USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=21 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 9 GLU H : A 9 GLU N : A 110 RCY O1G :(H bumps) USER MOD NoAdj-H: A 29 LYS H : A 29 LYS N : A 130 RCY C1U :(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 9 GLU O :(H bumps) USER MOD NoAdj-H: A 110 RCYH1CB : A 110 RCY C1C : A 9 GLU OE1 :(H bumps) USER MOD NoAdj-H: A 110 RCY H1U : A 110 RCY C1U : A 9 GLU CD :(H bumps) USER MOD NoAdj-H: A 110 RCY H1L : A 110 RCY C1L : A 10 CYS N :(H bumps) USER MOD NoAdj-H: A 121 RCYH1SA : A 121 RCY C1S : A 21 CYS SG :(H bumps) USER MOD NoAdj-H: A 130 RCYH1VB : A 130 RCY C1V : A 27 PRO O :(H bumps) USER MOD NoAdj-H: A 130 RCYH1SA : A 130 RCY C1S : A 30 CYS SG :(H bumps) USER MOD NoAdj-H: A 130 RCYH1MA : A 130 RCY C1M : A 29 LYS N :(H bumps) USER MOD NoAdj-H: A 130 RCYH1CB : A 130 RCY C1C : A 27 PRO C :(H bumps) USER MOD NoAdj-H: A 130 RCYH1CA : A 130 RCY C1C : A 28 PRO N :(H bumps) USER MOD NoAdj-H: A 130 RCY H1U : A 130 RCY C1U : A 29 LYS N :(H bumps) USER MOD NoAdj-H: A 130 RCY H1C : A 130 RCY C1C : A 27 PRO C :(H bumps) USER MOD NoAdj-H: A 138 RCYH1YB : A 138 RCY C1Y : A 150 RCY C1W :(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 RCY H1U : A 138 RCY C1U : A 138 RCY C1L :(H bumps) USER MOD NoAdj-H: A 138 RCY H1L : A 138 RCY C1L : A 138 RCY C1U :(H bumps) USER MOD NoAdj-H: A 150 RCYH1YB : A 150 RCY C1Y : A 138 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 150 RCYH1YA : A 150 RCY C1Y : A 138 RCY C1W :(H bumps) USER MOD NoAdj-H: A 150 RCYH1SA : A 150 RCY C1S : A 50 CYS SG :(H bumps) USER MOD NoAdj-H: A 150 RCY H1Y : A 150 RCY C1Y : A 138 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 160 RCYH1ZA : A 160 RCY C1Z : A 65 THR CB :(H bumps) USER MOD NoAdj-H: A 160 RCYH1YB : A 160 RCY C1Y : A 168 RCY C1S :(H bumps) USER MOD NoAdj-H: A 160 RCYH1YA : A 160 RCY C1Y : A 168 RCY C1L :(H bumps) USER MOD NoAdj-H: A 160 RCYH1VA : A 160 RCY C1V : A 168 RCY C1P :(H bumps) USER MOD NoAdj-H: A 160 RCYH1SA : A 160 RCY C1S : A 60 CYS SG :(H bumps) USER MOD NoAdj-H: A 160 RCY H1Y : A 160 RCY C1Y : A 168 RCY C1L :(H bumps) USER MOD NoAdj-H: A 160 RCY H1V : A 160 RCY C1V : A 168 RCY C1P :(H bumps) USER MOD NoAdj-H: A 168 RCYH1ZB : A 168 RCY C1Z : A 69 PRO CG :(H bumps) USER MOD NoAdj-H: A 168 RCYH1ZA : A 168 RCY C1Z : A 69 PRO CG :(H bumps) USER MOD NoAdj-H: A 168 RCYH1VB : A 168 RCY C1V : A 187 RCY C1X :(H bumps) USER MOD NoAdj-H: A 168 RCYH1VA : A 168 RCY C1V : A 187 RCY C1X :(H bumps) USER MOD NoAdj-H: A 168 RCYH1SA : A 168 RCY C1S : A 160 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 168 RCY H1Z : A 168 RCY C1Z : A 69 PRO CG :(H bumps) USER MOD NoAdj-H: A 168 RCY H1V : A 168 RCY C1V : A 187 RCY C1X :(H bumps) USER MOD NoAdj-H: A 168 RCY H1S : A 168 RCY C1S : A 160 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 168 RCY H1L : A 168 RCY C1L : A 160 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 173 RCYH1ZB : A 173 RCY C1Z : A 176 RCY O1G :(H bumps) USER MOD NoAdj-H: A 173 RCYH1VB : A 173 RCY C1V : A 76 CYS SG :(H bumps) USER MOD NoAdj-H: A 173 RCYH1VA : A 173 RCY C1V : A 176 RCY O1H :(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 RCYH1LA : A 173 RCY C1L : A 76 CYS CA :(H bumps) USER MOD NoAdj-H: A 173 RCY H1V : A 173 RCY C1V : A 76 CYS SG :(H bumps) USER MOD NoAdj-H: A 173 RCY H1L : A 173 RCY C1L : A 76 CYS CA :(H bumps) USER MOD NoAdj-H: A 173 RCY H1C : A 173 RCY C1C : A 187 RCY C1Y :(H bumps) USER MOD NoAdj-H: A 176 RCYH1ZB : A 176 RCY C1Z : A 187 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 176 RCYH1YB : A 176 RCY C1Y : A 187 RCY N1V :(H bumps) USER MOD NoAdj-H: A 176 RCYH1YA : A 176 RCY C1Y : A 187 RCY C1X :(H bumps) USER MOD NoAdj-H: A 176 RCYH1VA : A 176 RCY C1V : A 187 RCY C1V :(H bumps) USER MOD NoAdj-H: A 176 RCYH1SA : A 176 RCY C1S : A 173 RCY C1X :(H bumps) USER MOD NoAdj-H: A 176 RCYH1MA : A 176 RCY C1M : A 187 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 176 RCYH1LA : A 176 RCY C1L : A 173 RCY C1W :(H bumps) USER MOD NoAdj-H: A 176 RCY H1Z : A 176 RCY C1Z : A 187 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 176 RCY H1V : A 176 RCY C1V : A 187 RCY C1V :(H bumps) USER MOD NoAdj-H: A 176 RCY H1U : A 176 RCY C1U : A 173 RCY O1J :(H bumps) USER MOD NoAdj-H: A 176 RCY H1S : A 176 RCY C1S : A 173 RCY C1X :(H bumps) USER MOD NoAdj-H: A 176 RCY H1M : A 176 RCY C1M : A 187 RCY C1Z :(H bumps) USER MOD NoAdj-H: A 176 RCY H1L : A 176 RCY C1L : A 173 RCY C1U :(H bumps) USER MOD NoAdj-H: A 187 RCYH1ZA : A 187 RCY C1Z : A 176 RCY C1M :(H bumps) USER MOD NoAdj-H: A 187 RCYH1YB : A 187 RCY C1Y : A 176 RCY C1Q :(H bumps) USER MOD NoAdj-H: A 187 RCYH1YA : A 187 RCY C1Y : A 173 RCY C1C :(H bumps) USER MOD NoAdj-H: A 187 RCYH1VB : A 187 RCY C1V : A 176 RCY C1V :(H bumps) USER MOD NoAdj-H: A 187 RCYH1SA : A 187 RCY C1S : A 87 CYS SG :(H bumps) USER MOD NoAdj-H: A 187 RCYH1MA : A 187 RCY C1M : A 176 RCY C1X :(H bumps) USER MOD NoAdj-H: A 187 RCYH1CB : A 187 RCY C1C : A 168 RCY C1X :(H bumps) USER MOD NoAdj-H: A 187 RCY H1V : A 187 RCY C1V : A 176 RCY C1V :(H bumps) USER MOD NoAdj-H: A 187 RCY H1U : A 187 RCY C1U : A 176 RCY C1X :(H bumps) USER MOD NoAdj-H: A 187 RCY H1M : A 187 RCY C1M : A 176 RCY C1X :(H bumps) USER MOD NoAdj-H: A 187 RCY H1C : A 187 RCY C1C : A 168 RCY C1X :(H bumps) USER MOD Single : A 1 MET CE :methyl -167:sc=-0.00159 (180deg=-0.352) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.133 K(o=-0.13,f=-3.9!) USER MOD Single : A 7 LYS NZ :NH3+ 153:sc=-0.00986 (180deg=-1.01) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -34:sc= 0.187 USER MOD Single : A 17 MET CE :methyl 159:sc= -0.63 (180deg=-0.641) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 175:sc= -4.32 (180deg=-4.52) USER MOD Single : A 29 LYS NZ :NH3+ 161:sc= -0.0159 (180deg=-0.195) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN :FLIP amide:sc= -0.32 F(o=-3.5!,f=-0.32) USER MOD Single : A 34 GLN :FLIP amide:sc= -0.508 F(o=-1.4,f=-0.51) USER MOD Single : A 35 THR OG1 : rot 9:sc= 0.365! USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 39 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.229) USER MOD Single : A 40 SER OG : rot 51:sc= 0.266 USER MOD Single : A 41 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.111) USER MOD Single : A 44 LYS NZ :NH3+ -143:sc= -1.91! (180deg=-2.28!) USER MOD Single : A 45 LYS NZ :NH3+ 156:sc= -0.0702 (180deg=-0.66) USER MOD Single : A 48 GLN : amide:sc= -0.0571 K(o=-0.057,f=-2.2!) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= -1.11! USER MOD Single : A 65 THR OG1 : rot -179:sc= -15.8! USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 HIS : no HE2:sc= -12.6! C(o=-13!,f=-13!) USER MOD Single : A 79 HIS : no HD1:sc= -0.313 X(o=-0.31,f=-0.074) USER MOD Single : A 83 GLN :FLIP amide:sc= -0.209 F(o=-4.6!,f=-0.21) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 89.034 -2.081 25.031 1.00 1.00 N ATOM 2 CA MET A 1 89.199 -2.522 23.617 1.00 1.00 C ATOM 3 C MET A 1 88.591 -1.472 22.683 1.00 1.00 C ATOM 4 O MET A 1 88.805 -0.287 22.844 1.00 1.00 O ATOM 5 CB MET A 1 88.487 -3.864 23.415 1.00 1.00 C ATOM 6 CG MET A 1 89.048 -4.560 22.174 1.00 1.00 C ATOM 7 SD MET A 1 87.869 -5.805 21.595 1.00 1.00 S ATOM 8 CE MET A 1 88.058 -6.956 22.979 1.00 1.00 C ATOM 0 H1 MET A 1 89.446 -2.793 25.667 1.00 1.00 H new ATOM 0 H2 MET A 1 89.518 -1.171 25.170 1.00 1.00 H new ATOM 0 H3 MET A 1 88.022 -1.971 25.244 1.00 1.00 H new ATOM 0 HA MET A 1 90.259 -2.638 23.391 1.00 1.00 H new ATOM 0 HB2 MET A 1 88.625 -4.496 24.292 1.00 1.00 H new ATOM 0 HB3 MET A 1 87.415 -3.705 23.302 1.00 1.00 H new ATOM 0 HG2 MET A 1 89.236 -3.829 21.388 1.00 1.00 H new ATOM 0 HG3 MET A 1 90.003 -5.030 22.408 1.00 1.00 H new ATOM 0 HE1 MET A 1 87.596 -7.910 22.725 1.00 1.00 H new ATOM 0 HE2 MET A 1 89.118 -7.109 23.183 1.00 1.00 H new ATOM 0 HE3 MET A 1 87.575 -6.543 23.864 1.00 1.00 H new ATOM 17 N ASN A 2 87.834 -1.901 21.706 1.00 1.00 N ATOM 18 CA ASN A 2 87.207 -0.935 20.756 1.00 1.00 C ATOM 19 C ASN A 2 85.687 -0.965 20.930 1.00 1.00 C ATOM 20 O ASN A 2 85.026 -1.902 20.530 1.00 1.00 O ATOM 21 CB ASN A 2 87.562 -1.331 19.321 1.00 1.00 C ATOM 22 CG ASN A 2 89.034 -1.012 19.052 1.00 1.00 C ATOM 23 OD1 ASN A 2 89.881 -1.247 19.891 1.00 1.00 O ATOM 24 ND2 ASN A 2 89.376 -0.482 17.910 1.00 1.00 N ATOM 0 H ASN A 2 87.623 -2.882 21.525 1.00 1.00 H new ATOM 0 HA ASN A 2 87.578 0.070 20.960 1.00 1.00 H new ATOM 0 HB2 ASN A 2 87.376 -2.394 19.169 1.00 1.00 H new ATOM 0 HB3 ASN A 2 86.928 -0.793 18.617 1.00 1.00 H new ATOM 0 HD21 ASN A 2 90.355 -0.265 17.721 1.00 1.00 H new ATOM 0 HD22 ASN A 2 88.665 -0.285 17.206 1.00 1.00 H new ATOM 31 N LEU A 3 85.129 0.054 21.524 1.00 1.00 N ATOM 32 CA LEU A 3 83.652 0.082 21.723 1.00 1.00 C ATOM 33 C LEU A 3 82.962 0.233 20.364 1.00 1.00 C ATOM 34 O LEU A 3 82.737 1.328 19.888 1.00 1.00 O ATOM 35 CB LEU A 3 83.271 1.262 22.632 1.00 1.00 C ATOM 36 CG LEU A 3 84.328 2.362 22.519 1.00 1.00 C ATOM 37 CD1 LEU A 3 83.686 3.720 22.807 1.00 1.00 C ATOM 38 CD2 LEU A 3 85.444 2.101 23.533 1.00 1.00 C ATOM 0 H LEU A 3 85.631 0.867 21.880 1.00 1.00 H new ATOM 0 HA LEU A 3 83.331 -0.847 22.194 1.00 1.00 H new ATOM 0 HB2 LEU A 3 82.294 1.652 22.347 1.00 1.00 H new ATOM 0 HB3 LEU A 3 83.191 0.926 23.666 1.00 1.00 H new ATOM 0 HG LEU A 3 84.744 2.364 21.511 1.00 1.00 H new ATOM 0 HD11 LEU A 3 84.440 4.503 22.726 1.00 1.00 H new ATOM 0 HD12 LEU A 3 82.890 3.907 22.086 1.00 1.00 H new ATOM 0 HD13 LEU A 3 83.270 3.719 23.814 1.00 1.00 H new ATOM 0 HD21 LEU A 3 86.198 2.884 23.454 1.00 1.00 H new ATOM 0 HD22 LEU A 3 85.027 2.099 24.540 1.00 1.00 H new ATOM 0 HD23 LEU A 3 85.903 1.134 23.328 1.00 1.00 H new ATOM 50 N GLU A 4 82.626 -0.862 19.736 1.00 1.00 N ATOM 51 CA GLU A 4 81.952 -0.790 18.408 1.00 1.00 C ATOM 52 C GLU A 4 80.430 -0.775 18.614 1.00 1.00 C ATOM 53 O GLU A 4 79.903 -1.555 19.381 1.00 1.00 O ATOM 54 CB GLU A 4 82.345 -2.020 17.582 1.00 1.00 C ATOM 55 CG GLU A 4 82.052 -1.760 16.103 1.00 1.00 C ATOM 56 CD GLU A 4 82.578 -2.926 15.265 1.00 1.00 C ATOM 57 OE1 GLU A 4 83.408 -3.664 15.768 1.00 1.00 O ATOM 58 OE2 GLU A 4 82.141 -3.061 14.134 1.00 1.00 O ATOM 0 H GLU A 4 82.790 -1.806 20.087 1.00 1.00 H new ATOM 0 HA GLU A 4 82.256 0.116 17.884 1.00 1.00 H new ATOM 0 HB2 GLU A 4 83.404 -2.240 17.720 1.00 1.00 H new ATOM 0 HB3 GLU A 4 81.790 -2.893 17.925 1.00 1.00 H new ATOM 0 HG2 GLU A 4 80.979 -1.643 15.949 1.00 1.00 H new ATOM 0 HG3 GLU A 4 82.523 -0.829 15.786 1.00 1.00 H new ATOM 65 N PRO A 5 79.721 0.100 17.938 1.00 1.00 N ATOM 66 CA PRO A 5 78.241 0.196 18.063 1.00 1.00 C ATOM 67 C PRO A 5 77.579 -1.185 18.202 1.00 1.00 C ATOM 68 O PRO A 5 77.520 -1.942 17.254 1.00 1.00 O ATOM 69 CB PRO A 5 77.829 0.861 16.752 1.00 1.00 C ATOM 70 CG PRO A 5 78.985 1.736 16.389 1.00 1.00 C ATOM 71 CD PRO A 5 80.244 1.088 16.980 1.00 1.00 C ATOM 0 HA PRO A 5 77.934 0.746 18.953 1.00 1.00 H new ATOM 0 HB2 PRO A 5 77.635 0.120 15.976 1.00 1.00 H new ATOM 0 HB3 PRO A 5 76.915 1.443 16.873 1.00 1.00 H new ATOM 0 HG2 PRO A 5 79.072 1.830 15.307 1.00 1.00 H new ATOM 0 HG3 PRO A 5 78.847 2.742 16.786 1.00 1.00 H new ATOM 0 HD2 PRO A 5 80.849 0.613 16.207 1.00 1.00 H new ATOM 0 HD3 PRO A 5 80.878 1.825 17.473 1.00 1.00 H new ATOM 79 N PRO A 6 77.087 -1.514 19.373 1.00 1.00 N ATOM 80 CA PRO A 6 76.429 -2.827 19.623 1.00 1.00 C ATOM 81 C PRO A 6 74.974 -2.848 19.142 1.00 1.00 C ATOM 82 O PRO A 6 74.334 -1.823 19.022 1.00 1.00 O ATOM 83 CB PRO A 6 76.498 -2.970 21.144 1.00 1.00 C ATOM 84 CG PRO A 6 76.484 -1.570 21.666 1.00 1.00 C ATOM 85 CD PRO A 6 77.105 -0.678 20.584 1.00 1.00 C ATOM 0 HA PRO A 6 76.915 -3.640 19.084 1.00 1.00 H new ATOM 0 HB2 PRO A 6 75.652 -3.542 21.525 1.00 1.00 H new ATOM 0 HB3 PRO A 6 77.402 -3.496 21.450 1.00 1.00 H new ATOM 0 HG2 PRO A 6 75.465 -1.252 21.889 1.00 1.00 H new ATOM 0 HG3 PRO A 6 77.050 -1.500 22.595 1.00 1.00 H new ATOM 0 HD2 PRO A 6 76.530 0.238 20.444 1.00 1.00 H new ATOM 0 HD3 PRO A 6 78.120 -0.380 20.847 1.00 1.00 H new ATOM 93 N LYS A 7 74.449 -4.011 18.864 1.00 1.00 N ATOM 94 CA LYS A 7 73.038 -4.102 18.390 1.00 1.00 C ATOM 95 C LYS A 7 72.106 -4.289 19.590 1.00 1.00 C ATOM 96 O LYS A 7 72.218 -5.243 20.334 1.00 1.00 O ATOM 97 CB LYS A 7 72.893 -5.297 17.441 1.00 1.00 C ATOM 98 CG LYS A 7 73.531 -6.537 18.070 1.00 1.00 C ATOM 99 CD LYS A 7 74.718 -6.989 17.218 1.00 1.00 C ATOM 100 CE LYS A 7 75.314 -8.268 17.809 1.00 1.00 C ATOM 101 NZ LYS A 7 74.389 -9.409 17.559 1.00 1.00 N ATOM 0 H LYS A 7 74.937 -4.903 18.945 1.00 1.00 H new ATOM 0 HA LYS A 7 72.773 -3.185 17.864 1.00 1.00 H new ATOM 0 HB2 LYS A 7 71.839 -5.484 17.235 1.00 1.00 H new ATOM 0 HB3 LYS A 7 73.370 -5.075 16.486 1.00 1.00 H new ATOM 0 HG2 LYS A 7 73.862 -6.314 19.084 1.00 1.00 H new ATOM 0 HG3 LYS A 7 72.797 -7.339 18.144 1.00 1.00 H new ATOM 0 HD2 LYS A 7 74.396 -7.166 16.192 1.00 1.00 H new ATOM 0 HD3 LYS A 7 75.474 -6.205 17.184 1.00 1.00 H new ATOM 0 HE2 LYS A 7 76.287 -8.470 17.360 1.00 1.00 H new ATOM 0 HE3 LYS A 7 75.476 -8.145 18.880 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 74.932 -10.295 17.525 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 73.688 -9.462 18.325 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 73.900 -9.267 16.652 1.00 1.00 H new ATOM 115 N ALA A 8 71.186 -3.385 19.784 1.00 1.00 N ATOM 116 CA ALA A 8 70.247 -3.511 20.934 1.00 1.00 C ATOM 117 C ALA A 8 69.097 -2.515 20.765 1.00 1.00 C ATOM 118 O ALA A 8 68.273 -2.351 21.642 1.00 1.00 O ATOM 119 CB ALA A 8 70.992 -3.214 22.237 1.00 1.00 C ATOM 0 H ALA A 8 71.044 -2.564 19.196 1.00 1.00 H new ATOM 0 HA ALA A 8 69.848 -4.525 20.967 1.00 1.00 H new ATOM 0 HB1 ALA A 8 70.305 -3.306 23.078 1.00 1.00 H new ATOM 0 HB2 ALA A 8 71.811 -3.923 22.358 1.00 1.00 H new ATOM 0 HB3 ALA A 8 71.392 -2.201 22.205 1.00 1.00 H new ATOM 125 N GLU A 9 69.040 -1.852 19.640 1.00 1.00 N ATOM 126 CA GLU A 9 67.948 -0.864 19.399 1.00 1.00 C ATOM 127 C GLU A 9 67.945 0.189 20.511 1.00 1.00 C ATOM 128 O GLU A 9 68.358 -0.065 21.624 1.00 1.00 O ATOM 129 CB GLU A 9 66.596 -1.584 19.369 1.00 1.00 C ATOM 130 CG GLU A 9 66.448 -2.338 18.046 1.00 1.00 C ATOM 131 CD GLU A 9 65.067 -2.993 17.983 1.00 1.00 C ATOM 132 OE1 GLU A 9 64.087 -2.266 17.984 1.00 1.00 O ATOM 133 OE2 GLU A 9 65.012 -4.211 17.935 1.00 1.00 O ATOM 0 HA GLU A 9 68.117 -0.373 18.440 1.00 1.00 H new ATOM 0 HB2 GLU A 9 66.523 -2.279 20.206 1.00 1.00 H new ATOM 0 HB3 GLU A 9 65.786 -0.864 19.482 1.00 1.00 H new ATOM 0 HG2 GLU A 9 66.575 -1.652 17.208 1.00 1.00 H new ATOM 0 HG3 GLU A 9 67.226 -3.096 17.958 1.00 1.00 H new ATOM 140 N CYS A 10 67.478 1.372 20.216 1.00 1.00 N ATOM 141 CA CYS A 10 67.445 2.442 21.252 1.00 1.00 C ATOM 142 C CYS A 10 68.875 2.809 21.653 1.00 1.00 C ATOM 143 O CYS A 10 69.164 3.048 22.809 1.00 1.00 O ATOM 144 CB CYS A 10 66.677 1.940 22.479 1.00 1.00 C ATOM 145 SG CYS A 10 65.442 0.723 21.960 1.00 1.00 S ATOM 0 H CYS A 10 67.118 1.643 19.301 1.00 1.00 H new ATOM 0 HA CYS A 10 66.946 3.324 20.850 1.00 1.00 H new ATOM 0 HB2 CYS A 10 67.366 1.492 23.195 1.00 1.00 H new ATOM 0 HB3 CYS A 10 66.191 2.775 22.984 1.00 1.00 H new ATOM 150 N ARG A 11 69.772 2.860 20.703 1.00 1.00 N ATOM 151 CA ARG A 11 71.189 3.215 21.017 1.00 1.00 C ATOM 152 C ARG A 11 71.652 4.319 20.064 1.00 1.00 C ATOM 153 O ARG A 11 72.603 5.027 20.334 1.00 1.00 O ATOM 154 CB ARG A 11 72.081 1.982 20.836 1.00 1.00 C ATOM 155 CG ARG A 11 71.594 0.856 21.750 1.00 1.00 C ATOM 156 CD ARG A 11 72.121 1.085 23.168 1.00 1.00 C ATOM 157 NE ARG A 11 73.231 0.130 23.445 1.00 1.00 N ATOM 158 CZ ARG A 11 73.528 -0.186 24.676 1.00 1.00 C ATOM 159 NH1 ARG A 11 72.852 0.335 25.664 1.00 1.00 N ATOM 160 NH2 ARG A 11 74.500 -1.022 24.919 1.00 1.00 N ATOM 0 H ARG A 11 69.584 2.670 19.719 1.00 1.00 H new ATOM 0 HA ARG A 11 71.258 3.563 22.048 1.00 1.00 H new ATOM 0 HB2 ARG A 11 72.060 1.655 19.796 1.00 1.00 H new ATOM 0 HB3 ARG A 11 73.116 2.232 21.070 1.00 1.00 H new ATOM 0 HG2 ARG A 11 70.504 0.824 21.756 1.00 1.00 H new ATOM 0 HG3 ARG A 11 71.939 -0.107 21.374 1.00 1.00 H new ATOM 0 HD2 ARG A 11 72.474 2.111 23.275 1.00 1.00 H new ATOM 0 HD3 ARG A 11 71.319 0.947 23.893 1.00 1.00 H new ATOM 0 HE ARG A 11 73.759 -0.277 22.673 1.00 1.00 H new ATOM 0 HH11 ARG A 11 72.092 0.988 25.474 1.00 1.00 H new ATOM 0 HH12 ARG A 11 73.084 0.089 26.626 1.00 1.00 H new ATOM 0 HH21 ARG A 11 75.028 -1.429 24.147 1.00 1.00 H new ATOM 0 HH22 ARG A 11 74.732 -1.269 25.881 1.00 1.00 H new ATOM 174 N SER A 12 70.987 4.470 18.949 1.00 1.00 N ATOM 175 CA SER A 12 71.384 5.527 17.972 1.00 1.00 C ATOM 176 C SER A 12 70.441 6.725 18.101 1.00 1.00 C ATOM 177 O SER A 12 70.856 7.822 18.416 1.00 1.00 O ATOM 178 CB SER A 12 71.294 4.963 16.553 1.00 1.00 C ATOM 179 OG SER A 12 72.347 4.031 16.351 1.00 1.00 O ATOM 0 H SER A 12 70.184 3.905 18.672 1.00 1.00 H new ATOM 0 HA SER A 12 72.406 5.846 18.177 1.00 1.00 H new ATOM 0 HB2 SER A 12 70.330 4.478 16.403 1.00 1.00 H new ATOM 0 HB3 SER A 12 71.362 5.770 15.823 1.00 1.00 H new ATOM 0 HG SER A 12 72.291 3.666 15.443 1.00 1.00 H new ATOM 185 N ALA A 13 69.174 6.523 17.858 1.00 1.00 N ATOM 186 CA ALA A 13 68.202 7.648 17.965 1.00 1.00 C ATOM 187 C ALA A 13 68.576 8.745 16.963 1.00 1.00 C ATOM 188 O ALA A 13 67.965 8.880 15.921 1.00 1.00 O ATOM 189 CB ALA A 13 68.227 8.215 19.388 1.00 1.00 C ATOM 0 H ALA A 13 68.770 5.626 17.590 1.00 1.00 H new ATOM 0 HA ALA A 13 67.199 7.284 17.742 1.00 1.00 H new ATOM 0 HB1 ALA A 13 67.516 9.037 19.465 1.00 1.00 H new ATOM 0 HB2 ALA A 13 67.955 7.433 20.096 1.00 1.00 H new ATOM 0 HB3 ALA A 13 69.229 8.579 19.617 1.00 1.00 H new ATOM 195 N THR A 14 69.574 9.530 17.268 1.00 1.00 N ATOM 196 CA THR A 14 69.983 10.615 16.331 1.00 1.00 C ATOM 197 C THR A 14 71.355 11.154 16.748 1.00 1.00 C ATOM 198 O THR A 14 72.352 10.465 16.666 1.00 1.00 O ATOM 199 CB THR A 14 68.947 11.744 16.376 1.00 1.00 C ATOM 200 OG1 THR A 14 67.645 11.196 16.226 1.00 1.00 O ATOM 201 CG2 THR A 14 69.220 12.735 15.243 1.00 1.00 C ATOM 0 H THR A 14 70.123 9.467 18.125 1.00 1.00 H new ATOM 0 HA THR A 14 70.043 10.222 15.316 1.00 1.00 H new ATOM 0 HB THR A 14 69.015 12.262 17.332 1.00 1.00 H new ATOM 0 HG1 THR A 14 67.683 10.423 15.624 1.00 1.00 H new ATOM 0 HG21 THR A 14 68.483 13.537 15.276 1.00 1.00 H new ATOM 0 HG22 THR A 14 70.219 13.155 15.360 1.00 1.00 H new ATOM 0 HG23 THR A 14 69.153 12.220 14.285 1.00 1.00 H new ATOM 209 N ARG A 15 71.413 12.380 17.196 1.00 1.00 N ATOM 210 CA ARG A 15 72.719 12.963 17.621 1.00 1.00 C ATOM 211 C ARG A 15 73.710 12.910 16.455 1.00 1.00 C ATOM 212 O ARG A 15 74.849 13.313 16.580 1.00 1.00 O ATOM 213 CB ARG A 15 73.267 12.162 18.811 1.00 1.00 C ATOM 214 CG ARG A 15 74.465 12.894 19.419 1.00 1.00 C ATOM 215 CD ARG A 15 75.758 12.360 18.801 1.00 1.00 C ATOM 216 NE ARG A 15 76.590 11.725 19.862 1.00 1.00 N ATOM 217 CZ ARG A 15 76.442 10.458 20.136 1.00 1.00 C ATOM 218 NH1 ARG A 15 75.565 9.747 19.482 1.00 1.00 N ATOM 219 NH2 ARG A 15 77.171 9.901 21.065 1.00 1.00 N ATOM 0 H ARG A 15 70.611 13.004 17.286 1.00 1.00 H new ATOM 0 HA ARG A 15 72.578 14.002 17.919 1.00 1.00 H new ATOM 0 HB2 ARG A 15 72.489 12.032 19.563 1.00 1.00 H new ATOM 0 HB3 ARG A 15 73.565 11.166 18.485 1.00 1.00 H new ATOM 0 HG2 ARG A 15 74.379 13.966 19.239 1.00 1.00 H new ATOM 0 HG3 ARG A 15 74.481 12.753 20.500 1.00 1.00 H new ATOM 0 HD2 ARG A 15 75.528 11.634 18.021 1.00 1.00 H new ATOM 0 HD3 ARG A 15 76.310 13.172 18.328 1.00 1.00 H new ATOM 0 HE ARG A 15 77.275 12.281 20.374 1.00 1.00 H new ATOM 0 HH11 ARG A 15 74.995 10.182 18.756 1.00 1.00 H new ATOM 0 HH12 ARG A 15 75.449 8.756 19.696 1.00 1.00 H new ATOM 0 HH21 ARG A 15 77.856 10.456 21.577 1.00 1.00 H new ATOM 0 HH22 ARG A 15 77.055 8.910 21.279 1.00 1.00 H new ATOM 233 N VAL A 16 73.287 12.423 15.318 1.00 1.00 N ATOM 234 CA VAL A 16 74.210 12.350 14.147 1.00 1.00 C ATOM 235 C VAL A 16 73.425 12.600 12.855 1.00 1.00 C ATOM 236 O VAL A 16 73.975 12.581 11.772 1.00 1.00 O ATOM 237 CB VAL A 16 74.857 10.963 14.094 1.00 1.00 C ATOM 238 CG1 VAL A 16 75.834 10.899 12.919 1.00 1.00 C ATOM 239 CG2 VAL A 16 75.613 10.705 15.399 1.00 1.00 C ATOM 0 H VAL A 16 72.344 12.073 15.150 1.00 1.00 H new ATOM 0 HA VAL A 16 74.985 13.109 14.249 1.00 1.00 H new ATOM 0 HB VAL A 16 74.084 10.206 13.964 1.00 1.00 H new ATOM 0 HG11 VAL A 16 76.294 9.912 12.882 1.00 1.00 H new ATOM 0 HG12 VAL A 16 75.297 11.084 11.989 1.00 1.00 H new ATOM 0 HG13 VAL A 16 76.608 11.655 13.048 1.00 1.00 H new ATOM 0 HG21 VAL A 16 76.074 9.718 15.363 1.00 1.00 H new ATOM 0 HG22 VAL A 16 76.386 11.463 15.527 1.00 1.00 H new ATOM 0 HG23 VAL A 16 74.918 10.750 16.237 1.00 1.00 H new ATOM 249 N MET A 17 72.143 12.836 12.959 1.00 1.00 N ATOM 250 CA MET A 17 71.325 13.090 11.735 1.00 1.00 C ATOM 251 C MET A 17 70.357 14.246 11.996 1.00 1.00 C ATOM 252 O MET A 17 69.899 14.446 13.103 1.00 1.00 O ATOM 253 CB MET A 17 70.525 11.831 11.382 1.00 1.00 C ATOM 254 CG MET A 17 71.469 10.630 11.299 1.00 1.00 C ATOM 255 SD MET A 17 71.646 9.887 12.939 1.00 1.00 S ATOM 256 CE MET A 17 72.765 8.547 12.462 1.00 1.00 C ATOM 0 H MET A 17 71.627 12.864 13.838 1.00 1.00 H new ATOM 0 HA MET A 17 71.986 13.347 10.907 1.00 1.00 H new ATOM 0 HB2 MET A 17 69.758 11.652 12.135 1.00 1.00 H new ATOM 0 HB3 MET A 17 70.011 11.969 10.431 1.00 1.00 H new ATOM 0 HG2 MET A 17 71.078 9.895 10.595 1.00 1.00 H new ATOM 0 HG3 MET A 17 72.443 10.945 10.924 1.00 1.00 H new ATOM 0 HE1 MET A 17 73.299 8.188 13.342 1.00 1.00 H new ATOM 0 HE2 MET A 17 72.189 7.729 12.028 1.00 1.00 H new ATOM 0 HE3 MET A 17 73.482 8.915 11.728 1.00 1.00 H new ATOM 266 N GLY A 18 70.040 15.008 10.983 1.00 1.00 N ATOM 267 CA GLY A 18 69.099 16.150 11.173 1.00 1.00 C ATOM 268 C GLY A 18 69.497 17.307 10.253 1.00 1.00 C ATOM 269 O GLY A 18 69.092 17.373 9.110 1.00 1.00 O ATOM 0 H GLY A 18 70.392 14.889 10.033 1.00 1.00 H new ATOM 0 HA2 GLY A 18 68.079 15.833 10.954 1.00 1.00 H new ATOM 0 HA3 GLY A 18 69.115 16.478 12.213 1.00 1.00 H new ATOM 273 N GLY A 19 70.285 18.223 10.747 1.00 1.00 N ATOM 274 CA GLY A 19 70.707 19.381 9.908 1.00 1.00 C ATOM 275 C GLY A 19 71.820 18.960 8.942 1.00 1.00 C ATOM 276 O GLY A 19 71.823 19.343 7.789 1.00 1.00 O ATOM 0 H GLY A 19 70.655 18.219 11.697 1.00 1.00 H new ATOM 0 HA2 GLY A 19 69.854 19.762 9.347 1.00 1.00 H new ATOM 0 HA3 GLY A 19 71.057 20.193 10.546 1.00 1.00 H new ATOM 280 N PRO A 20 72.764 18.185 9.411 1.00 1.00 N ATOM 281 CA PRO A 20 73.912 17.710 8.577 1.00 1.00 C ATOM 282 C PRO A 20 73.462 16.925 7.335 1.00 1.00 C ATOM 283 O PRO A 20 74.199 16.117 6.806 1.00 1.00 O ATOM 284 CB PRO A 20 74.711 16.804 9.525 1.00 1.00 C ATOM 285 CG PRO A 20 74.292 17.198 10.903 1.00 1.00 C ATOM 286 CD PRO A 20 72.847 17.681 10.790 1.00 1.00 C ATOM 0 HA PRO A 20 74.489 18.548 8.185 1.00 1.00 H new ATOM 0 HB2 PRO A 20 74.497 15.752 9.336 1.00 1.00 H new ATOM 0 HB3 PRO A 20 75.784 16.941 9.387 1.00 1.00 H new ATOM 0 HG2 PRO A 20 74.367 16.354 11.589 1.00 1.00 H new ATOM 0 HG3 PRO A 20 74.936 17.985 11.295 1.00 1.00 H new ATOM 0 HD2 PRO A 20 72.138 16.872 10.966 1.00 1.00 H new ATOM 0 HD3 PRO A 20 72.626 18.462 11.517 1.00 1.00 H new ATOM 294 N CYS A 21 72.264 17.157 6.866 1.00 1.00 N ATOM 295 CA CYS A 21 71.777 16.427 5.659 1.00 1.00 C ATOM 296 C CYS A 21 71.041 17.403 4.737 1.00 1.00 C ATOM 297 O CYS A 21 70.006 17.938 5.082 1.00 1.00 O ATOM 298 CB CYS A 21 70.822 15.311 6.091 1.00 1.00 C ATOM 299 SG CYS A 21 69.862 14.750 4.663 1.00 1.00 S ATOM 0 H CYS A 21 71.602 17.821 7.267 1.00 1.00 H new ATOM 0 HA CYS A 21 72.624 15.994 5.127 1.00 1.00 H new ATOM 0 HB2 CYS A 21 71.386 14.479 6.513 1.00 1.00 H new ATOM 0 HB3 CYS A 21 70.154 15.672 6.873 1.00 1.00 H new ATOM 304 N THR A 22 71.569 17.639 3.564 1.00 1.00 N ATOM 305 CA THR A 22 70.901 18.580 2.617 1.00 1.00 C ATOM 306 C THR A 22 70.042 17.781 1.626 1.00 1.00 C ATOM 307 O THR A 22 70.446 16.733 1.165 1.00 1.00 O ATOM 308 CB THR A 22 71.967 19.362 1.846 1.00 1.00 C ATOM 309 OG1 THR A 22 71.415 19.832 0.624 1.00 1.00 O ATOM 310 CG2 THR A 22 73.160 18.450 1.553 1.00 1.00 C ATOM 0 H THR A 22 72.434 17.221 3.221 1.00 1.00 H new ATOM 0 