374 1.00 1.00 H new ATOM 150 N ARG A 11 62.987 -6.750 -10.396 1.00 1.00 N ATOM 151 CA ARG A 11 63.002 -5.409 -9.741 1.00 1.00 C ATOM 152 C ARG A 11 61.833 -5.303 -8.760 1.00 1.00 C ATOM 153 O ARG A 11 61.332 -4.229 -8.491 1.00 1.00 O ATOM 154 CB ARG A 11 62.868 -4.318 -10.807 1.00 1.00 C ATOM 155 CG ARG A 11 64.084 -4.357 -11.735 1.00 1.00 C ATOM 156 CD ARG A 11 64.149 -3.062 -12.547 1.00 1.00 C ATOM 157 NE ARG A 11 62.770 -2.541 -12.762 1.00 1.00 N ATOM 158 CZ ARG A 11 61.992 -3.101 -13.648 1.00 1.00 C ATOM 159 NH1 ARG A 11 62.422 -4.117 -14.345 1.00 1.00 N ATOM 160 NH2 ARG A 11 60.784 -2.644 -13.837 1.00 1.00 N ATOM 0 H ARG A 11 62.065 -7.175 -10.494 1.00 1.00 H new ATOM 0 HA ARG A 11 63.941 -5.282 -9.203 1.00 1.00 H new ATOM 0 HB2 ARG A 11 61.954 -4.467 -11.382 1.00 1.00 H new ATOM 0 HB3 ARG A 11 62.790 -3.340 -10.333 1.00 1.00 H new ATOM 0 HG2 ARG A 11 64.996 -4.479 -11.151 1.00 1.00 H new ATOM 0 HG3 ARG A 11 64.017 -5.215 -12.404 1.00 1.00 H new ATOM 0 HD2 ARG A 11 64.752 -2.321 -12.022 1.00 1.00 H new ATOM 0 HD3 ARG A 11 64.634 -3.245 -13.506 1.00 1.00 H new ATOM 0 HE ARG A 11 62.434 -1.747 -12.217 1.00 1.00 H new ATOM 0 HH11 ARG A 11 63.366 -4.474 -14.197 1.00 1.00 H new ATOM 0 HH12 ARG A 11 61.814 -4.554 -15.037 1.00 1.00 H new ATOM 0 HH21 ARG A 11 60.448 -1.850 -13.292 1.00 1.00 H new ATOM 0 HH22 ARG A 11 60.176 -3.081 -14.529 1.00 1.00 H new ATOM 174 N SER A 12 61.392 -6.408 -8.222 1.00 1.00 N ATOM 175 CA SER A 12 60.255 -6.364 -7.260 1.00 1.00 C ATOM 176 C SER A 12 60.126 -7.717 -6.559 1.00 1.00 C ATOM 177 O SER A 12 60.636 -8.718 -7.022 1.00 1.00 O ATOM 178 CB SER A 12 58.961 -6.055 -8.014 1.00 1.00 C ATOM 179 OG SER A 12 57.954 -5.681 -7.084 1.00 1.00 O ATOM 0 H SER A 12 61.769 -7.337 -8.407 1.00 1.00 H new ATOM 0 HA SER A 12 60.438 -5.587 -6.518 1.00 1.00 H new ATOM 0 HB2 SER A 12 59.127 -5.251 -8.731 1.00 1.00 H new ATOM 0 HB3 SER A 12 58.641 -6.928 -8.583 1.00 1.00 H new ATOM 0 HG SER A 12 57.124 -5.481 -7.564 1.00 1.00 H new ATOM 185 N ALA A 13 59.449 -7.757 -5.444 1.00 1.00 N ATOM 186 CA ALA A 13 59.290 -9.048 -4.716 1.00 1.00 C ATOM 187 C ALA A 13 58.348 -8.854 -3.525 1.00 1.00 C ATOM 188 O ALA A 13 58.587 -9.360 -2.448 1.00 1.00 O ATOM 189 CB ALA A 13 60.656 -9.521 -4.215 1.00 1.00 C ATOM 0 H ALA A 13 59.000 -6.953 -5.006 1.00 1.00 H new ATOM 0 HA ALA A 13 58.870 -9.795 -5.390 1.00 1.00 H new ATOM 0 HB1 ALA A 13 60.541 -10.465 -3.682 1.00 1.00 H new ATOM 0 HB2 ALA A 13 61.326 -9.662 -5.063 1.00 1.00 H new ATOM 0 HB3 ALA A 13 61.076 -8.773 -3.542 1.00 1.00 H new ATOM 195 N THR A 14 57.278 -8.129 -3.713 1.00 1.00 N ATOM 196 CA THR A 14 56.312 -7.903 -2.597 1.00 1.00 C ATOM 197 C THR A 14 56.962 -7.016 -1.526 1.00 1.00 C ATOM 198 O THR A 14 56.398 -6.779 -0.478 1.00 1.00 O ATOM 199 CB THR A 14 55.880 -9.266 -2.010 1.00 1.00 C ATOM 200 OG1 THR A 14 54.462 -9.344 -1.992 1.00 1.00 O ATOM 201 CG2 THR A 14 56.419 -9.404 -0.585 1.00 1.00 C ATOM 0 H THR A 14 57.030 -7.681 -4.595 1.00 1.00 H new ATOM 0 HA THR A 14 55.424 -7.392 -2.968 1.00 1.00 H new ATOM 0 HB THR A 14 56.280 -10.071 -2.627 1.00 1.00 H new ATOM 0 HG1 THR A 14 54.187 -10.209 -1.622 1.00 1.00 H new ATOM 0 HG21 THR A 14 56.114 -10.365 -0.172 1.00 1.00 H new ATOM 0 HG22 THR A 14 57.507 -9.345 -0.600 1.00 1.00 H new ATOM 0 HG23 THR A 14 56.021 -8.600 0.034 1.00 1.00 H new ATOM 209 N ARG A 15 58.141 -6.520 -1.788 1.00 1.00 N ATOM 210 CA ARG A 15 58.827 -5.647 -0.790 1.00 1.00 C ATOM 211 C ARG A 15 59.203 -6.478 0.439 1.00 1.00 C ATOM 212 O ARG A 15 58.462 -7.342 0.865 1.00 1.00 O ATOM 213 CB ARG A 15 57.891 -4.504 -0.372 1.00 1.00 C ATOM 214 CG ARG A 15 58.718 -3.336 0.169 1.00 1.00 C ATOM 215 CD ARG A 15 59.121 -2.417 -0.986 1.00 1.00 C ATOM 216 NE ARG A 15 59.931 -1.283 -0.459 1.00 1.00 N ATOM 217 CZ ARG A 15 60.003 -0.166 -1.129 1.00 1.00 C ATOM 218 NH1 ARG A 15 59.365 -0.041 -2.260 1.00 1.00 N ATOM 219 NH2 ARG A 15 60.712 0.828 -0.667 1.00 1.00 N ATOM 0 H ARG A 15 58.660 -6.681 -2.651 1.00 1.00 H new ATOM 0 HA ARG A 15 59.729 -5.227 -1.236 1.00 1.00 H new ATOM 0 HB2 ARG A 15 57.296 -4.177 -1.225 1.00 1.00 H new ATOM 0 HB3 ARG A 15 57.193 -4.852 0.389 1.00 1.00 H new ATOM 0 HG2 ARG A 15 58.141 -2.779 0.907 1.00 1.00 H new ATOM 0 HG3 ARG A 15 59.607 -3.710 0.677 1.00 1.00 H new ATOM 0 HD2 ARG A 15 59.695 -2.975 -1.726 1.00 1.00 H new ATOM 0 HD3 ARG A 15 58.232 -2.039 -1.491 1.00 1.00 H new ATOM 0 HE ARG A 15 60.429 -1.380 0.426 1.00 1.00 H new ATOM 0 HH11 ARG A 15 58.810 -0.817 -2.621 1.00 1.00 H new ATOM 0 HH12 ARG A 15 59.422 0.833 -2.784 1.00 1.00 H new ATOM 0 HH21 ARG A 15 61.210 0.731 0.218 1.00 1.00 H new ATOM 0 HH22 ARG A 15 60.768 1.701 -1.191 1.00 1.00 H new ATOM 233 N VAL A 16 60.352 -6.225 1.009 1.00 1.00 N ATOM 234 CA VAL A 16 60.787 -6.999 2.210 1.00 1.00 C ATOM 235 C VAL A 16 60.778 -6.088 3.440 1.00 1.00 C ATOM 236 O VAL A 16 60.761 -6.549 4.564 1.00 1.00 O ATOM 237 CB VAL A 16 62.204 -7.529 1.982 1.00 1.00 C ATOM 238 CG1 VAL A 16 62.196 -8.529 0.824 1.00 1.00 C ATOM 239 CG2 VAL A 16 63.134 -6.363 1.641 1.00 1.00 C ATOM 0 H VAL A 16 61.011 -5.513 0.693 1.00 1.00 H new ATOM 0 HA VAL A 16 60.104 -7.832 2.373 1.00 1.00 H new ATOM 0 HB VAL A 16 62.556 -8.024 2.887 1.00 1.00 H new ATOM 0 HG11 VAL A 16 63.206 -8.906 0.662 1.00 1.00 H new ATOM 0 HG12 VAL A 16 61.533 -9.360 1.065 1.00 1.00 H new ATOM 0 HG13 VAL A 16 61.844 -8.035 -0.081 1.00 1.00 H new ATOM 0 HG21 VAL A 16 64.144 -6.739 1.478 1.00 1.00 H new ATOM 0 HG22 VAL A 16 62.781 -5.868 0.736 1.00 1.00 H new ATOM 0 HG23 VAL A 16 63.141 -5.650 2.465 1.00 1.00 H new ATOM 249 N MET A 17 60.789 -4.799 3.238 1.00 1.00 N ATOM 250 CA MET A 17 60.783 -3.864 4.398 1.00 1.00 C ATOM 251 C MET A 17 59.637 -4.235 5.344 1.00 1.00 C ATOM 252 O MET A 17 58.687 -4.887 4.958 1.00 1.00 O ATOM 253 CB MET A 17 60.595 -2.427 3.894 1.00 1.00 C ATOM 254 CG MET A 17 61.250 -1.451 4.873 1.00 1.00 C ATOM 255 SD MET A 17 63.044 -1.472 4.637 1.00 1.00 S ATOM 256 CE MET A 17 63.452 -0.223 5.882 1.00 1.00 C ATOM 0 H MET A 17 60.802 -4.353 2.321 1.00 1.00 H new ATOM 0 HA MET A 17 61.730 -3.937 4.933 1.00 1.00 H new ATOM 0 HB2 MET A 17 61.038 -2.317 2.904 1.00 1.00 H new ATOM 0 HB3 MET A 17 59.533 -2.201 3.795 1.00 1.00 H new ATOM 0 HG2 MET A 17 60.863 -0.445 4.713 1.00 1.00 H new ATOM 0 HG3 MET A 17 61.004 -1.728 5.898 1.00 1.00 H new ATOM 0 HE1 MET A 17 64.532 -0.188 6.022 1.00 1.00 H new ATOM 0 HE2 MET A 17 63.097 0.752 5.549 1.00 1.00 H new ATOM 0 HE3 MET A 17 62.972 -0.480 6.826 1.00 1.00 H new ATOM 266 N GLY A 18 59.718 -3.825 6.582 1.00 1.00 N ATOM 267 CA GLY A 18 58.635 -4.154 7.555 1.00 1.00 C ATOM 268 C GLY A 18 59.030 -5.393 8.361 1.00 1.00 C ATOM 269 O GLY A 18 60.125 -5.904 8.234 1.00 1.00 O ATOM 0 H GLY A 18 60.489 -3.276 6.962 1.00 1.00 H new ATOM 0 HA2 GLY A 18 58.465 -3.311 8.225 1.00 1.00 H new ATOM 0 HA3 GLY A 18 57.699 -4.335 7.026 1.00 1.00 H new ATOM 273 N GLY A 19 58.148 -5.880 9.192 1.00 1.00 N ATOM 274 CA GLY A 19 58.477 -7.085 10.005 1.00 1.00 C ATOM 275 C GLY A 19 59.608 -6.747 10.980 1.00 1.00 C ATOM 276 O GLY A 19 59.807 -5.601 11.333 1.00 1.00 O ATOM 0 H GLY A 19 57.215 -5.496 9.343 1.00 1.00 H new ATOM 0 HA2 GLY A 19 57.596 -7.419 10.554 1.00 1.00 H new ATOM 0 HA3 GLY A 19 58.777 -7.906 9.354 1.00 1.00 H new ATOM 280 N PRO A 20 60.347 -7.737 11.411 1.00 1.00 N ATOM 281 CA PRO A 20 61.482 -7.539 12.361 1.00 1.00 C ATOM 282 C PRO A 20 62.449 -6.448 11.884 1.00 1.00 C ATOM 283 O PRO A 20 63.449 -6.171 12.515 1.00 1.00 O ATOM 284 CB PRO A 20 62.177 -8.906 12.392 1.00 1.00 C ATOM 285 CG PRO A 20 61.128 -9.889 11.991 1.00 1.00 C ATOM 286 CD PRO A 20 60.180 -9.152 11.044 1.00 1.00 C ATOM 0 HA PRO A 20 61.140 -7.208 13.342 1.00 1.00 H new ATOM 0 HB2 PRO A 20 63.024 -8.933 11.706 1.00 1.00 H new ATOM 0 HB3 PRO A 20 62.565 -9.128 13.386 1.00 1.00 H new ATOM 0 HG2 PRO A 20 61.574 -10.753 11.498 1.00 1.00 H new ATOM 0 HG3 PRO A 20 60.592 -10.262 12.864 1.00 1.00 H new ATOM 0 HD2 PRO A 20 60.441 -9.328 10.000 1.00 1.00 H new ATOM 0 HD3 PRO A 20 59.149 -9.480 11.175 1.00 1.00 H new ATOM 294 N CYS A 21 62.150 -5.829 10.772 1.00 1.00 N ATOM 295 CA CYS A 21 63.036 -4.754 10.239 1.00 1.00 C ATOM 296 C CYS A 21 62.179 -3.551 9.835 1.00 1.00 C ATOM 297 O CYS A 21 61.630 -3.507 8.752 1.00 1.00 O ATOM 298 CB CYS A 21 63.789 -5.283 9.013 1.00 1.00 C ATOM 299 SG CYS A 21 65.510 -5.623 9.458 1.00 1.00 S ATOM 0 H CYS A 21 61.324 -6.024 10.207 1.00 1.00 H new ATOM 0 HA CYS A 21 63.752 -4.451 11.003 1.00 1.00 H new ATOM 0 HB2 CYS A 21 63.312 -6.191 8.644 1.00 1.00 H new ATOM 0 HB3 CYS A 21 63.749 -4.552 8.206 1.00 1.00 H new ATOM 304 N THR A 22 62.060 -2.574 10.697 1.00 1.00 N ATOM 305 CA THR A 22 61.235 -1.373 10.362 1.00 1.00 C ATOM 306 C THR A 22 62.146 -0.142 10.254 1.00 1.00 C ATOM 307 O THR A 22 63.103 -0.011 10.991 1.00 1.00 O ATOM 308 CB THR A 22 60.202 -1.143 11.469 1.00 1.00 C ATOM 309 OG1 THR A 22 60.845 -1.203 12.734 1.00 1.00 O ATOM 310 CG2 THR A 22 59.120 -2.222 11.392 1.00 1.00 C ATOM 0 H THR A 22 62.498 -2.555 11.618 1.00 1.00 H new ATOM 0 HA THR A 22 60.725 -1.534 9.412 1.00 1.00 H new ATOM 0 HB THR A 22 59.743 -0.163 11.341 1.00 1.00 H new ATOM 0 HG1 THR A 22 60.186 -1.054 13.444 1.00 1.00 H new ATOM 0 HG21 THR A 22 58.385 -2.057 12.180 1.00 1.00 H new ATOM 0 HG22 THR A 22 58.627 -2.174 10.421 1.00 1.00 H new ATOM 0 HG23 THR A 22 59.576 -3.204 11.520 1.00 1.00 H new ATOM 318 N PRO A 23 61.852 0.757 9.346 1.00 1.00 N ATOM 319 CA PRO A 23 62.660 1.993 9.153 1.00 1.00 C ATOM 320 C PRO A 23 63.070 2.636 10.482 1.00 1.00 C ATOM 321 O PRO A 23 62.322 2.637 11.439 1.00 1.00 O ATOM 322 CB PRO A 23 61.721 2.919 8.379 1.00 1.00 C ATOM 323 CG PRO A 23 60.811 2.009 7.620 1.00 1.00 C ATOM 324 CD PRO A 23 60.719 0.697 8.408 1.00 1.00 C ATOM 0 HA PRO A 23 63.597 1.787 8.636 1.00 1.00 H new ATOM 0 HB2 PRO A 23 61.159 3.564 9.055 1.00 1.00 H new ATOM 0 HB3 PRO A 23 62.278 3.571 7.705 1.00 1.00 H new ATOM 0 HG2 PRO A 23 59.825 2.459 7.506 1.00 1.00 H new ATOM 0 HG3 PRO A 23 61.197 1.829 6.617 1.00 1.00 H new ATOM 0 HD2 PRO A 23 59.769 0.616 8.936 1.00 1.00 H new ATOM 0 HD3 PRO A 23 60.793 -0.169 7.750 1.00 1.00 H new ATOM 332 N ARG A 24 64.252 3.187 10.546 1.00 1.00 N ATOM 333 CA ARG A 24 64.708 3.836 11.808 1.00 1.00 C ATOM 334 C ARG A 24 64.296 5.312 