USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 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 Set 1.1: A 73 TYR OH : rot -57:sc= 0.72 USER MOD Set 1.2: A 77 LYS NZ :NH3+ 159:sc= 1.9 (180deg=0.147) USER MOD Set 2.1: A 65 TYR OH : rot -151:sc= -1.64! USER MOD Set 2.2: B 116 THR OG1 : rot 86:sc= 1.88 USER MOD Set 2.3: B 119 SER OG : rot -159:sc= -0.695 USER MOD Set 3.1: A 21 LYS NZ :NH3+ -164:sc= 2.25 (180deg=1.04) USER MOD Set 3.2: A 24 GLN : amide:sc= 0.672 K(o=2.9,f=-8.1!) USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.113 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 163:sc= 1.51 (180deg=0.668) USER MOD Single : A 7 HIS : no HD1:sc= -0.283 X(o=-0.28,f=-0.1) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 12 GLN :FLIP amide:sc= -0.0562 F(o=-1.6,f=-0.056) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HE2:sc= -1.96 X(o=-2,f=-1.8) USER MOD Single : A 20 HIS : no HE2:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 29 THR OG1 : rot -123:sc= 0.398 USER MOD Single : A 36 LYS NZ :NH3+ -141:sc= -0.793 (180deg=-2.74!) USER MOD Single : A 40 MET CE :methyl -141:sc= -3.65! (180deg=-8.04!) USER MOD Single : A 42 ASN : amide:sc= -0.0178 K(o=-0.018,f=-0.86) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= -0.0686 (180deg=-0.392) USER MOD Single : A 49 LYS NZ :NH3+ 158:sc= 2.09 (180deg=1.16) USER MOD Single : A 54 MET CE :methyl 163:sc= -2.05 (180deg=-2.76!) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.203 USER MOD Single : A 57 SER OG : rot 85:sc= 0.683 USER MOD Single : A 59 ASN : amide:sc= 0.723 K(o=0.72,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0.165 USER MOD Single : A 64 TYR OH : rot 41:sc= 1.18 USER MOD Single : A 66 HIS : no HE2:sc= 0.371 K(o=0.37,f=-1.3) USER MOD Single : A 71 LYS NZ :NH3+ -166:sc= -0.938 (180deg=-1.06) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.86 X(o=-1.9,f=-1.8!) USER MOD Single : A 82 LYS NZ :NH3+ 152:sc= 1.16 (180deg=0.889) USER MOD Single : A 85 SER OG : rot 180:sc= -0.229 USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 103 MET CE :methyl 161:sc= -0.0905 (180deg=-0.514) USER MOD Single : B 104 SER OG : rot 180:sc= 0 USER MOD Single : B 105 HIS : no HD1:sc= -0.274 X(o=-0.27,f=-0.27) USER MOD Single : B 106 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 ASN : amide:sc= 0.768 K(o=0.77,f=-3.4!) USER MOD Single : B 109 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : B 110 THR OG1 : rot 180:sc= 0 USER MOD Single : B 112 GLN : amide:sc= -0.569 K(o=-0.57,f=-5.2!) USER MOD Single : B 117 SER OG : rot 71:sc= 1.31 USER MOD Single : B 121 SER OG : rot 92:sc= 1.99 USER MOD Single : B 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot -33:sc= 0.416 USER MOD Single : B 132 SER OG : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 139 CYS SG : rot 54:sc= 1.18 USER MOD Single : B 141 MET CE :methyl -112:sc= -0.238 (180deg=-1.32) USER MOD Single : B 143 SER OG : rot -82:sc= 0.346 USER MOD Single : B 147 SER OG : rot 22:sc= 1.16 USER MOD Single : B 150 MET CE :methyl 138:sc= -0.118 (180deg=-1.29) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.289 -7.666 -14.291 1.00 0.00 N ATOM 2 CA GLY A 1 18.759 -6.553 -13.512 1.00 0.00 C ATOM 3 C GLY A 1 19.724 -5.400 -13.474 1.00 0.00 C ATOM 4 O GLY A 1 20.846 -5.498 -13.984 1.00 0.00 O ATOM 0 H1 GLY A 1 18.660 -7.856 -15.097 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.238 -7.424 -14.641 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.347 -8.513 -13.691 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.813 -6.224 -13.942 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.548 -6.886 -12.496 1.00 0.00 H new ATOM 10 N VAL A 2 19.291 -4.311 -12.894 1.00 0.00 N ATOM 11 CA VAL A 2 20.091 -3.119 -12.763 1.00 0.00 C ATOM 12 C VAL A 2 20.599 -3.035 -11.361 1.00 0.00 C ATOM 13 O VAL A 2 19.833 -3.221 -10.391 1.00 0.00 O ATOM 14 CB VAL A 2 19.296 -1.845 -13.140 1.00 0.00 C ATOM 15 CG1 VAL A 2 20.135 -0.578 -12.976 1.00 0.00 C ATOM 16 CG2 VAL A 2 18.800 -1.967 -14.561 1.00 0.00 C ATOM 0 H VAL A 2 18.357 -4.225 -12.492 1.00 0.00 H new ATOM 0 HA VAL A 2 20.929 -3.179 -13.458 1.00 0.00 H new ATOM 0 HB VAL A 2 18.449 -1.759 -12.459 1.00 0.00 H new ATOM 0 HG11 VAL A 2 19.538 0.292 -13.251 1.00 0.00 H new ATOM 0 HG12 VAL A 2 20.455 -0.485 -11.938 1.00 0.00 H new ATOM 0 HG13 VAL A 2 21.011 -0.636 -13.622 1.00 0.00 H new ATOM 0 HG21 VAL A 2 18.240 -1.071 -14.829 1.00 0.00 H new ATOM 0 HG22 VAL A 2 19.650 -2.079 -15.235 1.00 0.00 H new ATOM 0 HG23 VAL A 2 18.152 -2.839 -14.647 1.00 0.00 H new ATOM 26 N ARG A 3 21.857 -2.754 -11.247 1.00 0.00 N ATOM 27 CA ARG A 3 22.525 -2.793 -10.001 1.00 0.00 C ATOM 28 C ARG A 3 22.357 -1.498 -9.256 1.00 0.00 C ATOM 29 O ARG A 3 22.910 -0.464 -9.634 1.00 0.00 O ATOM 30 CB ARG A 3 23.989 -3.107 -10.209 1.00 0.00 C ATOM 31 CG ARG A 3 24.588 -3.918 -9.104 1.00 0.00 C ATOM 32 CD ARG A 3 23.918 -5.269 -9.083 1.00 0.00 C ATOM 33 NE ARG A 3 24.453 -6.152 -8.063 1.00 0.00 N ATOM 34 CZ ARG A 3 23.909 -7.312 -7.714 1.00 0.00 C ATOM 35 NH1 ARG A 3 22.768 -7.714 -8.279 1.00 0.00 N ATOM 36 NH2 ARG A 3 24.494 -8.060 -6.793 1.00 0.00 N ATOM 0 H ARG A 3 22.451 -2.488 -12.032 1.00 0.00 H new ATOM 0 HA ARG A 3 22.080 -3.582 -9.395 1.00 0.00 H new ATOM 0 HB2 ARG A 3 24.107 -3.646 -11.149 1.00 0.00 H new ATOM 0 HB3 ARG A 3 24.543 -2.173 -10.305 1.00 0.00 H new ATOM 0 HG2 ARG A 3 25.662 -4.030 -9.256 1.00 0.00 H new ATOM 0 HG3 ARG A 3 24.452 -3.413 -8.147 1.00 0.00 H new ATOM 0 HD2 ARG A 3 22.849 -5.136 -8.916 1.00 0.00 H new ATOM 0 HD3 ARG A 3 24.032 -5.740 -10.059 1.00 0.00 H new ATOM 0 HE ARG A 3 25.304 -5.862 -7.582 1.00 0.00 H new ATOM 0 HH11 ARG A 3 22.313 -7.130 -8.980 1.00 0.00 H new ATOM 0 HH12 ARG A 3 22.352 -8.605 -8.010 1.00 0.00 H new ATOM 0 HH21 ARG A 3 25.359 -7.745 -6.354 1.00 0.00 H new ATOM 0 HH22 ARG A 3 24.080 -8.952 -6.522 1.00 0.00 H new ATOM 50 N LYS A 4 21.585 -1.559 -8.214 1.00 0.00 N ATOM 51 CA LYS A 4 21.327 -0.418 -7.395 1.00 0.00 C ATOM 52 C LYS A 4 21.781 -0.802 -5.999 1.00 0.00 C ATOM 53 O LYS A 4 21.276 -1.757 -5.436 1.00 0.00 O ATOM 54 CB LYS A 4 19.825 -0.123 -7.386 1.00 0.00 C ATOM 55 CG LYS A 4 19.117 -0.403 -8.702 1.00 0.00 C ATOM 56 CD LYS A 4 17.634 -0.163 -8.585 1.00 0.00 C ATOM 57 CE LYS A 4 16.891 -0.680 -9.793 1.00 0.00 C ATOM 58 NZ LYS A 4 16.970 -2.157 -9.905 1.00 0.00 N ATOM 0 H LYS A 4 21.113 -2.410 -7.907 1.00 0.00 H new ATOM 0 HA LYS A 4 21.845 0.469 -7.759 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.356 -0.718 -6.602 1.00 0.00 H new ATOM 0 HB3 LYS A 4 19.675 0.924 -7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 4 19.531 0.235 -9.483 1.00 0.00 H new ATOM 0 HG3 LYS A 4 19.298 -1.435 -9.003 1.00 0.00 H new ATOM 0 HD2 LYS A 4 17.255 -0.652 -7.687 1.00 0.00 H new ATOM 0 HD3 LYS A 4 17.445 0.904 -8.470 1.00 0.00 H new ATOM 0 HE2 LYS A 4 15.846 -0.377 -9.733 1.00 0.00 H new ATOM 0 HE3 LYS A 4 17.303 -0.226 -10.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 16.232 -2.496 -10.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 17.905 -2.428 -10.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 16.829 -2.584 -8.967 1.00 0.00 H new ATOM 72 N GLY A 5 22.711 -0.091 -5.444 1.00 0.00 N ATOM 73 CA GLY A 5 23.277 -0.500 -4.170 1.00 0.00 C ATOM 74 C GLY A 5 22.360 -0.301 -2.981 1.00 0.00 C ATOM 75 O GLY A 5 22.665 -0.754 -1.870 1.00 0.00 O ATOM 0 H GLY A 5 23.099 0.767 -5.836 1.00 0.00 H new ATOM 0 HA2 GLY A 5 23.550 -1.554 -4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 5 24.198 0.058 -4.000 1.00 0.00 H new ATOM 79 N TRP A 6 21.251 0.364 -3.197 1.00 0.00 N ATOM 80 CA TRP A 6 20.303 0.615 -2.140 1.00 0.00 C ATOM 81 C TRP A 6 19.480 -0.619 -1.785 1.00 0.00 C ATOM 82 O TRP A 6 18.897 -0.681 -0.696 1.00 0.00 O ATOM 83 CB TRP A 6 19.365 1.772 -2.496 1.00 0.00 C ATOM 84 CG TRP A 6 18.488 1.543 -3.691 1.00 0.00 C ATOM 85 CD1 TRP A 6 18.727 1.933 -4.962 1.00 0.00 C ATOM 86 CD2 TRP A 6 17.211 0.882 -3.716 1.00 0.00 C ATOM 87 NE1 TRP A 6 17.683 1.575 -5.766 1.00 0.00 N ATOM 88 CE2 TRP A 6 16.753 0.919 -5.030 1.00 0.00 C ATOM 89 CE3 TRP A 6 16.420 0.262 -2.750 1.00 0.00 C ATOM 90 CZ2 TRP A 6 15.548 0.370 -5.409 1.00 0.00 C ATOM 91 CZ3 TRP A 6 15.221 -0.286 -3.130 1.00 0.00 C ATOM 92 CH2 TRP A 6 14.796 -0.229 -4.446 1.00 0.00 C ATOM 0 H TRP A 6 20.982 0.744 -4.104 1.00 0.00 H new ATOM 0 HA TRP A 6 20.894 0.887 -1.265 1.00 0.00 H new ATOM 0 HB2 TRP A 6 18.730 1.981 -1.635 1.00 0.00 H new ATOM 0 HB3 TRP A 6 19.966 2.664 -2.673 1.00 0.00 H new ATOM 0 HD1 TRP A 6 19.614 2.452 -5.294 1.00 0.00 H new ATOM 0 HE1 TRP A 6 17.614 1.771 -6.765 1.00 0.00 H new ATOM 0 HE3 TRP A 6 16.745 0.214 -1.