HA THR A 22 70.269 19.272 3.174 1.00 1.00 H new ATOM 0 HB THR A 22 72.300 20.210 2.444 1.00 1.00 H new ATOM 0 HG1 THR A 22 72.096 20.334 0.129 1.00 1.00 H new ATOM 0 HG21 THR A 22 73.918 19.008 1.004 1.00 1.00 H new ATOM 0 HG22 THR A 22 73.582 18.091 2.491 1.00 1.00 H new ATOM 0 HG23 THR A 22 72.830 17.601 0.955 1.00 1.00 H new ATOM 318 N PRO A 23 68.867 18.268 1.298 1.00 1.00 N ATOM 319 CA PRO A 23 67.948 17.581 0.341 1.00 1.00 C ATOM 320 C PRO A 23 68.669 17.066 -0.914 1.00 1.00 C ATOM 321 O PRO A 23 68.544 17.625 -1.984 1.00 1.00 O ATOM 322 CB PRO A 23 66.938 18.670 -0.033 1.00 1.00 C ATOM 323 CG PRO A 23 66.904 19.589 1.144 1.00 1.00 C ATOM 324 CD PRO A 23 68.287 19.524 1.801 1.00 1.00 C ATOM 0 HA PRO A 23 67.497 16.695 0.787 1.00 1.00 H new ATOM 0 HB2 PRO A 23 67.243 19.198 -0.937 1.00 1.00 H new ATOM 0 HB3 PRO A 23 65.954 18.244 -0.230 1.00 1.00 H new ATOM 0 HG2 PRO A 23 66.672 20.607 0.832 1.00 1.00 H new ATOM 0 HG3 PRO A 23 66.128 19.287 1.847 1.00 1.00 H new ATOM 0 HD2 PRO A 23 68.899 20.383 1.527 1.00 1.00 H new ATOM 0 HD3 PRO A 23 68.212 19.521 2.888 1.00 1.00 H new ATOM 332 N ARG A 24 69.414 15.999 -0.791 1.00 1.00 N ATOM 333 CA ARG A 24 70.134 15.444 -1.976 1.00 1.00 C ATOM 334 C ARG A 24 70.783 16.580 -2.773 1.00 1.00 C ATOM 335 O ARG A 24 70.153 17.208 -3.601 1.00 1.00 O ATOM 336 CB ARG A 24 69.140 14.698 -2.870 1.00 1.00 C ATOM 337 CG ARG A 24 68.204 13.856 -2.001 1.00 1.00 C ATOM 338 CD ARG A 24 67.259 13.053 -2.898 1.00 1.00 C ATOM 339 NE ARG A 24 66.343 12.239 -2.051 1.00 1.00 N ATOM 340 CZ ARG A 24 65.345 12.810 -1.433 1.00 1.00 C ATOM 341 NH1 ARG A 24 65.151 14.095 -1.557 1.00 1.00 N ATOM 342 NH2 ARG A 24 64.543 12.097 -0.691 1.00 1.00 N ATOM 0 H ARG A 24 69.555 15.487 0.080 1.00 1.00 H new ATOM 0 HA ARG A 24 70.910 14.758 -1.635 1.00 1.00 H new ATOM 0 HB2 ARG A 24 68.563 15.408 -3.462 1.00 1.00 H new ATOM 0 HB3 ARG A 24 69.675 14.059 -3.572 1.00 1.00 H new ATOM 0 HG2 ARG A 24 68.784 13.182 -1.370 1.00 1.00 H new ATOM 0 HG3 ARG A 24 67.630 14.501 -1.335 1.00 1.00 H new ATOM 0 HD2 ARG A 24 66.683 13.726 -3.532 1.00 1.00 H new ATOM 0 HD3 ARG A 24 67.832 12.404 -3.560 1.00 1.00 H new ATOM 0 HE ARG A 24 66.496 11.235 -1.954 1.00 1.00 H new ATOM 0 HH11 ARG A 24 65.779 14.652 -2.136 1.00 1.00 H new ATOM 0 HH12 ARG A 24 64.371 14.542 -1.074 1.00 1.00 H new ATOM 0 HH21 ARG A 24 64.696 11.093 -0.594 1.00 1.00 H new ATOM 0 HH22 ARG A 24 63.763 12.543 -0.208 1.00 1.00 H new ATOM 356 N LYS A 25 72.039 16.847 -2.534 1.00 1.00 N ATOM 357 CA LYS A 25 72.723 17.942 -3.281 1.00 1.00 C ATOM 358 C LYS A 25 73.334 17.380 -4.570 1.00 1.00 C ATOM 359 O LYS A 25 73.780 18.116 -5.428 1.00 1.00 O ATOM 360 CB LYS A 25 73.812 18.568 -2.385 1.00 1.00 C ATOM 361 CG LYS A 25 75.180 17.986 -2.744 1.00 1.00 C ATOM 362 CD LYS A 25 75.191 16.485 -2.448 1.00 1.00 C ATOM 363 CE LYS A 25 75.814 16.240 -1.072 1.00 1.00 C ATOM 364 NZ LYS A 25 75.234 17.196 -0.087 1.00 1.00 N ATOM 0 H LYS A 25 72.620 16.355 -1.855 1.00 1.00 H new ATOM 0 HA LYS A 25 72.004 18.716 -3.549 1.00 1.00 H new ATOM 0 HB2 LYS A 25 73.823 19.650 -2.513 1.00 1.00 H new ATOM 0 HB3 LYS A 25 73.588 18.373 -1.336 1.00 1.00 H new ATOM 0 HG2 LYS A 25 75.396 18.161 -3.798 1.00 1.00 H new ATOM 0 HG3 LYS A 25 75.961 18.486 -2.171 1.00 1.00 H new ATOM 0 HD2 LYS A 25 74.175 16.091 -2.474 1.00 1.00 H new ATOM 0 HD3 LYS A 25 75.758 15.957 -3.215 1.00 1.00 H new ATOM 0 HE2 LYS A 25 75.627 15.215 -0.753 1.00 1.00 H new ATOM 0 HE3 LYS A 25 76.896 16.365 -1.123 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 75.593 16.975 0.864 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 75.506 18.166 -0.343 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 74.197 17.114 -0.093 1.00 1.00 H new ATOM 378 N GLY A 26 73.359 16.082 -4.715 1.00 1.00 N ATOM 379 CA GLY A 26 73.943 15.480 -5.949 1.00 1.00 C ATOM 380 C GLY A 26 72.840 15.303 -7.003 1.00 1.00 C ATOM 381 O GLY A 26 71.791 14.762 -6.715 1.00 1.00 O ATOM 0 H GLY A 26 73.001 15.413 -4.033 1.00 1.00 H new ATOM 0 HA2 GLY A 26 74.735 16.120 -6.339 1.00 1.00 H new ATOM 0 HA3 GLY A 26 74.397 14.517 -5.717 1.00 1.00 H new ATOM 385 N PRO A 27 73.068 15.749 -8.216 1.00 1.00 N ATOM 386 CA PRO A 27 72.062 15.624 -9.314 1.00 1.00 C ATOM 387 C PRO A 27 71.583 14.175 -9.497 1.00 1.00 C ATOM 388 O PRO A 27 72.298 13.240 -9.193 1.00 1.00 O ATOM 389 CB PRO A 27 72.814 16.097 -10.565 1.00 1.00 C ATOM 390 CG PRO A 27 73.928 16.953 -10.057 1.00 1.00 C ATOM 391 CD PRO A 27 74.296 16.418 -8.671 1.00 1.00 C ATOM 0 HA PRO A 27 71.164 16.205 -9.103 1.00 1.00 H new ATOM 0 HB2 PRO A 27 73.197 15.252 -11.136 1.00 1.00 H new ATOM 0 HB3 PRO A 27 72.158 16.659 -11.229 1.00 1.00 H new ATOM 0 HG2 PRO A 27 74.786 16.911 -10.728 1.00 1.00 H new ATOM 0 HG3 PRO A 27 73.619 17.997 -10.000 1.00 1.00 H new ATOM 0 HD2 PRO A 27 75.135 15.724 -8.720 1.00 1.00 H new ATOM 0 HD3 PRO A 27 74.587 17.223 -7.996 1.00 1.00 H new ATOM 399 N PRO A 28 70.386 13.989 -9.997 1.00 1.00 N ATOM 400 CA PRO A 28 69.818 12.631 -10.229 1.00 1.00 C ATOM 401 C PRO A 28 70.842 11.672 -10.847 1.00 1.00 C ATOM 402 O PRO A 28 71.874 12.083 -11.339 1.00 1.00 O ATOM 403 CB PRO A 28 68.667 12.887 -11.204 1.00 1.00 C ATOM 404 CG PRO A 28 68.225 14.287 -10.926 1.00 1.00 C ATOM 405 CD PRO A 28 69.445 15.048 -10.397 1.00 1.00 C ATOM 0 HA PRO A 28 69.506 12.155 -9.299 1.00 1.00 H new ATOM 0 HB2 PRO A 28 68.994 12.775 -12.238 1.00 1.00 H new ATOM 0 HB3 PRO A 28 67.853 12.179 -11.048 1.00 1.00 H new ATOM 0 HG2 PRO A 28 67.841 14.757 -11.832 1.00 1.00 H new ATOM 0 HG3 PRO A 28 67.417 14.298 -10.194 1.00 1.00 H new ATOM 0 HD2 PRO A 28 69.874 15.694 -11.163 1.00 1.00 H new ATOM 0 HD3 PRO A 28 69.181 15.686 -9.553 1.00 1.00 H new ATOM 413 N LYS A 29 70.564 10.397 -10.825 1.00 1.00 N ATOM 414 CA LYS A 29 71.521 9.415 -11.411 1.00 1.00 C ATOM 415 C LYS A 29 71.792 9.774 -12.874 1.00 1.00 C ATOM 416 O LYS A 29 70.894 9.803 -13.693 1.00 1.00 O ATOM 417 CB LYS A 29 70.921 8.009 -11.335 1.00 1.00 C ATOM 418 CG LYS A 29 70.359 7.768 -9.933 1.00 1.00 C ATOM 419 CD LYS A 29 71.441 8.062 -8.891 1.00 1.00 C ATOM 420 CE LYS A 29 71.059 7.410 -7.561 1.00 1.00 C ATOM 421 NZ LYS A 29 71.311 5.943 -7.636 1.00 1.00 N ATOM 0 HA LYS A 29 72.456 9.443 -10.851 1.00 1.00 H new ATOM 0 HB2 LYS A 29 70.132 7.899 -12.078 1.00 1.00 H new ATOM 0 HB3 LYS A 29 71.683 7.264 -11.566 1.00 1.00 H new ATOM 0 HG2 LYS A 29 69.492 8.406 -9.763 1.00 1.00 H new ATOM 0 HG3 LYS A 29 70.019 6.737 -9.838 1.00 1.00 H new ATOM 0 HD2 LYS A 29 72.403 7.680 -9.232 1.00 1.00 H new ATOM 0 HD3 LYS A 29 71.553 9.138 -8.762 1.00 1.00 H new ATOM 0 HE2 LYS A 29 71.639 7.848 -6.749 1.00 1.00 H new ATOM 0 HE3 LYS A 29 70.008 7.598 -7.340 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 71.366 5.551 -6.674 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 70.535 5.483 -8.154 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 72.208 5.770 -8.132 1.00 1.00 H new ATOM 435 N CYS A 30 73.024 10.045 -13.211 1.00 1.00 N ATOM 436 CA CYS A 30 73.351 10.399 -14.621 1.00 1.00 C ATOM 437 C CYS A 30 73.360 9.129 -15.476 1.00 1.00 C ATOM 438 O CYS A 30 72.328 8.640 -15.890 1.00 1.00 O ATOM 439 CB CYS A 30 74.732 11.056 -14.678 1.00 1.00 C ATOM 440 SG CYS A 30 74.739 12.544 -13.648 1.00 1.00 S ATOM 0 H CYS A 30 73.818 10.036 -12.570 1.00 1.00 H new ATOM 0 HA CYS A 30 72.602 11.093 -15.002 1.00 1.00 H new ATOM 0 HB2 CYS A 30 75.493 10.357 -14.330 1.00 1.00 H new ATOM 0 HB3 CYS A 30 74.982 11.313 -15.707 1.00 1.00 H new ATOM 445 N LYS A 31 74.522 8.595 -15.742 1.00 1.00 N ATOM 446 CA LYS A 31 74.613 7.356 -16.570 1.00 1.00 C ATOM 447 C LYS A 31 75.731 6.466 -16.014 1.00 1.00 C ATOM 448 O LYS A 31 76.832 6.437 -16.529 1.00 1.00 O ATOM 449 CB LYS A 31 74.916 7.727 -18.036 1.00 1.00 C ATOM 450 CG LYS A 31 75.360 9.189 -18.116 1.00 1.00 C ATOM 451 CD LYS A 31 76.706 9.354 -17.406 1.00 1.00 C ATOM 452 CE LYS A 31 77.839 8.988 -18.367 1.00 1.00 C ATOM 453 NZ LYS A 31 78.360 10.225 -19.014 1.00 1.00 N ATOM 0 H LYS A 31 75.416 8.965 -15.420 1.00 1.00 H new ATOM 0 HA LYS A 31 73.665 6.819 -16.533 1.00 1.00 H new ATOM 0 HB2 LYS A 31 75.697 7.077 -18.432 1.00 1.00 H new ATOM 0 HB3 LYS A 31 74.030 7.572 -18.651 1.00 1.00 H new ATOM 0 HG2 LYS A 31 75.446 9.497 -19.158 1.00 1.00 H new ATOM 0 HG3 LYS A 31 74.612 9.833 -17.654 1.00 1.00 H new ATOM 0 HD2 LYS A 31 76.824 10.382 -17.062 1.00 1.00 H new ATOM 0 HD3 LYS A 31 76.744 8.716 -16.523 1.00 1.00 H new ATOM 0 HE2 LYS A 31 78.639 8.482 -17.827 1.00 1.00 H new ATOM 0 HE3 LYS A 31 77.477 8.293 -19.125 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 79.130 9.977 -19.667 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 77.594 10.690 -19.542 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 78.720 10.873 -18.285 1.00 1.00 H new ATOM 467 N GLN A 32 75.459 5.745 -14.962 1.00 1.00 N ATOM 468 CA GLN A 32 76.506 4.865 -14.371 1.00 1.00 C ATOM 469 C GLN A 32 76.715 3.640 -15.264 1.00 1.00 C ATOM 470 O GLN A 32 75.779 2.958 -15.630 1.00 1.00 O ATOM 471 CB GLN A 32 76.062 4.413 -12.976 1.00 1.00 C ATOM 472 CG GLN A 32 77.167 3.572 -12.334 1.00 1.00 C ATOM 473 CD GLN A 32 78.422 4.427 -12.155 1.00 1.00 C ATOM 474 OE1 GLN A 32 79.311 4.468 -13.109 1.00 1.00 O flip ATOM 475 NE2 GLN A 32 78.596 5.065 -11.136 1.00 1.00 N flip ATOM 0 H GLN A 32 74.557 5.727 -14.486 1.00 1.00 H new ATOM 0 HA GLN A 32 77.443 5.417 -14.295 1.00 1.00 H new ATOM 0 HB2 GLN A 32 75.843 5.281 -12.354 1.00 1.00 H new ATOM 0 HB3 GLN A 32 75.143 3.832 -13.046 1.00 1.00 H new ATOM 0 HG2 GLN A 32 76.834 3.190 -11.369 1.00 1.00 H new ATOM 0 HG3 GLN A 32 77.390 2.707 -12.959 1.00 1.00 H new ATOM 0 HE21 GLN A 32 77.901 5.033 -10.390 1.00 1.00 H new ATOM 0 HE22 GLN A 32 79.437 5.632 -11.027 1.00 1.00 H new ATOM 484 N ARG A 33 77.940 3.355 -15.614 1.00 1.00 N ATOM 485 CA ARG A 33 78.217 2.172 -16.479 1.00 1.00 C ATOM 486 C ARG A 33 79.644 1.681 -16.221 1.00 1.00 C ATOM 487 O ARG A 33 80.416 1.480 -17.138 1.00 1.00 O ATOM 488 CB ARG A 33 78.074 2.566 -17.953 1.00 1.00 C ATOM 489 CG ARG A 33 76.591 2.670 -18.316 1.00 1.00 C ATOM 490 CD ARG A 33 76.429 2.577 -19.834 1.00 1.00 C ATOM 491 NE ARG A 33 77.559 3.285 -20.499 1.00 1.00 N ATOM 492 CZ ARG A 33 77.964 2.903 -21.679 1.00 1.00 C ATOM 493 NH1 ARG A 33 77.380 1.902 -22.277 1.00 1.00 N ATOM 494 NH2 ARG A 33 78.954 3.523 -22.261 1.00 1.00 N ATOM 0 H ARG A 33 78.763 3.891 -15.338 1.00 1.00 H new ATOM 0 HA ARG A 33 77.507 1.378 -16.247 1.00 1.00 H new ATOM 0 HB2 ARG A 33 78.571 3.519 -18.135 1.00 1.00 H new ATOM 0 HB3 ARG A 33 78.563 1.826 -18.587 1.00 1.00 H new ATOM 0 HG2 ARG A 33 76.030 1.872 -17.830 1.00 1.00 H new ATOM 0 HG3 ARG A 33 76.182 3.613 -17.953 1.00 1.00 H new ATOM 0 HD2 ARG A 33 76.407 1.532 -20.145 1.00 1.00 H new ATOM 0 HD3 ARG A 33 75.480 3.020 -20.137 1.00 1.00 H new ATOM 0 HE ARG A 33 78.016 4.068 -20.032 1.00 1.00 H new ATOM 0 HH11 ARG A 33 76.606 1.417 -21.822 1.00 1.00 H new ATOM 0 HH12 ARG A 33 77.697 1.604 -23.199 1.00 1.00 H new ATOM 0 HH21 ARG A 33 79.411 4.306 -21.793 1.00 1.00 H new ATOM 0 HH22 ARG A 33 79.271 3.225 -23.183 1.00 1.00 H new ATOM 508 N GLN A 34 79.998 1.486 -14.980 1.00 1.00 N ATOM 509 CA GLN A 34 81.374 1.007 -14.662 1.00 1.00 C ATOM 510 C GLN A 34 82.402 2.018 -15.177 1.00 1.00 C ATOM 511 O GLN A 34 82.516 2.252 -16.364 1.00 1.00 O ATOM 512 CB GLN A 34 81.609 -0.350 -15.333 1.00 1.00 C ATOM 513 CG GLN A 34 82.772 -1.066 -14.644 1.00 1.00 C ATOM 514 CD GLN A 34 82.303 -1.627 -13.300 1.00 1.00 C ATOM 515 OE1 GLN A 34 82.576 -0.975 -12.203 1.00 1.00 O flip ATOM 516 NE2 GLN A 34 81.681 -2.669 -13.247 1.00 1.00 N flip ATOM 0 H GLN A 34 79.394 1.638 -14.172 1.00 1.00 H new ATOM 0 HA GLN A 34 81.481 0.902 -13.582 1.00 1.00 H new ATOM 0 HB2 GLN A 34 80.707 -0.958 -15.273 1.00 1.00 H new ATOM 0 HB3 GLN A 34 81.830 -0.211 -16.391 1.00 1.00 H new ATOM 0 HG2 GLN A 34 83.143 -1.872 -15.277 1.00 1.00 H new ATOM 0 HG3 GLN A 34 83.600 -0.374 -14.492 1.00 1.00 H new ATOM 0 HE21 GLN A 34 81.467 -3.179 -14.104 1.00 1.00 H new ATOM 0 HE22 GLN A 34 81.373 -3.034 -12.346 