11.790 1.00 1.00 C ATOM 335 O ARG A 24 64.893 6.142 12.445 1.00 1.00 O ATOM 336 CB ARG A 24 66.238 3.722 11.913 1.00 1.00 C ATOM 337 CG ARG A 24 66.601 2.579 12.863 1.00 1.00 C ATOM 338 CD ARG A 24 66.185 2.947 14.288 1.00 1.00 C ATOM 339 NE ARG A 24 67.361 2.827 15.195 1.00 1.00 N ATOM 340 CZ ARG A 24 68.235 3.794 15.262 1.00 1.00 C ATOM 341 NH1 ARG A 24 68.079 4.866 14.535 1.00 1.00 N ATOM 342 NH2 ARG A 24 69.264 3.689 16.057 1.00 1.00 N ATOM 0 H ARG A 24 64.922 3.216 9.778 1.00 1.00 H new ATOM 0 HA ARG A 24 64.252 3.343 12.666 1.00 1.00 H new ATOM 0 HB2 ARG A 24 66.668 3.541 10.928 1.00 1.00 H new ATOM 0 HB3 ARG A 24 66.659 4.659 12.277 1.00 1.00 H new ATOM 0 HG2 ARG A 24 66.101 1.662 12.553 1.00 1.00 H new ATOM 0 HG3 ARG A 24 67.673 2.387 12.824 1.00 1.00 H new ATOM 0 HD2 ARG A 24 65.795 3.965 14.313 1.00 1.00 H new ATOM 0 HD3 ARG A 24 65.383 2.290 14.625 1.00 1.00 H new ATOM 0 HE ARG A 24 67.483 1.989 15.764 1.00 1.00 H new ATOM 0 HH11 ARG A 24 67.274 4.948 13.914 1.00 1.00 H new ATOM 0 HH12 ARG A 24 68.762 5.622 14.587 1.00 1.00 H new ATOM 0 HH21 ARG A 24 69.385 2.851 16.626 1.00 1.00 H new ATOM 0 HH22 ARG A 24 69.947 4.445 16.109 1.00 1.00 H new ATOM 356 N LYS A 25 63.280 5.642 11.037 1.00 1.00 N ATOM 357 CA LYS A 25 62.822 7.050 10.960 1.00 1.00 C ATOM 358 C LYS A 25 62.840 7.684 12.356 1.00 1.00 C ATOM 359 O LYS A 25 62.395 7.099 13.324 1.00 1.00 O ATOM 360 CB LYS A 25 61.395 7.077 10.387 1.00 1.00 C ATOM 361 CG LYS A 25 61.393 7.836 9.058 1.00 1.00 C ATOM 362 CD LYS A 25 61.701 9.312 9.312 1.00 1.00 C ATOM 363 CE LYS A 25 62.262 9.944 8.037 1.00 1.00 C ATOM 364 NZ LYS A 25 62.618 11.367 8.302 1.00 1.00 N ATOM 0 H LYS A 25 62.746 4.985 10.468 1.00 1.00 H new ATOM 0 HA LYS A 25 63.489 7.619 10.312 1.00 1.00 H new ATOM 0 HB2 LYS A 25 61.032 6.060 10.238 1.00 1.00 H new ATOM 0 HB3 LYS A 25 60.717 7.557 11.093 1.00 1.00 H new ATOM 0 HG2 LYS A 25 62.135 7.410 8.383 1.00 1.00 H new ATOM 0 HG3 LYS A 25 60.423 7.735 8.571 1.00 1.00 H new ATOM 0 HD2 LYS A 25 60.796 9.835 9.622 1.00 1.00 H new ATOM 0 HD3 LYS A 25 62.420 9.409 10.125 1.00 1.00 H new ATOM 0 HE2 LYS A 25 63.142 9.394 7.703 1.00 1.00 H new ATOM 0 HE3 LYS A 25 61.526 9.886 7.235 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 62.999 11.797 7.435 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 61.769 11.887 8.602 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 63.335 11.411 9.054 1.00 1.00 H new ATOM 378 N GLY A 26 63.351 8.880 12.459 1.00 1.00 N ATOM 379 CA GLY A 26 63.404 9.565 13.782 1.00 1.00 C ATOM 380 C GLY A 26 64.014 10.962 13.595 1.00 1.00 C ATOM 381 O GLY A 26 63.493 11.765 12.846 1.00 1.00 O ATOM 0 H GLY A 26 63.736 9.415 11.680 1.00 1.00 H new ATOM 0 HA2 GLY A 26 62.403 9.645 14.206 1.00 1.00 H new ATOM 0 HA3 GLY A 26 64.002 8.984 14.484 1.00 1.00 H new ATOM 385 N PRO A 27 65.112 11.258 14.252 1.00 1.00 N ATOM 386 CA PRO A 27 65.778 12.586 14.118 1.00 1.00 C ATOM 387 C PRO A 27 65.902 12.997 12.643 1.00 1.00 C ATOM 388 O PRO A 27 65.534 12.248 11.760 1.00 1.00 O ATOM 389 CB PRO A 27 67.158 12.367 14.747 1.00 1.00 C ATOM 390 CG PRO A 27 66.980 11.236 15.708 1.00 1.00 C ATOM 391 CD PRO A 27 65.831 10.372 15.181 1.00 1.00 C ATOM 0 HA PRO A 27 65.218 13.388 14.599 1.00 1.00 H new ATOM 0 HB2 PRO A 27 67.902 12.125 13.988 1.00 1.00 H new ATOM 0 HB3 PRO A 27 67.504 13.266 15.257 1.00 1.00 H new ATOM 0 HG2 PRO A 27 67.896 10.651 15.788 1.00 1.00 H new ATOM 0 HG3 PRO A 27 66.753 11.611 16.706 1.00 1.00 H new ATOM 0 HD2 PRO A 27 66.202 9.481 14.675 1.00 1.00 H new ATOM 0 HD3 PRO A 27 65.184 10.033 15.990 1.00 1.00 H new ATOM 399 N PRO A 28 66.410 14.172 12.370 1.00 1.00 N ATOM 400 CA PRO A 28 66.567 14.661 10.970 1.00 1.00 C ATOM 401 C PRO A 28 67.218 13.608 10.067 1.00 1.00 C ATOM 402 O PRO A 28 67.839 12.675 10.537 1.00 1.00 O ATOM 403 CB PRO A 28 67.466 15.892 11.114 1.00 1.00 C ATOM 404 CG PRO A 28 67.225 16.387 12.502 1.00 1.00 C ATOM 405 CD PRO A 28 66.885 15.160 13.353 1.00 1.00 C ATOM 0 HA PRO A 28 65.609 14.884 10.501 1.00 1.00 H new ATOM 0 HB2 PRO A 28 68.514 15.635 10.963 1.00 1.00 H new ATOM 0 HB3 PRO A 28 67.215 16.653 10.375 1.00 1.00 H new ATOM 0 HG2 PRO A 28 68.108 16.895 12.891 1.00 1.00 H new ATOM 0 HG3 PRO A 28 66.408 17.109 12.519 1.00 1.00 H new ATOM 0 HD2 PRO A 28 67.757 14.796 13.897 1.00 1.00 H new ATOM 0 HD3 PRO A 28 66.119 15.387 14.094 1.00 1.00 H new ATOM 413 N LYS A 29 67.074 13.747 8.775 1.00 1.00 N ATOM 414 CA LYS A 29 67.680 12.751 7.842 1.00 1.00 C ATOM 415 C LYS A 29 69.088 12.389 8.323 1.00 1.00 C ATOM 416 O LYS A 29 69.903 13.251 8.565 1.00 1.00 O ATOM 417 CB LYS A 29 67.756 13.349 6.432 1.00 1.00 C ATOM 418 CG LYS A 29 66.521 14.214 6.175 1.00 1.00 C ATOM 419 CD LYS A 29 65.257 13.386 6.419 1.00 1.00 C ATOM 420 CE LYS A 29 64.026 14.204 6.023 1.00 1.00 C ATOM 421 NZ LYS A 29 63.875 15.357 6.955 1.00 1.00 N ATOM 0 H LYS A 29 66.563 14.507 8.326 1.00 1.00 H new ATOM 0 HA LYS A 29 67.063 11.852 7.821 1.00 1.00 H new ATOM 0 HB2 LYS A 29 68.660 13.949 6.328 1.00 1.00 H new ATOM 0 HB3 LYS A 29 67.815 12.552 5.691 1.00 1.00 H new ATOM 0 HG2 LYS A 29 66.531 15.084 6.831 1.00 1.00 H new ATOM 0 HG3 LYS A 29 66.532 14.587 5.151 1.00 1.00 H new ATOM 0 HD2 LYS A 29 65.296 12.464 5.839 1.00 1.00 H new ATOM 0 HD3 LYS A 29 65.194 13.100 7.469 1.00 1.00 H new ATOM 0 HE2 LYS A 29 64.128 14.562 4.998 1.00 1.00 H new ATOM 0 HE3 LYS A 29 63.134 13.578 6.055 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 62.928 15.772 6.844 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 63.997 15.030 7.935 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 64.595 16.075 6.738 1.00 1.00 H new ATOM 435 N CYS A 30 69.367 11.119 8.466 1.00 1.00 N ATOM 436 CA CYS A 30 70.714 10.675 8.935 1.00 1.00 C ATOM 437 C CYS A 30 70.793 10.792 10.458 1.00 1.00 C ATOM 438 O CYS A 30 70.327 11.749 11.045 1.00 1.00 O ATOM 439 CB CYS A 30 71.804 11.536 8.283 1.00 1.00 C ATOM 440 SG CYS A 30 72.212 12.925 9.370 1.00 1.00 S ATOM 0 H CYS A 30 68.711 10.362 8.275 1.00 1.00 H new ATOM 0 HA CYS A 30 70.869 9.635 8.649 1.00 1.00 H new ATOM 0 HB2 CYS A 30 72.693 10.934 8.096 1.00 1.00 H new ATOM 0 HB3 CYS A 30 71.460 11.906 7.317 1.00 1.00 H new ATOM 445 N LYS A 31 71.374 9.815 11.100 1.00 1.00 N ATOM 446 CA LYS A 31 71.484 9.846 12.584 1.00 1.00 C ATOM 447 C LYS A 31 72.316 11.063 13.006 1.00 1.00 C ATOM 448 O LYS A 31 72.174 12.140 12.462 1.00 1.00 O ATOM 449 CB LYS A 31 72.165 8.560 13.073 1.00 1.00 C ATOM 450 CG LYS A 31 71.201 7.381 12.933 1.00 1.00 C ATOM 451 CD LYS A 31 70.998 7.059 11.451 1.00 1.00 C ATOM 452 CE LYS A 31 72.348 6.727 10.811 1.00 1.00 C ATOM 453 NZ LYS A 31 72.147 5.740 9.713 1.00 1.00 N ATOM 0 H LYS A 31 71.780 8.991 10.656 1.00 1.00 H new ATOM 0 HA LYS A 31 70.489 9.917 13.024 1.00 1.00 H new ATOM 0 HB2 LYS A 31 73.070 8.373 12.494 1.00 1.00 H new ATOM 0 HB3 LYS A 31 72.470 8.671 14.114 1.00 1.00 H new ATOM 0 HG2 LYS A 31 71.598 6.510 13.454 1.00 1.00 H new ATOM 0 HG3 LYS A 31 70.245 7.622 13.398 1.00 1.00 H new ATOM 0 HD2 LYS A 31 70.315 6.217 11.341 1.00 1.00 H new ATOM 0 HD3 LYS A 31 70.542 7.908 10.943 1.00 1.00 H new ATOM 0 HE2 LYS A 31 72.810 7.633 10.420 1.00 1.00 H new ATOM 0 HE3 LYS A 31 73.028 6.321 11.560 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 73.069 5.475 9.311 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 71.677 4.892 10.090 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 71.554 6.163 8.970 1.00 1.00 H new ATOM 467 N GLN A 32 73.184 10.903 13.969 1.00 1.00 N ATOM 468 CA GLN A 32 74.021 12.051 14.419 1.00 1.00 C ATOM 469 C GLN A 32 75.341 11.527 14.988 1.00 1.00 C ATOM 470 O GLN A 32 76.213 12.287 15.359 1.00 1.00 O ATOM 471 CB GLN A 32 73.274 12.835 15.502 1.00 1.00 C ATOM 472 CG GLN A 32 72.763 11.869 16.573 1.00 1.00 C ATOM 473 CD GLN A 32 71.474 11.204 16.087 1.00 1.00 C ATOM 474 OE1 GLN A 32 71.330 10.000 16.169 1.00 1.00 O ATOM 475 NE2 GLN A 32 70.523 11.941 15.582 1.00 1.00 N ATOM 0 H GLN A 32 73.349 10.026 14.463 1.00 1.00 H new ATOM 0 HA GLN A 32 74.224 12.706 13.572 1.00 1.00 H new ATOM 0 HB2 GLN A 32 73.936 13.575 15.951 1.00 1.00 H new ATOM 0 HB3 GLN A 32 72.439 13.380 15.061 1.00 1.00 H new ATOM 0 HG2 GLN A 32 73.518 11.112 16.785 1.00 1.00 H new ATOM 0 HG3 GLN A 32 72.579 12.405 17.504 1.00 1.00 H new ATOM 0 HE21 GLN A 32 70.643 12.952 15.513 1.00 1.00 H new ATOM 0 HE22 GLN A 32 69.659 11.507 15.256 1.00 1.00 H new ATOM 484 N ARG A 33 75.496 10.232 15.058 1.00 1.00 N ATOM 485 CA ARG A 33 76.761 9.662 15.602 1.00 1.00 C ATOM 486 C ARG A 33 77.954 10.368 14.958 1.00 1.00 C ATOM 487 O ARG A 33 78.525 11.283 15.518 1.00 1.00 O ATOM 488 CB ARG A 33 76.825 8.162 15.293 1.00 1.00 C ATOM 489 CG ARG A 33 75.518 7.494 15.724 1.00 1.00 C ATOM 490 CD ARG A 33 75.231 7.831 17.189 1.00 1.00 C ATOM 491 NE ARG A 33 74.262 6.845 17.745 1.00 1.00 N ATOM 492 CZ ARG A 33 73.018 6.859 17.351 1.00 1.00 C ATOM 493 NH1 ARG A 33 72.622 7.737 16.470 1.00 1.00 N ATOM 494 NH2 ARG A 33 72.169 5.996 17.838 1.00 1.00 N ATOM 0 H ARG A 33 74.802 9.546 14.762 1.00 1.00 H new ATOM 0 HA ARG A 33 76.790 9.809 16.682 1.00 1.00 H new ATOM 0 HB2 ARG A 33 76.990 8.007 14.227 1.00 1.00 H new ATOM 0 HB3 ARG A 33 77.667 7.708 15.816 1.00 1.00 H new ATOM 0 HG2 ARG A 33 74.697 7.836 15.094 1.00 1.00 H new ATOM 0 HG3 ARG A 33 75.590 6.414 15.596 1.00 1.00 H new ATOM 0 HD2 ARG A 33 76.156 7.813 17.765 1.00 1.00 H new ATOM 0 HD3 ARG A 33 74.826 8.840 17.269 1.00 1.00 H new ATOM 0 HE ARG A 33 74.571 6.159 18.434 1.00 1.00 H new ATOM 0 HH11 ARG A 33 73.285 8.412 16.089 1.00 1.00 H new ATOM 0 HH12 ARG A 33 71.650 7.748 16.162 1.00 1.00 H new ATOM 0 HH21 ARG A 33 72.478 5.310 18.527 1.00 1.00 H new ATOM 0 HH22 ARG A 33 71.197 6.007 17.530 1.00 1.00 H new ATOM 508 N GLN A 34 78.332 9.951 13.785 1.00 1.00 N ATOM 509 CA GLN A 34 79.486 10.594 13.098 1.00 1.00 C ATOM 510 C GLN A 34 79.597 10.044 11.672 1.00 1.00 C ATOM 511 O GLN A 34 80.657 9.649 11.228 1.00 1.00 O ATOM 512 CB GLN A 34 80.775 10.292 13.876 1.00 1.00 C ATOM 513 CG GLN A 34 81.752 11.459 13.721 1.00 1.00 C ATOM 514 CD GLN A 34 83.094 11.091 14.356 1.00 1.00 C ATOM 515 OE1 GLN A 34 83.498 9.851 14.325 1.00 1.00 O flip ATOM 516 NE2 GLN A 34 83.782 11.941 14.886 1.00 1.00 N flip ATOM 0 H GLN A 34 77.891 9.190 