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 15.212 0.413 -6.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 14.599 -0.769 -2.391 1.00 0.00 H new ATOM 0 HH2 TRP A 6 13.847 -0.669 -4.714 1.00 0.00 H new ATOM 103 N HIS A 7 19.425 -1.623 -2.673 1.00 0.00 N ATOM 104 CA HIS A 7 18.553 -2.766 -2.404 1.00 0.00 C ATOM 105 C HIS A 7 19.031 -3.698 -1.305 1.00 0.00 C ATOM 106 O HIS A 7 18.355 -4.654 -0.952 1.00 0.00 O ATOM 107 CB HIS A 7 17.977 -3.505 -3.652 1.00 0.00 C ATOM 108 CG HIS A 7 18.917 -4.005 -4.722 1.00 0.00 C ATOM 109 ND1 HIS A 7 19.784 -5.082 -4.591 1.00 0.00 N ATOM 110 CD2 HIS A 7 19.043 -3.587 -6.007 1.00 0.00 C ATOM 111 CE1 HIS A 7 20.383 -5.268 -5.780 1.00 0.00 C ATOM 112 NE2 HIS A 7 19.967 -4.385 -6.671 1.00 0.00 N ATOM 0 H HIS A 7 19.951 -1.666 -3.546 1.00 0.00 H new ATOM 0 HA HIS A 7 17.677 -2.271 -1.984 1.00 0.00 H new ATOM 0 HB2 HIS A 7 17.409 -4.362 -3.290 1.00 0.00 H new ATOM 0 HB3 HIS A 7 17.267 -2.831 -4.131 1.00 0.00 H new ATOM 0 HD2 HIS A 7 18.506 -2.759 -6.447 1.00 0.00 H new ATOM 0 HE1 HIS A 7 21.111 -6.040 -5.981 1.00 0.00 H new ATOM 0 HE2 HIS A 7 20.263 -4.306 -7.644 1.00 0.00 H new ATOM 120 N GLU A 8 20.170 -3.382 -0.731 1.00 0.00 N ATOM 121 CA GLU A 8 20.658 -4.101 0.424 1.00 0.00 C ATOM 122 C GLU A 8 20.152 -3.429 1.710 1.00 0.00 C ATOM 123 O GLU A 8 20.351 -3.930 2.804 1.00 0.00 O ATOM 124 CB GLU A 8 22.177 -4.135 0.434 1.00 0.00 C ATOM 125 CG GLU A 8 22.794 -4.820 -0.765 1.00 0.00 C ATOM 126 CD GLU A 8 24.289 -4.888 -0.657 1.00 0.00 C ATOM 127 OE1 GLU A 8 24.805 -5.799 0.019 1.00 0.00 O ATOM 128 OE2 GLU A 8 24.982 -4.033 -1.240 1.00 0.00 O ATOM 0 H GLU A 8 20.779 -2.627 -1.048 1.00 0.00 H new ATOM 0 HA GLU A 8 20.285 -5.124 0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 8 22.551 -3.112 0.485 1.00 0.00 H new ATOM 0 HB3 GLU A 8 22.511 -4.642 1.339 1.00 0.00 H new ATOM 0 HG2 GLU A 8 22.390 -5.828 -0.856 1.00 0.00 H new ATOM 0 HG3 GLU A 8 22.519 -4.283 -1.673 1.00 0.00 H new ATOM 135 N HIS A 9 19.500 -2.285 1.565 1.00 0.00 N ATOM 136 CA HIS A 9 19.031 -1.513 2.724 1.00 0.00 C ATOM 137 C HIS A 9 17.531 -1.602 2.899 1.00 0.00 C ATOM 138 O HIS A 9 16.933 -0.863 3.691 1.00 0.00 O ATOM 139 CB HIS A 9 19.459 -0.047 2.616 1.00 0.00 C ATOM 140 CG HIS A 9 20.936 0.159 2.760 1.00 0.00 C ATOM 141 ND1 HIS A 9 21.550 0.538 3.935 1.00 0.00 N ATOM 142 CD2 HIS A 9 21.932 0.018 1.846 1.00 0.00 C ATOM 143 CE1 HIS A 9 22.862 0.610 3.710 1.00 0.00 C ATOM 144 NE2 HIS A 9 23.152 0.303 2.452 1.00 0.00 N ATOM 0 H HIS A 9 19.280 -1.865 0.662 1.00 0.00 H new ATOM 0 HA HIS A 9 19.496 -1.955 3.605 1.00 0.00 H new ATOM 0 HB2 HIS A 9 19.138 0.346 1.651 1.00 0.00 H new ATOM 0 HB3 HIS A 9 18.944 0.531 3.383 1.00 0.00 H new ATOM 0 HD2 HIS A 9 21.798 -0.269 0.814 1.00 0.00 H new ATOM 0 HE1 HIS A 9 23.594 0.883 4.455 1.00 0.00 H new ATOM 0 HE2 HIS A 9 24.076 0.281 2.020 1.00 0.00 H new ATOM 152 N VAL A 10 16.931 -2.500 2.192 1.00 0.00 N ATOM 153 CA VAL A 10 15.511 -2.688 2.265 1.00 0.00 C ATOM 154 C VAL A 10 15.204 -4.163 2.503 1.00 0.00 C ATOM 155 O VAL A 10 15.437 -5.030 1.650 1.00 0.00 O ATOM 156 CB VAL A 10 14.812 -2.109 0.997 1.00 0.00 C ATOM 157 CG1 VAL A 10 15.387 -2.656 -0.291 1.00 0.00 C ATOM 158 CG2 VAL A 10 13.303 -2.257 1.051 1.00 0.00 C ATOM 0 H VAL A 10 17.407 -3.128 1.545 1.00 0.00 H new ATOM 0 HA VAL A 10 15.104 -2.133 3.110 1.00 0.00 H new ATOM 0 HB VAL A 10 15.026 -1.040 1.000 1.00 0.00 H new ATOM 0 HG11 VAL A 10 14.861 -2.217 -1.139 1.00 0.00 H new ATOM 0 HG12 VAL A 10 16.446 -2.406 -0.352 1.00 0.00 H new ATOM 0 HG13 VAL A 10 15.268 -3.739 -0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.864 -1.839 0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 10 13.043 -3.313 1.126 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.916 -1.726 1.921 1.00 0.00 H new ATOM 168 N THR A 11 14.735 -4.429 3.687 1.00 0.00 N ATOM 169 CA THR A 11 14.470 -5.758 4.166 1.00 0.00 C ATOM 170 C THR A 11 13.212 -6.332 3.511 1.00 0.00 C ATOM 171 O THR A 11 12.278 -5.576 3.176 1.00 0.00 O ATOM 172 CB THR A 11 14.233 -5.668 5.677 1.00 0.00 C ATOM 173 OG1 THR A 11 15.208 -4.788 6.254 1.00 0.00 O ATOM 174 CG2 THR A 11 14.345 -7.027 6.330 1.00 0.00 C ATOM 0 H THR A 11 14.518 -3.703 4.370 1.00 0.00 H new ATOM 0 HA THR A 11 15.314 -6.405 3.927 1.00 0.00 H new ATOM 0 HB THR A 11 13.226 -5.286 5.846 1.00 0.00 H new ATOM 0 HG1 THR A 11 15.060 -4.725 7.221 1.00 0.00 H new ATOM 0 HG21 THR A 11 14.172 -6.931 7.402 1.00 0.00 H new ATOM 0 HG22 THR A 11 13.602 -7.699 5.901 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.342 -7.432 6.158 1.00 0.00 H new ATOM 182 N GLN A 12 13.171 -7.658 3.367 1.00 0.00 N ATOM 183 CA GLN A 12 12.012 -8.344 2.821 1.00 0.00 C ATOM 184 C GLN A 12 10.793 -8.079 3.705 1.00 0.00 C ATOM 185 O GLN A 12 9.702 -7.854 3.211 1.00 0.00 O ATOM 186 CB GLN A 12 12.293 -9.860 2.622 1.00 0.00 C ATOM 187 CG GLN A 12 11.092 -10.686 2.133 1.00 0.00 C ATOM 188 CD GLN A 12 10.414 -11.543 3.221 1.00 0.00 C ATOM 189 OE1 GLN A 12 10.539 -11.168 4.471 1.00 0.00 O flip ATOM 190 NE2 GLN A 12 9.826 -12.587 2.922 1.00 0.00 N flip ATOM 0 H GLN A 12 13.938 -8.278 3.626 1.00 0.00 H new ATOM 0 HA GLN A 12 11.795 -7.948 1.829 1.00 0.00 H new ATOM 0 HB2 GLN A 12 13.107 -9.972 1.906 1.00 0.00 H new ATOM 0 HB3 GLN A 12 12.640 -10.277 3.567 1.00 0.00 H new ATOM 0 HG2 GLN A 12 10.351 -10.009 1.709 1.00 0.00 H new ATOM 0 HG3 GLN A 12 11.423 -11.341 1.327 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.739 -12.861 1.943 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.427 -13.175 3.654 1.00 0.00 H new ATOM 199 N ASP A 13 11.011 -8.048 5.015 1.00 0.00 N ATOM 200 CA ASP A 13 9.937 -7.730 5.974 1.00 0.00 C ATOM 201 C ASP A 13 9.384 -6.344 5.749 1.00 0.00 C ATOM 202 O ASP A 13 8.194 -6.153 5.805 1.00 0.00 O ATOM 203 CB ASP A 13 10.391 -7.823 7.438 1.00 0.00 C ATOM 204 CG ASP A 13 10.633 -9.219 7.918 1.00 0.00 C ATOM 205 OD1 ASP A 13 9.660 -9.945 8.191 1.00 0.00 O ATOM 206 OD2 ASP A 13 11.801 -9.607 8.063 1.00 0.00 O ATOM 0 H ASP A 13 11.916 -8.237 5.445 1.00 0.00 H new ATOM 0 HA ASP A 13 9.168 -8.481 5.794 1.00 0.00 H new ATOM 0 HB2 ASP A 13 11.307 -7.245 7.560 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.635 -7.359 8.071 1.00 0.00 H new ATOM 211 N LEU A 14 10.257 -5.409 5.400 1.00 0.00 N ATOM 212 CA LEU A 14 9.884 -3.997 5.297 1.00 0.00 C ATOM 213 C LEU A 14 9.044 -3.803 4.052 1.00 0.00 C ATOM 214 O LEU A 14 7.975 -3.196 4.085 1.00 0.00 O ATOM 215 CB LEU A 14 11.190 -3.121 5.307 1.00 0.00 C ATOM 216 CG LEU A 14 11.098 -1.555 5.264 1.00 0.00 C ATOM 217 CD1 LEU A 14 10.792 -1.025 3.899 1.00 0.00 C ATOM 218 CD2 LEU A 14 10.073 -1.016 6.223 1.00 0.00 C ATOM 0 H LEU A 14 11.235 -5.600 5.181 1.00 0.00 H new ATOM 0 HA LEU A 14 9.279 -3.679 6.146 1.00 0.00 H new ATOM 0 HB2 LEU A 14 11.749 -3.386 6.205 1.00 0.00 H new ATOM 0 HB3 LEU A 14 11.792 -3.432 4.453 1.00 0.00 H new ATOM 0 HG LEU A 14 12.090 -1.213 5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 14 10.741 0.063 3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.576 -1.330 3.206 1.00 0.00 H new ATOM 0 HD13 LEU A 14 9.835 -1.422 3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 