1.00 1.00 H new ATOM 525 N THR A 35 83.151 2.618 -14.293 1.00 1.00 N ATOM 526 CA THR A 35 84.172 3.611 -14.731 1.00 1.00 C ATOM 527 C THR A 35 84.967 4.094 -13.515 1.00 1.00 C ATOM 528 O THR A 35 85.959 4.784 -13.645 1.00 1.00 O ATOM 529 CB THR A 35 83.476 4.805 -15.392 1.00 1.00 C ATOM 530 OG1 THR A 35 84.304 5.954 -15.282 1.00 1.00 O ATOM 531 CG2 THR A 35 82.139 5.069 -14.696 1.00 1.00 C ATOM 0 H THR A 35 83.100 2.463 -13.286 1.00 1.00 H new ATOM 0 HA THR A 35 84.848 3.144 -15.447 1.00 1.00 H new ATOM 0 HB THR A 35 83.297 4.584 -16.444 1.00 1.00 H new ATOM 0 HG1 THR A 35 85.185 5.691 -14.943 1.00 1.00 H new ATOM 0 HG21 THR A 35 81.645 5.919 -15.167 1.00 1.00 H new ATOM 0 HG22 THR A 35 81.504 4.187 -14.781 1.00 1.00 H new ATOM 0 HG23 THR A 35 82.314 5.290 -13.643 1.00 1.00 H new ATOM 539 N ARG A 36 84.539 3.737 -12.334 1.00 1.00 N ATOM 540 CA ARG A 36 85.268 4.174 -11.108 1.00 1.00 C ATOM 541 C ARG A 36 86.238 3.074 -10.674 1.00 1.00 C ATOM 542 O ARG A 36 86.534 2.922 -9.506 1.00 1.00 O ATOM 543 CB ARG A 36 84.262 4.437 -9.982 1.00 1.00 C ATOM 544 CG ARG A 36 83.234 5.473 -10.442 1.00 1.00 C ATOM 545 CD ARG A 36 83.758 6.879 -10.145 1.00 1.00 C ATOM 546 NE ARG A 36 83.447 7.237 -8.733 1.00 1.00 N ATOM 547 CZ ARG A 36 83.314 8.490 -8.391 1.00 1.00 C ATOM 548 NH1 ARG A 36 83.453 9.429 -9.287 1.00 1.00 N ATOM 549 NH2 ARG A 36 83.042 8.803 -7.154 1.00 1.00 N ATOM 0 H ARG A 36 83.715 3.161 -12.165 1.00 1.00 H new ATOM 0 HA ARG A 36 85.823 5.087 -11.322 1.00 1.00 H new ATOM 0 HB2 ARG A 36 83.760 3.510 -9.706 1.00 1.00 H new ATOM 0 HB3 ARG A 36 84.781 4.795 -9.093 1.00 1.00 H new ATOM 0 HG2 ARG A 36 83.043 5.362 -11.509 1.00 1.00 H new ATOM 0 HG3 ARG A 36 82.285 5.311 -9.930 1.00 1.00 H new ATOM 0 HD2 ARG A 36 84.834 6.921 -10.313 1.00 1.00 H new ATOM 0 HD3 ARG A 36 83.301 7.600 -10.823 1.00 1.00 H new ATOM 0 HE ARG A 36 83.338 6.503 -8.033 1.00 1.00 H new ATOM 0 HH11 ARG A 36 83.665 9.184 -10.254 1.00 1.00 H new ATOM 0 HH12 ARG A 36 83.349 10.408 -9.020 1.00 1.00 H new ATOM 0 HH21 ARG A 36 82.933 8.069 -6.454 1.00 1.00 H new ATOM 0 HH22 ARG A 36 82.938 9.782 -6.887 1.00 1.00 H new ATOM 563 N GLN A 37 86.733 2.304 -11.607 1.00 1.00 N ATOM 564 CA GLN A 37 87.683 1.210 -11.254 1.00 1.00 C ATOM 565 C GLN A 37 87.044 0.294 -10.208 1.00 1.00 C ATOM 566 O GLN A 37 86.875 0.664 -9.063 1.00 1.00 O ATOM 567 CB GLN A 37 88.973 1.811 -10.688 1.00 1.00 C ATOM 568 CG GLN A 37 89.586 2.766 -11.715 1.00 1.00 C ATOM 569 CD GLN A 37 90.613 3.666 -11.026 1.00 1.00 C ATOM 570 OE1 GLN A 37 90.265 4.473 -10.188 1.00 1.00 O ATOM 571 NE2 GLN A 37 91.874 3.560 -11.347 1.00 1.00 N ATOM 0 H GLN A 37 86.519 2.386 -12.601 1.00 1.00 H new ATOM 0 HA GLN A 37 87.916 0.632 -12.148 1.00 1.00 H new ATOM 0 HB2 GLN A 37 88.762 2.344 -9.761 1.00 1.00 H new ATOM 0 HB3 GLN A 37 89.680 1.018 -10.446 1.00 1.00 H new ATOM 0 HG2 GLN A 37 90.062 2.199 -12.515 1.00 1.00 H new ATOM 0 HG3 GLN A 37 88.806 3.372 -12.175 1.00 1.00 H new ATOM 0 HE21 GLN A 37 92.166 2.882 -12.051 1.00 1.00 H new ATOM 0 HE22 GLN A 37 92.567 4.155 -10.894 1.00 1.00 H new ATOM 580 N CYS A 38 86.688 -0.902 -10.591 1.00 1.00 N ATOM 581 CA CYS A 38 86.061 -1.840 -9.617 1.00 1.00 C ATOM 582 C CYS A 38 86.275 -3.281 -10.088 1.00 1.00 C ATOM 583 O CYS A 38 85.631 -4.199 -9.620 1.00 1.00 O ATOM 584 CB CYS A 38 84.560 -1.548 -9.520 1.00 1.00 C ATOM 585 SG CYS A 38 84.260 -0.377 -8.173 1.00 1.00 S ATOM 0 H CYS A 38 86.804 -1.270 -11.535 1.00 1.00 H new ATOM 0 HA CYS A 38 86.519 -1.708 -8.637 1.00 1.00 H new ATOM 0 HB2 CYS A 38 84.197 -1.136 -10.462 1.00 1.00 H new ATOM 0 HB3 CYS A 38 84.009 -2.472 -9.343 1.00 1.00 H new ATOM 590 N LYS A 39 87.176 -3.488 -11.009 1.00 1.00 N ATOM 591 CA LYS A 39 87.431 -4.870 -11.505 1.00 1.00 C ATOM 592 C LYS A 39 88.014 -5.712 -10.366 1.00 1.00 C ATOM 593 O LYS A 39 87.917 -6.923 -10.364 1.00 1.00 O ATOM 594 CB LYS A 39 88.427 -4.817 -12.674 1.00 1.00 C ATOM 595 CG LYS A 39 87.694 -5.108 -13.985 1.00 1.00 C ATOM 596 CD LYS A 39 86.658 -4.012 -14.245 1.00 1.00 C ATOM 597 CE LYS A 39 86.810 -3.494 -15.677 1.00 1.00 C ATOM 598 NZ LYS A 39 85.834 -2.393 -15.913 1.00 1.00 N ATOM 0 H LYS A 39 87.746 -2.760 -11.439 1.00 1.00 H new ATOM 0 HA LYS A 39 86.499 -5.318 -11.848 1.00 1.00 H new ATOM 0 HB2 LYS A 39 88.899 -3.835 -12.719 1.00 1.00 H new ATOM 0 HB3 LYS A 39 89.223 -5.546 -12.521 1.00 1.00 H new ATOM 0 HG2 LYS A 39 88.406 -5.153 -14.809 1.00 1.00 H new ATOM 0 HG3 LYS A 39 87.205 -6.081 -13.932 1.00 1.00 H new ATOM 0 HD2 LYS A 39 85.652 -4.404 -14.094 1.00 1.00 H new ATOM 0 HD3 LYS A 39 86.791 -3.195 -13.536 1.00 1.00 H new ATOM 0 HE2 LYS A 39 87.826 -3.135 -15.839 1.00 1.00 H new ATOM 0 HE3 LYS A 39 86.641 -4.303 -16.388 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 86.153 -1.813 -16.715 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 84.900 -2.797 -16.127 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 85.767 -1.800 -15.061 1.00 1.00 H new ATOM 612 N SER A 40 88.619 -5.079 -9.398 1.00 1.00 N ATOM 613 CA SER A 40 89.208 -5.842 -8.261 1.00 1.00 C ATOM 614 C SER A 40 88.124 -6.700 -7.607 1.00 1.00 C ATOM 615 O SER A 40 87.517 -6.312 -6.629 1.00 1.00 O ATOM 616 CB SER A 40 89.775 -4.865 -7.231 1.00 1.00 C ATOM 617 OG SER A 40 88.823 -3.840 -6.983 1.00 1.00 O ATOM 0 H SER A 40 88.731 -4.067 -9.345 1.00 1.00 H new ATOM 0 HA SER A 40 90.007 -6.485 -8.630 1.00 1.00 H new ATOM 0 HB2 SER A 40 90.010 -5.390 -6.305 1.00 1.00 H new ATOM 0 HB3 SER A 40 90.706 -4.432 -7.597 1.00 1.00 H new ATOM 0 HG SER A 40 87.956 -4.244 -6.771 1.00 1.00 H new ATOM 623 N LYS A 41 87.877 -7.866 -8.138 1.00 1.00 N ATOM 624 CA LYS A 41 86.833 -8.748 -7.546 1.00 1.00 C ATOM 625 C LYS A 41 87.179 -9.028 -6.076 1.00 1.00 C ATOM 626 O LYS A 41 88.227 -9.565 -5.779 1.00 1.00 O ATOM 627 CB LYS A 41 86.791 -10.071 -8.321 1.00 1.00 C ATOM 628 CG LYS A 41 88.175 -10.723 -8.307 1.00 1.00 C ATOM 629 CD LYS A 41 88.168 -11.917 -7.351 1.00 1.00 C ATOM 630 CE LYS A 41 87.572 -13.135 -8.058 1.00 1.00 C ATOM 631 NZ LYS A 41 88.591 -13.729 -8.968 1.00 1.00 N ATOM 0 H LYS A 41 88.353 -8.246 -8.956 1.00 1.00 H new ATOM 0 HA LYS A 41 85.861 -8.258 -7.605 1.00 1.00 H new ATOM 0 HB2 LYS A 41 86.058 -10.742 -7.874 1.00 1.00 H new ATOM 0 HB3 LYS A 41 86.474 -9.892 -9.348 1.00 1.00 H new ATOM 0 HG2 LYS A 41 88.445 -11.050 -9.311 1.00 1.00 H new ATOM 0 HG3 LYS A 41 88.927 -9.998 -7.995 1.00 1.00 H new ATOM 0 HD2 LYS A 41 89.183 -12.137 -7.019 1.00 1.00 H new ATOM 0 HD3 LYS A 41 87.586 -11.680 -6.460 1.00 1.00 H new ATOM 0 HE2 LYS A 41 87.250 -13.874 -7.324 1.00 1.00 H new ATOM 0 HE3 LYS A 41 86.688 -12.843 -8.625 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 88.289 -14.683 -9.251 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 88.691 -13.132 -9.814 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 89.505 -13.787 -8.475 1.00 1.00 H new ATOM 645 N PRO A 42 86.313 -8.668 -5.156 1.00 1.00 N ATOM 646 CA PRO A 42 86.556 -8.895 -3.702 1.00 1.00 C ATOM 647 C PRO A 42 86.294 -10.351 -3.297 1.00 1.00 C ATOM 648 O PRO A 42 85.622 -11.083 -3.996 1.00 1.00 O ATOM 649 CB PRO A 42 85.555 -7.957 -3.024 1.00 1.00 C ATOM 650 CG PRO A 42 84.425 -7.833 -3.994 1.00 1.00 C ATOM 651 CD PRO A 42 85.018 -8.010 -5.396 1.00 1.00 C ATOM 0 HA PRO A 42 87.591 -8.702 -3.421 1.00 1.00 H new ATOM 0 HB2 PRO A 42 85.215 -8.364 -2.072 1.00 1.00 H new ATOM 0 HB3 PRO A 42 86.003 -6.986 -2.814 1.00 1.00 H new ATOM 0 HG2 PRO A 42 83.664 -8.589 -3.799 1.00 1.00 H new ATOM 0 HG3 PRO A 42 83.941 -6.861 -3.900 1.00 1.00 H new ATOM 0 HD2 PRO A 42 84.372 -8.619 -6.028 1.00 1.00 H new ATOM 0 HD3 PRO A 42 85.145 -7.052 -5.899 1.00 1.00 H new ATOM 659 N PRO A 43 86.820 -10.764 -2.174 1.00 1.00 N ATOM 660 CA PRO A 43 86.639 -12.156 -1.666 1.00 1.00 C ATOM 661 C PRO A 43 85.162 -12.492 -1.437 1.00 1.00 C ATOM 662 O PRO A 43 84.467 -11.817 -0.703 1.00 1.00 O ATOM 663 CB PRO A 43 87.416 -12.179 -0.339 1.00 1.00 C ATOM 664 CG PRO A 43 87.614 -10.748 0.041 1.00 1.00 C ATOM 665 CD PRO A 43 87.639 -9.951 -1.263 1.00 1.00 C ATOM 0 HA PRO A 43 86.998 -12.898 -2.380 1.00 1.00 H new ATOM 0 HB2 PRO A 43 86.860 -12.715 0.430 1.00 1.00 H new ATOM 0 HB3 PRO A 43 88.372 -12.689 -0.455 1.00 1.00 H new ATOM 0 HG2 PRO A 43 86.809 -10.404 0.690 1.00 1.00 H new ATOM 0 HG3 PRO A 43 88.545 -10.619 0.592 1.00 1.00 H new ATOM 0 HD2 PRO A 43 87.223 -8.952 -1.132 1.00 1.00 H new ATOM 0 HD3 PRO A 43 88.655 -9.826 -1.639 1.00 1.00 H new ATOM 673 N LYS A 44 84.677 -13.530 -2.063 1.00 1.00 N ATOM 674 CA LYS A 44 83.247 -13.908 -1.885 1.00 1.00 C ATOM 675 C LYS A 44 83.059 -15.377 -2.269 1.00 1.00 C ATOM 676 O LYS A 44 83.609 -16.266 -1.650 1.00 1.00 O ATOM 677 CB LYS A 44 82.373 -13.026 -2.784 1.00 1.00 C ATOM 678 CG LYS A 44 80.895 -13.279 -2.478 1.00 1.00 C ATOM 679 CD LYS A 44 80.312 -12.073 -1.740 1.00 1.00 C ATOM 680 CE LYS A 44 80.910 -11.997 -0.334 1.00 1.00 C ATOM 681 NZ LYS A 44 80.763 -13.317 0.340 1.00 1.00 N ATOM 0 H LYS A 44 85.210 -14.132 -2.690 1.00 1.00 H new ATOM 0 HA LYS A 44 82.957 -13.765 -0.844 1.00 1.00 H new ATOM 0 HB2 LYS A 44 82.613 -11.975 -2.622 1.00 1.00 H new ATOM 0 HB3 LYS A 44 82.579 -13.242 -3.832 1.00 1.00 H new ATOM 0 HG2 LYS A 44 80.346 -13.453 -3.403 1.00 1.00 H new ATOM 0 HG3 LYS A 44 80.787 -14.177 -1.870 1.00 1.00 H new ATOM 0 HD2 LYS A 44 80.530 -11.157 -2.289 1.00 1.00 H new ATOM 0 HD3 LYS A 44 79.227 -12.159 -1.681 1.00 1.00 H new ATOM 0 HE2 LYS A 44 81.963 -11.720 -0.389 1.00 1.00 H new ATOM 0 HE3 LYS A 44 80.407 -11.223 0.245 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 80.557 -13.171 1.349 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 79.983 -13.846 -0.100 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 81.646 -13.857 0.242 1.00 1.00 H new ATOM 695 N LYS A 45 82.286 -15.640 -3.288 1.00 1.00 N ATOM 696 CA LYS A 45 82.066 -17.051 -3.710 1.00 1.00 C ATOM 697 C LYS A 45 81.384 -17.073 -5.079 1.00 1.00 C ATOM 698 O LYS A 45 81.129 -18.121 -5.639 1.00 1.00 O ATOM 699 CB LYS A 45 81.178 -17.761 -2.684 1.00 1.00 C ATOM 700 CG LYS A 45 80.949 -19.210 -3.118 1.00 1.00 C ATOM 701 CD LYS A 45 80.712 -20.082 -1.883 1.00 1.00 C ATOM 702 CE LYS A 45 79.384 -19.692 -1.230 1.00 1.00 C ATOM 703 NZ LYS A 45 78.263 -19.995 -2.164 1.00 1.00 N ATOM 0 H LYS A 45 81.798 -14.939 -3.845 1.00 1.00 H new ATOM 0 HA LYS A 45 83.026 -17.564 -3.774 1.00 1.00 H new ATOM 0 HB2 LYS A 45 81.649 -17.735 -1.701 1.00 1.00 H new ATOM 0 HB3 LYS A 45 80.223 -17.243 -2.594 1.00 1.00 H new ATOM 0 HG2 LYS A 45 80.091 -19.269 -3.788 1.00 1.00 H new ATOM 0 HG3 LYS A 45 81.813 -19.575 -3.674 1.00 1.00 H new ATOM 0 HD2 LYS A 45 80.695 -21.135 -2.166 1.00 1.00 H new ATOM 0 HD3 LYS A 45 81.529 -19.956 -1.173 1.00 1.00 H new ATOM 0 HE2 LYS A 45 79.251 -20.239 -0.296 1.00 1.00 H new ATOM 0 HE3 LYS A 45 79.387 -18.631 -0.981 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 77.385 -20.125 -1.622 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 78.144 -19.206 -2.831 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 78.476 -20.866 -2.691 1.00 1.00 H new ATOM 717 N GLY A 46 81.086 -15.923 -5.624 1.00 1.00 N ATOM 718 CA GLY A 46 80.420 -15.878 -6.959 1.00 1.00 C ATOM 719 C GLY A 46 80.941 -14.677 -7.749 1.00 1.00 C ATOM 720 O GLY A 46 81.517 -13.762 -7.197 1.00 1.00 O ATOM 0 H GLY A 46 81.275 -15.013 -5.203 1.00 1.00 H new ATOM 0 HA2 GLY A 46 80.617 -16.800 -7.506 1.00 1.00 H new ATOM 0 HA3 GLY A 46 79.339 -15.805 -6.836 1.00 1.00 H new ATOM 724 N VAL A 47 80.741 -14.675 -9.040 1.00 1.00 N ATOM 725 CA VAL A 47 81.222 -13.534 -9.873 1.00 1.00 C ATOM 726 C VAL A 47 80.176 -13.211 -10.942 1.00 1.00 C ATOM 727 O VAL A 47 80.044 -12.084 -11.374 1.00 1.00 O ATOM 728 CB VAL A 47 82.541 -13.915 -10.549 1.00 1.00 C ATOM 729 CG1 VAL A 47 82.975 -12.792 -11.492 1.00 1.00 C ATOM 730 CG2 VAL A 47 83.617 -14.127 -9.482 1.00 1.00 C ATOM 0 H VAL A 47 80.264 -15.416 -9.555 1.00 1.00 H new ATOM 0 HA VAL A 47 81.379 -12.661 -9.240 1.00 1.00 H new ATOM 0 HB VAL A 47 82.405 -14.835 -11.118 1.00 1.00 H new ATOM 0 HG11 VAL A 47 83.914 -13.064 -11.973 1.00 1.00 H new ATOM 0 HG12 VAL A 47 82.209 -12.639 -12.252 1.00 1.00 H new ATOM 0 HG13 VAL A 47 83.111 -11.872 -10.924 1.00 1.00 H new ATOM 0 HG21 VAL A 47 84.557 -14.398 -9.962 1.00 1.00 H new ATOM 0 HG22 VAL A 47 83.752 -13.207 -8.914 1.00 1.00 H new ATOM 0 HG23 VAL A 47 83.309 -14.927 -8.809 1.00 1.00 H new ATOM 740 N GLN A 48 79.430 -14.193 -11.370 1.00 1.00 N ATOM 741 CA GLN A 48 78.391 -13.940 -12.407 1.00 1.00 C ATOM 742 C GLN A 48 77.326 -13.001 -11.837 1.00 1.00 C ATOM 743 O GLN A 48 76.901 -12.063 -12.482 1.00 1.00 O ATOM 744 CB GLN A 48 77.742 -15.265 -12.815 1.00 1.00 C ATOM 745 CG GLN A 48 76.992 -15.858 -11.620 1.00 1.00 C ATOM 746 CD GLN A 48 76.704 -17.337 -11.881 1.00 1.00 C ATOM 747 OE1 GLN A 48 77.379 -17.970 -12.668 1.00 1.00 O ATOM 748 NE2 GLN A 48 75.722 -17.919 -11.249 1.00 1.00 N ATOM 0 H GLN A 48 79.495 -15.158 -11.047 1.00 1.00 H new ATOM 0 HA GLN A 48 78.852 -13.480 -13.281 1.00 1.00 H new ATOM 0 HB2 GLN A 48 77.055 -15.104 -13.646 1.00 1.00 H new ATOM 0 HB3 GLN A 48 78.504 -15.963 -13.162 1.00 1.00 H new ATOM 0 HG2 GLN A 48 77.586 -15.747 -10.713 1.00 1.00 H new ATOM 0 HG3 GLN A 48 76.059 -15.318 -11.458 1.00 1.00 H new ATOM 0 HE21 GLN A 48 75.155 -17.388 -10.588 1.00 1.00 H new ATOM 0 HE22 GLN A 48 75.521 -18.905 -11.416 1.00 1.00 H new ATOM 757 N GLY A 49 76.894 -13.245 -10.630 1.00 1.00 N ATOM 758 CA GLY A 49 75.860 -12.365 -10.015 1.00 1.00 C ATOM 759 C GLY A 49 76.538 -11.141 -9.397 1.00 1.00 C ATOM 760 O GLY A 49 76.254 -10.763 -8.277 1.00 1.00 O ATOM 0 H GLY A 49 77.212 -14.016 -10.043 1.00 1.00 H new ATOM 0 HA2 GLY A 49 75.137 -12.052 -10.769 1.00 1.00 H new ATOM 0 HA3 GLY A 49 75.308 -12.913 -9.252 1.00 1.00 H new ATOM 764 N CYS A 50 77.434 -10.521 -10.118 1.00 1.00 N ATOM 765 CA CYS A 50 78.138 -9.322 -9.579 1.00 1.00 C ATOM 766 C CYS A 50 78.244 -8.260 -10.675 1.00 1.00 C ATOM 767 O CYS A 50 78.800 -7.198 -10.473 1.00 1.00 O ATOM 768 CB CYS A 50 79.541 -9.721 -9.116 1.00 1.00 C ATOM 769 SG CYS A 50 80.467 -8.238 -8.648 1.00 1.00 S ATOM 0 H CYS A 50 77.709 -10.795 -11.061 1.00 1.00 H new ATOM 0 HA CYS A 50 77.579 -8.919 -8.735 1.00 1.00 H new ATOM 0 HB2 CYS A 50 79.475 -10.404 -8.269 1.00 1.00 H new ATOM 0 HB3 CYS A 50 80.062 -10.251 -9.914 1.00 1.00 H new ATOM 774 N GLY A 51 77.715 -8.537 -11.836 1.00 1.00 N ATOM 775 CA GLY A 51 77.783 -7.543 -12.946 1.00 1.00 C ATOM 776 C GLY A 51 76.549 -7.689 -13.837 1.00 1.00 C ATOM 777 O GLY A 51 75.944 -6.715 -14.239 1.00 1.00 O ATOM 0 H GLY A 51 77.238 -9.409 -12.064 1.00 1.00 H new ATOM 0 HA2 GLY A 51 77.835 -6.532 -12.541 1.00 1.00 H new ATOM 0 HA3 GLY A 51 78.689 -7.698 -13.532 1.00 1.00 H new ATOM 781 N ASP A 52 76.170 -8.898 -14.150 1.00 1.00 N ATOM 782 CA ASP A 52 74.974 -9.104 -15.016 1.00 1.00 C ATOM 783 C ASP A 52 73.712 -9.094 -14.151 1.00 1.00 C ATOM 784 O ASP A 52 73.090 -10.115 -13.931 1.00 1.00 O ATOM 785 CB ASP A 52 75.093 -10.451 -15.734 1.00 1.00 C ATOM 786 CG ASP A 52 75.628 -11.503 -14.761 1.00 1.00 C ATOM 787 OD1 ASP A 52 74.848 -11.993 -13.961 1.00 1.00 O ATOM 788 OD2 ASP A 52 76.809 -11.800 -14.831 1.00 1.00 O ATOM 0 H ASP A 52 76.636 -9.752 -13.844 1.00 1.00 H new ATOM 0 HA ASP A 52 74.914 -8.304 -15.753 1.00 1.00 H new ATOM 0 HB2 ASP A 52 74.120 -10.757 -16.118 1.00 1.00 H new ATOM 0 HB3 ASP A 52 75.760 -10.360 -16.591 1.00 1.00 H new ATOM 793 N ASP A 53 73.327 -7.948 -13.659 1.00 1.00 N ATOM 794 CA ASP A 53 72.104 -7.873 -12.809 1.00 1.00 C ATOM 795 C ASP A 53 70.867 -7.772 -13.705 1.00 1.00 C ATOM 796 O ASP A 53 70.970 -7.647 -14.909 1.00 1.00 O ATOM 797 CB ASP A 53 72.186 -6.640 -11.905 1.00 1.00 C ATOM 798 CG ASP A 53 73.631 -6.442 -11.442 1.00 1.00 C ATOM 799 OD1 ASP A 53 74.138 -7.316 -10.758 1.00 1.00 O ATOM 800 OD2 ASP A 53 74.205 -5.420 -11.779 1.00 1.00 O ATOM 0 H ASP A 53 73.806 -7.060 -13.809 1.00 1.00 H new ATOM 0 HA ASP A 53 72.032 -8.769 -12.192 1.00 1.00 H new ATOM 0 HB2 ASP A 53 71.841 -5.757 -12.444 1.00 1.00 H new ATOM 0 HB3 ASP A 53 71.530 -6.764 -11.043 1.00 1.00 H new ATOM 805 N ILE A 54 69.698 -7.823 -13.128 1.00 1.00 N ATOM 806 CA ILE A 54 68.458 -7.729 -13.950 1.00 1.00 C ATOM 807 C ILE A 54 68.229 -6.262 -14.348 1.00 1.00 C ATOM 808 O ILE A 54 68.380 -5.370 -13.538 1.00 1.00 O ATOM 809 CB ILE A 54 67.254 -8.236 -13.136 1.00 1.00 C ATOM 810 CG1 ILE A 54 67.570 -8.133 -11.642 1.00 1.00 C ATOM 811 CG2 ILE A 54 66.971 -9.696 -13.496 1.00 1.00 C ATOM 812 CD1 ILE A 54 68.359 -9.367 -11.201 1.00 1.00 C ATOM 0 H ILE A 54 69.548 -7.926 -12.124 1.00 1.00 H new ATOM 0 HA ILE A 54 68.566 -8.341 -14.845 1.00 1.00 H new ATOM 0 HB ILE A 54 66.379 -7.629 -13.367 1.00 1.00 H new ATOM 0 HG12 ILE A 54 68.146 -7.229 -11.443 1.00 1.00 H new ATOM 0 HG13 ILE A 54 66.646 -8.055 -11.069 1.00 1.00 H new ATOM 0 HG21 ILE A 54 66.118 -10.054 -12.919 1.00 1.00 H new ATOM 0 HG22 ILE A 54 66.747 -9.772 -14.560 1.00 1.00 H new ATOM 0 HG23 ILE A 54 67.846 -10.304 -13.266 1.00 1.00 H new ATOM 0 HD11 ILE A 54 68.584 -9.294 -10.137 1.00 1.00 H new ATOM 0 HD12 ILE A 54 67.766 -10.263 -11.386 1.00 1.00 H new ATOM 0 HD13 ILE A 54 69.290 -9.425 -11.766 1.00 1.00 H new ATOM 824 N PRO A 55 67.869 -6.011 -15.584 1.00 1.00 N ATOM 825 CA PRO A 55 67.620 -4.625 -16.081 1.00 1.00 C ATOM 826 C PRO A 55 66.273 -4.065 -15.607 1.00 1.00 C ATOM 827 O PRO A 55 65.334 -3.954 -16.370 1.00 1.00 O ATOM 828 CB PRO A 55 67.627 -4.787 -17.602 1.00 1.00 C ATOM 829 CG PRO A 55 67.169 -6.189 -17.837 1.00 1.00 C ATOM 830 CD PRO A 55 67.657 -7.013 -16.641 1.00 1.00 C ATOM 0 HA PRO A 55 68.364 -3.921 -15.710 1.00 1.00 H new ATOM 0 HB2 PRO A 55 66.962 -4.068 -18.080 1.00 1.00 H new ATOM 0 HB3 PRO A 55 68.623 -4.622 -18.013 1.00 1.00 H new ATOM 0 HG2 PRO A 55 66.083 -6.233 -17.921 1.00 1.00 H new ATOM 0 HG3 PRO A 55 67.577 -6.579 -18.769 1.00 1.00 H new ATOM 0 HD2 PRO A 55 66.920 -7.759 -16.342 1.00 1.00 H new ATOM 0 HD3 PRO A 55 68.577 -7.549 -16.874 1.00 1.00 H new ATOM 838 N GLY A 56 66.173 -3.704 -14.356 1.00 1.00 N ATOM 839 CA GLY A 56 64.890 -3.145 -13.843 1.00 1.00 C ATOM 840 C GLY A 56 63.918 -4.280 -13.515 1.00 1.00 C ATOM 841 O GLY A 56 62.922 -4.468 -14.184 1.00 1.00 O ATOM 0 H GLY A 56 66.923 -3.772 -13.668 1.00 1.00 H new ATOM 0 HA2 GLY A 56 65.076 -2.545 -12.952 1.00 1.00 H new ATOM 0 HA3 GLY A 56 64.449 -2.482 -14.587 1.00 1.00 H new ATOM 845 N MET A 57 64.194 -5.033 -12.485 1.00 1.00 N ATOM 846 CA MET A 57 63.277 -6.149 -12.114 1.00 1.00 C ATOM 847 C MET A 57 63.724 -6.758 -10.781 1.00 1.00 C ATOM 848 O MET A 57 64.321 -7.815 -10.739 1.00 1.00 O ATOM 849 CB MET A 57 63.302 -7.222 -13.211 1.00 1.00 C ATOM 850 CG MET A 57 61.990 -8.009 -13.187 1.00 1.00 C ATOM 851 SD MET A 57 61.825 -8.858 -11.597 1.00 1.00 S ATOM 852 CE MET A 57 60.783 -10.220 -12.174 1.00 1.00 C ATOM 0 H MET A 57 65.012 -4.924 -11.886 1.00 1.00 H new ATOM 0 HA MET A 57 62.262 -5.766 -12.011 1.00 1.00 H new ATOM 0 HB2 MET A 57 63.441 -6.756 -14.187 1.00 1.00 H new ATOM 0 HB3 MET A 57 64.145 -7.895 -13.056 1.00 1.00 H new ATOM 0 HG2 MET A 57 61.147 -7.336 -13.341 1.00 1.00 H new ATOM 0 HG3 MET A 57 61.973 -8.733 -14.002 1.00 1.00 H new ATOM 0 HE1 MET A 57 60.554 -10.882 -11.339 1.00 1.00 H new ATOM 0 HE2 MET A 57 59.856 -9.820 -12.585 1.00 1.00 H new ATOM 0 HE3 MET A 57 61.311 -10.780 -12.946 1.00 1.00 H new ATOM 862 N GLU A 58 63.434 -6.099 -9.691 1.00 1.00 N ATOM 863 CA GLU A 58 63.833 -6.637 -8.359 1.00 1.00 C ATOM 864 C GLU A 58 65.354 -6.550 -8.197 1.00 1.00 C ATOM 865 O GLU A 58 66.104 -7.141 -8.949 1.00 1.00 O ATOM 866 CB GLU A 58 63.386 -8.100 -8.242 1.00 1.00 C ATOM 867 CG GLU A 58 63.153 -8.446 -6.770 1.00 1.00 C ATOM 868 CD GLU A 58 62.768 -9.922 -6.647 1.00 1.00 C ATOM 869 OE1 GLU A 58 61.613 -10.234 -6.887 1.00 1.00 O ATOM 870 OE2 GLU A 58 63.634 -10.714 -6.315 1.00 1.00 O ATOM 0 H GLU A 58 62.937 -5.209 -9.666 1.00 1.00 H new ATOM 0 HA GLU A 58 63.356 -6.047 -7.576 1.00 1.00 H new ATOM 0 HB2 GLU A 58 62.471 -8.259 -8.813 1.00 1.00 H new ATOM 0 HB3 GLU A 58 64.145 -8.758 -8.666 1.00 1.00 H new ATOM 0 HG2 GLU A 58 64.054 -8.245 -6.191 1.00 1.00 H new ATOM 0 HG3 GLU A 58 62.363 -7.818 -6.358 1.00 1.00 H new ATOM 877 N GLY A 59 65.814 -5.822 -7.215 1.00 1.00 N ATOM 878 CA GLY A 59 67.285 -5.702 -6.995 1.00 1.00 C ATOM 879 C GLY A 59 67.859 -4.603 -7.892 1.00 1.00 C ATOM 880 O GLY A 59 69.038 -4.311 -7.851 1.00 1.00 O ATOM 0 H GLY A 59 65.234 -5.304 -6.555 1.00 1.00 H new ATOM 0 HA2 GLY A 59 67.487 -5.472 -5.949 1.00 1.00 H new ATOM 0 HA3 GLY A 59 67.773 -6.652 -7.212 1.00 1.00 H new ATOM 884 N CYS A 60 67.041 -3.991 -8.704 1.00 1.00 N ATOM 885 CA CYS A 60 67.550 -2.914 -9.601 1.00 1.00 C ATOM 886 C CYS A 60 66.375 -2.264 -10.335 1.00 1.00 C ATOM 887 O CYS A 60 66.531 -1.721 -11.410 1.00 1.00 O ATOM 888 CB CYS A 60 68.522 -3.520 -10.620 1.00 1.00 C ATOM 889 SG CYS A 60 69.990 -2.470 -10.752 1.00 1.00 S ATOM 0 H CYS A 60 66.044 -4.189 -8.785 1.00 1.00 H new ATOM 0 HA CYS A 60 68.068 -2.159 -9.009 1.00 1.00 H new ATOM 0 HB2 CYS A 60 68.808 -4.526 -10.312 1.00 1.00 H new ATOM 0 HB3 CYS A 60 68.037 -3.610 -11.592 1.00 1.00 H new ATOM 894 N GLY A 61 65.201 -2.317 -9.760 1.00 1.00 N ATOM 895 CA GLY A 61 64.008 -1.706 -10.419 1.00 1.00 C ATOM 896 C GLY A 61 64.407 -0.407 -11.120 1.00 1.00 C ATOM 897 O GLY A 61 64.041 -0.165 -12.252 1.00 1.00 O ATOM 0 H GLY A 61 65.017 -2.759 -8.859 1.00 1.00 H new ATOM 0 HA2 GLY A 61 63.584 -2.404 -11.141 1.00 1.00 H new ATOM 0 HA3 GLY A 61 63.235 -1.506 -9.677 1.00 1.00 H new ATOM 901 N THR A 62 65.160 0.424 -10.454 1.00 1.00 N ATOM 902 CA THR A 62 65.593 1.710 -11.071 1.00 1.00 C ATOM 903 C THR A 62 66.355 2.532 -10.030 1.00 1.00 C ATOM 904 O THR A 62 67.360 2.103 -9.500 1.00 1.00 O ATOM 905 CB THR A 62 64.364 2.496 -11.544 1.00 1.00 C ATOM 906 OG1 THR A 62 64.735 3.843 -11.799 1.00 1.00 O ATOM 907 CG2 THR A 62 63.284 2.458 -10.461 1.00 1.00 C ATOM 0 H THR A 62 65.496 0.267 -9.504 1.00 1.00 H new ATOM 0 HA THR A 62 66.238 1.507 -11.925 1.00 1.00 H new ATOM 0 HB THR A 62 63.974 2.047 -12.458 1.00 1.00 H new ATOM 0 HG1 THR A 62 63.951 4.346 -12.102 1.00 1.00 H new ATOM 0 HG21 THR A 62 62.411 3.017 -10.798 1.00 1.00 H new ATOM 0 HG22 THR A 62 63.000 1.424 -10.267 1.00 1.00 H new ATOM 0 HG23 THR A 62 63.671 2.906 -9.546 1.00 1.00 H new ATOM 915 N ASP A 63 65.882 3.710 -9.731 1.00 1.00 N ATOM 916 CA ASP A 63 66.575 4.558 -8.720 1.00 1.00 C ATOM 917 C ASP A 63 66.379 3.947 -7.331 1.00 1.00 C ATOM 918 O ASP A 63 67.327 3.614 -6.647 1.00 1.00 O ATOM 919 CB ASP A 63 65.988 5.972 -8.752 1.00 1.00 C ATOM 920 CG ASP A 63 65.721 6.381 -10.202 1.00 1.00 C ATOM 921 OD1 ASP A 63 66.228 5.714 -11.088 1.00 1.00 O ATOM 922 OD2 ASP A 63 65.013 7.355 -10.401 1.00 1.00 O ATOM 0 H ASP A 63 65.045 4.123 -10.143 1.00 1.00 H new ATOM 0 HA ASP A 63 67.640 4.607 -8.948 1.00 1.00 H new ATOM 0 HB2 ASP A 63 65.063 6.006 -8.177 1.00 1.00 H new ATOM 0 HB3 ASP A 63 66.679 6.675 -8.286 1.00 1.00 H new ATOM 927 N ILE A 64 65.152 3.795 -6.911 1.00 1.00 N ATOM 928 CA ILE A 64 64.889 3.202 -5.570 1.00 1.00 C ATOM 929 C ILE A 64 65.461 1.783 -5.530 1.00 1.00 C ATOM 930 O ILE A 64 65.635 1.205 -4.475 1.00 1.00 O ATOM 931 CB ILE A 64 63.373 3.156 -5.319 1.00 1.00 C ATOM 932 CG1 ILE A 64 62.890 4.537 -4.871 1.00 1.00 C ATOM 933 CG2 ILE A 64 63.066 2.131 -4.226 1.00 1.00 C ATOM 934 CD1 ILE A 64 62.537 5.378 -6.099 1.00 1.00 C ATOM 0 H ILE A 64 64.320 4.056 -7.440 1.00 1.00 H new ATOM 0 HA ILE A 64 65.362 3.809 -4.798 1.00 1.00 H new ATOM 0 HB ILE A 64 62.861 2.870 -6.238 1.00 1.00 H new ATOM 0 HG12 ILE A 64 62.019 4.437 -4.223 1.00 1.00 H new ATOM 0 HG13 ILE A 64 63.666 5.034 -4.288 1.00 1.00 H new ATOM 0 HG21 ILE A 64 61.991 2.099 -4.049 1.00 1.00 H new ATOM 0 HG22 ILE A 64 63.411 1.147 -4.543 1.00 1.00 H new ATOM 0 HG23 ILE A 64 63.577 2.416 -3.306 1.00 1.00 H new ATOM 0 HD11 ILE A 64 62.193 6.362 -5.780 1.00 1.00 H new ATOM 0 HD12 ILE A 64 63.419 5.489 -6.730 1.00 1.00 H new ATOM 0 HD13 ILE A 64 61.747 4.883 -6.664 1.00 1.00 H new ATOM 946 N THR A 65 65.756 1.221 -6.670 1.00 1.00 N ATOM 947 CA THR A 65 66.320 -0.161 -6.705 1.00 1.00 C ATOM 