13.269 1.00 1.00 H new ATOM 0 HA GLN A 34 79.336 11.673 13.057 1.00 1.00 H new ATOM 0 HB2 GLN A 34 80.547 10.133 14.930 1.00 1.00 H new ATOM 0 HB3 GLN A 34 81.229 9.373 13.506 1.00 1.00 H new ATOM 0 HG2 GLN A 34 81.890 11.694 12.666 1.00 1.00 H new ATOM 0 HG3 GLN A 34 81.346 12.352 14.196 1.00 1.00 H new ATOM 0 HE21 GLN A 34 83.466 12.911 14.910 1.00 1.00 H new ATOM 0 HE22 GLN A 34 84.675 11.685 15.307 1.00 1.00 H new ATOM 525 N THR A 35 78.509 10.012 10.952 1.00 1.00 N ATOM 526 CA THR A 35 78.551 9.486 9.559 1.00 1.00 C ATOM 527 C THR A 35 79.488 10.350 8.712 1.00 1.00 C ATOM 528 O THR A 35 79.856 9.988 7.613 1.00 1.00 O ATOM 529 CB THR A 35 77.143 9.518 8.958 1.00 1.00 C ATOM 530 OG1 THR A 35 76.631 10.841 9.028 1.00 1.00 O ATOM 531 CG2 THR A 35 76.230 8.573 9.741 1.00 1.00 C ATOM 0 H THR A 35 77.592 10.328 11.269 1.00 1.00 H new ATOM 0 HA THR A 35 78.918 8.460 9.571 1.00 1.00 H new ATOM 0 HB THR A 35 77.184 9.198 7.917 1.00 1.00 H new ATOM 0 HG1 THR A 35 77.369 11.470 9.170 1.00 1.00 H new ATOM 0 HG21 THR A 35 75.228 8.597 9.312 1.00 1.00 H new ATOM 0 HG22 THR A 35 76.624 7.558 9.687 1.00 1.00 H new ATOM 0 HG23 THR A 35 76.186 8.890 10.783 1.00 1.00 H new ATOM 539 N ARG A 36 79.878 11.491 9.215 1.00 1.00 N ATOM 540 CA ARG A 36 80.792 12.374 8.435 1.00 1.00 C ATOM 541 C ARG A 36 82.244 12.001 8.740 1.00 1.00 C ATOM 542 O ARG A 36 83.168 12.542 8.165 1.00 1.00 O ATOM 543 CB ARG A 36 80.548 13.835 8.822 1.00 1.00 C ATOM 544 CG ARG A 36 80.814 14.021 10.317 1.00 1.00 C ATOM 545 CD ARG A 36 80.502 15.464 10.716 1.00 1.00 C ATOM 546 NE ARG A 36 80.953 16.387 9.637 1.00 1.00 N ATOM 547 CZ ARG A 36 80.113 16.775 8.717 1.00 1.00 C ATOM 548 NH1 ARG A 36 78.878 16.356 8.743 1.00 1.00 N ATOM 549 NH2 ARG A 36 80.509 17.583 7.771 1.00 1.00 N ATOM 0 H ARG A 36 79.604 11.849 10.130 1.00 1.00 H new ATOM 0 HA ARG A 36 80.599 12.245 7.370 1.00 1.00 H new ATOM 0 HB2 ARG A 36 81.199 14.489 8.242 1.00 1.00 H new ATOM 0 HB3 ARG A 36 79.522 14.118 8.587 1.00 1.00 H new ATOM 0 HG2 ARG A 36 80.199 13.332 10.895 1.00 1.00 H new ATOM 0 HG3 ARG A 36 81.854 13.787 10.544 1.00 1.00 H new ATOM 0 HD2 ARG A 36 79.432 15.582 10.886 1.00 1.00 H new ATOM 0 HD3 ARG A 36 81.003 15.710 11.652 1.00 1.00 H new ATOM 0 HE ARG A 36 81.918 16.716 9.617 1.00 1.00 H new ATOM 0 HH11 ARG A 36 78.569 15.725 9.483 1.00 1.00 H new ATOM 0 HH12 ARG A 36 78.221 16.659 8.024 1.00 1.00 H new ATOM 0 HH21 ARG A 36 81.475 17.911 7.751 1.00 1.00 H new ATOM 0 HH22 ARG A 36 79.853 17.887 7.052 1.00 1.00 H new ATOM 563 N GLN A 37 82.453 11.079 9.639 1.00 1.00 N ATOM 564 CA GLN A 37 83.846 10.673 9.976 1.00 1.00 C ATOM 565 C GLN A 37 84.492 10.026 8.748 1.00 1.00 C ATOM 566 O GLN A 37 83.897 9.199 8.086 1.00 1.00 O ATOM 567 CB GLN A 37 83.824 9.670 11.138 1.00 1.00 C ATOM 568 CG GLN A 37 85.066 9.867 12.009 1.00 1.00 C ATOM 569 CD GLN A 37 86.310 9.927 11.119 1.00 1.00 C ATOM 570 OE1 GLN A 37 86.514 9.069 10.283 1.00 1.00 O ATOM 571 NE2 GLN A 37 87.155 10.910 11.265 1.00 1.00 N ATOM 0 H GLN A 37 81.721 10.590 10.154 1.00 1.00 H new ATOM 0 HA GLN A 37 84.422 11.550 10.272 1.00 1.00 H new ATOM 0 HB2 GLN A 37 82.923 9.809 11.735 1.00 1.00 H new ATOM 0 HB3 GLN A 37 83.796 8.651 10.752 1.00 1.00 H new ATOM 0 HG2 GLN A 37 84.975 10.786 12.588 1.00 1.00 H new ATOM 0 HG3 GLN A 37 85.156 9.048 12.723 1.00 1.00 H new ATOM 0 HE21 GLN A 37 86.983 11.630 11.967 1.00 1.00 H new ATOM 0 HE22 GLN A 37 87.987 10.959 10.677 1.00 1.00 H new ATOM 580 N CYS A 38 85.706 10.395 8.439 1.00 1.00 N ATOM 581 CA CYS A 38 86.390 9.802 7.256 1.00 1.00 C ATOM 582 C CYS A 38 87.881 9.639 7.563 1.00 1.00 C ATOM 583 O CYS A 38 88.663 10.553 7.397 1.00 1.00 O ATOM 584 CB CYS A 38 86.207 10.726 6.046 1.00 1.00 C ATOM 585 SG CYS A 38 85.915 9.728 4.565 1.00 1.00 S ATOM 0 H CYS A 38 86.254 11.083 8.956 1.00 1.00 H new ATOM 0 HA CYS A 38 85.959 8.826 7.032 1.00 1.00 H new ATOM 0 HB2 CYS A 38 85.368 11.401 6.214 1.00 1.00 H new ATOM 0 HB3 CYS A 38 87.093 11.346 5.911 1.00 1.00 H new ATOM 590 N LYS A 39 88.281 8.483 8.019 1.00 1.00 N ATOM 591 CA LYS A 39 89.720 8.270 8.343 1.00 1.00 C ATOM 592 C LYS A 39 90.052 6.775 8.240 1.00 1.00 C ATOM 593 O LYS A 39 89.474 6.055 7.449 1.00 1.00 O ATOM 594 CB LYS A 39 89.994 8.782 9.770 1.00 1.00 C ATOM 595 CG LYS A 39 91.201 9.723 9.756 1.00 1.00 C ATOM 596 CD LYS A 39 92.465 8.927 9.427 1.00 1.00 C ATOM 597 CE LYS A 39 92.943 8.188 10.678 1.00 1.00 C ATOM 598 NZ LYS A 39 93.237 6.768 10.335 1.00 1.00 N ATOM 0 H LYS A 39 87.675 7.679 8.181 1.00 1.00 H new ATOM 0 HA LYS A 39 90.347 8.817 7.639 1.00 1.00 H new ATOM 0 HB2 LYS A 39 89.118 9.304 10.154 1.00 1.00 H new ATOM 0 HB3 LYS A 39 90.183 7.942 10.438 1.00 1.00 H new ATOM 0 HG2 LYS A 39 91.052 10.511 9.018 1.00 1.00 H new ATOM 0 HG3 LYS A 39 91.307 10.210 10.725 1.00 1.00 H new ATOM 0 HD2 LYS A 39 92.261 8.215 8.627 1.00 1.00 H new ATOM 0 HD3 LYS A 39 93.246 9.597 9.067 1.00 1.00 H new ATOM 0 HE2 LYS A 39 93.836 8.669 11.078 1.00 1.00 H new ATOM 0 HE3 LYS A 39 92.180 8.235 11.455 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 92.495 6.155 10.728 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 93.264 6.659 9.301 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 94.158 6.498 10.736 1.00 1.00 H new ATOM 612 N SER A 40 90.978 6.304 9.031 1.00 1.00 N ATOM 613 CA SER A 40 91.351 4.861 8.979 1.00 1.00 C ATOM 614 C SER A 40 91.543 4.439 7.522 1.00 1.00 C ATOM 615 O SER A 40 91.768 5.260 6.658 1.00 1.00 O ATOM 616 CB SER A 40 90.241 4.023 9.614 1.00 1.00 C ATOM 617 OG SER A 40 90.745 2.730 9.918 1.00 1.00 O ATOM 0 H SER A 40 91.494 6.859 9.714 1.00 1.00 H new ATOM 0 HA SER A 40 92.280 4.704 9.528 1.00 1.00 H new ATOM 0 HB2 SER A 40 89.878 4.507 10.521 1.00 1.00 H new ATOM 0 HB3 SER A 40 89.394 3.945 8.933 1.00 1.00 H new ATOM 0 HG SER A 40 90.036 2.191 10.327 1.00 1.00 H new ATOM 623 N LYS A 41 91.455 3.168 7.238 1.00 1.00 N ATOM 624 CA LYS A 41 91.632 2.708 5.830 1.00 1.00 C ATOM 625 C LYS A 41 90.705 1.516 5.561 1.00 1.00 C ATOM 626 O LYS A 41 90.468 0.701 6.430 1.00 1.00 O ATOM 627 CB LYS A 41 93.087 2.280 5.608 1.00 1.00 C ATOM 628 CG LYS A 41 93.555 1.419 6.783 1.00 1.00 C ATOM 629 CD LYS A 41 94.289 2.297 7.799 1.00 1.00 C ATOM 630 CE LYS A 41 95.753 2.447 7.381 1.00 1.00 C ATOM 631 NZ LYS A 41 96.341 3.640 8.053 1.00 1.00 N ATOM 0 H LYS A 41 91.269 2.430 7.917 1.00 1.00 H new ATOM 0 HA LYS A 41 91.385 3.523 5.150 1.00 1.00 H new ATOM 0 HB2 LYS A 41 93.174 1.720 4.677 1.00 1.00 H new ATOM 0 HB3 LYS A 41 93.724 3.159 5.512 1.00 1.00 H new ATOM 0 HG2 LYS A 41 92.701 0.934 7.255 1.00 1.00 H new ATOM 0 HG3 LYS A 41 94.214 0.627 6.427 1.00 1.00 H new ATOM 0 HD2 LYS A 41 93.815 3.277 7.859 1.00 1.00 H new ATOM 0 HD3 LYS A 41 94.227 1.852 8.792 1.00 1.00 H new ATOM 0 HE2 LYS A 41 96.313 1.552 7.651 1.00 1.00 H new ATOM 0 HE3 LYS A 41 95.824 2.554 6.299 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 97.336 3.743 7.769 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 95.812 4.491 7.775 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 96.286 3.520 9.085 1.00 1.00 H new ATOM 645 N PRO A 42 90.189 1.412 4.361 1.00 1.00 N ATOM 646 CA PRO A 42 89.278 0.295 3.972 1.00 1.00 C ATOM 647 C PRO A 42 90.027 -1.038 3.859 1.00 1.00 C ATOM 648 O PRO A 42 91.237 -1.069 3.758 1.00 1.00 O ATOM 649 CB PRO A 42 88.733 0.727 2.605 1.00 1.00 C ATOM 650 CG PRO A 42 89.763 1.654 2.049 1.00 1.00 C ATOM 651 CD PRO A 42 90.420 2.345 3.246 1.00 1.00 C ATOM 0 HA PRO A 42 88.496 0.126 4.713 1.00 1.00 H new ATOM 0 HB2 PRO A 42 88.583 -0.132 1.951 1.00 1.00 H new ATOM 0 HB3 PRO A 42 87.768 1.224 2.705 1.00 1.00 H new ATOM 0 HG2 PRO A 42 90.502 1.106 1.464 1.00 1.00 H new ATOM 0 HG3 PRO A 42 89.307 2.385 1.382 1.00 1.00 H new ATOM 0 HD2 PRO A 42 91.484 2.511 3.077 1.00 1.00 H new ATOM 0 HD3 PRO A 42 89.972 3.320 3.441 1.00 1.00 H new ATOM 659 N PRO A 43 89.310 -2.131 3.872 1.00 1.00 N ATOM 660 CA PRO A 43 89.914 -3.492 3.766 1.00 1.00 C ATOM 661 C PRO A 43 90.760 -3.643 2.497 1.00 1.00 C ATOM 662 O PRO A 43 90.511 -3.004 1.495 1.00 1.00 O ATOM 663 CB PRO A 43 88.704 -4.443 3.733 1.00 1.00 C ATOM 664 CG PRO A 43 87.513 -3.585 3.453 1.00 1.00 C ATOM 665 CD PRO A 43 87.846 -2.191 3.982 1.00 1.00 C ATOM 0 HA PRO A 43 90.593 -3.700 4.593 1.00 1.00 H new ATOM 0 HB2 PRO A 43 88.827 -5.204 2.962 1.00 1.00 H new ATOM 0 HB3 PRO A 43 88.593 -4.966 4.683 1.00 1.00 H new ATOM 0 HG2 PRO A 43 87.301 -3.553 2.384 1.00 1.00 H new ATOM 0 HG3 PRO A 43 86.625 -3.983 3.943 1.00 1.00 H new ATOM 0 HD2 PRO A 43 87.366 -1.411 3.392 1.00 1.00 H new ATOM 0 HD3 PRO A 43 87.514 -2.061 5.012 1.00 1.00 H new ATOM 673 N LYS A 44 91.760 -4.481 2.536 1.00 1.00 N ATOM 674 CA LYS A 44 92.624 -4.671 1.336 1.00 1.00 C ATOM 675 C LYS A 44 93.347 -3.357 1.019 1.00 1.00 C ATOM 676 O LYS A 44 94.014 -2.793 1.865 1.00 1.00 O ATOM 677 CB LYS A 44 91.756 -5.100 0.145 1.00 1.00 C ATOM 678 CG LYS A 44 92.627 -5.803 -0.898 1.00 1.00 C ATOM 679 CD LYS A 44 91.735 -6.429 -1.971 1.00 1.00 C ATOM 680 CE LYS A 44 90.936 -7.583 -1.362 1.00 1.00 C ATOM 681 NZ LYS A 44 90.687 -8.619 -2.404 1.00 1.00 N ATOM 0 H LYS A 44 92.016 -5.043 3.348 1.00 1.00 H new ATOM 0 HA LYS A 44 93.365 -5.446 1.532 1.00 1.00 H new ATOM 0 HB2 LYS A 44 90.963 -5.768 0.482 1.00 1.00 H new ATOM 0 HB3 LYS A 44 91.272 -4.229 -0.298 1.00 1.00 H new ATOM 0 HG2 LYS A 44 93.315 -5.090 -1.353 1.00 1.00 H new ATOM 0 HG3 LYS A 44 93.234 -6.572 -0.421 1.00 1.00 H new ATOM 0 HD2 LYS A 44 91.057 -5.679 -2.378 1.00 1.00 H new ATOM 0 HD3 LYS A 44 92.344 -6.792 -2.799 1.00 1.00 H new ATOM 0 HE2 LYS A 44 91.484 -8.017 -0.526 1.00 1.00 H new ATOM 0 HE3 LYS A 44 89.989 -7.215 -0.966 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 90.144 -9.404 -1.991 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 90.148 -8.200 -3.188 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 91.596 -8.977 -2.761 1.00 1.00 H new ATOM 695 N LYS A 45 93.225 -2.862 -0.187 1.00 1.00 N ATOM 696 CA LYS A 45 93.912 -1.583 -0.545 1.00 1.00 C ATOM 697 C LYS A 45 92.915 -0.631 -1.212 1.00 1.00 C ATOM 698 O LYS A 45 93.082 -0.239 -2.350 1.00 1.00 O ATOM 699 CB LYS A 45 95.069 -1.876 -1.507 1.00 1.00 C ATOM 700 CG LYS A 45 94.530 -2.552 -2.769 1.00 1.00 C ATOM 701 CD LYS A 45 95.605 -3.471 -3.355 1.00 1.00 