14 10.048 0.072 6.155 1.00 0.00 H new ATOM 0 HD22 LEU A 14 9.092 -1.418 5.971 1.00 0.00 H new ATOM 0 HD23 LEU A 14 10.335 -1.310 7.239 1.00 0.00 H new ATOM 230 N ARG A 15 9.497 -4.385 2.979 1.00 0.00 N ATOM 231 CA ARG A 15 8.809 -4.281 1.721 1.00 0.00 C ATOM 232 C ARG A 15 7.504 -5.057 1.715 1.00 0.00 C ATOM 233 O ARG A 15 6.485 -4.540 1.289 1.00 0.00 O ATOM 234 CB ARG A 15 9.711 -4.692 0.592 1.00 0.00 C ATOM 235 CG ARG A 15 10.303 -6.053 0.703 1.00 0.00 C ATOM 236 CD ARG A 15 11.381 -6.215 -0.306 1.00 0.00 C ATOM 237 NE ARG A 15 10.878 -5.946 -1.667 1.00 0.00 N ATOM 238 CZ ARG A 15 11.335 -6.479 -2.791 1.00 0.00 C ATOM 239 NH1 ARG A 15 12.404 -7.272 -2.776 1.00 0.00 N ATOM 240 NH2 ARG A 15 10.719 -6.205 -3.929 1.00 0.00 N ATOM 0 H ARG A 15 10.350 -4.943 2.949 1.00 0.00 H new ATOM 0 HA ARG A 15 8.541 -3.235 1.575 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.147 -4.636 -0.339 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.522 -3.968 0.517 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.704 -6.205 1.705 1.00 0.00 H new ATOM 0 HG3 ARG A 15 9.532 -6.809 0.550 1.00 0.00 H new ATOM 0 HD2 ARG A 15 12.203 -5.536 -0.078 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.781 -7.228 -0.256 1.00 0.00 H new ATOM 0 HE ARG A 15 10.104 -5.287 -1.751 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.877 -7.473 -1.895 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.750 -7.678 -3.645 1.00 0.00 H new ATOM 0 HH21 ARG A 15 9.904 -5.591 -3.933 1.00 0.00 H new ATOM 0 HH22 ARG A 15 11.059 -6.607 -4.803 1.00 0.00 H new ATOM 254 N SER A 16 7.521 -6.274 2.257 1.00 0.00 N ATOM 255 CA SER A 16 6.331 -7.101 2.324 1.00 0.00 C ATOM 256 C SER A 16 5.307 -6.441 3.257 1.00 0.00 C ATOM 257 O SER A 16 4.089 -6.592 3.085 1.00 0.00 O ATOM 258 CB SER A 16 6.701 -8.522 2.791 1.00 0.00 C ATOM 259 OG SER A 16 5.575 -9.390 2.834 1.00 0.00 O ATOM 0 H SER A 16 8.354 -6.705 2.657 1.00 0.00 H new ATOM 0 HA SER A 16 5.882 -7.190 1.335 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.451 -8.938 2.119 1.00 0.00 H new ATOM 0 HB3 SER A 16 7.154 -8.470 3.781 1.00 0.00 H new ATOM 0 HG SER A 16 5.858 -10.279 3.134 1.00 0.00 H new ATOM 265 N HIS A 17 5.816 -5.679 4.213 1.00 0.00 N ATOM 266 CA HIS A 17 4.996 -4.919 5.123 1.00 0.00 C ATOM 267 C HIS A 17 4.242 -3.856 4.333 1.00 0.00 C ATOM 268 O HIS A 17 3.028 -3.714 4.471 1.00 0.00 O ATOM 269 CB HIS A 17 5.877 -4.262 6.195 1.00 0.00 C ATOM 270 CG HIS A 17 5.129 -3.599 7.288 1.00 0.00 C ATOM 271 ND1 HIS A 17 4.819 -4.205 8.472 1.00 0.00 N ATOM 272 CD2 HIS A 17 4.623 -2.359 7.357 1.00 0.00 C ATOM 273 CE1 HIS A 17 4.148 -3.341 9.212 1.00 0.00 C ATOM 274 NE2 HIS A 17 3.998 -2.194 8.576 1.00 0.00 N ATOM 0 H HIS A 17 6.818 -5.575 4.374 1.00 0.00 H new ATOM 0 HA HIS A 17 4.283 -5.577 5.620 1.00 0.00 H new ATOM 0 HB2 HIS A 17 6.528 -5.022 6.627 1.00 0.00 H new ATOM 0 HB3 HIS A 17 6.522 -3.526 5.715 1.00 0.00 H new ATOM 0 HD1 HIS A 17 5.063 -5.159 8.738 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.693 -1.610 6.583 1.00 0.00 H new ATOM 0 HE1 HIS A 17 3.773 -3.545 10.204 1.00 0.00 H new ATOM 282 N LEU A 18 4.967 -3.131 3.487 1.00 0.00 N ATOM 283 CA LEU A 18 4.357 -2.112 2.624 1.00 0.00 C ATOM 284 C LEU A 18 3.334 -2.760 1.705 1.00 0.00 C ATOM 285 O LEU A 18 2.263 -2.210 1.480 1.00 0.00 O ATOM 286 CB LEU A 18 5.417 -1.335 1.804 1.00 0.00 C ATOM 287 CG LEU A 18 6.307 -0.280 2.537 1.00 0.00 C ATOM 288 CD1 LEU A 18 6.157 -0.332 4.040 1.00 0.00 C ATOM 289 CD2 LEU A 18 7.750 -0.514 2.192 1.00 0.00 C ATOM 0 H LEU A 18 5.977 -3.226 3.377 1.00 0.00 H new ATOM 0 HA LEU A 18 3.856 -1.386 3.265 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.082 -2.067 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.898 -0.824 0.993 1.00 0.00 H new ATOM 0 HG LEU A 18 5.975 0.703 2.201 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.798 0.422 4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.119 -0.137 4.309 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.446 -1.319 4.401 1.00 0.00 H new ATOM 0 HD21 LEU A 18 8.370 0.222 2.703 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.042 -1.516 2.507 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.887 -0.418 1.115 1.00 0.00 H new ATOM 301 N VAL A 19 3.664 -3.952 1.223 1.00 0.00 N ATOM 302 CA VAL A 19 2.762 -4.762 0.399 1.00 0.00 C ATOM 303 C VAL A 19 1.450 -5.030 1.157 1.00 0.00 C ATOM 304 O VAL A 19 0.359 -4.843 0.618 1.00 0.00 O ATOM 305 CB VAL A 19 3.421 -6.124 0.012 1.00 0.00 C ATOM 306 CG1 VAL A 19 2.482 -6.996 -0.766 1.00 0.00 C ATOM 307 CG2 VAL A 19 4.669 -5.913 -0.794 1.00 0.00 C ATOM 0 H VAL A 19 4.569 -4.390 1.391 1.00 0.00 H new ATOM 0 HA VAL A 19 2.553 -4.204 -0.514 1.00 0.00 H new ATOM 0 HB VAL A 19 3.672 -6.623 0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.979 -7.934 -1.016 1.00 0.00 H new ATOM 0 HG12 VAL A 19 1.596 -7.203 -0.166 1.00 0.00 H new ATOM 0 HG13 VAL A 19 2.187 -6.486 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.105 -6.879 -1.049 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.424 -5.373 -1.709 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.385 -5.334 -0.211 1.00 0.00 H new ATOM 317 N HIS A 20 1.575 -5.438 2.413 1.00 0.00 N ATOM 318 CA HIS A 20 0.416 -5.701 3.252 1.00 0.00 C ATOM 319 C HIS A 20 -0.402 -4.422 3.467 1.00 0.00 C ATOM 320 O HIS A 20 -1.618 -4.464 3.448 1.00 0.00 O ATOM 321 CB HIS A 20 0.822 -6.372 4.587 1.00 0.00 C ATOM 322 CG HIS A 20 -0.319 -6.603 5.560 1.00 0.00 C ATOM 323 ND1 HIS A 20 -0.267 -6.234 6.876 1.00 0.00 N ATOM 324 CD2 HIS A 20 -1.546 -7.165 5.383 1.00 0.00 C ATOM 325 CE1 HIS A 20 -1.419 -6.549 7.454 1.00 0.00 C ATOM 326 NE2 HIS A 20 -2.243 -7.125 6.592 1.00 0.00 N ATOM 0 H HIS A 20 2.472 -5.594 2.874 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.226 -6.412 2.732 1.00 0.00 H new ATOM 0 HB2 HIS A 20 1.292 -7.331 4.367 1.00 0.00 H new ATOM 0 HB3 HIS A 20 1.575 -5.752 5.074 1.00 0.00 H new ATOM 0 HD1 HIS A 20 0.527 -5.790 7.337 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -1.920 -7.576 4.457 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -1.654 -6.360 8.491 1.00 0.00 H new ATOM 334 N LYS A 21 0.258 -3.284 3.634 1.00 0.00 N ATOM 335 CA LYS A 21 -0.493 -2.038 3.749 1.00 0.00 C ATOM 336 C LYS A 21 -1.153 -1.664 2.439 1.00 0.00 C ATOM 337 O LYS A 21 -2.247 -1.112 2.442 1.00 0.00 O ATOM 338 CB LYS A 21 0.293 -0.847 4.296 1.00 0.00 C ATOM 339 CG LYS A 21 0.466 -0.776 5.816 1.00 0.00 C ATOM 340 CD LYS A 21 1.583 -1.668 6.344 1.00 0.00 C ATOM 341 CE LYS A 21 1.098 -3.000 6.916 1.00 0.00 C ATOM 342 NZ LYS A 21 0.348 -2.832 8.181 1.00 0.00 N ATOM 0 H LYS A 21 1.272 -3.195 3.691 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.252 -2.259 4.499 1.00 0.00 H new ATOM 0 HB2 LYS A 21 1.283 -0.855 3.841 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.201 0.067 3.967 1.00 0.00 H new ATOM 0 HG2 LYS A 21 0.670 0.256 6.103 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.472 -1.060 6.294 1.00 0.00 H new ATOM 0 HD2 LYS A 21 2.288 -1.866 5.537 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.129 -1.129 7.118 1.00 0.00 H new ATOM 0 HE2 LYS A 21 0.462 -3.497 6.183 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.955 -3.652 7.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 0.276 -3.749 8.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 0.847 -2.155 8.