948 C THR A 65 65.608 -1.032 -5.668 1.00 1.00 C ATOM 949 O THR A 65 66.156 -1.984 -5.152 1.00 1.00 O ATOM 950 CB THR A 65 67.819 -0.105 -6.394 1.00 1.00 C ATOM 951 OG1 THR A 65 68.491 0.588 -7.436 1.00 1.00 O ATOM 952 CG2 THR A 65 68.373 -1.527 -6.284 1.00 1.00 C ATOM 0 H THR A 65 65.631 1.660 -7.582 1.00 1.00 H new ATOM 0 HA THR A 65 66.172 -0.591 -7.695 1.00 1.00 H new ATOM 0 HB THR A 65 67.975 0.417 -5.450 1.00 1.00 H new ATOM 0 HG1 THR A 65 69.452 0.612 -7.246 1.00 1.00 H new ATOM 0 HG21 THR A 65 69.440 -1.486 -6.063 1.00 1.00 H new ATOM 0 HG22 THR A 65 67.857 -2.058 -5.484 1.00 1.00 H new ATOM 0 HG23 THR A 65 68.218 -2.052 -7.227 1.00 1.00 H new ATOM 960 N VAL A 66 64.388 -0.704 -5.360 1.00 1.00 N ATOM 961 CA VAL A 66 63.624 -1.496 -4.355 1.00 1.00 C ATOM 962 C VAL A 66 64.282 -1.351 -2.980 1.00 1.00 C ATOM 963 O VAL A 66 63.615 -1.346 -1.965 1.00 1.00 O ATOM 964 CB VAL A 66 63.599 -2.973 -4.763 1.00 1.00 C ATOM 965 CG1 VAL A 66 62.478 -3.692 -4.010 1.00 1.00 C ATOM 966 CG2 VAL A 66 63.351 -3.080 -6.269 1.00 1.00 C ATOM 0 H VAL A 66 63.881 0.084 -5.763 1.00 1.00 H new ATOM 0 HA VAL A 66 62.601 -1.123 -4.308 1.00 1.00 H new ATOM 0 HB VAL A 66 64.555 -3.434 -4.517 1.00 1.00 H new ATOM 0 HG11 VAL A 66 62.460 -4.742 -4.300 1.00 1.00 H new ATOM 0 HG12 VAL A 66 62.653 -3.615 -2.937 1.00 1.00 H new ATOM 0 HG13 VAL A 66 61.521 -3.232 -4.256 1.00 1.00 H new ATOM 0 HG21 VAL A 66 63.333 -4.130 -6.561 1.00 1.00 H new ATOM 0 HG22 VAL A 66 62.394 -2.619 -6.514 1.00 1.00 H new ATOM 0 HG23 VAL A 66 64.149 -2.568 -6.806 1.00 1.00 H new ATOM 976 N ILE A 67 65.585 -1.232 -2.935 1.00 1.00 N ATOM 977 CA ILE A 67 66.277 -1.087 -1.622 1.00 1.00 C ATOM 978 C ILE A 67 67.327 0.024 -1.699 1.00 1.00 C ATOM 979 O ILE A 67 68.473 -0.210 -2.028 1.00 1.00 O ATOM 980 CB ILE A 67 66.959 -2.403 -1.259 1.00 1.00 C ATOM 981 CG1 ILE A 67 65.959 -3.552 -1.405 1.00 1.00 C ATOM 982 CG2 ILE A 67 67.454 -2.340 0.187 1.00 1.00 C ATOM 983 CD1 ILE A 67 66.623 -4.864 -0.984 1.00 1.00 C ATOM 0 H ILE A 67 66.197 -1.229 -3.751 1.00 1.00 H new ATOM 0 HA ILE A 67 65.541 -0.830 -0.860 1.00 1.00 H new ATOM 0 HB ILE A 67 67.805 -2.569 -1.926 1.00 1.00 H new ATOM 0 HG12 ILE A 67 65.080 -3.363 -0.789 1.00 1.00 H new ATOM 0 HG13 ILE A 67 65.616 -3.621 -2.437 1.00 1.00 H new ATOM 0 HG21 ILE A 67 67.941 -3.280 0.446 1.00 1.00 H new ATOM 0 HG22 ILE A 67 68.166 -1.521 0.293 1.00 1.00 H new ATOM 0 HG23 ILE A 67 66.608 -2.174 0.854 1.00 1.00 H new ATOM 0 HD11 ILE A 67 65.910 -5.682 -1.088 1.00 1.00 H new ATOM 0 HD12 ILE A 67 67.489 -5.054 -1.619 1.00 1.00 H new ATOM 0 HD13 ILE A 67 66.944 -4.792 0.055 1.00 1.00 H new ATOM 995 N CYS A 68 66.941 1.228 -1.378 1.00 1.00 N ATOM 996 CA CYS A 68 67.897 2.373 -1.404 1.00 1.00 C ATOM 997 C CYS A 68 67.906 3.033 -0.021 1.00 1.00 C ATOM 998 O CYS A 68 67.024 2.803 0.779 1.00 1.00 O ATOM 999 CB CYS A 68 67.442 3.382 -2.464 1.00 1.00 C ATOM 1000 SG CYS A 68 67.815 2.735 -4.113 1.00 1.00 S ATOM 0 H CYS A 68 65.992 1.471 -1.095 1.00 1.00 H new ATOM 0 HA CYS A 68 68.901 2.027 -1.650 1.00 1.00 H new ATOM 0 HB2 CYS A 68 66.372 3.569 -2.368 1.00 1.00 H new ATOM 0 HB3 CYS A 68 67.947 4.336 -2.313 1.00 1.00 H new ATOM 1005 N PRO A 69 68.893 3.840 0.279 1.00 1.00 N ATOM 1006 CA PRO A 69 69.009 4.530 1.588 1.00 1.00 C ATOM 1007 C PRO A 69 67.662 4.735 2.301 1.00 1.00 C ATOM 1008 O PRO A 69 67.544 4.493 3.486 1.00 1.00 O ATOM 1009 CB PRO A 69 69.638 5.862 1.191 1.00 1.00 C ATOM 1010 CG PRO A 69 70.499 5.549 0.003 1.00 1.00 C ATOM 1011 CD PRO A 69 70.012 4.218 -0.593 1.00 1.00 C ATOM 0 HA PRO A 69 69.586 3.953 2.311 1.00 1.00 H new ATOM 0 HB2 PRO A 69 68.875 6.599 0.942 1.00 1.00 H new ATOM 0 HB3 PRO A 69 70.229 6.278 2.007 1.00 1.00 H new ATOM 0 HG2 PRO A 69 70.433 6.346 -0.737 1.00 1.00 H new ATOM 0 HG3 PRO A 69 71.546 5.475 0.299 1.00 1.00 H new ATOM 0 HD2 PRO A 69 69.692 4.335 -1.628 1.00 1.00 H new ATOM 0 HD3 PRO A 69 70.799 3.464 -0.586 1.00 1.00 H new ATOM 1019 N TRP A 70 66.646 5.177 1.606 1.00 1.00 N ATOM 1020 CA TRP A 70 65.329 5.384 2.284 1.00 1.00 C ATOM 1021 C TRP A 70 64.678 4.024 2.564 1.00 1.00 C ATOM 1022 O TRP A 70 63.890 3.880 3.477 1.00 1.00 O ATOM 1023 CB TRP A 70 64.404 6.237 1.402 1.00 1.00 C ATOM 1024 CG TRP A 70 64.784 6.067 -0.034 1.00 1.00 C ATOM 1025 CD1 TRP A 70 64.351 5.070 -0.839 1.00 1.00 C ATOM 1026 CD2 TRP A 70 65.663 6.897 -0.847 1.00 1.00 C ATOM 1027 NE1 TRP A 70 64.907 5.234 -2.094 1.00 1.00 N ATOM 1028 CE2 TRP A 70 65.724 6.346 -2.151 1.00 1.00 C ATOM 1029 CE3 TRP A 70 66.406 8.061 -0.585 1.00 1.00 C ATOM 1030 CZ2 TRP A 70 66.495 6.932 -3.157 1.00 1.00 C ATOM 1031 CZ3 TRP A 70 67.182 8.652 -1.594 1.00 1.00 C ATOM 1032 CH2 TRP A 70 67.227 8.090 -2.877 1.00 1.00 C ATOM 0 H TRP A 70 66.668 5.401 0.611 1.00 1.00 H new ATOM 0 HA TRP A 70 65.492 5.908 3.226 1.00 1.00 H new ATOM 0 HB2 TRP A 70 63.366 5.940 1.552 1.00 1.00 H new ATOM 0 HB3 TRP A 70 64.479 7.286 1.687 1.00 1.00 H new ATOM 0 HD1 TRP A 70 63.680 4.275 -0.549 1.00 1.00 H new ATOM 0 HE1 TRP A 70 64.735 4.610 -2.882 1.00 1.00 H new ATOM 0 HE3 TRP A 70 66.380 8.504 0.400 1.00 1.00 H new ATOM 0 HZ2 TRP A 70 66.526 6.494 -4.144 1.00 1.00 H new ATOM 0 HZ3 TRP A 70 67.749 9.546 -1.380 1.00 1.00 H new ATOM 0 HH2 TRP A 70 67.826 8.551 -3.648 1.00 1.00 H new ATOM 1043 N GLU A 71 65.014 3.027 1.791 1.00 1.00 N ATOM 1044 CA GLU A 71 64.437 1.667 2.004 1.00 1.00 C ATOM 1045 C GLU A 71 65.583 0.679 2.207 1.00 1.00 C ATOM 1046 O GLU A 71 65.937 -0.075 1.323 1.00 1.00 O ATOM 1047 CB GLU A 71 63.623 1.261 0.776 1.00 1.00 C ATOM 1048 CG GLU A 71 62.374 2.139 0.675 1.00 1.00 C ATOM 1049 CD GLU A 71 61.213 1.464 1.407 1.00 1.00 C ATOM 1050 OE1 GLU A 71 61.474 0.764 2.372 1.00 1.00 O ATOM 1051 OE2 GLU A 71 60.083 1.657 0.990 1.00 1.00 O ATOM 0 H GLU A 71 65.670 3.097 1.013 1.00 1.00 H new ATOM 0 HA GLU A 71 63.787 1.669 2.879 1.00 1.00 H new ATOM 0 HB2 GLU A 71 64.228 1.366 -0.125 1.00 1.00 H new ATOM 0 HB3 GLU A 71 63.337 0.212 0.847 1.00 1.00 H new ATOM 0 HG2 GLU A 71 62.570 3.119 1.109 1.00 1.00 H new ATOM 0 HG3 GLU A 71 62.114 2.300 -0.371 1.00 1.00 H new ATOM 1058 N ALA A 72 66.173 0.690 3.366 1.00 1.00 N ATOM 1059 CA ALA A 72 67.311 -0.231 3.641 1.00 1.00 C ATOM 1060 C ALA A 72 66.879 -1.681 3.408 1.00 1.00 C ATOM 1061 O ALA A 72 65.706 -1.992 3.361 1.00 1.00 O ATOM 1062 CB ALA A 72 67.759 -0.058 5.092 1.00 1.00 C ATOM 0 H ALA A 72 65.916 1.301 4.141 1.00 1.00 H new ATOM 0 HA ALA A 72 68.136 0.005 2.970 1.00 1.00 H new ATOM 0 HB1 ALA A 72 68.592 -0.730 5.298 1.00 1.00 H new ATOM 0 HB2 ALA A 72 68.075 0.972 5.255 1.00 1.00 H new ATOM 0 HB3 ALA A 72 66.930 -0.293 5.759 1.00 1.00 H new ATOM 1068 N CYS A 73 67.825 -2.569 3.259 1.00 1.00 N ATOM 1069 CA CYS A 73 67.482 -4.000 3.024 1.00 1.00 C ATOM 1070 C CYS A 73 67.124 -4.662 4.357 1.00 1.00 C ATOM 1071 O CYS A 73 66.894 -5.853 4.428 1.00 1.00 O ATOM 1072 CB CYS A 73 68.687 -4.712 2.390 1.00 1.00 C ATOM 1073 SG CYS A 73 69.391 -5.887 3.573 1.00 1.00 S ATOM 0 H CYS A 73 68.824 -2.363 3.290 1.00 1.00 H new ATOM 0 HA CYS A 73 66.628 -4.071 2.350 1.00 1.00 H new ATOM 0 HB2 CYS A 73 68.378 -5.234 1.484 1.00 1.00 H new ATOM 0 HB3 CYS A 73 69.440 -3.981 2.096 1.00 1.00 H new ATOM 1078 N ASN A 74 67.078 -3.900 5.416 1.00 1.00 N ATOM 1079 CA ASN A 74 66.743 -4.491 6.741 1.00 1.00 C ATOM 1080 C ASN A 74 67.700 -5.651 7.021 1.00 1.00 C ATOM 1081 O ASN A 74 68.460 -6.057 6.165 1.00 1.00 O ATOM 1082 CB ASN A 74 65.296 -5.003 6.729 1.00 1.00 C ATOM 1083 CG ASN A 74 64.354 -3.883 7.175 1.00 1.00 C ATOM 1084 OD1 ASN A 74 64.134 -3.692 8.354 1.00 1.00 O ATOM 1085 ND2 ASN A 74 63.785 -3.128 6.275 1.00 1.00 N ATOM 0 H ASN A 74 67.258 -2.896 5.420 1.00 1.00 H new ATOM 0 HA ASN A 74 66.843 -3.734 7.519 1.00 1.00 H new ATOM 0 HB2 ASN A 74 65.027 -5.342 5.728 1.00 1.00 H new ATOM 0 HB3 ASN A 74 65.197 -5.862 7.393 1.00 1.00 H new ATOM 0 HD21 ASN A 74 63.156 -2.378 6.562 1.00 1.00 H new ATOM 0 HD22 ASN A 74 63.969 -3.288 5.285 1.00 1.00 H new ATOM 1092 N HIS A 75 67.672 -6.183 8.214 1.00 1.00 N ATOM 1093 CA HIS A 75 68.582 -7.315 8.557 1.00 1.00 C ATOM 1094 C HIS A 75 69.975 -7.054 7.976 1.00 1.00 C ATOM 1095 O HIS A 75 70.763 -7.961 7.797 1.00 1.00 O ATOM 1096 CB HIS A 75 68.021 -8.621 7.985 1.00 1.00 C ATOM 1097 CG HIS A 75 67.985 -8.538 6.484 1.00 1.00 C ATOM 1098 ND1 HIS A 75 69.095 -8.819 5.701 1.00 1.00 N ATOM 1099 CD2 HIS A 75 66.981 -8.206 5.607 1.00 1.00 C ATOM 1100 CE1 HIS A 75 68.739 -8.654 4.415 1.00 1.00 C ATOM 1101 NE2 HIS A 75 67.462 -8.282 4.303 1.00 1.00 N ATOM 0 H HIS A 75 67.056 -5.881 8.969 1.00 1.00 H new ATOM 0 HA HIS A 75 68.655 -7.399 9.641 1.00 1.00 H new ATOM 0 HB2 HIS A 75 68.639 -9.462 8.298 1.00 1.00 H new ATOM 0 HB3 HIS A 75 67.019 -8.800 8.374 1.00 1.00 H new ATOM 0 HD1 HIS A 75 70.015 -9.100 6.040 1.00 1.00 H new ATOM 0 HD2 HIS A 75 65.975 -7.929 5.886 1.00 1.00 H new ATOM 0 HE1 HIS A 75 69.404 -8.804 3.577 1.00 1.00 H new ATOM 1110 N CYS A 76 70.285 -5.819 7.684 1.00 1.00 N ATOM 1111 CA CYS A 76 71.628 -5.503 7.120 1.00 1.00 C ATOM 1112 C CYS A 76 72.671 -5.566 8.236 1.00 1.00 C ATOM 1113 O CYS A 76 73.778 -6.027 8.040 1.00 1.00 O ATOM 1114 CB CYS A 76 71.612 -4.098 6.514 1.00 1.00 C ATOM 1115 SG CYS A 76 73.296 -3.621 6.054 1.00 1.00 S ATOM 0 H CYS A 76 69.667 -5.017 7.812 1.00 1.00 H new ATOM 0 HA CYS A 76 71.878 -6.227 6.344 1.00 1.00 H new ATOM 0 HB2 CYS A 76 70.964 -4.076 5.638 1.00 1.00 H new ATOM 0 HB3 CYS A 76 71.204 -3.386 7.231 1.00 1.00 H new ATOM 1120 N GLU A 77 72.322 -5.110 9.409 1.00 1.00 N ATOM 1121 CA GLU A 77 73.288 -5.150 10.542 1.00 1.00 C ATOM 1122 C GLU A 77 73.838 -6.571 10.678 1.00 1.00 C ATOM 1123 O GLU A 77 73.529 -7.440 9.887 1.00 1.00 O ATOM 1124 CB GLU A 77 72.576 -4.748 11.836 1.00 1.00 C ATOM 1125 CG GLU A 77 71.837 -3.425 11.623 1.00 1.00 C ATOM 1126 CD GLU A 77 72.835 -2.345 11.202 1.00 1.00 C ATOM 1127 OE1 GLU A 77 73.617 -1.929 12.041 1.00 1.00 O ATOM 1128 OE2 GLU A 77 72.800 -1.951 10.048 1.00 1.00 O ATOM 0 H GLU A 77 71.409 -4.712 9.631 1.00 1.00 H new ATOM 0 HA GLU A 77 74.107 -4.456 10.354 1.00 1.00 H new ATOM 0 HB2 GLU A 77 71.873 -5.526 12.133 1.00 1.00 H new ATOM 0 HB3 GLU A 77 73.299 -4.646 12.645 1.00 1.00 H new ATOM 0 HG2 GLU A 77 71.070 -3.544 10.858 1.00 1.00 H new ATOM 0 HG3 GLU A 77 71.329 -3.128 12.541 1.00 1.00 H new ATOM 1135 N LEU A 78 74.653 -6.820 11.669 1.00 1.00 N ATOM 1136 CA LEU A 78 75.219 -8.190 11.837 1.00 1.00 C ATOM 1137 C LEU A 78 75.701 -8.696 10.477 1.00 1.00 C ATOM 1138 O LEU A 78 75.173 -9.648 9.935 1.00 1.00 O ATOM 1139 CB LEU A 78 74.138 -9.130 12.382 1.00 1.00 C ATOM 1140 CG LEU A 78 74.759 -10.486 12.723 1.00 1.00 C ATOM 1141 CD1 LEU A 78 75.437 -10.407 14.092 1.00 1.00 C ATOM 1142 CD2 LEU A 78 73.663 -11.553 12.759 1.00 1.00 C ATOM 0 H LEU A 78 74.950 -6.137 12.366 1.00 1.00 H new ATOM 0 HA LEU A 78 76.053 -8.162 12.538 1.00 1.00 H new ATOM 0 HB2 LEU A 78 73.679 -8.696 13.270 1.00 1.00 H new ATOM 0 HB3 LEU A 78 73.347 -9.257 11.643 1.00 1.00 H new ATOM 0 HG LEU A 78 75.498 -10.748 11.966 1.00 1.00 H new ATOM 0 HD11 LEU A 78 75.879 -11.373 14.335 1.00 1.00 H new ATOM 0 HD12 LEU A 78 76.217 -9.646 14.068 1.00 1.00 H new ATOM 0 HD13 LEU A 78 74.698 -10.145 14.849 1.00 1.00 H new ATOM 0 HD21 LEU A 78 74.104 -12.520 13.002 1.00 1.00 H new ATOM 0 HD22 LEU A 78 72.924 -11.291 13.517 1.00 1.00 H new ATOM 0 HD23 LEU A 78 73.178 -11.610 11.784 1.00 1.00 H new ATOM 1154 N HIS A 79 76.691 -8.056 9.915 1.00 1.00 N ATOM 1155 CA HIS A 79 77.204 -8.483 8.581 1.00 1.00 C ATOM 1156 C HIS A 79 78.686 -8.853 8.694 1.00 1.00 C ATOM 1157 O HIS A 79 79.538 -8.000 8.843 1.00 1.00 O ATOM 1158 CB HIS A 79 77.037 -7.324 7.586 1.00 1.00 C ATOM 1159 CG HIS A 79 76.057 -7.718 6.515 1.00 1.00 C ATOM 1160 ND1 HIS A 79 76.205 -7.319 5.195 1.00 1.00 N ATOM 1161 CD2 HIS A 79 74.911 -8.475 6.553 1.00 1.00 C ATOM 1162 CE1 HIS A 79 75.175 -7.831 4.497 1.00 1.00 C ATOM 1163 NE2 HIS A 79 74.359 -8.542 5.277 1.00 1.00 N ATOM 0 H HIS A 79 77.168 -7.253 10.324 1.00 1.00 H new ATOM 0 HA HIS A 79 76.644 -9.351 8.233 1.00 1.00 H new ATOM 0 HB2 HIS A 79 76.685 -6.433 8.106 1.00 1.00 H new ATOM 0 HB3 HIS A 79 77.999 -7.073 7.139 1.00 1.00 H new ATOM 0 HD2 HIS A 79 74.502 -8.945 7.435 1.00 1.00 H new ATOM 0 HE1 HIS A 79 75.027 -7.685 3.437 1.00 1.00 H new ATOM 0 HE2 HIS A 79 73.509 -9.032 4.997 1.00 1.00 H new ATOM 1172 N GLU A 80 79.000 -10.117 8.612 1.00 1.00 N ATOM 1173 CA GLU A 80 80.428 -10.531 8.701 1.00 1.00 C ATOM 1174 C GLU A 80 81.215 -9.810 7.604 1.00 1.00 C ATOM 1175 O GLU A 80 82.405 -9.594 7.715 1.00 1.00 O ATOM 1176 CB GLU A 80 80.533 -12.051 8.502 1.00 1.00 C ATOM 1177 CG GLU A 80 80.738 -12.732 9.857 1.00 1.00 C ATOM 1178 CD GLU A 80 82.175 -12.504 10.331 1.00 1.00 C ATOM 1179 OE1 GLU A 80 83.079 -12.991 9.672 1.00 1.00 O ATOM 1180 OE2 GLU A 80 82.346 -11.846 11.344 1.00 1.00 O ATOM 0 H GLU A 80 78.332 -10.878 8.488 1.00 1.00 H new ATOM 0 HA GLU A 80 80.834 -10.272 9.679 1.00 1.00 H new ATOM 0 HB2 GLU A 80 79.628 -12.429 8.027 1.00 1.00 H new ATOM 0 HB3 GLU A 80 81.364 -12.284 7.837 1.00 1.00 H new ATOM 0 HG2 GLU A 80 80.035 -12.331 10.587 1.00 1.00 H new ATOM 0 HG3 GLU A 80 80.537 -13.800 9.773 1.00 1.00 H new ATOM 1187 N LEU A 81 80.551 -9.432 6.546 1.00 1.00 N ATOM 1188 CA LEU A 81 81.243 -8.722 5.437 1.00 1.00 C ATOM 1189 C LEU A 81 81.277 -7.228 5.757 1.00 1.00 C ATOM 1190 O LEU A 81 81.626 -6.409 4.930 1.00 1.00 O ATOM 1191 CB LEU A 81 80.479 -8.943 4.125 1.00 1.00 C ATOM 1192 CG LEU A 81 80.133 -10.425 3.972 1.00 1.00 C ATOM 1193 CD1 LEU A 81 81.377 -11.272 4.245 1.00 1.00 C ATOM 1194 CD2 LEU A 81 79.035 -10.797 4.972 1.00 1.00 C ATOM 0 H LEU A 81 79.553 -9.586 6.403 1.00 1.00 H new ATOM 0 HA LEU A 81 82.257 -9.106 5.329 1.00 1.00 H new ATOM 0 HB2 LEU A 81 79.568 -8.345 4.118 1.00 1.00 H new ATOM 0 HB3 LEU A 81 81.084 -8.612 3.281 1.00 1.00 H new ATOM 0 HG LEU A 81 79.782 -10.613 2.957 1.00 1.00 H new ATOM 0 HD11 LEU A 81 81.129 -12.328 4.136 1.00 1.00 H new ATOM 0 HD12 LEU A 81 82.160 -11.008 3.535 1.00 1.00 H new ATOM 0 HD13 LEU A 81 81.729 -11.085 5.259 1.00 1.00 H new ATOM 0 HD21 LEU A 81 78.787 -11.853 4.864 1.00 1.00 H new ATOM 0 HD22 LEU A 81 79.387 -10.609 5.986 1.00 1.00 H new ATOM 0 HD23 LEU A 81 78.147 -10.195 4.779 1.00 1.00 H new ATOM 1206 N ALA A 82 80.913 -6.872 6.958 1.00 1.00 N ATOM 1207 CA ALA A 82 80.914 -5.436 7.351 1.00 1.00 C ATOM 1208 C ALA A 82 82.240 -4.795 6.952 1.00 1.00 C ATOM 1209 O ALA A 82 83.228 -4.914 7.648 1.00 1.00 O ATOM 1210 CB ALA A 82 80.732 -5.326 8.866 1.00 1.00 C ATOM 0 H ALA A 82 80.613 -7.519 7.688 1.00 1.00 H new ATOM 0 HA ALA A 82 80.098 -4.921 6.845 1.00 1.00 H new ATOM 0 HB1 ALA A 82 80.732 -4.276 9.157 1.00 1.00 H new ATOM 0 HB2 ALA A 82 79.784 -5.782 9.153 1.00 1.00 H new ATOM 0 HB3 ALA A 82 81.550 -5.842 9.369 1.00 1.00 H new ATOM 1216 N GLN A 83 82.264 -4.110 5.838 1.00 1.00 N ATOM 1217 CA GLN A 83 83.524 -3.447 5.388 1.00 1.00 C ATOM 1218 C GLN A 83 84.262 -2.892 6.609 1.00 1.00 C ATOM 1219 O GLN A 83 83.666 -2.279 7.470 1.00 1.00 O ATOM 1220 CB GLN A 83 83.174 -2.299 4.432 1.00 1.00 C ATOM 1221 CG GLN A 83 83.026 -2.843 3.010 1.00 1.00 C ATOM 1222 CD GLN A 83 82.148 -4.096 3.031 1.00 1.00 C ATOM 1223 OE1 GLN A 83 80.945 -4.026 3.534 1.00 1.00 O flip ATOM 1224 NE2 GLN A 83 82.559 -5.148 2.585 1.00 1.00 N flip ATOM 0 H GLN A 83 81.463 -3.981 5.219 1.00 1.00 H new ATOM 0 HA GLN A 83 84.161 -4.167 4.874 1.00 1.00 H new ATOM 0 HB2 GLN A 83 82.247 -1.820 4.747 1.00 1.00 H new ATOM 0 HB3 GLN A 83 83.953 -1.537 4.462 1.00 1.00 H new ATOM 0 HG2 GLN A 83 82.582 -2.086 2.364 1.00 1.00 H new ATOM 0 HG3 GLN A 83 84.006 -3.080 2.596 1.00 1.00 H new ATOM 0 HE21 GLN A 83 83.499 -5.203 2.192 1.00 1.00 H new ATOM 0 HE22 GLN A 83 81.965 -5.977 2.603 1.00 1.00 H new ATOM 1233 N TYR A 84 85.547 -3.115 6.698 1.00 1.00 N ATOM 1234 CA TYR A 84 86.313 -2.610 7.876 1.00 1.00 C ATOM 1235 C TYR A 84 85.860 -1.190 8.223 1.00 1.00 C ATOM 1236 O TYR A 84 86.433 -0.220 7.766 1.00 1.00 O ATOM 1237 CB TYR A 84 87.811 -2.584 7.557 1.00 1.00 C ATOM 1238 CG TYR A 84 88.204 -3.857 6.846 1.00 1.00 C ATOM 1239 CD1 TYR A 84 87.936 -4.007 5.480 1.00 1.00 C ATOM 1240 CD2 TYR A 84 88.837 -4.886 7.552 1.00 1.00 C ATOM 1241 CE1 TYR A 84 88.300 -5.187 4.821 1.00 1.00 C ATOM 1242 CE2 TYR A 84 89.202 -6.066 6.893 1.00 1.00 C ATOM 1243 CZ TYR A 84 88.933 -6.217 5.527 1.00 1.00 C ATOM 1244 OH TYR A 84 89.293 -7.380 4.877 1.00 1.00 O ATOM 0 H TYR A 84 86.099 -3.624 6.007 1.00 1.00 H new ATOM 0 HA TYR A 84 86.128 -3.275 8.720 1.00 1.00 H new ATOM 0 HB2 TYR A 84 88.045 -1.721 6.933 1.00 1.00 H new ATOM 0 HB3 TYR A 84 88.386 -2.478 8.477 1.00 1.00 H new ATOM 0 HD1 TYR A 84 87.448 -3.212 4.935 1.00 1.00 H new ATOM 0 HD2 TYR A 84 89.044 -4.770 8.606 1.00 1.00 H new ATOM 0 HE1 TYR A 84 88.092 -5.303 3.767 1.00 1.00 H new ATOM 0 HE2 TYR A 84 89.691 -6.860 7.438 1.00 1.00 H new ATOM 0 HH TYR A 84 89.723 -7.990 5.512 1.00 1.00 H new ATOM 1254 N GLY A 85 84.843 -1.055 9.030 1.00 1.00 N ATOM 1255 CA GLY A 85 84.365 0.308 9.406 1.00 1.00 C ATOM 1256 C GLY A 85 83.165 0.692 8.538 1.00 1.00 C ATOM 1257 O GLY A 85 83.016 1.831 8.141 1.00 1.00 O ATOM 0 H GLY A 85 84.323 -1.828 9.445 1.00 1.00 H new ATOM 0 HA2 GLY A 85 84.085 0.328 10.459 1.00 1.00 H new ATOM 0 HA3 GLY A 85 85.167 1.034 9.276 1.00 1.00 H new ATOM 1261 N ILE A 86 82.309 -0.252 8.245 1.00 1.00 N ATOM 1262 CA ILE A 86 81.103 0.036 7.405 1.00 1.00 C ATOM 1263 C ILE A 86 81.436 1.085 6.338 1.00 1.00 C ATOM 1264 O ILE A 86 82.564 1.208 5.907 1.00 1.00 O ATOM 1265 CB ILE A 86 79.963 0.543 8.296 1.00 1.00 C ATOM 1266 CG1 ILE A 86 80.438 1.767 9.083 1.00 1.00 C ATOM 1267 CG2 ILE A 86 79.548 -0.559 9.272 1.00 1.00 C ATOM 1268 CD1 ILE A 86 79.242 2.430 9.767 1.00 1.00 C ATOM 0 H ILE A 86 82.393 -1.220 8.554 1.00 1.00 H new ATOM 0 HA ILE A 86 80.792 -0.882 6.907 1.00 1.00 H new ATOM 0 HB ILE A 86 79.111 0.817 7.674 1.00 1.00 H new ATOM 0 HG12 ILE A 86 81.177 1.470 9.827 1.00 1.00 H new ATOM 0 HG13 ILE A 86 80.926 2.475 8.414 1.00 1.00 H new ATOM 0 HG21 ILE A 86 78.738 -0.198 9.905 1.00 1.00 H new ATOM 0 HG22 ILE A 86 79.211 -1.432 8.713 1.00 1.00 H new ATOM 0 HG23 ILE A 86 80.400 -0.834 9.894 1.00 1.00 H new ATOM 0 HD11 ILE A 86 79.580 3.302 10.327 1.00 1.00 H new ATOM 0 HD12 ILE A 86 78.519 2.742 9.013 1.00 1.00 H new ATOM 0 HD13 ILE A 86 78.773 1.720 10.448 1.00 1.00 H new ATOM 1280 N CYS A 87 80.461 1.839 5.906 1.00 1.00 N ATOM 1281 CA CYS A 87 80.724 2.875 4.867 1.00 1.00 C ATOM 1282 C CYS A 87 81.764 3.868 5.388 1.00 1.00 C ATOM 1283 CB CYS A 87 79.425 3.617 4.546 1.00 1.00 C ATOM 1284 SG CYS A 87 79.672 4.670 3.095 1.00 1.00 S ATOM 0 H CYS A 87 79.495 1.782 6.228 1.00 1.00 H new ATOM 0 HA CYS A 87 81.101 2.396 3.964 1.00 1.00 H new ATOM 0 HB2 CYS A 87 78.623 2.903 4.358 1.00 1.00 H new ATOM 0 HB3 CYS A 87 79.119 4.222 5.400 1.00 1.00 H new TER 1289 CYS A 87 HETATM 1290 C1C RCY A 110 64.239 -1.121 17.043 1.00 1.00 C HETATM 1291 O1G RCY A 110 68.786 -1.364 18.664 1.00 1.00 O HETATM 1292 O1H RCY A 110 64.304 -1.386 20.151 1.00 1.00 O HETATM 1293 O1J RCY A 110 66.413 -0.103 15.225 1.00 1.00 O HETATM 1294 C1L RCY A 110 67.619 -0.215 20.482 1.00 1.00 C HETATM 1295 C1M RCY A 110 67.233 -3.290 17.193 1.00 1.00 C HETATM 1296 C1P RCY A 110 67.734 -1.131 19.257 1.00 1.00 C HETATM 1297 C1Q RCY A 110 65.436 -1.020 19.837 1.00 1.00 C HETATM 1298 N1R RCY A 110 66.379 -1.717 18.864 1.00 1.00 N HETATM 1299 C1S RCY A 110 66.153 0.214 20.352 1.00 1.00 C HETATM 1300 C1U RCY A 110 66.043 -2.739 17.776 1.00 1.00 C HETATM 1301 C1V RCY A 110 64.724 -3.191 15.662 1.00 1.00 C HETATM 1302 N1V RCY A 110 66.453 -1.395 15.904 1.00 1.00 N HETATM 1303 C1W RCY A 110 67.656 -2.318 16.085 1.00 1.00 C HETATM 1304 C1X RCY A 110 65.304 -2.121 16.590 1.00 1.00 C HETATM 1305 C1Y RCY A 110 67.950 -3.076 14.787 1.00 1.00 C HETATM 1306 C1Z RCY A 110 68.866 -1.485 16.508 1.00 1.00 C HETATM 0 H1ZB RCY A 110 68.617 -0.908 17.398 1.00 1.00 H new HETATM 0 H1ZA RCY A 110 69.704 -2.146 16.727 1.00 1.00 H new HETATM 0 H1YB RCY A 110 68.756 -3.790 14.957 1.00 1.00 H new HETATM 0 H1YA RCY A 110 67.055 -3.609 14.466 1.00 1.00 H new HETATM 0 H1VB RCY A 110 63.941 -3.740 16.185 1.00 1.00 H new HETATM 0 H1VA RCY A 110 64.304 -2.715 14.776 1.00 1.00 H new HETATM 0 H1MA RCY A 110 68.020 -3.395 17.940 1.00 1.00 H new HETATM 0 H1CA RCY A 110 64.711 -0.317 17.608 1.00 1.00 H new HETATM 0 H1Z RCY A 110 69.141 -0.806 15.701 1.00 1.00 H new HETATM 0 H1Y RCY A 110 68.249 -2.369 14.013 1.00 1.00 H new HETATM 0 H1V RCY A 110 65.514 -3.881 15.364 1.00 1.00 H new HETATM 0 H1S RCY A 110 66.045 1.052 19.663 1.00 1.00 H new HETATM 0 H1M RCY A 110 67.044 -4.284 16.788 1.00 1.00 H new HETATM 0 H1C RCY A 110 63.737 -0.704 16.170 1.00 1.00 H new HETATM 1309 C1C RCY A 121 64.708 10.860 6.036 1.00 1.00 C HETATM 1310 O1G RCY A 121 65.210 12.636 5.205 1.00 1.00 O HETATM 1311 O1H RCY A 121 69.774 12.276 6.361 1.00 1.00 O HETATM 1312 O1J RCY A 121 66.008 8.923 4.131 1.00 1.00 O HETATM 1313 C1L RCY A 121 67.208 13.884 4.545 1.00 1.00 C HETATM 1314 C1M RCY A 121 68.083 9.895 7.206 1.00 1.00 C HETATM 1315 C1P RCY A 121 66.420 12.821 5.321 1.00 1.00 C HETATM 1316 C1Q RCY A 121 68.664 12.729 6.087 1.00 1.00 C HETATM 1317 N1R RCY A 121 67.326 12.021 6.256 1.00 1.00 N HETATM 1318 C1S RCY A 121 68.375 14.104 5.513 1.00 1.00 C HETATM 1319 C1U RCY A 121 66.987 10.818 7.138 1.00 1.00 C HETATM 1320 C1V RCY A 121 65.321 8.970 7.610 1.00 1.00 C HETATM 1321 N1V RCY A 121 66.545 9.263 5.445 1.00 1.00 N HETATM 1322 C1W RCY A 121 67.946 8.979 5.983 1.00 1.00 C HETATM 1323 C1X RCY A 121 65.835 9.982 6.584 1.00 1.00 C HETATM 1324 C1Y RCY A 121 68.073 7.509 6.395 1.00 1.00 C HETATM 1325 C1Z RCY A 121 68.976 9.328 4.909 1.00 1.00 C HETATM 0 H1ZB RCY A 121 68.831 10.359 4.587 1.00 1.00 H new HETATM 0 H1ZA RCY A 121 69.980 9.213 5.317 1.00 1.00 H new HETATM 0 H1YB RCY A 121 69.048 7.343 6.854 1.00 1.00 H new HETATM 0 H1YA RCY A 121 67.289 7.263 7.111 1.00 1.00 H new HETATM 0 H1VB RCY A 121 64.864 9.500 8.446 1.00 1.00 H new HETATM 0 H1VA RCY A 121 64.580 8.322 7.142 1.00 1.00 H new HETATM 0 H1MA RCY A 121 69.037 10.422 7.193 1.00 1.00 H new HETATM 0 H1LA RCY A 121 67.537 13.529 3.568 1.00 1.00 H new HETATM 0 H1CB RCY A 121 64.319 11.492 6.834 1.00 1.00 H new HETATM 0 H1CA RCY A 121 65.093 11.487 5.232 1.00 1.00 H new HETATM 0 H1Z RCY A 121 68.852 8.661 4.056 1.00 1.00 H new HETATM 0 H1Y RCY A 121 67.973 6.874 5.514 1.00 1.00 H new HETATM 0 H1V RCY A 121 66.153 8.367 7.974 1.00 1.00 H new HETATM 0 H1U RCY A 121 66.736 11.256 8.104 1.00 1.00 H new HETATM 0 H1S RCY A 121 68.111 14.813 6.297 1.00 1.00 H new HETATM 0 H1M RCY A 121 68.050 9.318 8.130 1.00 1.00 H new HETATM 0 H1L RCY A 121 66.629 14.792 4.376 1.00 1.00 H new HETATM 0 H1C RCY A 121 63.908 10.227 5.651 1.00 1.00 H new HETATM 1328 C1C RCY A 130 70.591 13.368 -9.090 1.00 1.00 C HETATM 1329 O1G RCY A 130 69.867 10.982 -13.171 1.00 1.00 O HETATM 1330 O1H RCY A 130 73.890 11.846 -10.854 1.00 1.00 O HETATM 1331 O1J RCY A 130 70.073 11.775 -6.588 1.00 1.00 O HETATM 1332 C1L RCY A 130 72.115 11.618 -13.898 1.00 1.00 C HETATM 1333 C1M RCY A 130 71.172 9.758 -9.659 1.00 1.00 C HETATM 1334 C1P RCY A 130 71.020 11.291 -12.875 1.00 1.00 C HETATM 1335 C1Q RCY A 130 72.958 11.910 -11.655 1.00 1.00 C HETATM 1336 N1R RCY A 130 71.540 11.396 -11.442 1.00 1.00 N HETATM 1337 C1S RCY A 130 73.012 12.520 -13.043 1.00 1.00 C HETATM 1338 C1U RCY A 130 70.829 11.071 -10.127 1.00 1.00 C HETATM 1339 C1V RCY A 130 72.772 12.095 -8.866 1.00 1.00 C HETATM 1340 N1V RCY A 130 70.681 11.226 -7.796 1.00 1.00 N HETATM 1341 C1W RCY A 130 70.888 9.755 -8.152 1.00 1.00 C HETATM 1342 C1X RCY A 130 71.250 11.992 -8.983 1.00 1.00 C HETATM 1343 C1Y RCY A 130 72.080 9.180 -7.381 1.00 1.00 C HETATM 1344 C1Z RCY A 130 69.612 8.977 -7.829 1.00 1.00 C HETATM 0 H1ZB RCY A 130 68.766 9.437 -8.340 1.00 1.00 H new HETATM 0 H1ZA RCY A 130 69.721 7.945 -8.163 1.00 1.00 H new HETATM 0 H1YB RCY A 130 72.265 8.157 -7.708 1.00 1.00 H new HETATM 0 H1YA RCY A 130 72.964 9.788 -7.573 1.00 1.00 H new HETATM 0 H1VA RCY A 130 73.031 12.667 -7.975 1.00 1.00 H new HETATM 0 H1LA RCY A 130 