C ATOM 702 CE LYS A 45 96.854 -2.651 -3.685 1.00 1.00 C ATOM 703 NZ LYS A 45 97.842 -3.515 -4.390 1.00 1.00 N ATOM 0 H LYS A 45 92.681 -3.287 -0.938 1.00 1.00 H new ATOM 0 HA LYS A 45 94.303 -1.117 0.359 1.00 1.00 H new ATOM 0 HB2 LYS A 45 95.581 -0.950 -1.769 1.00 1.00 H new ATOM 0 HB3 LYS A 45 95.803 -2.520 -1.023 1.00 1.00 H new ATOM 0 HG2 LYS A 45 93.635 -3.127 -2.532 1.00 1.00 H new ATOM 0 HG3 LYS A 45 94.241 -1.799 -3.502 1.00 1.00 H new ATOM 0 HD2 LYS A 45 95.852 -4.259 -2.643 1.00 1.00 H new ATOM 0 HD3 LYS A 45 95.230 -3.960 -4.254 1.00 1.00 H new ATOM 0 HE2 LYS A 45 96.588 -1.799 -4.311 1.00 1.00 H new ATOM 0 HE3 LYS A 45 97.292 -2.251 -2.770 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 98.691 -2.959 -4.615 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 98.103 -4.314 -3.778 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 97.422 -3.876 -5.270 1.00 1.00 H new ATOM 717 N GLY A 46 91.882 -0.250 -0.511 1.00 1.00 N ATOM 718 CA GLY A 46 90.879 0.681 -1.105 1.00 1.00 C ATOM 719 C GLY A 46 91.292 2.126 -0.816 1.00 1.00 C ATOM 720 O GLY A 46 90.464 3.010 -0.726 1.00 1.00 O ATOM 0 H GLY A 46 91.689 -0.543 0.447 1.00 1.00 H new ATOM 0 HA2 GLY A 46 90.809 0.519 -2.181 1.00 1.00 H new ATOM 0 HA3 GLY A 46 89.891 0.483 -0.688 1.00 1.00 H new ATOM 724 N VAL A 47 92.569 2.369 -0.669 1.00 1.00 N ATOM 725 CA VAL A 47 93.049 3.753 -0.383 1.00 1.00 C ATOM 726 C VAL A 47 92.380 4.283 0.888 1.00 1.00 C ATOM 727 O VAL A 47 91.283 3.893 1.234 1.00 1.00 O ATOM 728 CB VAL A 47 92.713 4.671 -1.562 1.00 1.00 C ATOM 729 CG1 VAL A 47 93.176 6.095 -1.249 1.00 1.00 C ATOM 730 CG2 VAL A 47 93.428 4.168 -2.818 1.00 1.00 C ATOM 0 H VAL A 47 93.303 1.664 -0.735 1.00 1.00 H new ATOM 0 HA VAL A 47 94.129 3.733 -0.238 1.00 1.00 H new ATOM 0 HB VAL A 47 91.636 4.668 -1.729 1.00 1.00 H new ATOM 0 HG11 VAL A 47 92.937 6.748 -2.088 1.00 1.00 H new ATOM 0 HG12 VAL A 47 92.669 6.454 -0.354 1.00 1.00 H new ATOM 0 HG13 VAL A 47 94.253 6.099 -1.082 1.00 1.00 H new ATOM 0 HG21 VAL A 47 93.190 4.820 -3.658 1.00 1.00 H new ATOM 0 HG22 VAL A 47 94.505 4.172 -2.650 1.00 1.00 H new ATOM 0 HG23 VAL A 47 93.099 3.153 -3.042 1.00 1.00 H new ATOM 740 N GLN A 48 93.034 5.170 1.587 1.00 1.00 N ATOM 741 CA GLN A 48 92.439 5.724 2.836 1.00 1.00 C ATOM 742 C GLN A 48 91.016 6.212 2.553 1.00 1.00 C ATOM 743 O GLN A 48 90.742 6.788 1.519 1.00 1.00 O ATOM 744 CB GLN A 48 93.291 6.896 3.332 1.00 1.00 C ATOM 745 CG GLN A 48 92.570 7.602 4.482 1.00 1.00 C ATOM 746 CD GLN A 48 93.569 8.459 5.262 1.00 1.00 C ATOM 747 OE1 GLN A 48 94.499 7.945 5.851 1.00 1.00 O ATOM 748 NE2 GLN A 48 93.415 9.755 5.290 1.00 1.00 N ATOM 0 H GLN A 48 93.956 5.535 1.347 1.00 1.00 H new ATOM 0 HA GLN A 48 92.411 4.946 3.599 1.00 1.00 H new ATOM 0 HB2 GLN A 48 94.264 6.536 3.666 1.00 1.00 H new ATOM 0 HB3 GLN A 48 93.473 7.597 2.518 1.00 1.00 H new ATOM 0 HG2 GLN A 48 91.766 8.226 4.092 1.00 1.00 H new ATOM 0 HG3 GLN A 48 92.111 6.867 5.143 1.00 1.00 H new ATOM 0 HE21 GLN A 48 92.634 10.187 4.795 1.00 1.00 H new ATOM 0 HE22 GLN A 48 94.075 10.336 5.806 1.00 1.00 H new ATOM 757 N GLY A 49 90.108 5.989 3.466 1.00 1.00 N ATOM 758 CA GLY A 49 88.704 6.445 3.251 1.00 1.00 C ATOM 759 C GLY A 49 87.733 5.460 3.906 1.00 1.00 C ATOM 760 O GLY A 49 86.893 4.876 3.250 1.00 1.00 O ATOM 0 H GLY A 49 90.278 5.511 4.351 1.00 1.00 H new ATOM 0 HA2 GLY A 49 88.567 7.440 3.673 1.00 1.00 H new ATOM 0 HA3 GLY A 49 88.496 6.520 2.184 1.00 1.00 H new ATOM 764 N CYS A 50 87.836 5.273 5.195 1.00 1.00 N ATOM 765 CA CYS A 50 86.911 4.327 5.881 1.00 1.00 C ATOM 766 C CYS A 50 87.075 4.458 7.397 1.00 1.00 C ATOM 767 O CYS A 50 87.309 3.489 8.092 1.00 1.00 O ATOM 768 CB CYS A 50 87.236 2.894 5.453 1.00 1.00 C ATOM 769 SG CYS A 50 85.851 1.809 5.877 1.00 1.00 S ATOM 0 H CYS A 50 88.517 5.732 5.799 1.00 1.00 H new ATOM 0 HA CYS A 50 85.883 4.563 5.607 1.00 1.00 H new ATOM 0 HB2 CYS A 50 87.425 2.858 4.380 1.00 1.00 H new ATOM 0 HB3 CYS A 50 88.145 2.552 5.949 1.00 1.00 H new ATOM 774 N GLY A 51 86.950 5.649 7.916 1.00 1.00 N ATOM 775 CA GLY A 51 87.096 5.845 9.387 1.00 1.00 C ATOM 776 C GLY A 51 86.293 4.779 10.135 1.00 1.00 C ATOM 777 O GLY A 51 86.762 4.193 11.090 1.00 1.00 O ATOM 0 H GLY A 51 86.753 6.497 7.384 1.00 1.00 H new ATOM 0 HA2 GLY A 51 88.147 5.785 9.668 1.00 1.00 H new ATOM 0 HA3 GLY A 51 86.747 6.839 9.667 1.00 1.00 H new ATOM 781 N ASP A 52 85.084 4.525 9.712 1.00 1.00 N ATOM 782 CA ASP A 52 84.253 3.499 10.403 1.00 1.00 C ATOM 783 C ASP A 52 84.212 3.801 11.903 1.00 1.00 C ATOM 784 O ASP A 52 83.339 4.498 12.381 1.00 1.00 O ATOM 785 CB ASP A 52 84.862 2.112 10.179 1.00 1.00 C ATOM 786 CG ASP A 52 84.028 1.063 10.916 1.00 1.00 C ATOM 787 OD1 ASP A 52 84.167 0.966 12.124 1.00 1.00 O ATOM 788 OD2 ASP A 52 83.264 0.374 10.260 1.00 1.00 O ATOM 0 H ASP A 52 84.637 4.984 8.918 1.00 1.00 H new ATOM 0 HA ASP A 52 83.241 3.521 10.000 1.00 1.00 H new ATOM 0 HB2 ASP A 52 84.893 1.884 9.113 1.00 1.00 H new ATOM 0 HB3 ASP A 52 85.891 2.092 10.539 1.00 1.00 H new ATOM 793 N ASP A 53 85.150 3.283 12.649 1.00 1.00 N ATOM 794 CA ASP A 53 85.169 3.540 14.119 1.00 1.00 C ATOM 795 C ASP A 53 83.932 2.913 14.768 1.00 1.00 C ATOM 796 O ASP A 53 84.028 1.953 15.505 1.00 1.00 O ATOM 797 CB ASP A 53 85.175 5.051 14.377 1.00 1.00 C ATOM 798 CG ASP A 53 86.015 5.748 13.305 1.00 1.00 C ATOM 799 OD1 ASP A 53 87.221 5.567 13.315 1.00 1.00 O ATOM 800 OD2 ASP A 53 85.437 6.451 12.492 1.00 1.00 O ATOM 0 H ASP A 53 85.906 2.692 12.304 1.00 1.00 H new ATOM 0 HA ASP A 53 86.066 3.096 14.551 1.00 1.00 H new ATOM 0 HB2 ASP A 53 84.156 5.437 14.364 1.00 1.00 H new ATOM 0 HB3 ASP A 53 85.582 5.260 15.366 1.00 1.00 H new ATOM 805 N ILE A 54 82.771 3.452 14.502 1.00 1.00 N ATOM 806 CA ILE A 54 81.525 2.893 15.105 1.00 1.00 C ATOM 807 C ILE A 54 80.805 2.015 14.070 1.00 1.00 C ATOM 808 O ILE A 54 80.250 2.518 13.113 1.00 1.00 O ATOM 809 CB ILE A 54 80.604 4.045 15.514 1.00 1.00 C ATOM 810 CG1 ILE A 54 81.415 5.101 16.269 1.00 1.00 C ATOM 811 CG2 ILE A 54 79.492 3.514 16.421 1.00 1.00 C ATOM 812 CD1 ILE A 54 82.200 4.432 17.398 1.00 1.00 C ATOM 0 H ILE A 54 82.632 4.257 13.892 1.00 1.00 H new ATOM 0 HA ILE A 54 81.779 2.294 15.979 1.00 1.00 H new ATOM 0 HB ILE A 54 80.163 4.491 14.623 1.00 1.00 H new ATOM 0 HG12 ILE A 54 82.098 5.606 15.587 1.00 1.00 H new ATOM 0 HG13 ILE A 54 80.750 5.863 16.676 1.00 1.00 H new ATOM 0 HG21 ILE A 54 78.837 4.335 16.712 1.00 1.00 H new ATOM 0 HG22 ILE A 54 78.914 2.761 15.885 1.00 1.00 H new ATOM 0 HG23 ILE A 54 79.932 3.068 17.313 1.00 1.00 H new ATOM 0 HD11 ILE A 54 82.777 5.184 17.935 1.00 1.00 H new ATOM 0 HD12 ILE A 54 81.507 3.947 18.086 1.00 1.00 H new ATOM 0 HD13 ILE A 54 82.876 3.687 16.979 1.00 1.00 H new ATOM 824 N PRO A 55 80.809 0.715 14.251 1.00 1.00 N ATOM 825 CA PRO A 55 80.140 -0.224 13.307 1.00 1.00 C ATOM 826 C PRO A 55 78.632 -0.321 13.561 1.00 1.00 C ATOM 827 O PRO A 55 78.147 -1.291 14.108 1.00 1.00 O ATOM 828 CB PRO A 55 80.824 -1.559 13.598 1.00 1.00 C ATOM 829 CG PRO A 55 81.212 -1.484 15.039 1.00 1.00 C ATOM 830 CD PRO A 55 81.449 -0.004 15.365 1.00 1.00 C ATOM 0 HA PRO A 55 80.232 0.098 12.270 1.00 1.00 H new ATOM 0 HB2 PRO A 55 80.151 -2.397 13.413 1.00 1.00 H new ATOM 0 HB3 PRO A 55 81.696 -1.704 12.961 1.00 1.00 H new ATOM 0 HG2 PRO A 55 80.426 -1.897 15.672 1.00 1.00 H new ATOM 0 HG3 PRO A 55 82.112 -2.069 15.227 1.00 1.00 H new ATOM 0 HD2 PRO A 55 81.006 0.269 16.323 1.00 1.00 H new ATOM 0 HD3 PRO A 55 82.513 0.225 15.429 1.00 1.00 H new ATOM 838 N GLY A 56 77.889 0.680 13.169 1.00 1.00 N ATOM 839 CA GLY A 56 76.413 0.650 13.388 1.00 1.00 C ATOM 840 C GLY A 56 75.703 1.220 12.160 1.00 1.00 C ATOM 841 O GLY A 56 75.522 0.543 11.167 1.00 1.00 O ATOM 0 H GLY A 56 78.241 1.518 12.706 1.00 1.00 H new ATOM 0 HA2 GLY A 56 76.083 -0.373 13.570 1.00 1.00 H new ATOM 0 HA3 GLY A 56 76.154 1.231 14.273 1.00 1.00 H new ATOM 845 N MET A 57 75.297 2.459 12.217 1.00 1.00 N ATOM 846 CA MET A 57 74.598 3.066 11.049 1.00 1.00 C ATOM 847 C MET A 57 73.510 2.110 10.552 1.00 1.00 C ATOM 848 O MET A 57 73.640 1.491 9.515 1.00 1.00 O ATOM 849 CB MET A 57 75.607 3.317 9.926 1.00 1.00 C ATOM 850 CG MET A 57 76.536 4.466 10.322 1.00 1.00 C ATOM 851 SD MET A 57 77.578 3.950 11.708 1.00 1.00 S ATOM 852 CE MET A 57 77.918 5.602 12.364 1.00 1.00 C ATOM 0 H MET A 57 75.419 3.076 13.020 1.00 1.00 H new ATOM 0 HA MET A 57 74.143 4.010 11.348 1.00 1.00 H new ATOM 0 HB2 MET A 57 76.188 2.414 9.736 1.00 1.00 H new ATOM 0 HB3 MET A 57 75.084 3.560 9.001 1.00 1.00 H new ATOM 0 HG2 MET A 57 77.157 4.754 9.474 1.00 1.00 H new ATOM 0 HG3 MET A 57 75.950 5.342 10.600 1.00 1.00 H new ATOM 0 HE1 MET A 57 78.558 5.520 13.242 1.00 1.00 H new ATOM 0 HE2 MET A 57 78.420 6.199 11.603 1.00 1.00 H new ATOM 0 HE3 MET A 57 76.980 6.083 12.642 1.00 1.00 H new ATOM 862 N GLU A 58 72.439 1.984 11.287 1.00 1.00 N ATOM 863 CA GLU A 58 71.344 1.068 10.859 1.00 1.00 C ATOM 864 C GLU A 58 71.007 1.323 9.388 1.00 1.00 C ATOM 865 O GLU A 58 71.158 0.459 8.547 1.00 1.00 O ATOM 866 CB GLU A 58 70.102 1.324 11.715 1.00 1.00 C ATOM 867 CG GLU A 58 70.399 0.955 13.170 1.00 1.00 C ATOM 868 CD GLU A 58 70.541 -0.563 13.293 1.00 1.00 C ATOM 869 OE1 GLU A 58 69.523 -1.234 13.313 1.00 1.00 O ATOM 870 OE2 GLU A 58 71.667 -1.029 13.366 1.00 1.00 O ATOM 0 H GLU A 58 72.275 2.476 12.165 1.00 1.00 H new ATOM 0 HA GLU A 58 71.668 0.035 10.984 1.00 1.00 H new ATOM 0 HB2 GLU A 58 69.810 2.372 11.647 1.00 1.00 H new ATOM 0 HB3 GLU A 58 69.264 0.735 11.343 1.00 1.00 H new ATOM 0 HG2 GLU A 58 71.315 1.445 13.501 1.00 1.00 H new ATOM 0 HG3 GLU A 58 69.597 1.309 13.817 1.00 1.00 H new ATOM 877 N GLY A 59 70.551 2.503 9.073 1.00 1.00 N ATOM 878 CA GLY A 59 70.202 2.817 7.659 1.00 1.00 C ATOM 879 C GLY A 59 69.315 4.060 7.620 1.00 1.00 C ATOM 880 O GLY A 59 68.552 4.259 6.696 1.00 1.00 O ATOM 0 H GLY A 59 70.405 3.265 9.735 1.00 1.00 H new ATOM 0 HA2 GLY A 59 71.109 2.985 7.078 1.00 1.00 H new ATOM 0 HA3 GLY A 59 69.684 1.973 7.204 1.00 1.00 H new ATOM 884 N CYS A 60 69.411 4.896 8.624 1.00 1.00 N ATOM 885 CA CYS A 60 68.581 6.135 8.667 1.00 1.00 C ATOM 886 C CYS A 60 67.192 5.850 8.098 1.00 1.00 C ATOM 887 O CYS A 60 66.720 4.730 8.107 1.00 1.00 O ATOM 888 CB CYS A 60 69.246 7.232 7.834 1.00 1.00 C ATOM 