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.606 -2.474 7.974 1.00 0.00 H new ATOM 356 N LEU A 22 -0.481 -1.952 1.314 1.00 0.00 N ATOM 357 CA LEU A 22 -1.065 -1.734 -0.015 1.00 0.00 C ATOM 358 C LEU A 22 -2.368 -2.496 -0.109 1.00 0.00 C ATOM 359 O LEU A 22 -3.364 -1.978 -0.597 1.00 0.00 O ATOM 360 CB LEU A 22 -0.099 -2.162 -1.136 1.00 0.00 C ATOM 361 CG LEU A 22 1.151 -1.295 -1.342 1.00 0.00 C ATOM 362 CD1 LEU A 22 2.092 -1.946 -2.340 1.00 0.00 C ATOM 363 CD2 LEU A 22 0.755 0.061 -1.867 1.00 0.00 C ATOM 0 H LEU A 22 0.464 -2.335 1.299 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.252 -0.668 -0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 22 0.225 -3.183 -0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -0.655 -2.184 -2.073 1.00 0.00 H new ATOM 0 HG LEU A 22 1.655 -1.192 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.972 -1.317 -2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 22 2.397 -2.924 -1.968 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.583 -2.065 -3.296 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.647 0.670 -2.011 1.00 0.00 H new ATOM 0 HD22 LEU A 22 0.237 -0.054 -2.819 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.094 0.549 -1.151 1.00 0.00 H new ATOM 375 N VAL A 23 -2.340 -3.715 0.407 1.00 0.00 N ATOM 376 CA VAL A 23 -3.514 -4.549 0.547 1.00 0.00 C ATOM 377 C VAL A 23 -4.581 -3.849 1.419 1.00 0.00 C ATOM 378 O VAL A 23 -5.718 -3.740 1.022 1.00 0.00 O ATOM 379 CB VAL A 23 -3.138 -5.900 1.202 1.00 0.00 C ATOM 380 CG1 VAL A 23 -4.367 -6.618 1.700 1.00 0.00 C ATOM 381 CG2 VAL A 23 -2.380 -6.777 0.218 1.00 0.00 C ATOM 0 H VAL A 23 -1.484 -4.156 0.745 1.00 0.00 H new ATOM 0 HA VAL A 23 -3.921 -4.724 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.493 -5.692 2.056 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -4.076 -7.564 2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.875 -6.000 2.440 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.040 -6.810 0.864 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.124 -7.723 0.696 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.005 -6.969 -0.654 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.467 -6.269 -0.094 1.00 0.00 H new ATOM 391 N GLN A 24 -4.182 -3.357 2.592 1.00 0.00 N ATOM 392 CA GLN A 24 -5.127 -2.722 3.531 1.00 0.00 C ATOM 393 C GLN A 24 -5.767 -1.469 2.927 1.00 0.00 C ATOM 394 O GLN A 24 -6.890 -1.108 3.269 1.00 0.00 O ATOM 395 CB GLN A 24 -4.449 -2.353 4.860 1.00 0.00 C ATOM 396 CG GLN A 24 -3.681 -3.487 5.510 1.00 0.00 C ATOM 397 CD GLN A 24 -3.169 -3.141 6.887 1.00 0.00 C ATOM 398 OE1 GLN A 24 -2.083 -2.596 7.038 1.00 0.00 O ATOM 399 NE2 GLN A 24 -3.915 -3.487 7.902 1.00 0.00 N ATOM 0 H GLN A 24 -3.217 -3.382 2.920 1.00 0.00 H new ATOM 0 HA GLN A 24 -5.906 -3.459 3.726 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -3.766 -1.521 4.686 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.210 -2.001 5.556 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -4.326 -4.363 5.578 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -2.839 -3.760 4.874 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -4.815 -3.940 7.743 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -3.597 -3.305 8.854 1.00 0.00 H new ATOM 408 N ALA A 25 -5.036 -0.795 2.062 1.00 0.00 N ATOM 409 CA ALA A 25 -5.542 0.380 1.405 1.00 0.00 C ATOM 410 C ALA A 25 -6.440 0.034 0.229 1.00 0.00 C ATOM 411 O ALA A 25 -7.480 0.641 0.060 1.00 0.00 O ATOM 412 CB ALA A 25 -4.408 1.233 0.951 1.00 0.00 C ATOM 0 H ALA A 25 -4.083 -1.048 1.800 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.148 0.928 2.127 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -4.797 2.122 0.454 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -3.810 1.531 1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -3.786 0.671 0.254 1.00 0.00 H new ATOM 418 N ILE A 26 -6.037 -0.940 -0.586 1.00 0.00 N ATOM 419 CA ILE A 26 -6.843 -1.328 -1.751 1.00 0.00 C ATOM 420 C ILE A 26 -8.105 -2.041 -1.285 1.00 0.00 C ATOM 421 O ILE A 26 -9.182 -1.924 -1.883 1.00 0.00 O ATOM 422 CB ILE A 26 -6.061 -2.266 -2.754 1.00 0.00 C ATOM 423 CG1 ILE A 26 -6.930 -2.576 -3.955 1.00 0.00 C ATOM 424 CG2 ILE A 26 -5.623 -3.568 -2.111 1.00 0.00 C ATOM 425 CD1 ILE A 26 -6.391 -3.667 -4.854 1.00 0.00 C ATOM 0 H ILE A 26 -5.173 -1.469 -0.468 1.00 0.00 H new ATOM 0 HA ILE A 26 -7.090 -0.411 -2.285 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.165 -1.726 -3.059 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -7.921 -2.867 -3.606 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -7.054 -1.666 -4.543 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.091 -4.175 -2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.964 -3.355 -1.269 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -6.499 -4.112 -1.757 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -7.076 -3.823 -5.687 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -5.414 -3.373 -5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.294 -4.592 -4.286 1.00 0.00 H new ATOM 437 N PHE A 27 -7.960 -2.742 -0.207 1.00 0.00 N ATOM 438 CA PHE A 27 -8.984 -3.528 0.353 1.00 0.00 C ATOM 439 C PHE A 27 -9.192 -3.132 1.804 1.00 0.00 C ATOM 440 O PHE A 27 -8.518 -3.658 2.705 1.00 0.00 O ATOM 441 CB PHE A 27 -8.572 -4.994 0.241 1.00 0.00 C ATOM 442 CG PHE A 27 -9.530 -6.017 0.770 1.00 0.00 C ATOM 443 CD1 PHE A 27 -10.714 -6.271 0.129 1.00 0.00 C ATOM 444 CD2 PHE A 27 -9.221 -6.739 1.908 1.00 0.00 C ATOM 445 CE1 PHE A 27 -11.584 -7.221 0.612 1.00 0.00 C ATOM 446 CE2 PHE A 27 -10.086 -7.693 2.390 1.00 0.00 C ATOM 447 CZ PHE A 27 -11.272 -7.931 1.742 1.00 0.00 C ATOM 0 H PHE A 27 -7.087 -2.776 0.319 1.00 0.00 H new ATOM 0 HA PHE A 27 -9.924 -3.374 -0.176 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.390 -5.214 -0.811 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -7.623 -5.119 0.762 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -10.967 -5.720 -0.765 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -8.291 -6.552 2.424 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -12.516 -7.408 0.099 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -9.832 -8.254 3.277 1.00 0.00 H new ATOM 0 HZ PHE A 27 -11.957 -8.675 2.121 1.00 0.00 H new ATOM 457 N PRO A 28 -10.005 -2.091 2.047 1.00 0.00 N ATOM 458 CA PRO A 28 -10.483 -1.748 3.384 1.00 0.00 C ATOM 459 C PRO A 28 -11.268 -2.937 3.948 1.00 0.00 C ATOM 460 O PRO A 28 -12.492 -3.033 3.791 1.00 0.00 O ATOM 461 CB PRO A 28 -11.429 -0.564 3.113 1.00 0.00 C ATOM 462 CG PRO A 28 -11.734 -0.698 1.663 1.00 0.00 C ATOM 463 CD PRO A 28 -10.468 -1.112 1.062 1.00 0.00 C ATOM 0 HA PRO A 28 -9.694 -1.510 4.098 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.332 -0.622 3.721 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.954 0.391 3.338 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.517 -1.436 1.488 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -12.084 0.244 1.242 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.604 -1.552 0.074 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.773 -0.280 0.948 1.00 0.00 H new ATOM 471 N THR A 29 -10.548 -3.844 4.534 1.00 0.00 N ATOM 472 CA THR A 29 -11.070 -5.102 4.950 1.00 0.00 C ATOM 473 C THR A 29 -12.154 -5.007 6.040 1.00 0.00 C ATOM 474 O THR A 29 -12.097 -4.146 6.935 1.00 0.00 O ATOM 475 CB THR A 29 -9.926 -6.072 5.362 1.00 0.00 C ATOM 476 OG1 THR A 29 -10.452 -7.372 5.562 1.00 0.00 O ATOM 477 CG2 THR A 29 -9.205 -5.616 6.623 1.00 0.00 C ATOM 0 H THR A 29 -9.556 -3.723 4.740 1.00 0.00 H new ATOM 0 HA THR A 29 -11.580 -5.513 4.079 1.00 0.00 H new ATOM 0 HB THR A 29 -9.197 -6.078 4.551 1.00 0.00 H new ATOM 0 HG1 THR A 29 -10.237 -7.676 6.469 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.416 -6.327 6.868 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.768 -4.632 6.456 1.00 0.00 H new ATOM 0 HG23 THR A 29 -9.915 -5.563 7.449 1.00 0.00 H new ATOM 485 N PRO A 30 -13.193 -5.853 5.924 1.00 0.00 N ATOM 486 CA PRO A 30 -14.236 -5.969 6.933 1.00 0.00 C ATOM 487 C PRO A 30 -13.796 -6.872 8.099 1.00 0.00 C ATOM 488 O PRO A 30 -14.336 -6.788 9.204 1.00 0.00 O ATOM 489 CB PRO A 30 -15.372 -6.650 6.161 1.00 0.00 C ATOM 490 CG PRO A 30 -14.663 -7.518 5.179 1.00 0.00 C ATOM 491 CD PRO A 30 -13.464 -6.730 4.749 1.00 0.00 C ATOM 0 HA PRO A 30 -14.500 -5.009 7.376 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -16.012 -7.234 6.823 