72.635 10.728 -14.252 1.00 1.00 H new HETATM 0 H1Z RCY A 130 69.438 8.993 -6.753 1.00 1.00 H new HETATM 0 H1Y RCY A 130 71.860 9.186 -6.313 1.00 1.00 H new HETATM 0 H1V RCY A 130 73.200 11.095 -8.792 1.00 1.00 H new HETATM 0 H1S RCY A 130 72.651 13.548 -13.038 1.00 1.00 H new HETATM 0 H1M RCY A 130 72.220 9.535 -9.858 1.00 1.00 H new HETATM 0 H1L RCY A 130 71.725 12.130 -14.777 1.00 1.00 H new HETATM 1347 C1C RCY A 138 84.789 0.367 -3.942 1.00 1.00 C HETATM 1348 O1G RCY A 138 83.062 -2.911 -8.237 1.00 1.00 O HETATM 1349 O1H RCY A 138 81.486 -2.332 -6.657 1.00 1.00 O HETATM 1350 O1J RCY A 138 84.198 -0.842 -1.248 1.00 1.00 O HETATM 1351 C1L RCY A 138 82.437 -1.601 -6.195 1.00 1.00 C HETATM 1352 C1M RCY A 138 82.970 -2.837 -4.284 1.00 1.00 C HETATM 1353 C1P RCY A 138 83.049 -1.891 -7.577 1.00 1.00 C HETATM 1354 C1Q RCY A 138 82.530 -2.018 -7.226 1.00 1.00 C HETATM 1355 N1R RCY A 138 83.682 -1.569 -6.255 1.00 1.00 N HETATM 1356 C1S RCY A 138 83.864 -1.544 -6.820 1.00 1.00 C HETATM 1357 C1U RCY A 138 83.335 -1.535 -4.765 1.00 1.00 C HETATM 1358 C1V RCY A 138 85.774 -1.952 -4.225 1.00 1.00 C HETATM 1359 N1V RCY A 138 83.990 -1.532 -2.518 1.00 1.00 N HETATM 1360 C1W RCY A 138 83.191 -2.809 -2.767 1.00 1.00 C HETATM 1361 C1X RCY A 138 84.522 -1.138 -3.889 1.00 1.00 C HETATM 1362 C1Y RCY A 138 83.988 -4.037 -2.316 1.00 1.00 C HETATM 1363 C1Z RCY A 138 81.863 -2.723 -2.014 1.00 1.00 C HETATM 0 H1ZB RCY A 138 81.338 -1.813 -2.305 1.00 1.00 H new HETATM 0 H1ZA RCY A 138 81.249 -3.590 -2.259 1.00 1.00 H new HETATM 0 H1YA RCY A 138 84.958 -4.044 -2.814 1.00 1.00 H new HETATM 0 H1VB RCY A 138 86.112 -1.701 -5.230 1.00 1.00 H new HETATM 0 H1VA RCY A 138 86.562 -1.720 -3.508 1.00 1.00 H new HETATM 0 H1MA RCY A 138 81.931 -3.063 -4.522 1.00 1.00 H new HETATM 0 H1LA RCY A 138 81.841 -0.715 -5.976 1.00 1.00 H new HETATM 0 H1CB RCY A 138 85.008 0.662 -4.968 1.00 1.00 H new HETATM 0 H1CA RCY A 138 83.909 0.905 -3.590 1.00 1.00 H new HETATM 0 H1Z RCY A 138 82.054 -2.705 -0.941 1.00 1.00 H new HETATM 0 H1Y RCY A 138 84.135 -3.999 -1.237 1.00 1.00 H new HETATM 0 H1V RCY A 138 85.541 -3.016 -4.176 1.00 1.00 H new HETATM 0 H1S RCY A 138 84.677 -2.209 -6.528 1.00 1.00 H new HETATM 0 H1M RCY A 138 83.579 -3.610 -4.752 1.00 1.00 H new HETATM 0 H1C RCY A 138 85.641 0.608 -3.306 1.00 1.00 H new HETATM 1366 C1C RCY A 150 80.294 -7.795 -2.586 1.00 1.00 C HETATM 1367 O1G RCY A 150 84.068 -9.682 -5.278 1.00 1.00 O HETATM 1368 O1H RCY A 150 80.583 -6.611 -6.128 1.00 1.00 O HETATM 1369 O1J RCY A 150 81.285 -5.747 -0.613 1.00 1.00 O HETATM 1370 C1L RCY A 150 82.634 -9.271 -7.218 1.00 1.00 C HETATM 1371 C1M RCY A 150 83.494 -6.305 -3.698 1.00 1.00 C HETATM 1372 C1P RCY A 150 83.136 -9.059 -5.784 1.00 1.00 C HETATM 1373 C1Q RCY A 150 81.262 -7.636 -6.089 1.00 1.00 C HETATM 1374 N1R RCY A 150 82.335 -7.977 -5.062 1.00 1.00 N HETATM 1375 C1S RCY A 150 81.184 -8.799 -7.060 1.00 1.00 C HETATM 1376 C1U RCY A 150 82.546 -7.382 -3.668 1.00 1.00 C HETATM 1377 C1V RCY A 150 80.627 -5.787 -4.098 1.00 1.00 C HETATM 1378 N1V RCY A 150 81.872 -5.964 -1.932 1.00 1.00 N HETATM 1379 C1W RCY A 150 83.217 -5.458 -2.450 1.00 1.00 C HETATM 1380 C1X RCY A 150 81.280 -6.743 -3.098 1.00 1.00 C HETATM 1381 C1Y RCY A 150 83.127 -3.974 -2.816 1.00 1.00 C HETATM 1382 C1Z RCY A 150 84.283 -5.684 -1.378 1.00 1.00 C HETATM 0 H1ZB RCY A 150 84.291 -6.735 -1.089 1.00 1.00 H new HETATM 0 H1ZA RCY A 150 85.261 -5.409 -1.773 1.00 1.00 H new HETATM 0 H1VB RCY A 150 80.257 -6.352 -4.953 1.00 1.00 H new HETATM 0 H1VA RCY A 150 79.796 -5.270 -3.618 1.00 1.00 H new HETATM 0 H1MA RCY A 150 84.516 -6.685 -3.692 1.00 1.00 H new HETATM 0 H1LA RCY A 150 83.189 -8.679 -7.946 1.00 1.00 H new HETATM 0 H1CB RCY A 150 80.006 -8.453 -3.406 1.00 1.00 H new HETATM 0 H1CA RCY A 150 80.765 -8.382 -1.798 1.00 1.00 H new HETATM 0 H1Z RCY A 150 84.058 -5.069 -0.506 1.00 1.00 H new HETATM 0 H1V RCY A 150 81.362 -5.056 -4.436 1.00 1.00 H new HETATM 0 H1U RCY A 150 82.877 -8.226 -3.063 1.00 1.00 H new HETATM 0 H1S RCY A 150 80.548 -9.596 -6.674 1.00 1.00 H new HETATM 0 H1M RCY A 150 83.380 -5.711 -4.605 1.00 1.00 H new HETATM 0 H1L RCY A 150 82.702 -10.312 -7.535 1.00 1.00 H new HETATM 0 H1C RCY A 150 79.408 -7.300 -2.189 1.00 1.00 H new HETATM 1385 C1C RCY A 160 73.639 0.533 -6.893 1.00 1.00 C HETATM 1386 O1G RCY A 160 73.623 -2.947 -7.150 1.00 1.00 O HETATM 1387 O1H RCY A 160 69.755 -0.566 -8.443 1.00 1.00 O HETATM 1388 O1J RCY A 160 71.453 2.421 -7.746 1.00 1.00 O HETATM 1389 C1L RCY A 160 72.226 -2.986 -9.158 1.00 1.00 C HETATM 1390 C1M RCY A 160 70.394 -0.412 -5.388 1.00 1.00 C HETATM 1391 C1P RCY A 160 72.630 -2.536 -7.748 1.00 1.00 C HETATM 1392 C1Q RCY A 160 70.578 -1.463 -8.265 1.00 1.00 C HETATM 1393 N1R RCY A 160 71.646 -1.515 -7.180 1.00 1.00 N HETATM 1394 C1S RCY A 160 70.716 -2.728 -9.092 1.00 1.00 C HETATM 1395 C1U RCY A 160 71.708 -0.739 -5.863 1.00 1.00 C HETATM 1396 C1V RCY A 160 72.708 1.243 -4.645 1.00 1.00 C HETATM 1397 N1V RCY A 160 71.298 1.405 -6.709 1.00 1.00 N HETATM 1398 C1W RCY A 160 70.000 0.895 -6.087 1.00 1.00 C HETATM 1399 C1X RCY A 160 72.396 0.618 -6.006 1.00 1.00 C HETATM 1400 C1Y RCY A 160 69.459 1.907 -5.073 1.00 1.00 C HETATM 1401 C1Z RCY A 160 68.978 0.646 -7.197 1.00 1.00 C HETATM 0 H1ZB RCY A 160 69.404 -0.029 -7.939 1.00 1.00 H new HETATM 0 H1VB RCY A 160 73.454 0.638 -4.129 1.00 1.00 H new HETATM 0 H1MA RCY A 160 69.686 -1.207 -5.622 1.00 1.00 H new HETATM 0 H1LA RCY A 160 72.715 -2.403 -9.938 1.00 1.00 H new HETATM 0 H1CB RCY A 160 74.351 -0.167 -6.456 1.00 1.00 H new HETATM 0 H1CA RCY A 160 73.354 0.187 -7.887 1.00 1.00 H new HETATM 0 H1Z RCY A 160 68.720 1.592 -7.673 1.00 1.00 H new HETATM 0 H1U RCY A 160 72.255 -1.397 -5.189 1.00 1.00 H new HETATM 0 H1S RCY A 160 70.191 -3.563 -8.629 1.00 1.00 H new HETATM 0 H1M RCY A 160 70.391 -0.291 -4.305 1.00 1.00 H new HETATM 0 H1L RCY A 160 72.463 -4.033 -9.346 1.00 1.00 H new HETATM 0 H1C RCY A 160 74.099 1.518 -6.970 1.00 1.00 H new HETATM 1404 C1C RCY A 168 74.149 1.723 -2.516 1.00 1.00 C HETATM 1405 O1G RCY A 168 72.923 2.190 -4.018 1.00 1.00 O HETATM 1406 O1H RCY A 168 68.997 2.264 -1.394 1.00 1.00 O HETATM 1407 O1J RCY A 168 74.229 4.593 -1.607 1.00 1.00 O HETATM 1408 C1L RCY A 168 70.576 2.658 -4.528 1.00 1.00 C HETATM 1409 C1M RCY A 168 71.693 2.340 0.182 1.00 1.00 C HETATM 1410 C1P RCY A 168 71.757 2.259 -3.633 1.00 1.00 C HETATM 1411 C1Q RCY A 168 69.790 2.086 -2.318 1.00 1.00 C HETATM 1412 N1R RCY A 168 71.304 1.959 -2.205 1.00 1.00 N HETATM 1413 C1S RCY A 168 69.436 1.951 -3.788 1.00 1.00 C HETATM 1414 C1U RCY A 168 72.145 1.619 -0.973 1.00 1.00 C HETATM 1415 C1V RCY A 168 74.483 1.432 -0.020 1.00 1.00 C HETATM 1416 N1V RCY A 168 73.480 3.540 -0.927 1.00 1.00 N HETATM 1417 C1W RCY A 168 72.396 3.703 0.136 1.00 1.00 C HETATM 1418 C1X RCY A 168 73.607 2.036 -1.120 1.00 1.00 C HETATM 1419 C1Y RCY A 168 73.023 4.032 1.494 1.00 1.00 C HETATM 1420 C1Z RCY A 168 71.434 4.810 -0.295 1.00 1.00 C HETATM 0 H1YB RCY A 168 72.245 4.062 2.256 1.00 1.00 H new HETATM 0 H1YA RCY A 168 73.754 3.266 1.752 1.00 1.00 H new HETATM 0 H1MA RCY A 168 70.610 2.460 0.167 1.00 1.00 H new HETATM 0 H1LA RCY A 168 70.436 3.738 -4.577 1.00 1.00 H new HETATM 0 H1CB RCY A 168 74.079 0.651 -2.702 1.00 1.00 H new HETATM 0 H1CA RCY A 168 73.563 2.260 -3.262 1.00 1.00 H new HETATM 0 H1Y RCY A 168 73.517 5.002 1.441 1.00 1.00 H new HETATM 0 H1U RCY A 168 72.045 0.539 -0.869 1.00 1.00 H new HETATM 0 H1M RCY A 168 71.942 1.804 1.098 1.00 1.00 H new HETATM 0 H1C RCY A 168 75.192 2.035 -2.580 1.00 1.00 H new HETATM 1423 C1C RCY A 173 73.557 -1.671 3.437 1.00 1.00 C HETATM 1424 O1G RCY A 173 71.912 -4.150 7.700 1.00 1.00 O HETATM 1425 O1H RCY A 173 70.822 -3.276 3.190 1.00 1.00 O HETATM 1426 O1J RCY A 173 75.130 0.479 4.840 1.00 1.00 O HETATM 1427 C1L RCY A 173 70.721 -5.428 5.987 1.00 1.00 C HETATM 1428 C1M RCY A 173 72.589 -1.414 6.999 1.00 1.00 C HETATM 1429 C1P RCY A 173 71.462 -4.212 6.557 1.00 1.00 C HETATM 1430 C1Q RCY A 173 70.764 -3.642 4.362 1.00 1.00 C HETATM 1431 N1R RCY A 173 71.571 -3.087 5.529 1.00 1.00 N HETATM 1432 C1S RCY A 173 69.871 -4.738 4.915 1.00 1.00 C HETATM 1433 C1U RCY A 173 72.300 -1.746 5.634 1.00 1.00 C HETATM 1434 C1V RCY A 173 74.505 -2.967 5.399 1.00 1.00 C HETATM 1435 N1V RCY A 173 74.263 -0.477 5.522 1.00 1.00 N HETATM 1436 C1W RCY A 173 73.749 -0.412 6.959 1.00 1.00 C HETATM 1437 C1X RCY A 173 73.671 -1.762 4.960 1.00 1.00 C HETATM 1438 C1Y RCY A 173 74.850 -0.823 7.941 1.00 1.00 C HETATM 1439 C1Z RCY A 173 73.267 1.009 7.254 1.00 1.00 C HETATM 0 H1ZA RCY A 173 72.815 1.042 8.246 1.00 1.00 H new HETATM 0 H1YB RCY A 173 74.444 -0.852 8.952 1.00 1.00 H new HETATM 0 H1YA RCY A 173 75.227 -1.810 7.673 1.00 1.00 H new HETATM 0 H1MA RCY A 173 71.716 -0.980 7.487 1.00 1.00 H new HETATM 0 H1CB RCY A 173 72.983 -2.519 3.064 1.00 1.00 H new HETATM 0 H1CA RCY A 173 73.053 -0.744 3.165 1.00 1.00 H new HETATM 0 H1Z RCY A 173 74.113 1.695 7.218 1.00 1.00 H new HETATM 0 H1Y RCY A 173 75.664 -0.100 7.898 1.00 1.00 H new HETATM 0 H1U RCY A 173 71.626 -1.036 5.155 1.00 1.00 H new HETATM 0 H1S RCY A 173 68.955 -4.326 5.340 1.00 1.00 H new HETATM 0 H1M RCY A 173 72.862 -2.304 7.567 1.00 1.00 H new HETATM 1442 C1C RCY A 176 73.247 3.162 4.265 1.00 1.00 C HETATM 1443 O1G RCY A 176 72.693 1.446 6.657 1.00 1.00 O HETATM 1444 O1H RCY A 176 75.213 -1.913 4.498 1.00 1.00 O HETATM 1445 O1J RCY A 176 75.124 4.225 2.163 1.00 1.00 O HETATM 1446 C1L RCY A 176 72.701 -0.996 6.804 1.00 1.00 C HETATM 1447 C1M RCY A 176 75.962 0.750 3.553 1.00 1.00 C HETATM 1448 C1P RCY A 176 73.139 0.370 6.262 1.00 1.00 C HETATM 1449 C1Q RCY A 176 74.287 -1.283 5.006 1.00 1.00 C HETATM 1450 N1R RCY A 176 74.198 0.229 5.170 1.00 1.00 N HETATM 1451 C1S RCY A 176 73.015 -1.874 5.587 1.00 1.00 C HETATM 1452 C1U RCY A 176 74.974 1.317 4.426 1.00 1.00 C HETATM 1453 C1V RCY A 176 73.230 1.258 2.592 1.00 1.00 C HETATM 1454 N1V RCY A 176 75.156 2.856 2.672 1.00 1.00 N HETATM 1455 C1W RCY A 176 76.264 1.820 2.497 1.00 1.00 C HETATM 1456 C1X RCY A 176 74.090 2.144 3.494 1.00 1.00 C HETATM 1457 C1Y RCY A 176 76.217 1.217 1.090 1.00 1.00 C HETATM 1458 C1Z RCY A 176 77.616 2.487 2.753 1.00 1.00 C HETATM 0 H1ZA RCY A 176 78.405 1.735 2.720 1.00 1.00 H new HETATM 0 H1VB RCY A 176 72.508 0.713 3.200 1.00 1.00 H new HETATM 0 H1CB RCY A 176 72.603 2.640 4.973 1.00 1.00 H new HETATM 0 H1CA RCY A 176 73.904 3.843 4.806 1.00 1.00 H new HETATM 0 H1Y RCY A 176 76.434 1.992 0.355 1.00 1.00 H new HETATM 0 H1C RCY A 176 72.633 3.730 3.566 1.00 1.00 H new HETATM 1461 C1C RCY A 187 74.733 1.843 -0.247 1.00 1.00 C HETATM 1462 O1G RCY A 187 76.249 3.179 -0.435 1.00 1.00 O HETATM 1463 O1H RCY A 187 77.397 3.015 4.142 1.00 1.00 O HETATM 1464 O1J RCY A 187 76.208 -0.726 0.297 1.00 1.00 O HETATM 1465 C1L RCY A 187 78.182 3.975 0.836 1.00 1.00 C HETATM 1466 C1M RCY A 187 75.060 1.233 3.388 1.00 1.00 C HETATM 1467 C1P RCY A 187 76.805 3.324 0.652 1.00 1.00 C HETATM 1468 C1Q RCY A 187 77.241 3.396 2.983 1.00 1.00 C HETATM 1469 N1R RCY A 187 76.210 2.879 1.987 1.00 1.00 N HETATM 1470 C1S RCY A 187 78.046 4.473 2.279 1.00 1.00 C HETATM 1471 C1U RCY A 187 74.916 2.112 2.264 1.00 1.00 C HETATM 1472 C1V RCY A 187 73.093 0.656 1.280 1.00 1.00 C HETATM 1473 N1V RCY A 187 75.525 0.058 1.322 1.00 1.00 N HETATM 1474 C1W RCY A 187 75.659 -0.068 2.838 1.00 1.00 C HETATM 1475 C1X RCY A 187 74.520 1.184 1.117 1.00 1.00 C HETATM 1476 C1Y RCY A 187 74.872 -1.280 3.347 1.00 1.00 C HETATM 1477 C1Z RCY A 187 77.138 -0.196 3.201 1.00 1.00 C HETATM 0 H1ZB RCY A 187 77.690 0.644 2.780 1.00 1.00 H new HETATM 0 H1VA RCY A 187 72.889 -0.086 0.508 1.00 1.00 H new HETATM 0 H1LA RCY A 187 78.999 3.264 0.715 1.00 1.00 H new HETATM 0 H1CA RCY A 187 75.785 2.103 -0.365 1.00 1.00 H new HETATM 0 H1Z RCY A 187 77.533 -1.128 2.797 1.00 1.00 H new HETATM 0 H1Y RCY A 187 75.311 -2.194 2.946 1.00 1.00 H new HETATM 0 H1S RCY A 187 77.539 5.437 2.319 1.00 1.00 H new HETATM 0 H1L RCY A 187 78.358 4.786 0.129 1.00 1.00 H new