889 SG CYS A 60 69.404 6.674 6.119 1.00 1.00 S ATOM 0 H CYS A 60 70.035 4.770 9.421 1.00 1.00 H new ATOM 0 HA CYS A 60 68.491 6.463 9.703 1.00 1.00 H new ATOM 0 HB2 CYS A 60 68.654 8.146 7.877 1.00 1.00 H new ATOM 0 HB3 CYS A 60 70.228 7.469 8.243 1.00 1.00 H new ATOM 894 N GLY A 61 66.547 6.865 7.593 1.00 1.00 N ATOM 895 CA GLY A 61 65.195 6.687 7.001 1.00 1.00 C ATOM 896 C GLY A 61 65.233 7.148 5.546 1.00 1.00 C ATOM 897 O GLY A 61 66.285 7.258 4.950 1.00 1.00 O ATOM 0 H GLY A 61 66.905 7.820 7.566 1.00 1.00 H new ATOM 0 HA2 GLY A 61 64.892 5.641 7.058 1.00 1.00 H new ATOM 0 HA3 GLY A 61 64.458 7.263 7.561 1.00 1.00 H new ATOM 901 N THR A 62 64.091 7.423 4.981 1.00 1.00 N ATOM 902 CA THR A 62 64.024 7.886 3.559 1.00 1.00 C ATOM 903 C THR A 62 65.181 7.293 2.748 1.00 1.00 C ATOM 904 O THR A 62 65.725 7.932 1.869 1.00 1.00 O ATOM 905 CB THR A 62 64.103 9.414 3.511 1.00 1.00 C ATOM 906 OG1 THR A 62 64.170 9.840 2.158 1.00 1.00 O ATOM 907 CG2 THR A 62 65.350 9.886 4.260 1.00 1.00 C ATOM 0 H THR A 62 63.187 7.347 5.447 1.00 1.00 H new ATOM 0 HA THR A 62 63.081 7.551 3.128 1.00 1.00 H new ATOM 0 HB THR A 62 63.217 9.840 3.983 1.00 1.00 H new ATOM 0 HG1 THR A 62 64.936 9.415 1.719 1.00 1.00 H new ATOM 0 HG21 THR A 62 65.405 10.974 4.225 1.00 1.00 H new ATOM 0 HG22 THR A 62 65.297 9.558 5.298 1.00 1.00 H new ATOM 0 HG23 THR A 62 66.238 9.462 3.791 1.00 1.00 H new ATOM 915 N ASP A 63 65.564 6.081 3.036 1.00 1.00 N ATOM 916 CA ASP A 63 66.686 5.460 2.280 1.00 1.00 C ATOM 917 C ASP A 63 66.243 5.187 0.843 1.00 1.00 C ATOM 918 O ASP A 63 67.056 5.055 -0.050 1.00 1.00 O ATOM 919 CB ASP A 63 67.087 4.145 2.951 1.00 1.00 C ATOM 920 CG ASP A 63 65.837 3.304 3.215 1.00 1.00 C ATOM 921 OD1 ASP A 63 64.872 3.854 3.720 1.00 1.00 O ATOM 922 OD2 ASP A 63 65.865 2.124 2.907 1.00 1.00 O ATOM 0 H ASP A 63 65.150 5.495 3.761 1.00 1.00 H new ATOM 0 HA ASP A 63 67.539 6.138 2.273 1.00 1.00 H new ATOM 0 HB2 ASP A 63 67.780 3.596 2.313 1.00 1.00 H new ATOM 0 HB3 ASP A 63 67.607 4.346 3.888 1.00 1.00 H new ATOM 927 N ILE A 64 64.959 5.104 0.612 1.00 1.00 N ATOM 928 CA ILE A 64 64.458 4.838 -0.771 1.00 1.00 C ATOM 929 C ILE A 64 63.262 5.746 -1.062 1.00 1.00 C ATOM 930 O ILE A 64 62.466 5.484 -1.940 1.00 1.00 O ATOM 931 CB ILE A 64 64.047 3.364 -0.888 1.00 1.00 C ATOM 932 CG1 ILE A 64 63.287 3.151 -2.199 1.00 1.00 C ATOM 933 CG2 ILE A 64 63.145 2.990 0.289 1.00 1.00 C ATOM 934 CD1 ILE A 64 63.447 1.698 -2.652 1.00 1.00 C ATOM 0 H ILE A 64 64.234 5.209 1.322 1.00 1.00 H new ATOM 0 HA ILE A 64 65.245 5.046 -1.496 1.00 1.00 H new ATOM 0 HB ILE A 64 64.938 2.736 -0.876 1.00 1.00 H new ATOM 0 HG12 ILE A 64 62.232 3.386 -2.062 1.00 1.00 H new ATOM 0 HG13 ILE A 64 63.667 3.826 -2.966 1.00 1.00 H new ATOM 0 HG21 ILE A 64 62.853 1.943 0.206 1.00 1.00 H new ATOM 0 HG22 ILE A 64 63.684 3.143 1.224 1.00 1.00 H new ATOM 0 HG23 ILE A 64 62.253 3.617 0.278 1.00 1.00 H new ATOM 0 HD11 ILE A 64 62.906 1.546 -3.586 1.00 1.00 H new ATOM 0 HD12 ILE A 64 64.504 1.479 -2.805 1.00 1.00 H new ATOM 0 HD13 ILE A 64 63.046 1.032 -1.888 1.00 1.00 H new ATOM 946 N THR A 65 63.134 6.829 -0.346 1.00 1.00 N ATOM 947 CA THR A 65 61.995 7.752 -0.608 1.00 1.00 C ATOM 948 C THR A 65 61.907 8.000 -2.115 1.00 1.00 C ATOM 949 O THR A 65 60.922 8.503 -2.618 1.00 1.00 O ATOM 950 CB THR A 65 62.229 9.080 0.119 1.00 1.00 C ATOM 951 OG1 THR A 65 62.069 8.887 1.517 1.00 1.00 O ATOM 952 CG2 THR A 65 61.220 10.119 -0.373 1.00 1.00 C ATOM 0 H THR A 65 63.764 7.113 0.404 1.00 1.00 H new ATOM 0 HA THR A 65 61.066 7.310 -0.247 1.00 1.00 H new ATOM 0 HB THR A 65 63.239 9.433 -0.086 1.00 1.00 H new ATOM 0 HG1 THR A 65 62.511 9.616 2.001 1.00 1.00 H new ATOM 0 HG21 THR A 65 61.388 11.063 0.145 1.00 1.00 H new ATOM 0 HG22 THR A 65 61.344 10.267 -1.446 1.00 1.00 H new ATOM 0 HG23 THR A 65 60.208 9.768 -0.170 1.00 1.00 H new ATOM 960 N VAL A 66 62.936 7.639 -2.836 1.00 1.00 N ATOM 961 CA VAL A 66 62.929 7.840 -4.310 1.00 1.00 C ATOM 962 C VAL A 66 63.775 6.752 -4.981 1.00 1.00 C ATOM 963 O VAL A 66 63.255 5.870 -5.636 1.00 1.00 O ATOM 964 CB VAL A 66 63.508 9.225 -4.642 1.00 1.00 C ATOM 965 CG1 VAL A 66 62.372 10.245 -4.737 1.00 1.00 C ATOM 966 CG2 VAL A 66 64.480 9.648 -3.538 1.00 1.00 C ATOM 0 H VAL A 66 63.784 7.212 -2.463 1.00 1.00 H new ATOM 0 HA VAL A 66 61.905 7.779 -4.680 1.00 1.00 H new ATOM 0 HB VAL A 66 64.035 9.179 -5.595 1.00 1.00 H new ATOM 0 HG11 VAL A 66 62.783 11.227 -4.972 1.00 1.00 H new ATOM 0 HG12 VAL A 66 61.678 9.945 -5.522 1.00 1.00 H new ATOM 0 HG13 VAL A 66 61.844 10.292 -3.784 1.00 1.00 H new ATOM 0 HG21 VAL A 66 64.891 10.630 -3.772 1.00 1.00 H new ATOM 0 HG22 VAL A 66 63.952 9.694 -2.586 1.00 1.00 H new ATOM 0 HG23 VAL A 66 65.290 8.922 -3.469 1.00 1.00 H new ATOM 976 N ILE A 67 65.075 6.812 -4.839 1.00 1.00 N ATOM 977 CA ILE A 67 65.948 5.787 -5.484 1.00 1.00 C ATOM 978 C ILE A 67 67.055 5.344 -4.523 1.00 1.00 C ATOM 979 O ILE A 67 68.082 5.985 -4.415 1.00 1.00 O ATOM 980 CB ILE A 67 66.580 6.391 -6.743 1.00 1.00 C ATOM 981 CG1 ILE A 67 65.524 6.485 -7.847 1.00 1.00 C ATOM 982 CG2 ILE A 67 67.731 5.501 -7.215 1.00 1.00 C ATOM 983 CD1 ILE A 67 66.045 7.374 -8.978 1.00 1.00 C ATOM 0 H ILE A 67 65.569 7.527 -4.304 1.00 1.00 H new ATOM 0 HA ILE A 67 65.344 4.918 -5.745 1.00 1.00 H new ATOM 0 HB ILE A 67 66.961 7.387 -6.516 1.00 1.00 H new ATOM 0 HG12 ILE A 67 65.293 5.491 -8.229 1.00 1.00 H new ATOM 0 HG13 ILE A 67 64.598 6.895 -7.445 1.00 1.00 H new ATOM 0 HG21 ILE A 67 68.180 5.931 -8.110 1.00 1.00 H new ATOM 0 HG22 ILE A 67 68.483 5.432 -6.429 1.00 1.00 H new ATOM 0 HG23 ILE A 67 67.351 4.505 -7.442 1.00 1.00 H new ATOM 0 HD11 ILE A 67 65.293 7.441 -9.764 1.00 1.00 H new ATOM 0 HD12 ILE A 67 66.254 8.371 -8.590 1.00 1.00 H new ATOM 0 HD13 ILE A 67 66.960 6.944 -9.387 1.00 1.00 H new ATOM 995 N CYS A 68 66.880 4.243 -3.845 1.00 1.00 N ATOM 996 CA CYS A 68 67.958 3.772 -2.930 1.00 1.00 C ATOM 997 C CYS A 68 69.132 3.262 -3.775 1.00 1.00 C ATOM 998 O CYS A 68 68.962 2.412 -4.626 1.00 1.00 O ATOM 999 CB CYS A 68 67.426 2.637 -2.046 1.00 1.00 C ATOM 1000 SG CYS A 68 68.744 1.433 -1.750 1.00 1.00 S ATOM 0 H CYS A 68 66.047 3.655 -3.884 1.00 1.00 H new ATOM 0 HA CYS A 68 68.288 4.592 -2.292 1.00 1.00 H new ATOM 0 HB2 CYS A 68 67.066 3.038 -1.099 1.00 1.00 H new ATOM 0 HB3 CYS A 68 66.578 2.152 -2.530 1.00 1.00 H new ATOM 1005 N PRO A 69 70.318 3.777 -3.561 1.00 1.00 N ATOM 1006 CA PRO A 69 71.517 3.354 -4.339 1.00 1.00 C ATOM 1007 C PRO A 69 71.583 1.834 -4.542 1.00 1.00 C ATOM 1008 O PRO A 69 72.043 1.355 -5.560 1.00 1.00 O ATOM 1009 CB PRO A 69 72.690 3.834 -3.481 1.00 1.00 C ATOM 1010 CG PRO A 69 72.163 5.005 -2.715 1.00 1.00 C ATOM 1011 CD PRO A 69 70.650 4.806 -2.563 1.00 1.00 C ATOM 0 HA PRO A 69 71.512 3.770 -5.346 1.00 1.00 H new ATOM 0 HB2 PRO A 69 73.035 3.047 -2.810 1.00 1.00 H new ATOM 0 HB3 PRO A 69 73.540 4.119 -4.101 1.00 1.00 H new ATOM 0 HG2 PRO A 69 72.642 5.072 -1.738 1.00 1.00 H new ATOM 0 HG3 PRO A 69 72.377 5.936 -3.240 1.00 1.00 H new ATOM 0 HD2 PRO A 69 70.390 4.482 -1.555 1.00 1.00 H new ATOM 0 HD3 PRO A 69 70.106 5.732 -2.750 1.00 1.00 H new ATOM 1019 N TRP A 70 71.135 1.074 -3.580 1.00 1.00 N ATOM 1020 CA TRP A 70 71.182 -0.412 -3.716 1.00 1.00 C ATOM 1021 C TRP A 70 70.008 -0.905 -4.565 1.00 1.00 C ATOM 1022 O TRP A 70 69.991 -2.033 -5.017 1.00 1.00 O ATOM 1023 CB TRP A 70 71.097 -1.053 -2.329 1.00 1.00 C ATOM 1024 CG TRP A 70 71.171 -2.540 -2.463 1.00 1.00 C ATOM 1025 CD1 TRP A 70 72.194 -3.219 -3.032 1.00 1.00 C ATOM 1026 CD2 TRP A 70 70.204 -3.542 -2.032 1.00 1.00 C ATOM 1027 NE1 TRP A 70 71.918 -4.572 -2.978 1.00 1.00 N ATOM 1028 CE2 TRP A 70 70.704 -4.824 -2.371 1.00 1.00 C ATOM 1029 CE3 TRP A 70 68.957 -3.466 -1.388 1.00 1.00 C ATOM 1030 CZ2 TRP A 70 69.988 -5.988 -2.080 1.00 1.00 C ATOM 1031 CZ3 TRP A 70 68.236 -4.633 -1.094 1.00 1.00 C ATOM 1032 CH2 TRP A 70 68.749 -5.891 -1.438 1.00 1.00 C ATOM 0 HA TRP A 70 72.118 -0.691 -4.201 1.00 1.00 H new ATOM 0 HB2 TRP A 70 71.911 -0.693 -1.699 1.00 1.00 H new ATOM 0 HB3 TRP A 70 70.165 -0.767 -1.841 1.00 1.00 H new ATOM 0 HD1 TRP A 70 73.082 -2.776 -3.459 1.00 1.00 H new ATOM 0 HE1 TRP A 70 72.536 -5.297 -3.342 1.00 1.00 H new ATOM 0 HE3 TRP A 70 68.551 -2.502 -1.118 1.00 1.00 H new ATOM 0 HZ2 TRP A 70 70.388 -6.955 -2.349 1.00 1.00 H new ATOM 0 HZ3 TRP A 70 67.279 -4.561 -0.599 1.00 1.00 H new ATOM 0 HH2 TRP A 70 68.188 -6.785 -1.208 1.00 1.00 H new ATOM 1043 N GLU A 71 69.017 -0.083 -4.771 1.00 1.00 N ATOM 1044 CA GLU A 71 67.838 -0.523 -5.573 1.00 1.00 C ATOM 1045 C GLU A 71 68.075 -0.265 -7.064 1.00 1.00 C ATOM 1046 O GLU A 71 68.236 -1.182 -7.844 1.00 1.00 O ATOM 1047 CB GLU A 71 66.599 0.252 -5.116 1.00 1.00 C ATOM 1048 CG GLU A 71 65.339 -0.451 -5.624 1.00 1.00 C ATOM 1049 CD GLU A 71 65.242 -0.293 -7.142 1.00 1.00 C ATOM 1050 OE1 GLU A 71 65.473 0.805 -7.620 1.00 1.00 O ATOM 1051 OE2 GLU A 71 64.939 -1.274 -7.802 1.00 1.00 O ATOM 0 HA GLU A 71 67.688 -1.592 -5.421 1.00 1.00 H new ATOM 0 HB2 GLU A 71 66.578 0.316 -4.028 1.00 1.00 H new ATOM 0 HB3 GLU A 71 66.636 1.273 -5.495 1.00 1.00 H new ATOM 0 HG2 GLU A 71 65.368 -1.508 -5.359 1.00 1.00 H new ATOM 0 HG3 GLU A 71 64.456 -0.027 -5.147 1.00 1.00 H new ATOM 1058 N ALA A 72 68.071 0.974 -7.471 1.00 1.00 N ATOM 1059 CA ALA A 72 68.265 1.286 -8.918 1.00 1.00 C ATOM 1060 C ALA A 72 69.708 1.006 -9.350 1.00 1.00 C ATOM 1061 O ALA A 72 69.995 0.000 -9.967 1.00 1.00 O ATOM 1062 CB ALA A 72 67.943 2.760 -9.167 1.00 1.00 C ATOM 0 H ALA A 72 67.942 1.785 -6.866 1.00 1.00 H new ATOM 0 HA ALA A 72 67.597 0.651 -9.500 1.00 1.00 H new ATOM 0 HB1 ALA A 72 68.084 2.990 -10.223 1.00 1.00 H new ATOM 0 HB2 ALA A 72 66.908 2.959 -8.887 1.00 1.00 H new ATOM 0 HB3 ALA A 72 68.607 3.384 -8.568 1.00 1.00 H new ATOM 1068 N CYS A 73 70.613 1.901 -9.055 1.00 1.00 N ATOM 1069 CA CYS A 73 72.030 1.704 -9.477 1.00 1.00 C ATOM 1070 C CYS A 73 72.505 0.303 -9.084 1.00 1.00 C ATOM 1071 O CYS A 73 73.082 0.101 -8.034 1.00 1.00 O ATOM 1072 CB CYS A 73 72.912 2.758 -8.803 1.00 1.00 C ATOM 1073 SG CYS A 73 72.641 4.363 -9.594 1.00 1.00 S ATOM 0 HA CYS A 73 72.100 1.809 -10.560 1.00 1.00 H new ATOM 0 HB2 CYS A 73 72.677 2.819 -7.740 1.00 1.00 H new ATOM 0 HB3 CYS A 73 73.961 2.474 -8.881 1.00 1.00 H new ATOM 1078 N ASN A 74 