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -16.011 -5.921 5.663 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -14.370 -8.465 5.631 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -15.303 -7.755 4.329 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -12.616 -7.377 4.526 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -13.666 -6.148 3.850 1.00 0.00 H new ATOM 499 N ASP A 31 -12.811 -7.719 7.845 1.00 0.00 N ATOM 500 CA ASP A 31 -12.355 -8.706 8.820 1.00 0.00 C ATOM 501 C ASP A 31 -10.914 -9.024 8.523 1.00 0.00 C ATOM 502 O ASP A 31 -10.567 -9.210 7.366 1.00 0.00 O ATOM 503 CB ASP A 31 -13.146 -10.007 8.631 1.00 0.00 C ATOM 504 CG ASP A 31 -12.962 -11.040 9.733 1.00 0.00 C ATOM 505 OD1 ASP A 31 -11.825 -11.415 10.036 1.00 0.00 O ATOM 506 OD2 ASP A 31 -13.984 -11.548 10.252 1.00 0.00 O ATOM 0 H ASP A 31 -12.304 -7.744 6.960 1.00 0.00 H new ATOM 0 HA ASP A 31 -12.487 -8.315 9.829 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -14.206 -9.762 8.557 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -12.855 -10.456 7.681 1.00 0.00 H new ATOM 511 N PRO A 32 -10.048 -9.086 9.519 1.00 0.00 N ATOM 512 CA PRO A 32 -8.646 -9.490 9.330 1.00 0.00 C ATOM 513 C PRO A 32 -8.478 -10.858 8.603 1.00 0.00 C ATOM 514 O PRO A 32 -7.453 -11.112 7.962 1.00 0.00 O ATOM 515 CB PRO A 32 -8.102 -9.599 10.747 1.00 0.00 C ATOM 516 CG PRO A 32 -9.290 -9.504 11.653 1.00 0.00 C ATOM 517 CD PRO A 32 -10.317 -8.722 10.917 1.00 0.00 C ATOM 0 HA PRO A 32 -8.126 -8.770 8.698 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -7.576 -10.542 10.891 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -7.389 -8.801 10.954 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -9.665 -10.495 11.907 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -9.026 -9.013 12.590 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -11.328 -8.993 11.220 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -10.210 -7.650 11.086 1.00 0.00 H new ATOM 525 N ALA A 33 -9.485 -11.712 8.675 1.00 0.00 N ATOM 526 CA ALA A 33 -9.423 -13.013 8.034 1.00 0.00 C ATOM 527 C ALA A 33 -9.675 -12.914 6.531 1.00 0.00 C ATOM 528 O ALA A 33 -9.377 -13.841 5.772 1.00 0.00 O ATOM 529 CB ALA A 33 -10.387 -13.985 8.678 1.00 0.00 C ATOM 0 H ALA A 33 -10.356 -11.527 9.172 1.00 0.00 H new ATOM 0 HA ALA A 33 -8.412 -13.394 8.174 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -10.319 -14.951 8.177 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -10.134 -14.104 9.732 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -11.404 -13.602 8.590 1.00 0.00 H new ATOM 535 N ALA A 34 -10.192 -11.789 6.083 1.00 0.00 N ATOM 536 CA ALA A 34 -10.409 -11.589 4.658 1.00 0.00 C ATOM 537 C ALA A 34 -9.073 -11.303 3.974 1.00 0.00 C ATOM 538 O ALA A 34 -8.941 -11.366 2.756 1.00 0.00 O ATOM 539 CB ALA A 34 -11.394 -10.461 4.424 1.00 0.00 C ATOM 0 H ALA A 34 -10.468 -11.005 6.674 1.00 0.00 H new ATOM 0 HA ALA A 34 -10.835 -12.495 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -11.544 -10.325 3.353 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.346 -10.705 4.896 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -11.001 -9.540 4.855 1.00 0.00 H new ATOM 545 N LEU A 35 -8.067 -11.070 4.793 1.00 0.00 N ATOM 546 CA LEU A 35 -6.729 -10.766 4.336 1.00 0.00 C ATOM 547 C LEU A 35 -5.957 -12.051 4.063 1.00 0.00 C ATOM 548 O LEU A 35 -4.773 -12.017 3.756 1.00 0.00 O ATOM 549 CB LEU A 35 -5.996 -9.990 5.399 1.00 0.00 C ATOM 550 CG LEU A 35 -6.683 -8.732 5.909 1.00 0.00 C ATOM 551 CD1 LEU A 35 -6.013 -8.253 7.172 1.00 0.00 C ATOM 552 CD2 LEU A 35 -6.655 -7.648 4.861 1.00 0.00 C ATOM 0 H LEU A 35 -8.159 -11.087 5.809 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.803 -10.180 3.420 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.821 -10.652 6.247 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.018 -9.711 5.006 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.724 -8.971 6.128 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -6.512 -7.352 7.529 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.076 -9.029 7.934 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.966 -8.031 6.967 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.151 -6.757 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.621 -7.409 4.613 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -7.172 -7.994 3.966 1.00 0.00 H new ATOM 564 N LYS A 36 -6.610 -13.173 4.215 1.00 0.00 N ATOM 565 CA LYS A 36 -5.987 -14.445 3.939 1.00 0.00 C ATOM 566 C LYS A 36 -6.912 -15.306 3.087 1.00 0.00 C ATOM 567 O LYS A 36 -6.696 -16.504 2.904 1.00 0.00 O ATOM 568 CB LYS A 36 -5.571 -15.147 5.245 1.00 0.00 C ATOM 569 CG LYS A 36 -6.689 -15.383 6.242 1.00 0.00 C ATOM 570 CD LYS A 36 -6.230 -16.144 7.503 1.00 0.00 C ATOM 571 CE LYS A 36 -5.355 -15.322 8.485 1.00 0.00 C ATOM 572 NZ LYS A 36 -3.995 -15.002 7.978 1.00 0.00 N ATOM 0 H LYS A 36 -7.578 -13.234 4.530 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.073 -14.279 3.368 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -5.122 -16.108 4.994 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -4.797 -14.550 5.728 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -7.111 -14.423 6.539 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -7.487 -15.945 5.757 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -7.112 -16.498 8.036 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.670 -17.026 7.193 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -5.870 -14.390 8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -5.260 -15.877 9.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.307 -15.082 8.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.741 -15.668 7.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.983 -14.032 7.603 1.00 0.00 H new ATOM 586 N ASP A 37 -7.905 -14.654 2.518 1.00 0.00 N ATOM 587 CA ASP A 37 -8.915 -15.297 1.668 1.00 0.00 C ATOM 588 C ASP A 37 -8.312 -15.625 0.295 1.00 0.00 C ATOM 589 O ASP A 37 -7.176 -15.262 0.018 1.00 0.00 O ATOM 590 CB ASP A 37 -10.085 -14.332 1.494 1.00 0.00 C ATOM 591 CG ASP A 37 -11.227 -14.886 0.703 1.00 0.00 C ATOM 592 OD1 ASP A 37 -11.913 -15.788 1.193 1.00 0.00 O ATOM 593 OD2 ASP A 37 -11.412 -14.450 -0.446 1.00 0.00 O ATOM 0 H ASP A 37 -8.045 -13.650 2.627 1.00 0.00 H new ATOM 0 HA ASP A 37 -9.255 -16.223 2.132 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -10.449 -14.039 2.479 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.725 -13.427 1.005 1.00 0.00 H new ATOM 598 N ARG A 38 -9.057 -16.285 -0.562 1.00 0.00 N ATOM 599 CA ARG A 38 -8.578 -16.601 -1.891 1.00 0.00 C ATOM 600 C ARG A 38 -8.505 -15.338 -2.745 1.00 0.00 C ATOM 601 O ARG A 38 -7.776 -15.268 -3.709 1.00 0.00 O ATOM 602 CB ARG A 38 -9.429 -17.682 -2.556 1.00 0.00 C ATOM 603 CG ARG A 38 -10.701 -17.233 -3.288 1.00 0.00 C ATOM 604 CD ARG A 38 -11.782 -16.754 -2.355 1.00 0.00 C ATOM 605 NE ARG A 38 -12.328 -17.822 -1.504 1.00 0.00 N ATOM 606 CZ ARG A 38 -13.474 -17.708 -0.803 1.00 0.00 C ATOM 607 NH1 ARG A 38 -14.170 -16.570 -0.835 1.00 0.00 N ATOM 608 NH2 ARG A 38 -13.910 -18.721 -0.073 1.00 0.00 N ATOM 0 H ARG A 38 -10.001 -16.615 -0.363 1.00 0.00 H new ATOM 0 HA ARG A 38 -7.571 -17.007 -1.799 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.800 -18.213 -3.270 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -9.718 -18.401 -1.790 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.449 -16.433 -3.984 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.083 -18.063 -3.882 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.382 -15.962 -1.722 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.590 -16.316 -2.940 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.810 -18.699 -1.441 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.835 -15.783 -1.391 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -15.037 -16.487 -0.304 