72.278 -0.659 -9.943 1.00 1.00 N ATOM 1079 CA ASN A 74 72.717 -2.061 -9.668 1.00 1.00 C ATOM 1080 C ASN A 74 72.496 -2.415 -8.194 1.00 1.00 C ATOM 1081 O ASN A 74 71.804 -1.727 -7.469 1.00 1.00 O ATOM 1082 CB ASN A 74 74.208 -2.201 -10.018 1.00 1.00 C ATOM 1083 CG ASN A 74 74.380 -3.265 -11.104 1.00 1.00 C ATOM 1084 OD1 ASN A 74 73.804 -3.162 -12.169 1.00 1.00 O ATOM 1085 ND2 ASN A 74 75.155 -4.291 -10.878 1.00 1.00 N ATOM 0 HA ASN A 74 72.127 -2.744 -10.279 1.00 1.00 H new ATOM 0 HB2 ASN A 74 74.602 -1.246 -10.364 1.00 1.00 H new ATOM 0 HB3 ASN A 74 74.776 -2.477 -9.130 1.00 1.00 H new ATOM 0 HD21 ASN A 74 75.277 -5.006 -11.595 1.00 1.00 H new ATOM 0 HD22 ASN A 74 75.639 -4.378 -9.984 1.00 1.00 H new ATOM 1092 N HIS A 75 73.084 -3.494 -7.753 1.00 1.00 N ATOM 1093 CA HIS A 75 72.926 -3.919 -6.334 1.00 1.00 C ATOM 1094 C HIS A 75 74.265 -4.459 -5.826 1.00 1.00 C ATOM 1095 O HIS A 75 75.236 -4.518 -6.554 1.00 1.00 O ATOM 1096 CB HIS A 75 71.866 -5.021 -6.249 1.00 1.00 C ATOM 1097 CG HIS A 75 70.545 -4.486 -6.729 1.00 1.00 C ATOM 1098 ND1 HIS A 75 70.353 -4.049 -8.031 1.00 1.00 N ATOM 1099 CD2 HIS A 75 69.339 -4.312 -6.092 1.00 1.00 C ATOM 1100 CE1 HIS A 75 69.077 -3.636 -8.138 1.00 1.00 C ATOM 1101 NE2 HIS A 75 68.418 -3.775 -6.986 1.00 1.00 N ATOM 0 H HIS A 75 73.672 -4.104 -8.321 1.00 1.00 H new ATOM 0 HA HIS A 75 72.615 -3.070 -5.725 1.00 1.00 H new ATOM 0 HB2 HIS A 75 72.166 -5.876 -6.855 1.00 1.00 H new ATOM 0 HB3 HIS A 75 71.775 -5.375 -5.222 1.00 1.00 H new ATOM 0 HD2 HIS A 75 69.138 -4.554 -5.059 1.00 1.00 H new ATOM 0 HE1 HIS A 75 68.640 -3.241 -9.043 1.00 1.00 H new ATOM 0 HE2 HIS A 75 67.444 -3.537 -6.800 1.00 1.00 H new ATOM 1110 N CYS A 76 74.329 -4.856 -4.585 1.00 1.00 N ATOM 1111 CA CYS A 76 75.609 -5.395 -4.044 1.00 1.00 C ATOM 1112 C CYS A 76 75.331 -6.168 -2.752 1.00 1.00 C ATOM 1113 O CYS A 76 75.730 -5.765 -1.678 1.00 1.00 O ATOM 1114 CB CYS A 76 76.572 -4.239 -3.758 1.00 1.00 C ATOM 1115 SG CYS A 76 75.633 -2.789 -3.216 1.00 1.00 S ATOM 0 H CYS A 76 73.553 -4.831 -3.924 1.00 1.00 H new ATOM 0 HA CYS A 76 76.060 -6.065 -4.776 1.00 1.00 H new ATOM 0 HB2 CYS A 76 77.288 -4.530 -2.989 1.00 1.00 H new ATOM 0 HB3 CYS A 76 77.146 -4.000 -4.653 1.00 1.00 H new ATOM 1120 N GLU A 77 74.644 -7.273 -2.852 1.00 1.00 N ATOM 1121 CA GLU A 77 74.331 -8.074 -1.635 1.00 1.00 C ATOM 1122 C GLU A 77 75.588 -8.792 -1.129 1.00 1.00 C ATOM 1123 O GLU A 77 75.667 -9.176 0.021 1.00 1.00 O ATOM 1124 CB GLU A 77 73.252 -9.107 -1.970 1.00 1.00 C ATOM 1125 CG GLU A 77 73.595 -9.796 -3.292 1.00 1.00 C ATOM 1126 CD GLU A 77 72.721 -11.040 -3.462 1.00 1.00 C ATOM 1127 OE1 GLU A 77 72.708 -11.859 -2.558 1.00 1.00 O ATOM 1128 OE2 GLU A 77 72.080 -11.153 -4.494 1.00 1.00 O ATOM 0 H GLU A 77 74.285 -7.656 -3.726 1.00 1.00 H new ATOM 0 HA GLU A 77 73.971 -7.404 -0.854 1.00 1.00 H new ATOM 0 HB2 GLU A 77 73.180 -9.845 -1.171 1.00 1.00 H new ATOM 0 HB3 GLU A 77 72.279 -8.621 -2.043 1.00 1.00 H new ATOM 0 HG2 GLU A 77 73.435 -9.110 -4.124 1.00 1.00 H new ATOM 0 HG3 GLU A 77 74.649 -10.074 -3.306 1.00 1.00 H new ATOM 1135 N LEU A 78 76.572 -8.986 -1.971 1.00 1.00 N ATOM 1136 CA LEU A 78 77.811 -9.689 -1.512 1.00 1.00 C ATOM 1137 C LEU A 78 79.041 -9.104 -2.221 1.00 1.00 C ATOM 1138 O LEU A 78 79.787 -8.340 -1.644 1.00 1.00 O ATOM 1139 CB LEU A 78 77.688 -11.192 -1.818 1.00 1.00 C ATOM 1140 CG LEU A 78 78.409 -11.998 -0.736 1.00 1.00 C ATOM 1141 CD1 LEU A 78 77.481 -12.186 0.465 1.00 1.00 C ATOM 1142 CD2 LEU A 78 78.800 -13.367 -1.297 1.00 1.00 C ATOM 0 H LEU A 78 76.573 -8.692 -2.948 1.00 1.00 H new ATOM 0 HA LEU A 78 77.930 -9.549 -0.438 1.00 1.00 H new ATOM 0 HB2 LEU A 78 76.638 -11.480 -1.860 1.00 1.00 H new ATOM 0 HB3 LEU A 78 78.118 -11.411 -2.795 1.00 1.00 H new ATOM 0 HG LEU A 78 79.305 -11.463 -0.422 1.00 1.00 H new ATOM 0 HD11 LEU A 78 77.995 -12.760 1.236 1.00 1.00 H new ATOM 0 HD12 LEU A 78 77.201 -11.211 0.865 1.00 1.00 H new ATOM 0 HD13 LEU A 78 76.584 -12.721 0.152 1.00 1.00 H new ATOM 0 HD21 LEU A 78 79.314 -13.942 -0.527 1.00 1.00 H new ATOM 0 HD22 LEU A 78 77.903 -13.901 -1.611 1.00 1.00 H new ATOM 0 HD23 LEU A 78 79.462 -13.234 -2.153 1.00 1.00 H new ATOM 1154 N HIS A 79 79.263 -9.451 -3.462 1.00 1.00 N ATOM 1155 CA HIS A 79 80.449 -8.903 -4.185 1.00 1.00 C ATOM 1156 C HIS A 79 80.271 -7.394 -4.371 1.00 1.00 C ATOM 1157 O HIS A 79 80.108 -6.912 -5.471 1.00 1.00 O ATOM 1158 CB HIS A 79 80.571 -9.580 -5.557 1.00 1.00 C ATOM 1159 CG HIS A 79 81.256 -10.910 -5.402 1.00 1.00 C ATOM 1160 ND1 HIS A 79 82.627 -11.057 -5.552 1.00 1.00 N ATOM 1161 CD2 HIS A 79 80.773 -12.163 -5.110 1.00 1.00 C ATOM 1162 CE1 HIS A 79 82.921 -12.355 -5.353 1.00 1.00 C ATOM 1163 NE2 HIS A 79 81.828 -13.070 -5.080 1.00 1.00 N ATOM 0 H HIS A 79 78.678 -10.087 -4.004 1.00 1.00 H new ATOM 0 HA HIS A 79 81.353 -9.096 -3.607 1.00 1.00 H new ATOM 0 HB2 HIS A 79 79.583 -9.717 -5.996 1.00 1.00 H new ATOM 0 HB3 HIS A 79 81.137 -8.945 -6.239 1.00 1.00 H new ATOM 0 HD2 HIS A 79 79.736 -12.406 -4.932 1.00 1.00 H new ATOM 0 HE1 HIS A 79 83.918 -12.767 -5.407 1.00 1.00 H new ATOM 0 HE2 HIS A 79 81.777 -14.071 -4.889 1.00 1.00 H new ATOM 1172 N GLU A 80 80.296 -6.645 -3.302 1.00 1.00 N ATOM 1173 CA GLU A 80 80.119 -5.169 -3.425 1.00 1.00 C ATOM 1174 C GLU A 80 81.361 -4.550 -4.064 1.00 1.00 C ATOM 1175 O GLU A 80 81.446 -3.352 -4.245 1.00 1.00 O ATOM 1176 CB GLU A 80 79.895 -4.554 -2.039 1.00 1.00 C ATOM 1177 CG GLU A 80 81.050 -4.938 -1.112 1.00 1.00 C ATOM 1178 CD GLU A 80 80.727 -6.262 -0.415 1.00 1.00 C ATOM 1179 OE1 GLU A 80 79.677 -6.344 0.201 1.00 1.00 O ATOM 1180 OE2 GLU A 80 81.535 -7.171 -0.509 1.00 1.00 O ATOM 0 H GLU A 80 80.431 -6.990 -2.351 1.00 1.00 H new ATOM 0 HA GLU A 80 79.251 -4.967 -4.053 1.00 1.00 H new ATOM 0 HB2 GLU A 80 79.825 -3.469 -2.119 1.00 1.00 H new ATOM 0 HB3 GLU A 80 78.950 -4.904 -1.623 1.00 1.00 H new ATOM 0 HG2 GLU A 80 81.973 -5.032 -1.684 1.00 1.00 H new ATOM 0 HG3 GLU A 80 81.212 -4.155 -0.371 1.00 1.00 H new ATOM 1187 N LEU A 81 82.324 -5.355 -4.409 1.00 1.00 N ATOM 1188 CA LEU A 81 83.560 -4.817 -5.037 1.00 1.00 C ATOM 1189 C LEU A 81 83.461 -4.984 -6.552 1.00 1.00 C ATOM 1190 O LEU A 81 83.356 -4.025 -7.288 1.00 1.00 O ATOM 1191 CB LEU A 81 84.772 -5.595 -4.517 1.00 1.00 C ATOM 1192 CG LEU A 81 84.716 -5.667 -2.990 1.00 1.00 C ATOM 1193 CD1 LEU A 81 85.839 -6.573 -2.480 1.00 1.00 C ATOM 1194 CD2 LEU A 81 84.891 -4.263 -2.408 1.00 1.00 C ATOM 0 H LEU A 81 82.308 -6.367 -4.282 1.00 1.00 H new ATOM 0 HA LEU A 81 83.673 -3.762 -4.789 1.00 1.00 H new ATOM 0 HB2 LEU A 81 84.781 -6.600 -4.939 1.00 1.00 H new ATOM 0 HB3 LEU A 81 85.694 -5.108 -4.835 1.00 1.00 H new ATOM 0 HG LEU A 81 83.753 -6.073 -2.680 1.00 1.00 H new ATOM 0 HD11 LEU A 81 85.799 -6.624 -1.392 1.00 1.00 H new ATOM 0 HD12 LEU A 81 85.716 -7.573 -2.895 1.00 1.00 H new ATOM 0 HD13 LEU A 81 86.802 -6.167 -2.789 1.00 1.00 H new ATOM 0 HD21 LEU A 81 84.851 -4.313 -1.320 1.00 1.00 H new ATOM 0 HD22 LEU A 81 85.854 -3.858 -2.718 1.00 1.00 H new ATOM 0 HD23 LEU A 81 84.092 -3.616 -2.771 1.00 1.00 H new ATOM 1206 N ALA A 82 83.500 -6.198 -7.018 1.00 1.00 N ATOM 1207 CA ALA A 82 83.417 -6.443 -8.484 1.00 1.00 C ATOM 1208 C ALA A 82 82.016 -6.121 -9.016 1.00 1.00 C ATOM 1209 O ALA A 82 81.855 -5.808 -10.178 1.00 1.00 O ATOM 1210 CB ALA A 82 83.740 -7.909 -8.766 1.00 1.00 C ATOM 0 H ALA A 82 83.586 -7.037 -6.444 1.00 1.00 H new ATOM 0 HA ALA A 82 84.134 -5.794 -8.986 1.00 1.00 H new ATOM 0 HB1 ALA A 82 83.681 -8.095 -9.838 1.00 1.00 H new ATOM 0 HB2 ALA A 82 84.747 -8.134 -8.414 1.00 1.00 H new ATOM 0 HB3 ALA A 82 83.023 -8.546 -8.247 1.00 1.00 H new ATOM 1216 N GLN A 83 80.998 -6.199 -8.193 1.00 1.00 N ATOM 1217 CA GLN A 83 79.620 -5.893 -8.695 1.00 1.00 C ATOM 1218 C GLN A 83 79.683 -4.643 -9.575 1.00 1.00 C ATOM 1219 O GLN A 83 78.814 -4.388 -10.384 1.00 1.00 O ATOM 1220 CB GLN A 83 78.670 -5.646 -7.513 1.00 1.00 C ATOM 1221 CG GLN A 83 78.077 -6.976 -7.044 1.00 1.00 C ATOM 1222 CD GLN A 83 76.822 -7.292 -7.861 1.00 1.00 C ATOM 1223 OE1 GLN A 83 76.589 -6.628 -8.960 1.00 1.00 O flip ATOM 1224 NE2 GLN A 83 76.046 -8.152 -7.495 1.00 1.00 N flip ATOM 0 H GLN A 83 81.059 -6.458 -7.208 1.00 1.00 H new ATOM 0 HA GLN A 83 79.246 -6.738 -9.273 1.00 1.00 H new ATOM 0 HB2 GLN A 83 79.208 -5.168 -6.695 1.00 1.00 H new ATOM 0 HB3 GLN A 83 77.872 -4.965 -7.811 1.00 1.00 H new ATOM 0 HG2 GLN A 83 78.810 -7.774 -7.160 1.00 1.00 H new ATOM 0 HG3 GLN A 83 77.830 -6.922 -5.984 1.00 1.00 H new ATOM 0 HE21 GLN A 83 76.228 -8.671 -6.636 1.00 1.00 H new ATOM 0 HE22 GLN A 83 75.212 -8.355 -8.047 1.00 1.00 H new ATOM 1233 N TYR A 84 80.721 -3.872 -9.423 1.00 1.00 N ATOM 1234 CA TYR A 84 80.879 -2.641 -10.243 1.00 1.00 C ATOM 1235 C TYR A 84 82.213 -1.991 -9.878 1.00 1.00 C ATOM 1236 O TYR A 84 82.440 -0.827 -10.138 1.00 1.00 O ATOM 1237 CB TYR A 84 79.720 -1.671 -9.955 1.00 1.00 C ATOM 1238 CG TYR A 84 79.047 -1.293 -11.253 1.00 1.00 C ATOM 1239 CD1 TYR A 84 79.721 -0.493 -12.184 1.00 1.00 C ATOM 1240 CD2 TYR A 84 77.750 -1.744 -11.526 1.00 1.00 C ATOM 1241 CE1 TYR A 84 79.097 -0.143 -13.387 1.00 1.00 C ATOM 1242 CE2 TYR A 84 77.126 -1.394 -12.729 1.00 1.00 C ATOM 1243 CZ TYR A 84 77.800 -0.593 -13.660 1.00 1.00 C ATOM 1244 OH TYR A 84 77.185 -0.248 -14.846 1.00 1.00 O ATOM 0 H TYR A 84 81.475 -4.044 -8.758 1.00 1.00 H new ATOM 0 HA TYR A 84 80.864 -2.889 -11.304 1.00 1.00 H new ATOM 0 HB2 TYR A 84 79.000 -2.137 -9.282 1.00 1.00 H new ATOM 0 HB3 TYR A 84 80.094 -0.779 -9.453 1.00 1.00 H new ATOM 0 HD1 TYR A 84 80.722 -0.146 -11.974 1.00 1.00 H new ATOM 0 HD2 TYR A 84 77.231 -2.362 -10.808 1.00 1.00 H new ATOM 0 HE1 TYR A 84 79.616 0.474 -14.105 1.00 1.00 H new ATOM 0 HE2 TYR A 84 76.125 -1.741 -12.939 1.00 1.00 H new ATOM 0 HH TYR A 84 76.289 -0.644 -14.877 1.00 1.00 H new ATOM 1254 N GLY A 85 83.093 -2.744 -9.268 1.00 1.00 N ATOM 1255 CA GLY A 85 84.415 -2.182 -8.868 1.00 1.00 C ATOM 1256 C GLY A 85 84.192 -1.084 -7.831 1.00 1.00 C ATOM 1257 O GLY A 85 84.579 -1.201 -6.684 1.00 1.00 O ATOM 0 H GLY A 85 82.951 -3.726 -9.030 1.00 1.00 H new ATOM 0 HA2 GLY A 85 85.049 -2.967 -8.456 1.00 1.00 H new ATOM 0 HA3 GLY A 85 84.932 -1.779 -9.739 1.00 1.00 H new ATOM 1261 N ILE A 86 83.560 -0.022 -8.235 1.00 1.00 N ATOM 1262 CA ILE A 86 83.286 1.106 -7.300 1.00 1.00 C ATOM 1263 C ILE A 86 82.200 1.999 -7.906 1.00 1.00 C ATOM 1264 O ILE A 86 82.472 3.067 -8.415 1.00 1.00 O ATOM 1265 CB ILE A 86 84.566 1.936 -7.089 1.00 1.00 C ATOM 1266 CG1 ILE A 86 85.480 1.779 -8.306 1.00 1.00 C ATOM 1267 CG2 ILE A 86 85.296 1.442 -5.838 1.00 1.00 C ATOM 1268 CD1 ILE A 86 84.756 2.279 -9.557 1.00 1.00 C ATOM 0 H ILE A 86 83.216 0.117 -9.185 1.00 1.00 H new ATOM 0 HA ILE A 86 82.955 0.710 -6.340 1.00 1.00 H new ATOM 0 HB ILE A 86 84.301 2.986 -6.964 1.00 1.00 H new ATOM 0 HG12 ILE A 86 86.401 2.342 -8.157 1.00 1.00 H new ATOM 0 HG13 ILE A 86 85.762 0.733 -8.430 1.00 1.00 H new ATOM 0 HG21 ILE A 86 86.202 2.030 -5.689 1.00 1.00 H new ATOM 0 HG22 ILE A 86 84.646 1.552 -4.970 1.00 1.00 H new ATOM 0 HG23 ILE A 86 85.561 0.392 -5.962 1.00 1.00 H new ATOM 0 HD11 ILE A 86 85.408 2.167 -10.424 1.00 1.00 H new ATOM 0 HD12 ILE A 86 83.847 1.697 -9.709 1.00 1.00 H new ATOM 0 HD13 ILE A 86 84.497 3.330 -9.432 1.00 1.00 H new ATOM 1280 N CYS A 87 80.972 1.573 -7.865 1.00 1.00 N ATOM 1281 CA CYS A 87 79.884 2.404 -8.453 1.00 1.00 C ATOM 1282 C CYS A 87 79.944 3.816 -7.866 1.00 1.00 C ATOM 1283 CB CYS A 87 78.523 1.773 -8.135 1.00 1.00 C ATOM 1284 SG CYS A 87 78.682 0.672 -6.707 1.00 1.00 S ATOM 0 H CYS A 87 80.673 0.690 -7.452 1.00 1.00 H new ATOM 0 HA CYS A 87 80.014 2.455 -9.534 1.00 1.00 H new ATOM 0 HB2 CYS A 87 77.790 2.552 -7.926 1.00 1.00 H new ATOM 0 HB3 CYS A 87 78.159 1.215 -8.998 1.00 1.00 H new TER 1289 CYS A 87 HETATM 1290 C1C RCY A 110 62.519 -7.909 -4.427 1.00 1.00 C HETATM 1291 O1G RCY A 110 65.644 -6.511 -8.425 1.00 1.00 O HETATM 1292 O1H RCY A 110 61.306 -8.147 -7.526 1.00 1.00 O HETATM 1293 O1J RCY A 110 62.073 -5.432 -2.773 1.00 1.00 O HETATM 1294 C1L RCY A 110 64.132 -8.004 -9.639 1.00 1.00 C HETATM 1295 C1M RCY A 110 63.339 -4.854 -6.347 1.00 1.00 C HETATM 1296 C1P RCY A 110 64.573 -7.115 -8.469 1.00 1.00 C HETATM 1297 C1Q RCY A 110 62.482 -8.067 -7.876 1.00 1.00 C HETATM 1298 N1R RCY A 110 63.519 -7.075 -7.364 1.00 1.00 N HETATM 1299 C1S RCY A 110 63.171 -8.946 -8.904 1.00 1.00 C HETATM 1300 C1U RCY A 110 63.498 -6.254 -6.073 1.00 1.00 C HETATM 1301 C1V RCY A 110 60.990 -6.579 -5.950 1.00 1.00 C HETATM 1302 N1V RCY A 110 62.362 -5.420 -4.205 1.00 1.00 N HETATM 1303 C1W RCY A 110 62.784 -4.228 -5.062 1.00 1.00 C HETATM 1304 C1X RCY A 110 62.309 -6.591 -5.175 1.00 1.00 C HETATM 1305 C1Y RCY A 110 61.578 -3.338 -5.373 1.00 1.00 C HETATM 1306 C1Z RCY A 110 63.861 -3.435 -4.321 1.00 1.00 C HETATM 0 H1ZB RCY A 110 64.684 -4.099 -4.056 1.00 1.00 H new HETATM 0 H1ZA RCY A 110 64.232 -2.636 -4.964 1.00 1.00 H new HETATM 0 H1YB RCY A 110 61.880 -2.541 -6.052 1.00 1.00 H new HETATM 0 H1YA RCY A 110 60.796 -3.936 -5.840 1.00 1.00 H new HETATM 0 H1MA RCY A 110 64.291 -4.400 -6.621 1.00 1.00 H new HETATM 0 H1CB RCY A 110 62.646 -8.719 -5.145 1.00 1.00 H new HETATM 0 H1CA RCY A 110 63.409 -7.835 -3.803 1.00 1.00 H new HETATM 0 H1Z RCY A 110 63.436 -3.004 -3.415 1.00 1.00 H new HETATM 0 H1Y RCY A 110 61.199 -2.903 -4.448 1.00 1.00 H new HETATM 0 H1U RCY A 110 64.446 -6.490 -5.589 1.00 1.00 H new HETATM 0 H1S RCY A 110 63.708 -9.767 -8.428 1.00 1.00 H new HETATM 0 H1M RCY A 110 62.658 -4.696 -7.183 1.00 1.00 H new HETATM 0 H1C RCY A 110 61.652 -8.113 -3.799 1.00 1.00 H new HETATM 1309 C1C RCY A 121 65.334 -0.493 6.950 1.00 1.00 C HETATM 1310 O1G RCY A 121 66.808 -5.219 4.503 1.00 1.00 O HETATM 1311 O1H RCY A 121 65.049 -2.921 8.234 1.00 1.00 O HETATM 1312 O1J RCY A 121 64.678 1.162 4.521 1.00 1.00 O HETATM 1313 C1L RCY A 121 66.201 -5.919 6.768 1.00 1.00 C HETATM 1314 C1M RCY A 121 65.627 -2.493 3.851 1.00 1.00 C HETATM 1315 C1P RCY A 121 66.400 -4.917 5.623 1.00 1.00 C HETATM 1316 C1Q RCY A 121 65.708 -3.681 7.526 1.00 1.00 C HETATM 1317 N1R RCY A 121 66.028 -3.498 6.048 1.00 1.00 N HETATM 1318 C1S RCY A 121 66.357 -4.980 7.969 1.00 1.00 C HETATM 1319 C1U RCY A 121 65.984 -2.216 5.213 1.00 1.00 C HETATM 1320 C1V RCY A 121 63.552 -1.925 5.855 1.00 1.00 C HETATM 1321 N1V RCY A 121 64.871 -0.285 4.498 1.00 1.00 N HETATM 1322 C1W RCY A 121 65.080 -1.180 3.277 1.00 1.00 C HETATM 1323 C1X RCY A 121 64.908 -1.239 5.684 1.00 1.00 C HETATM 1324 C1Y RCY A 121 63.751 -1.420 2.556 1.00 1.00 C HETATM 1325 C1Z RCY A 121 66.090 -0.520 2.340 1.00 1.00 C HETATM 0 H1ZB RCY A 121 67.007 -0.303 2.888 1.00 1.00 H new HETATM 0 H1ZA RCY A 121 66.313 -1.194 1.512 1.00 1.00 H new HETATM 0 H1YB RCY A 121 63.902 -2.126 1.740 1.00 1.00 H new HETATM 0 H1YA RCY A 121 63.024 -1.828 3.259 1.00 1.00 H new HETATM 0 H1VB RCY A 121 63.609 -2.644 6.672 1.00 1.00 H new HETATM 0 H1MA RCY A 121 66.492 -2.835 3.284 1.00 1.00 H new HETATM 0 H1LA RCY A 121 65.223 -6.398 6.738 1.00 1.00 H new HETATM 0 H1CB RCY A 121 65.519 -1.210 7.750 1.00 1.00 H new HETATM 0 H1CA RCY A 121 66.245 0.071 6.751 1.00 1.00 H new HETATM 0 H1Z RCY A 121 65.672 0.408 1.950 1.00 1.00 H new HETATM 0 H1Y RCY A 121 63.379 -0.477 2.156 1.00 1.00 H new HETATM 0 H1U RCY A 121 66.983 -1.793 5.316 1.00 1.00 H new HETATM 0 H1S RCY A 121 67.407 -4.832 8.223 1.00 1.00 H new HETATM 0 H1M RCY A 121 64.878 -3.283 3.798 1.00 1.00 H new HETATM 0 H1L RCY A 121 66.946 -6.714 6.761 1.00 1.00 H new HETATM 0 H1C RCY A 121 64.542 0.192 7.253 1.00 1.00 H new HETATM 1328 C1C RCY A 130 74.424 12.235 4.137 1.00 1.00 C HETATM 1329 O1G RCY A 130 77.294 13.309 8.717 1.00 1.00 O HETATM 1330 O1H RCY A 130 73.217 12.098 6.665 1.00 1.00 O HETATM 1331 O1J RCY A 130 76.559 10.974 2.428 1.00 1.00 O HETATM 1332 C1L RCY A 130 74.992 13.150 9.531 1.00 1.00 C HETATM 1333 C1M RCY A 130 77.558 11.762 6.046 1.00 1.00 C HETATM 1334 C1P RCY A 130 76.108 13.086 8.480 1.00 1.00 C HETATM 1335 C1Q RCY A 130 74.062 12.667 7.355 1.00 1.00 C HETATM 1336 N1R RCY A 130 75.563 12.711 7.103 1.00 1.00 N HETATM 1337 C1S RCY A 130 73.796 13.458 8.623 1.00 1.00 C HETATM 1338 C1U RCY A 130 76.321 12.445 5.800 1.00 1.00 C HETATM 1339 C1V RCY A 130 75.082 10.249 5.570 1.00 1.00 C HETATM 1340 N1V RCY A 130 76.675 11.169 3.871 1.00 1.00 N HETATM 1341 C1W RCY A 130 77.936 11.075 4.728 1.00 1.00 C HETATM 1342 C1X RCY A 130 75.565 11.513 4.855 1.00 1.00 C HETATM 1343 C1Y RCY A 130 78.309 9.610 4.972 1.00 1.00 C HETATM 1344 C1Z RCY A 130 79.076 11.811 4.024 1.00 1.00 C HETATM 0 H1ZB RCY A 130 78.769 12.834 3.806 1.00 1.00 H new HETATM 0 H1ZA RCY A 130 79.953 11.826 4.671 1.00 1.00 H new HETATM 0 H1YB RCY A 130 79.159 9.559 5.653 1.00 1.00 H new HETATM 0 H1YA RCY A 130 77.460 9.087 5.412 1.00 1.00 H new HETATM 0 H1VB RCY A 130 74.328 10.516 6.311 1.00 1.00 H new HETATM 0 H1VA RCY A 130 74.649 9.562 4.843 1.00 1.00 H new HETATM 0 H1MA RCY A 130 78.334 12.462 6.357 1.00 1.00 H new HETATM 0 H1LA RCY A 130 74.874 12.212 10.073 1.00 1.00 H new HETATM 0 H1CB RCY A 130 73.718 12.622 4.872 1.00 1.00 H new HETATM 0 H1CA RCY A 130 74.828 13.061 3.552 1.00 1.00 H new HETATM 0 H1Z RCY A 130 79.320 11.299 3.093 1.00 1.00 H new HETATM 0 H1Y RCY A 130 78.574 9.139 4.025 1.00 1.00 H new HETATM 0 H1V RCY A 130 75.924 9.767 6.067 1.00 1.00 H new HETATM 0 H1U RCY A 130 76.459 13.434 5.362 1.00 1.00 H new HETATM 0 H1S RCY A 130 73.721 14.525 8.416 1.00 1.00 H new HETATM 0 H1M RCY A 130 77.447 11.032 6.848 1.00 1.00 H new HETATM 0 H1L RCY A 130 75.163 13.928 10.275 1.00 1.00 H new HETATM 0 H1C RCY A 130 73.912 11.537 3.475 1.00 1.00 H new HETATM 1347 C1C RCY A 138 83.030 3.833 4.975 1.00 1.00 C HETATM 1348 O1G RCY A 138 82.952 5.744 5.889 1.00 1.00 O HETATM 1349 O1H RCY A 138 86.959 7.034 3.749 1.00 1.00 O HETATM 1350 O1J RCY A 138 82.948 4.097 1.976 1.00 1.00 O HETATM 1351 C1L RCY A 138 83.934 7.917 5.343 1.00 1.00 C HETATM 1352 C1M RCY A 138 86.439 4.109 3.563 1.00 1.00 C HETATM 1353 C1P RCY A 138 83.891 6.386 5.420 1.00 1.00 C HETATM 1354 C1Q RCY A 138 86.005 6.983 4.523 1.00 1.00 C HETATM 1355 N1R RCY A 138 85.158 5.757 4.842 1.00 1.00 N HETATM 1356 C1S RCY A 138 85.451 8.136 5.340 1.00 1.00 C HETATM 1357 C1U RCY A 138 85.498 4.280 4.632 1.00 1.00 C HETATM 1358 C1V RCY A 138 84.577 1.948 4.280 1.00 1.00 C HETATM 1359 N1V RCY A 138 84.170 3.886 2.746 1.00 1.00 N HETATM 1360 C1W RCY A 138 85.613 4.053 2.272 1.00 1.00 C HETATM 1361 C1X RCY A 138 84.292 3.449 4.199 1.00 1.00 C HETATM 1362 C1Y RCY A 138 86.036 2.859 1.412 1.00 1.00 C HETATM 1363 C1Z RCY A 138 85.731 5.356 1.480 1.00 1.00 C HETATM 0 H1ZB RCY A 138 85.369 6.185 2.088 1.00 1.00 H new HETATM 0 H1ZA RCY A 138 86.775 5.528 1.216 1.00 1.00 H new HETATM 0 H1YB RCY A 138 87.090 2.953 1.152 1.00 1.00 H new HETATM 0 H1YA RCY A 138 85.881 1.936 1.970 1.00 1.00 H new HETATM 0 H1VA RCY A 138 83.737 1.395 3.860 1.00 1.00 H new HETATM 0 H1LA RCY A 138 83.455 8.303 4.444 1.00 1.00 H new HETATM 0 H1Z RCY A 138 85.134 5.284 0.571 1.00 1.00 H new HETATM 0 H1Y RCY A 138 85.438 2.837 0.501 1.00 1.00 H new HETATM 0 H1V RCY A 138 85.481 1.718 3.716 1.00 1.00 H new HETATM 0 H1U RCY A 138 85.883 3.953 5.598 1.00 1.00 H new HETATM 0 H1S RCY A 138 85.854 8.133 6.353 1.00 1.00 H new HETATM 0 H1M RCY A 138 87.017 3.194 3.696 1.00 1.00 H new HETATM 0 H1L RCY A 138 83.445 8.392 6.194 1.00 1.00 H new HETATM 1366 C1C RCY A 150 80.443 1.262 3.353 1.00 1.00 C HETATM 1367 O1G RCY A 150 82.389 4.435 3.133 1.00 1.00 O HETATM 1368 O1H RCY A 150 82.984 1.274 6.590 1.00 1.00 O HETATM 1369 O1J RCY A 150 80.650 -0.740 5.593 1.00 1.00 O HETATM 1370 C1L RCY A 150 84.358 3.311 4.054 1.00 1.00 C HETATM 1371 C1M RCY A 150 80.215 2.919 6.654 1.00 1.00 C HETATM 1372 C1P RCY A 150 82.868 3.665 3.964 1.00 1.00 C HETATM 1373 C1Q RCY A 150 83.137 2.235 5.838 1.00 1.00 C HETATM 1374 N1R RCY A 150 82.053 2.944 5.036 1.00 1.00 N HETATM 1375 C1S RCY A 150 84.449 2.936 5.537 1.00 1.00 C HETATM 1376 C1U RCY A 150 80.539 2.929 5.257 1.00 1.00 C HETATM 1377 C1V RCY A 150 78.349 1.798 4.677 1.00 1.00 C HETATM 1378 N1V RCY A 150 80.289 0.662 5.780 1.00 1.00 N HETATM 1379 C1W RCY A 150 80.246 1.448 7.089 1.00 1.00 C HETATM 1380 C1X RCY A 150 79.873 1.666 4.714 1.00 1.00 C HETATM 1381 C1Y RCY A 150 78.986 1.095 7.884 1.00 1.00 C HETATM 1382 C1Z RCY A 150 81.501 1.135 7.903 1.00 1.00 C HETATM 0 H1ZB RCY A 150 82.386 1.336 7.299 1.00 1.00 H new HETATM 0 H1ZA RCY A 150 81.521 1.760 8.796 1.00 1.00 H new HETATM 0 H1YB RCY A 150 78.928 1.725 8.772 1.00 1.00 H new HETATM 0 H1YA RCY A 150 78.106 