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -13.379 -19.591 -0.039 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -14.777 -18.632 0.456 1.00 0.00 H new ATOM 622 N ARG A 39 -9.258 -14.328 -2.353 1.00 0.00 N ATOM 623 CA ARG A 39 -9.227 -13.052 -3.035 1.00 0.00 C ATOM 624 C ARG A 39 -7.945 -12.305 -2.649 1.00 0.00 C ATOM 625 O ARG A 39 -7.517 -11.353 -3.326 1.00 0.00 O ATOM 626 CB ARG A 39 -10.455 -12.255 -2.648 1.00 0.00 C ATOM 627 CG ARG A 39 -10.643 -10.945 -3.381 1.00 0.00 C ATOM 628 CD ARG A 39 -11.891 -10.291 -2.876 1.00 0.00 C ATOM 629 NE ARG A 39 -12.150 -8.988 -3.463 1.00 0.00 N ATOM 630 CZ ARG A 39 -12.820 -8.019 -2.833 1.00 0.00 C ATOM 631 NH1 ARG A 39 -13.374 -8.234 -1.653 1.00 0.00 N ATOM 632 NH2 ARG A 39 -12.985 -6.863 -3.395 1.00 0.00 N ATOM 0 H ARG A 39 -9.901 -14.369 -1.562 1.00 0.00 H new ATOM 0 HA ARG A 39 -9.231 -13.198 -4.115 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -11.336 -12.874 -2.817 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -10.410 -12.049 -1.579 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -9.783 -10.295 -3.220 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.715 -11.119 -4.455 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -12.740 -10.945 -3.078 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -11.821 -10.184 -1.794 1.00 0.00 H new ATOM 0 HE ARG A 39 -11.803 -8.803 -4.404 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -13.293 -9.150 -1.211 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -13.882 -7.484 -1.184 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -12.602 -6.688 -4.324 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -13.498 -6.128 -2.908 1.00 0.00 H new ATOM 646 N MET A 40 -7.319 -12.767 -1.578 1.00 0.00 N ATOM 647 CA MET A 40 -6.093 -12.188 -1.098 1.00 0.00 C ATOM 648 C MET A 40 -4.972 -12.382 -2.080 1.00 0.00 C ATOM 649 O MET A 40 -4.254 -11.458 -2.328 1.00 0.00 O ATOM 650 CB MET A 40 -5.716 -12.697 0.317 1.00 0.00 C ATOM 651 CG MET A 40 -4.267 -12.458 0.759 1.00 0.00 C ATOM 652 SD MET A 40 -3.717 -10.753 0.559 1.00 0.00 S ATOM 653 CE MET A 40 -5.081 -9.865 1.258 1.00 0.00 C ATOM 0 H MET A 40 -7.654 -13.555 -1.023 1.00 0.00 H new ATOM 0 HA MET A 40 -6.263 -11.115 -1.005 1.00 0.00 H new ATOM 0 HB2 MET A 40 -6.378 -12.220 1.040 1.00 0.00 H new ATOM 0 HB3 MET A 40 -5.915 -13.768 0.360 1.00 0.00 H new ATOM 0 HG2 MET A 40 -4.165 -12.742 1.806 1.00 0.00 H new ATOM 0 HG3 MET A 40 -3.610 -13.112 0.186 1.00 0.00 H new ATOM 0 HE1 MET A 40 -5.273 -8.969 0.667 1.00 0.00 H new ATOM 0 HE2 MET A 40 -5.968 -10.499 1.255 1.00 0.00 H new ATOM 0 HE3 MET A 40 -4.843 -9.580 2.283 1.00 0.00 H new ATOM 663 N GLU A 41 -4.873 -13.558 -2.699 1.00 0.00 N ATOM 664 CA GLU A 41 -3.775 -13.811 -3.650 1.00 0.00 C ATOM 665 C GLU A 41 -3.812 -12.788 -4.784 1.00 0.00 C ATOM 666 O GLU A 41 -2.795 -12.373 -5.271 1.00 0.00 O ATOM 667 CB GLU A 41 -3.836 -15.226 -4.206 1.00 0.00 C ATOM 668 CG GLU A 41 -5.063 -15.492 -5.020 1.00 0.00 C ATOM 669 CD GLU A 41 -5.238 -16.932 -5.355 1.00 0.00 C ATOM 670 OE1 GLU A 41 -5.455 -17.758 -4.436 1.00 0.00 O ATOM 671 OE2 GLU A 41 -5.140 -17.273 -6.549 1.00 0.00 O ATOM 0 H GLU A 41 -5.519 -14.337 -2.569 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.833 -13.708 -3.111 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.955 -15.405 -4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.797 -15.935 -3.379 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.938 -15.143 -4.472 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.013 -14.914 -5.942 1.00 0.00 H new ATOM 678 N ASN A 42 -5.013 -12.359 -5.121 1.00 0.00 N ATOM 679 CA ASN A 42 -5.267 -11.364 -6.144 1.00 0.00 C ATOM 680 C ASN A 42 -4.836 -9.964 -5.664 1.00 0.00 C ATOM 681 O ASN A 42 -4.087 -9.260 -6.348 1.00 0.00 O ATOM 682 CB ASN A 42 -6.764 -11.418 -6.499 1.00 0.00 C ATOM 683 CG ASN A 42 -7.274 -10.267 -7.340 1.00 0.00 C ATOM 684 OD1 ASN A 42 -7.208 -10.295 -8.567 1.00 0.00 O ATOM 685 ND2 ASN A 42 -7.836 -9.275 -6.683 1.00 0.00 N ATOM 0 H ASN A 42 -5.864 -12.704 -4.677 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.679 -11.576 -7.037 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.961 -12.349 -7.030 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -7.339 -11.452 -5.573 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.239 -8.489 -7.193 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.869 -9.292 -5.664 1.00 0.00 H new ATOM 692 N LEU A 43 -5.275 -9.595 -4.471 1.00 0.00 N ATOM 693 CA LEU A 43 -4.947 -8.289 -3.877 1.00 0.00 C ATOM 694 C LEU A 43 -3.468 -8.170 -3.554 1.00 0.00 C ATOM 695 O LEU A 43 -2.839 -7.149 -3.845 1.00 0.00 O ATOM 696 CB LEU A 43 -5.797 -8.084 -2.638 1.00 0.00 C ATOM 697 CG LEU A 43 -7.298 -8.132 -2.909 1.00 0.00 C ATOM 698 CD1 LEU A 43 -8.079 -8.196 -1.622 1.00 0.00 C ATOM 699 CD2 LEU A 43 -7.721 -6.924 -3.727 1.00 0.00 C ATOM 0 H LEU A 43 -5.866 -10.182 -3.882 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.168 -7.507 -4.604 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.545 -8.850 -1.904 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.548 -7.121 -2.192 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.513 -9.036 -3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -9.145 -8.229 -1.845 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.796 -9.091 -1.069 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.861 -7.314 -1.020 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.794 -6.969 -3.914 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.486 -6.012 -3.178 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.187 -6.923 -4.677 1.00 0.00 H new ATOM 711 N VAL A 44 -2.905 -9.214 -2.993 1.00 0.00 N ATOM 712 CA VAL A 44 -1.515 -9.211 -2.641 1.00 0.00 C ATOM 713 C VAL A 44 -0.658 -9.324 -3.899 1.00 0.00 C ATOM 714 O VAL A 44 0.448 -8.830 -3.925 1.00 0.00 O ATOM 715 CB VAL A 44 -1.147 -10.306 -1.588 1.00 0.00 C ATOM 716 CG1 VAL A 44 -1.120 -11.712 -2.159 1.00 0.00 C ATOM 717 CG2 VAL A 44 0.133 -9.967 -0.846 1.00 0.00 C ATOM 0 H VAL A 44 -3.397 -10.080 -2.771 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.303 -8.258 -2.155 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.959 -10.303 -0.860 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.858 -12.419 -1.372 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.103 -11.962 -2.558 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.380 -11.766 -2.957 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.354 -10.753 -0.124 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.955 -9.886 -1.557 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.010 -9.018 -0.324 1.00 0.00 H new ATOM 727 N ALA A 45 -1.196 -9.961 -4.954 1.00 0.00 N ATOM 728 CA ALA A 45 -0.494 -10.033 -6.245 1.00 0.00 C ATOM 729 C ALA A 45 -0.289 -8.628 -6.777 1.00 0.00 C ATOM 730 O ALA A 45 0.823 -8.237 -7.135 1.00 0.00 O ATOM 731 CB ALA A 45 -1.274 -10.863 -7.262 1.00 0.00 C ATOM 0 H ALA A 45 -2.103 -10.427 -4.938 1.00 0.00 H new ATOM 0 HA ALA A 45 0.468 -10.520 -6.088 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -0.726 -10.894 -8.203 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -1.402 -11.877 -6.883 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.252 -10.411 -7.427 1.00 0.00 H new ATOM 737 N TYR A 46 -1.376 -7.862 -6.788 1.00 0.00 N ATOM 738 CA TYR A 46 -1.350 -6.452 -7.172 1.00 0.00 C ATOM 739 C TYR A 46 -0.385 -5.688 -6.280 1.00 0.00 C ATOM 740 O TYR A 46 0.427 -4.935 -6.769 1.00 0.00 O ATOM 741 CB TYR A 46 -2.801 -5.862 -7.101 1.00 0.00 C ATOM 742 CG TYR A 46 -2.942 -4.342 -6.836 1.00 0.00 C ATOM 743 CD1 TYR A 46 -2.868 -3.847 -5.529 1.00 0.00 C ATOM 744 CD2 TYR A 46 -3.177 -3.421 -7.860 1.00 0.00 C ATOM 745 CE1 TYR A 46 -3.009 -2.506 -5.250 1.00 0.00 C ATOM 746 CE2 TYR A 46 -3.324 -2.057 -7.571 1.00 0.00 C ATOM 747 CZ TYR A 46 -3.235 -1.618 -6.266 1.00 0.00 C ATOM 748 OH TYR A 46 -3.373 -0.275 -5.972 1.00 0.00 O ATOM 0 H TYR A 46 -2.303 -8.201 -6.530 1.00 0.00 H new ATOM 0 HA TYR A 46 -0.996 -6.354 -8.198 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -3.302 -6.087 -8.042 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -3.342 -6.392 -6.317 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -2.695 -4.537 -4.716 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -3.246 -3.762 -8.882 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -2.941 -2.156 -4.231 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -3.506 -1.351 -8.368 1.00 0.00 H new ATOM 0 HH TYR A 46 -3.528 0.227 -6.799 1.00 0.00 H new ATOM 758 N ALA A 47 -0.463 -5.914 -4.991 1.00 0.00 N ATOM 759 CA ALA A 47 0.388 -5.224 -4.051 1.00 0.00 C ATOM 760 C ALA A 47 1.868 -5.524 -4.310 1.00 0.00 C ATOM 761 O ALA A 47 2.679 -4.618 -4.384 1.00 0.00 O ATOM 762 CB ALA A 47 -0.018 -5.569 -2.637 1.00 0.00 C ATOM 0 H ALA A 47 -1.112 -6.576 -4.566 1.00 0.00 H new ATOM 0 HA ALA A 47 0.260 -4.150 -4.189 1.00 0.00 H new ATOM 0 HB1 ALA A 47 0.629 -5.044 -1.934 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.053 -5.268 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 47 0.076 -6.644 -2.483 1.00 0.00 H new ATOM 768 N LYS A 48 2.186 -6.791 -4.505 1.00 0.00 N ATOM 769 CA LYS A 48 3.549 -7.240 -4.797 1.00 0.00 C ATOM 770 C LYS A 48 4.069 -6.680 -6.114 1.00 0.00 C ATOM 771 O LYS A 48 5.208 -6.218 -6.196 1.00 0.00 O ATOM 772 CB LYS A 48 3.594 -8.759 -4.847 1.00 0.00 C ATOM 773 CG LYS A 48 3.468 -9.434 -3.495 1.00 0.00 C ATOM 774 CD LYS A 48 3.252 -10.929 -3.648 1.00 0.00 C ATOM 775 CE LYS A 48 3.347 -11.658 -2.312 1.00 0.00 C ATOM 776 NZ LYS A 48 4.691 -11.527 -1.695 1.00 0.00 N ATOM 0 H LYS A 48 1.505 -7.549 -4.466 1.00 0.00 H new ATOM 0 HA LYS A 48 4.190 -6.868 -3.997 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.790 -9.113 -5.493 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.532 -9.068 -5.308 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.369 -9.252 -2.909 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.635 -8.998 -2.944 1.00 0.00 H new ATOM 0 HD2 LYS A 48 2.273 -11.111 -4.092 1.00 0.00 H new ATOM 0 HD3 LYS A 48 3.994 -11.334 -4.336 1.00 0.00 H new ATOM 0 HE2 LYS A 48 2.596 -11.261 -1.629 1.00 0.00 H new ATOM 0 HE3 LYS A 48 3.118 -12.713 -2.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 4.813 -12.263 -0.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.421 -11.637 -2.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.781 -10.589 -1.255 1.00 0.00 H new ATOM 790 N LYS A 49 3.242 -6.718 -7.139 1.00 0.00 N ATOM 791 CA LYS A 49 3.649 -6.245 -8.453 1.00 0.00 C ATOM 792 C LYS A 49 3.844 -4.715 -8.429 1.00 0.00 C ATOM 793 O LYS A 49 4.772 -4.173 -9.059 1.00 0.00 O ATOM 794 CB LYS A 49 2.616 -6.662 -9.521 1.00 0.00 C ATOM 795 CG LYS A 49 1.333 -5.939 -9.479 1.00 0.00 C ATOM 796 CD LYS A 49 0.426 -6.403 -10.577 1.00 0.00 C ATOM 797 CE LYS A 49 -0.628 -5.374 -10.861 1.00 0.00 C ATOM 798 NZ LYS A 49 -0.046 -4.114 -11.414 1.00 0.00 N ATOM 0 H LYS A 49 2.286 -7.070 -7.091 1.00 0.00 H new ATOM 0 HA LYS A 49 4.602 -6.704 -8.716 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.061 -6.521 -10.506 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.416 -7.728 -9.411 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.853 -6.097 -8.513 1.00 0.00 H new ATOM 0 HG3 LYS A 49 1.510 -4.868 -9.576 1.00 0.00 H new ATOM 0 HD2 LYS A 49 1.007 -6.595 -11.479 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.044 -7.345 -10.294 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.350 -5.781 -11.569 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.172 -5.150 -9.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.780 -3.591 -11.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.313 -3.526 -10.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.735 -4.347 -12.060 1.00 0.00 H new ATOM 812 N VAL A 50 2.984 -4.044 -7.675 1.00 0.00 N ATOM 813 CA VAL A 50 3.042 -2.613 -7.494 1.00 0.00 C ATOM 814 C VAL A 50 4.302 -2.246 -6.718 1.00 0.00 C ATOM 815 O VAL A 50 5.061 -1.375 -7.142 1.00 0.00 O ATOM 816 CB VAL A 50 1.742 -2.083 -6.791 1.00 0.00 C ATOM 817 CG1 VAL A 50 1.922 -0.696 -6.235 1.00 0.00 C ATOM 818 CG2 VAL A 50 0.590 -2.066 -7.782 1.00 0.00 C ATOM 0 H VAL A 50 2.219 -4.490 -7.168 1.00 0.00 H new ATOM 0 HA VAL A 50 3.091 -2.129 -8.469 1.00 0.00 H new ATOM 0 HB VAL A 50 1.527 -2.758 -5.963 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.997 -0.372 -5.759 1.00 0.00 H new ATOM 0 HG12 VAL A 50 2.727 -0.700 -5.500 1.00 0.00 H new ATOM 0 HG13 VAL A 50 2.173 -0.010 -7.044 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -0.309 -1.697 -7.288 1.00 0.00 H new ATOM 0 HG22 VAL A 50 0.839 -1.412 -8.618 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.413 -3.076 -8.151 1.00 0.00 H new ATOM 828 N GLU A 51 4.535 -2.966 -5.622 1.00 0.00 N ATOM 829 CA GLU A 51 5.713 -2.795 -4.777 1.00 0.00 C ATOM 830 C GLU A 51 6.959 -2.946 -5.630 1.00 0.00 C ATOM 831 O GLU A 51 7.807 -2.070 -5.642 1.00 0.00 O ATOM 832 CB GLU A 51 5.659 -3.838 -3.635 1.00 0.00 C ATOM 833 CG GLU A 51 6.749 -3.778 -2.549 1.00 0.00 C ATOM 834 CD GLU A 51 8.101 -4.345 -2.959 1.00 0.00 C ATOM 835 OE1 GLU A 51 8.145 -5.322 -3.738 1.00 0.00 O ATOM 836 OE2 GLU A 51 9.131 -3.859 -2.485 1.00 0.00 O ATOM 0 H GLU A 51 3.901 -3.694 -5.292 1.00 0.00 H new ATOM 0 HA GLU A 51 5.736 -1.802 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 51 4.691 -3.744 -3.142 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.692 -4.830 -4.087 1.00 0.00 H new ATOM 0 HG2 GLU A 51 6.884 -2.739 -2.249 1.00 0.00 H new ATOM 0 HG3 GLU A 51 6.396 -4.320 -1.672 1.00 0.00 H new ATOM 843 N GLY A 52 7.002 -4.021 -6.406 1.00 0.00 N ATOM 844 CA GLY A 52 8.126 -4.293 -7.280 1.00 0.00 C ATOM 845 C GLY A 52 8.350 -3.206 -8.307 1.00 0.00 C ATOM 846 O GLY A 52 9.491 -2.913 -8.675 1.00 0.00 O ATOM 0 H GLY A 52 6.262 -4.722 -6.445 1.00 0.00 H new ATOM 0 HA2 GLY A 52 9.028 -4.409 -6.679 1.00 0.00 H new ATOM 0 HA3 GLY A 52 7.960 -5.241 -7.792 1.00 0.00 H new ATOM 850 N ASP A 53 7.275 -2.603 -8.776 1.00 0.00 N ATOM 851 CA ASP A 53 7.370 -1.527 -9.764 1.00 0.00 C ATOM 852 C ASP A 53 8.047 -0.312 -9.169 1.00 0.00 C ATOM 853 O ASP A 53 9.066 0.135 -9.667 1.00 0.00 O ATOM 854 CB ASP A 53 5.996 -1.169 -10.317 1.00 0.00 C ATOM 855 CG ASP A 53 6.071 -0.148 -11.421 1.00 0.00 C ATOM 856 OD1 ASP A 53 6.780 -0.395 -12.426 1.00 0.00 O ATOM 857 OD2 ASP A 53 5.394 0.897 -11.324 1.00 0.00 O ATOM 0 H ASP A 53 6.322 -2.834 -8.494 1.00 0.00 H new ATOM 0 HA ASP A 53 7.981 -1.883 -10.594 1.00 0.00 H new ATOM 0 HB2 ASP A 53 5.512 -2.071 -10.692 1.00 0.00 H new ATOM 0 HB3 ASP A 53 5.372 -0.784 -9.511 1.00 0.00 H new ATOM 862 N MET A 54 7.523 0.163 -8.066 1.00 0.00 N ATOM 863 CA MET A 54 8.103 1.322 -7.363 1.00 0.00 C ATOM 864 C MET A 54 9.469 1.029 -6.774 1.00 0.00 C ATOM 865 O MET A 54 10.288 1.926 -6.634 1.00 0.00 O ATOM 866 CB MET A 54 7.141 1.922 -6.328 1.00 0.00 C ATOM 867 CG MET A 54 6.347 0.939 -5.533 1.00 0.00 C ATOM 868 SD MET A 54 4.622 1.490 -5.367 1.00 0.00 S ATOM 869 CE MET A 54 4.163 1.792 -7.091 1.00 0.00 C ATOM 0 H MET A 54 6.692 -0.225 -7.620 1.00 0.00 H new ATOM 0 HA MET A 54 8.258 2.087 -8.124 1.00 0.00 H new ATOM 0 HB2 MET A 54 7.718 2.538 -5.638 1.00 0.00 H new ATOM 0 HB3 MET A 54 6.449 2.586 -6.845 1.00 0.00 H new ATOM 0 HG2 MET A 54 6.377 -0.037 -6.017 1.00 0.00 H new ATOM 0 HG3 MET A 54 6.792 0.818 -4.545 1.00 0.00 H new ATOM 0 HE1 MET A 54 3.077 1.838 -7.176 1.00 0.00 H new ATOM 0 HE2 MET A 54 4.593 2.737 -7.422 1.00 0.00 H new ATOM 0 HE3 MET A 54 4.542 0.983 -7.715 1.00 0.00 H new ATOM 879 N TYR A 55 9.704 -0.223 -6.456 1.00 0.00 N ATOM 880 CA TYR A 55 10.984 -0.693 -5.972 1.00 0.00 C ATOM 881 C TYR A 55 12.021 -0.483 -7.079 1.00 0.00 C ATOM 882 O TYR A 55 12.997 0.199 -6.888 1.00 0.00 O ATOM 883 CB TYR A 55 10.826 -2.183 -5.643 1.00 0.00 C ATOM 884 