1.261 7.263 1.00 1.00 H new HETATM 0 H1VB RCY A 150 78.067 2.559 3.949 1.00 1.00 H new HETATM 0 H1VA RCY A 150 77.908 0.843 4.392 1.00 1.00 H new HETATM 0 H1MA RCY A 150 80.932 3.509 7.224 1.00 1.00 H new HETATM 0 H1CB RCY A 150 80.282 2.068 2.637 1.00 1.00 H new HETATM 0 H1CA RCY A 150 81.512 1.070 3.449 1.00 1.00 H new HETATM 0 H1Z RCY A 150 81.492 0.085 8.196 1.00 1.00 H new HETATM 0 H1Y RCY A 150 79.026 0.048 8.184 1.00 1.00 H new HETATM 0 H1V RCY A 150 77.985 2.086 5.663 1.00 1.00 H new HETATM 0 H1U RCY A 150 80.184 3.822 4.743 1.00 1.00 H new HETATM 0 H1S RCY A 150 84.578 3.820 6.162 1.00 1.00 H new HETATM 0 H1M RCY A 150 79.232 3.356 6.829 1.00 1.00 H new HETATM 0 H1C RCY A 150 79.942 0.359 3.002 1.00 1.00 H new HETATM 1385 C1C RCY A 160 73.498 2.153 4.022 1.00 1.00 C HETATM 1386 O1G RCY A 160 72.984 2.997 6.386 1.00 1.00 O HETATM 1387 O1H RCY A 160 71.375 6.645 3.855 1.00 1.00 O HETATM 1388 O1J RCY A 160 71.758 2.625 1.610 1.00 1.00 O HETATM 1389 C1L RCY A 160 71.029 4.453 6.602 1.00 1.00 C HETATM 1390 C1M RCY A 160 73.877 5.609 2.755 1.00 1.00 C HETATM 1391 C1P RCY A 160 72.341 3.962 5.976 1.00 1.00 C HETATM 1392 C1Q RCY A 160 71.685 5.911 4.792 1.00 1.00 C HETATM 1393 N1R RCY A 160 72.749 4.821 4.780 1.00 1.00 N HETATM 1394 C1S RCY A 160 71.074 5.927 6.181 1.00 1.00 C HETATM 1395 C1U RCY A 160 73.921 4.641 3.813 1.00 1.00 C HETATM 1396 C1V RCY A 160 75.203 3.015 2.356 1.00 1.00 C HETATM 1397 N1V RCY A 160 72.775 3.561 2.081 1.00 1.00 N HETATM 1398 C1W RCY A 160 72.958 5.023 1.676 1.00 1.00 C HETATM 1399 C1X RCY A 160 73.888 3.298 3.085 1.00 1.00 C HETATM 1400 C1Y RCY A 160 73.616 5.118 0.297 1.00 1.00 C HETATM 1401 C1Z RCY A 160 71.595 5.715 1.672 1.00 1.00 C HETATM 0 H1ZB RCY A 160 71.117 5.583 2.643 1.00 1.00 H new HETATM 0 H1ZA RCY A 160 71.728 6.779 1.474 1.00 1.00 H new HETATM 0 H1YB RCY A 160 73.816 6.163 0.060 1.00 1.00 H new HETATM 0 H1YA RCY A 160 74.553 4.562 0.302 1.00 1.00 H new HETATM 0 H1VB RCY A 160 76.002 2.883 3.085 1.00 1.00 H new HETATM 0 H1VA RCY A 160 75.101 2.107 1.761 1.00 1.00 H new HETATM 0 H1MA RCY A 160 73.494 6.563 3.116 1.00 1.00 H new HETATM 0 H1LA RCY A 160 70.157 3.932 6.206 1.00 1.00 H new HETATM 0 H1CB RCY A 160 74.222 2.084 4.834 1.00 1.00 H new HETATM 0 H1CA RCY A 160 72.507 2.342 4.435 1.00 1.00 H new HETATM 0 H1Z RCY A 160 70.967 5.277 0.896 1.00 1.00 H new HETATM 0 H1Y RCY A 160 72.948 4.697 -0.455 1.00 1.00 H new HETATM 0 H1V RCY A 160 75.443 3.852 1.701 1.00 1.00 H new HETATM 0 H1U RCY A 160 74.806 4.735 4.442 1.00 1.00 H new HETATM 0 H1S RCY A 160 71.675 6.518 6.872 1.00 1.00 H new HETATM 0 H1M RCY A 160 74.874 5.796 2.357 1.00 1.00 H new HETATM 0 H1L RCY A 160 71.011 4.328 7.685 1.00 1.00 H new HETATM 0 H1C RCY A 160 73.486 1.216 3.466 1.00 1.00 H new HETATM 1404 C1C RCY A 168 72.823 0.458 -4.961 1.00 1.00 C HETATM 1405 O1G RCY A 168 68.286 1.229 -6.863 1.00 1.00 O HETATM 1406 O1H RCY A 168 71.229 2.132 -3.282 1.00 1.00 O HETATM 1407 O1J RCY A 168 71.861 -1.785 -6.726 1.00 1.00 O HETATM 1408 C1L RCY A 168 67.987 1.338 -4.437 1.00 1.00 C HETATM 1409 C1M RCY A 168 70.918 1.756 -7.856 1.00 1.00 C HETATM 1410 C1P RCY A 168 68.782 1.385 -5.749 1.00 1.00 C HETATM 1411 C1Q RCY A 168 70.338 1.644 -3.977 1.00 1.00 C HETATM 1412 N1R RCY A 168 70.265 1.650 -5.498 1.00 1.00 N HETATM 1413 C1S RCY A 168 69.102 0.923 -3.471 1.00 1.00 C HETATM 1414 C1U RCY A 168 71.395 1.866 -6.507 1.00 1.00 C HETATM 1415 C1V RCY A 168 73.731 1.189 -7.212 1.00 1.00 C HETATM 1416 N1V RCY A 168 71.776 -0.371 -7.080 1.00 1.00 N HETATM 1417 C1W RCY A 168 70.957 0.263 -8.203 1.00 1.00 C HETATM 1418 C1X RCY A 168 72.485 0.800 -6.414 1.00 1.00 C HETATM 1419 C1Y RCY A 168 71.639 0.041 -9.555 1.00 1.00 C HETATM 1420 C1Z RCY A 168 69.553 -0.344 -8.202 1.00 1.00 C HETATM 0 H1VB RCY A 168 74.198 2.062 -6.755 1.00 1.00 H new HETATM 0 H1VA RCY A 168 74.437 0.359 -7.212 1.00 1.00 H new HETATM 0 H1CB RCY A 168 73.176 1.353 -4.449 1.00 1.00 H new HETATM 0 H1CA RCY A 168 71.932 0.081 -4.459 1.00 1.00 H new HETATM 0 H1U RCY A 168 71.782 2.857 -6.269 1.00 1.00 H new HETATM 0 H1L RCY A 168 67.171 0.616 -4.469 1.00 1.00 H new HETATM 0 H1C RCY A 168 73.602 -0.304 -4.938 1.00 1.00 H new HETATM 1423 C1C RCY A 173 76.890 7.552 -6.091 1.00 1.00 C HETATM 1424 O1G RCY A 173 74.019 7.469 -5.740 1.00 1.00 O HETATM 1425 O1H RCY A 173 74.917 3.370 -7.907 1.00 1.00 O HETATM 1426 O1J RCY A 173 75.229 8.169 -3.656 1.00 1.00 O HETATM 1427 C1L RCY A 173 72.928 6.269 -7.572 1.00 1.00 C HETATM 1428 C1M RCY A 173 75.827 4.450 -4.376 1.00 1.00 C HETATM 1429 C1P RCY A 173 74.002 6.503 -6.502 1.00 1.00 C HETATM 1430 C1Q RCY A 173 74.611 4.542 -7.689 1.00 1.00 C HETATM 1431 N1R RCY A 173 75.046 5.388 -6.499 1.00 1.00 N HETATM 1432 C1S RCY A 173 73.727 5.414 -8.562 1.00 1.00 C HETATM 1433 C1U RCY A 173 76.227 5.169 -5.552 1.00 1.00 C HETATM 1434 C1V RCY A 173 78.145 6.258 -4.308 1.00 1.00 C HETATM 1435 N1V RCY A 173 75.729 6.839 -3.989 1.00 1.00 N HETATM 1436 C1W RCY A 173 75.294 5.501 -3.394 1.00 1.00 C HETATM 1437 C1X RCY A 173 76.801 6.476 -5.007 1.00 1.00 C HETATM 1438 C1Y RCY A 173 75.913 5.305 -2.007 1.00 1.00 C HETATM 1439 C1Z RCY A 173 73.768 5.462 -3.313 1.00 1.00 C HETATM 0 H1ZB RCY A 173 73.346 5.663 -4.298 1.00 1.00 H new HETATM 0 H1YB RCY A 173 75.661 4.313 -1.633 1.00 1.00 H new HETATM 0 H1YA RCY A 173 76.996 5.403 -2.075 1.00 1.00 H new HETATM 0 H1VB RCY A 173 78.889 5.944 -5.040 1.00 1.00 H new HETATM 0 H1VA RCY A 173 78.467 7.188 -3.840 1.00 1.00 H new HETATM 0 H1MA RCY A 173 75.059 3.713 -4.612 1.00 1.00 H new HETATM 0 H1LA RCY A 173 72.055 5.748 -7.180 1.00 1.00 H new HETATM 0 H1CB RCY A 173 77.536 7.204 -6.897 1.00 1.00 H new HETATM 0 H1CA RCY A 173 75.894 7.754 -6.486 1.00 1.00 H new HETATM 0 H1Y RCY A 173 75.523 6.060 -1.324 1.00 1.00 H new HETATM 0 H1V RCY A 173 78.038 5.486 -3.546 1.00 1.00 H new HETATM 0 H1U RCY A 173 76.958 4.630 -6.155 1.00 1.00 H new HETATM 0 H1S RCY A 173 74.321 6.035 -9.232 1.00 1.00 H new HETATM 0 H1M RCY A 173 76.669 3.907 -3.946 1.00 1.00 H new HETATM 0 H1L RCY A 173 72.572 7.198 -8.016 1.00 1.00 H new HETATM 0 H1C RCY A 173 77.303 8.466 -5.664 1.00 1.00 H new HETATM 1442 C1C RCY A 176 74.515 -0.203 -0.404 1.00 1.00 C HETATM 1443 O1G RCY A 176 74.829 -3.570 -2.081 1.00 1.00 O HETATM 1444 O1H RCY A 176 75.001 -2.636 0.444 1.00 1.00 O HETATM 1445 O1J RCY A 176 74.393 -1.852 2.114 1.00 1.00 O HETATM 1446 C1L RCY A 176 75.638 -1.902 -0.397 1.00 1.00 C HETATM 1447 C1M RCY A 176 77.898 -1.243 0.680 1.00 1.00 C HETATM 1448 C1P RCY A 176 75.610 -3.196 -1.229 1.00 1.00 C HETATM 1449 C1Q RCY A 176 75.421 -2.963 -0.665 1.00 1.00 C HETATM 1450 N1R RCY A 176 76.568 -2.041 -1.216 1.00 1.00 N HETATM 1451 C1S RCY A 176 76.442 -2.472 -1.605 1.00 1.00 C HETATM 1452 C1U RCY A 176 76.962 -0.853 -0.335 1.00 1.00 C HETATM 1453 C1V RCY A 176 76.125 1.068 1.087 1.00 1.00 C HETATM 1454 N1V RCY A 176 75.631 -1.348 1.525 1.00 1.00 N HETATM 1455 C1W RCY A 176 77.061 -1.774 1.851 1.00 1.00 C HETATM 1456 C1X RCY A 176 75.783 -0.281 0.450 1.00 1.00 C HETATM 1457 C1Y RCY A 176 77.520 -1.145 3.169 1.00 1.00 C HETATM 1458 C1Z RCY A 176 77.123 -3.299 1.931 1.00 1.00 C HETATM 0 H1ZB RCY A 176 76.737 -3.728 1.006 1.00 1.00 H new HETATM 0 H1ZA RCY A 176 78.157 -3.614 2.073 1.00 1.00 H new HETATM 0 H1YB RCY A 176 78.568 -1.390 3.344 1.00 1.00 H new HETATM 0 H1YA RCY A 176 77.405 -0.062 3.115 1.00 1.00 H new HETATM 0 H1VB RCY A 176 76.286 1.810 0.304 1.00 1.00 H new HETATM 0 H1VA RCY A 176 75.302 1.388 1.726 1.00 1.00 H new HETATM 0 H1MA RCY A 176 78.578 -2.009 0.309 1.00 1.00 H new HETATM 0 H1LA RCY A 176 74.893 -1.112 -0.490 1.00 1.00 H new HETATM 0 H1CB RCY A 176 74.696 0.440 -1.266 1.00 1.00 H new HETATM 0 H1CA RCY A 176 74.245 -1.202 -0.747 1.00 1.00 H new HETATM 0 H1Z RCY A 176 76.520 -3.644 2.771 1.00 1.00 H new HETATM 0 H1Y RCY A 176 76.915 -1.534 3.988 1.00 1.00 H new HETATM 0 H1V RCY A 176 77.031 0.969 1.685 1.00 1.00 H new HETATM 0 H1U RCY A 176 77.370 -0.123 -1.034 1.00 1.00 H new HETATM 0 H1S RCY A 176 77.495 -2.750 -1.552 1.00 1.00 H new HETATM 0 H1M RCY A 176 78.510 -0.397 0.991 1.00 1.00 H new HETATM 0 H1C RCY A 176 73.700 0.209 0.191 1.00 1.00 H new HETATM 1461 C1C RCY A 187 81.240 5.365 -2.070 1.00 1.00 C HETATM 1462 O1G RCY A 187 80.705 4.987 -4.786 1.00 1.00 O HETATM 1463 O1H RCY A 187 78.037 1.211 -3.825 1.00 1.00 O HETATM 1464 O1J RCY A 187 80.866 4.989 0.894 1.00 1.00 O HETATM 1465 C1L RCY A 187 79.843 3.153 -6.157 1.00 1.00 C HETATM 1466 C1M RCY A 187 78.820 2.657 -1.360 1.00 1.00 C HETATM 1467 C1P RCY A 187 80.078 3.932 -4.856 1.00 1.00 C HETATM 1468 C1Q RCY A 187 78.908 1.948 -4.285 1.00 1.00 C HETATM 1469 N1R RCY A 187 79.436 3.233 -3.659 1.00 1.00 N HETATM 1470 C1S RCY A 187 79.658 1.742 -5.588 1.00 1.00 C HETATM 1471 C1U RCY A 187 79.342 3.694 -2.203 1.00 1.00 C HETATM 1472 C1V RCY A 187 81.713 2.886 -1.832 1.00 1.00 C HETATM 1473 N1V RCY A 187 80.333 4.083 -0.119 1.00 1.00 N HETATM 1474 C1W RCY A 187 79.279 2.993 0.065 1.00 1.00 C HETATM 1475 C1X RCY A 187 80.706 4.013 -1.593 1.00 1.00 C HETATM 1476 C1Y RCY A 187 79.892 1.762 0.737 1.00 1.00 C HETATM 1477 C1Z RCY A 187 78.127 3.548 0.903 1.00 1.00 C HETATM 0 H1ZB RCY A 187 77.744 4.457 0.439 1.00 1.00 H new HETATM 0 H1ZA RCY A 187 77.330 2.807 0.961 1.00 1.00 H new HETATM 0 H1YB RCY A 187 79.149 0.965 0.784 1.00 1.00 H new HETATM 0 H1YA RCY A 187 80.752 1.423 0.160 1.00 1.00 H new HETATM 0 H1VB RCY A 187 81.929 2.811 -2.898 1.00 1.00 H new HETATM 0 H1VA RCY A 187 82.634 3.100 -1.289 1.00 1.00 H new HETATM 0 H1MA RCY A 187 77.732 2.617 -1.420 1.00 1.00 H new HETATM 0 H1LA RCY A 187 78.965 3.503 -6.700 1.00 1.00 H new HETATM 0 H1CB RCY A 187 81.345 5.352 -3.155 1.00 1.00 H new HETATM 0 H1CA RCY A 187 80.544 6.153 -1.782 1.00 1.00 H new HETATM 0 H1Z RCY A 187 78.484 3.776 1.907 1.00 1.00 H new HETATM 0 H1Y RCY A 187 80.212 2.020 1.747 1.00 1.00 H new HETATM 0 H1V RCY A 187 81.295 1.943 -1.479 1.00 1.00 H new HETATM 0 H1U RCY A 187 78.703 4.576 -2.241 1.00 1.00 H new HETATM 0 H1S RCY A 187 80.618 1.254 -5.420 1.00 1.00 H new HETATM 0 H1M RCY A 187 79.192 1.680 -1.669 1.00 1.00 H new HETATM 0 H1L RCY A 187 80.688 3.219 -6.842 1.00 1.00 H new HETATM 0 H1C RCY A 187 82.211 5.554 -1.613 1.00 1.00 H new