CG TYR A 55 11.985 -2.877 -4.993 1.00 0.00 C ATOM 885 CD1 TYR A 55 12.203 -2.769 -3.631 1.00 0.00 C ATOM 886 CD2 TYR A 55 12.824 -3.694 -5.731 1.00 0.00 C ATOM 887 CE1 TYR A 55 13.227 -3.455 -3.020 1.00 0.00 C ATOM 888 CE2 TYR A 55 13.861 -4.378 -5.133 1.00 0.00 C ATOM 889 CZ TYR A 55 14.057 -4.256 -3.774 1.00 0.00 C ATOM 890 OH TYR A 55 15.068 -4.964 -3.158 1.00 0.00 O ATOM 0 H TYR A 55 9.000 -0.957 -6.527 1.00 0.00 H new ATOM 0 HA TYR A 55 11.312 -0.155 -5.082 1.00 0.00 H new ATOM 0 HB2 TYR A 55 9.960 -2.293 -4.991 1.00 0.00 H new ATOM 0 HB3 TYR A 55 10.596 -2.709 -6.570 1.00 0.00 H new ATOM 0 HD1 TYR A 55 11.559 -2.136 -3.038 1.00 0.00 H new ATOM 0 HD2 TYR A 55 12.663 -3.797 -6.794 1.00 0.00 H new ATOM 0 HE1 TYR A 55 13.380 -3.366 -1.955 1.00 0.00 H new ATOM 0 HE2 TYR A 55 14.514 -5.004 -5.724 1.00 0.00 H new ATOM 0 HH TYR A 55 15.561 -5.480 -3.829 1.00 0.00 H new ATOM 900 N GLU A 56 11.736 -1.002 -8.265 1.00 0.00 N ATOM 901 CA GLU A 56 12.652 -0.870 -9.413 1.00 0.00 C ATOM 902 C GLU A 56 12.750 0.581 -9.891 1.00 0.00 C ATOM 903 O GLU A 56 13.805 1.041 -10.332 1.00 0.00 O ATOM 904 CB GLU A 56 12.197 -1.756 -10.570 1.00 0.00 C ATOM 905 CG GLU A 56 12.388 -3.248 -10.349 1.00 0.00 C ATOM 906 CD GLU A 56 13.841 -3.632 -10.250 1.00 0.00 C ATOM 907 OE1 GLU A 56 14.674 -3.055 -10.983 1.00 0.00 O ATOM 908 OE2 GLU A 56 14.188 -4.513 -9.439 1.00 0.00 O ATOM 0 H GLU A 56 10.881 -1.520 -8.468 1.00 0.00 H new ATOM 0 HA GLU A 56 13.638 -1.191 -9.077 1.00 0.00 H new ATOM 0 HB2 GLU A 56 11.141 -1.564 -10.761 1.00 0.00 H new ATOM 0 HB3 GLU A 56 12.742 -1.464 -11.468 1.00 0.00 H new ATOM 0 HG2 GLU A 56 11.873 -3.546 -9.436 1.00 0.00 H new ATOM 0 HG3 GLU A 56 11.925 -3.796 -11.169 1.00 0.00 H new ATOM 915 N SER A 57 11.650 1.278 -9.786 1.00 0.00 N ATOM 916 CA SER A 57 11.531 2.657 -10.199 1.00 0.00 C ATOM 917 C SER A 57 12.338 3.648 -9.325 1.00 0.00 C ATOM 918 O SER A 57 12.702 4.744 -9.791 1.00 0.00 O ATOM 919 CB SER A 57 10.057 3.028 -10.191 1.00 0.00 C ATOM 920 OG SER A 57 9.345 2.431 -11.275 1.00 0.00 O ATOM 0 H SER A 57 10.787 0.895 -9.401 1.00 0.00 H new ATOM 0 HA SER A 57 11.959 2.739 -11.198 1.00 0.00 H new ATOM 0 HB2 SER A 57 9.610 2.714 -9.248 1.00 0.00 H new ATOM 0 HB3 SER A 57 9.957 4.112 -10.246 1.00 0.00 H new ATOM 0 HG SER A 57 9.072 1.523 -11.027 1.00 0.00 H new ATOM 926 N ALA A 58 12.611 3.282 -8.097 1.00 0.00 N ATOM 927 CA ALA A 58 13.293 4.175 -7.167 1.00 0.00 C ATOM 928 C ALA A 58 14.805 4.013 -7.157 1.00 0.00 C ATOM 929 O ALA A 58 15.353 3.001 -7.598 1.00 0.00 O ATOM 930 CB ALA A 58 12.762 3.994 -5.785 1.00 0.00 C ATOM 0 H ALA A 58 12.374 2.369 -7.708 1.00 0.00 H new ATOM 0 HA ALA A 58 13.088 5.185 -7.522 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.282 4.668 -5.104 1.00 0.00 H new ATOM 0 HB2 ALA A 58 11.695 4.218 -5.773 1.00 0.00 H new ATOM 0 HB3 ALA A 58 12.920 2.964 -5.467 1.00 0.00 H new ATOM 936 N ASN A 59 15.465 5.031 -6.644 1.00 0.00 N ATOM 937 CA ASN A 59 16.925 5.073 -6.532 1.00 0.00 C ATOM 938 C ASN A 59 17.358 4.907 -5.079 1.00 0.00 C ATOM 939 O ASN A 59 18.539 5.022 -4.761 1.00 0.00 O ATOM 940 CB ASN A 59 17.464 6.408 -7.051 1.00 0.00 C ATOM 941 CG ASN A 59 17.110 6.707 -8.492 1.00 0.00 C ATOM 942 OD1 ASN A 59 17.846 6.358 -9.412 1.00 0.00 O ATOM 943 ND2 ASN A 59 15.988 7.350 -8.701 1.00 0.00 N ATOM 0 H ASN A 59 15.005 5.868 -6.286 1.00 0.00 H new ATOM 0 HA ASN A 59 17.326 4.255 -7.130 1.00 0.00 H new ATOM 0 HB2 ASN A 59 17.080 7.211 -6.421 1.00 0.00 H new ATOM 0 HB3 ASN A 59 18.549 6.413 -6.948 1.00 0.00 H new ATOM 0 HD21 ASN A 59 15.700 7.577 -9.653 1.00 0.00 H new ATOM 0 HD22 ASN A 59 15.402 7.624 -7.912 1.00 0.00 H new ATOM 950 N SER A 60 16.408 4.650 -4.211 1.00 0.00 N ATOM 951 CA SER A 60 16.660 4.363 -2.813 1.00 0.00 C ATOM 952 C SER A 60 15.436 3.755 -2.252 1.00 0.00 C ATOM 953 O SER A 60 14.339 3.948 -2.806 1.00 0.00 O ATOM 954 CB SER A 60 17.050 5.604 -2.010 1.00 0.00 C ATOM 955 OG SER A 60 16.039 6.600 -2.049 1.00 0.00 O ATOM 0 H SER A 60 15.419 4.634 -4.459 1.00 0.00 H new ATOM 0 HA SER A 60 17.509 3.683 -2.745 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.241 5.321 -0.975 1.00 0.00 H new ATOM 0 HB3 SER A 60 17.979 6.015 -2.405 1.00 0.00 H new ATOM 0 HG SER A 60 16.324 7.376 -1.523 1.00 0.00 H new ATOM 961 N ARG A 61 15.571 3.021 -1.174 1.00 0.00 N ATOM 962 CA ARG A 61 14.410 2.391 -0.617 1.00 0.00 C ATOM 963 C ARG A 61 13.528 3.418 0.038 1.00 0.00 C ATOM 964 O ARG A 61 12.344 3.265 0.077 1.00 0.00 O ATOM 965 CB ARG A 61 14.717 1.234 0.341 1.00 0.00 C ATOM 966 CG ARG A 61 15.085 1.603 1.766 1.00 0.00 C ATOM 967 CD ARG A 61 16.351 2.365 1.880 1.00 0.00 C ATOM 968 NE ARG A 61 16.720 2.512 3.301 1.00 0.00 N ATOM 969 CZ ARG A 61 17.827 3.092 3.782 1.00 0.00 C ATOM 970 NH1 ARG A 61 18.598 3.819 2.997 1.00 0.00 N ATOM 971 NH2 ARG A 61 18.118 2.992 5.073 1.00 0.00 N ATOM 0 H ARG A 61 16.447 2.851 -0.681 1.00 0.00 H new ATOM 0 HA ARG A 61 13.882 1.933 -1.454 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.845 0.580 0.374 1.00 0.00 H new ATOM 0 HB3 ARG A 61 15.536 0.652 -0.081 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.277 2.193 2.199 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.166 0.691 2.358 1.00 0.00 H new ATOM 0 HD2 ARG A 61 17.146 1.850 1.340 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.238 3.347 1.421 1.00 0.00 H new ATOM 0 HE ARG A 61 16.066 2.134 3.986 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.353 3.943 2.015 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.439 4.257 3.372 1.00 0.00 H new ATOM 0 HH21 ARG A 61 17.499 2.474 5.697 1.00 0.00 H new ATOM 0 HH22 ARG A 61 18.961 3.433 5.441 1.00 0.00 H new ATOM 985 N ASP A 62 14.133 4.489 0.517 1.00 0.00 N ATOM 986 CA ASP A 62 13.388 5.561 1.147 1.00 0.00 C ATOM 987 C ASP A 62 12.529 6.246 0.112 1.00 0.00 C ATOM 988 O ASP A 62 11.380 6.567 0.361 1.00 0.00 O ATOM 989 CB ASP A 62 14.329 6.558 1.785 1.00 0.00 C ATOM 990 CG ASP A 62 13.597 7.728 2.384 1.00 0.00 C ATOM 991 OD1 ASP A 62 13.176 7.646 3.557 1.00 0.00 O ATOM 992 OD2 ASP A 62 13.424 8.749 1.686 1.00 0.00 O ATOM 0 H ASP A 62 15.141 4.639 0.481 1.00 0.00 H new ATOM 0 HA ASP A 62 12.753 5.143 1.928 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.911 6.060 2.560 1.00 0.00 H new ATOM 0 HB3 ASP A 62 15.036 6.918 1.037 1.00 0.00 H new ATOM 997 N GLU A 63 13.093 6.423 -1.070 1.00 0.00 N ATOM 998 CA GLU A 63 12.380 6.990 -2.191 1.00 0.00 C ATOM 999 C GLU A 63 11.241 6.087 -2.604 1.00 0.00 C ATOM 1000 O GLU A 63 10.119 6.550 -2.797 1.00 0.00 O ATOM 1001 CB GLU A 63 13.339 7.214 -3.345 1.00 0.00 C ATOM 1002 CG GLU A 63 12.702 7.596 -4.658 1.00 0.00 C ATOM 1003 CD GLU A 63 13.727 8.058 -5.636 1.00 0.00 C ATOM 1004 OE1 GLU A 63 14.277 9.153 -5.448 1.00 0.00 O ATOM 1005 OE2 GLU A 63 14.049 7.315 -6.578 1.00 0.00 O ATOM 0 H GLU A 63 14.061 6.176 -1.275 1.00 0.00 H new ATOM 0 HA GLU A 63 11.956 7.950 -1.897 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.043 7.997 -3.062 1.00 0.00 H new ATOM 0 HB3 GLU A 63 13.918 6.303 -3.494 1.00 0.00 H new ATOM 0 HG2 GLU A 63 12.164 6.741 -5.067 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.969 8.386 -4.494 1.00 0.00 H new ATOM 1012 N TYR A 64 11.523 4.796 -2.688 1.00 0.00 N ATOM 1013 CA TYR A 64 10.535 3.831 -3.090 1.00 0.00 C ATOM 1014 C TYR A 64 9.413 3.774 -2.055 1.00 0.00 C ATOM 1015 O TYR A 64 8.245 3.795 -2.400 1.00 0.00 O ATOM 1016 CB TYR A 64 11.215 2.451 -3.361 1.00 0.00 C ATOM 1017 CG TYR A 64 10.667 1.265 -2.626 1.00 0.00 C ATOM 1018 CD1 TYR A 64 9.579 0.569 -3.112 1.00 0.00 C ATOM 1019 CD2 TYR A 64 11.234 0.853 -1.431 1.00 0.00 C ATOM 1020 CE1 TYR A 64 9.073 -0.503 -2.437 1.00 0.00 C ATOM 1021 CE2 TYR A 64 10.726 -0.221 -0.745 1.00 0.00 C ATOM 1022 CZ TYR A 64 9.645 -0.893 -1.256 1.00 0.00 C ATOM 1023 OH TYR A 64 9.140 -1.962 -0.598 1.00 0.00 O ATOM 0 H TYR A 64 12.439 4.399 -2.479 1.00 0.00 H new ATOM 0 HA TYR A 64 10.070 4.131 -4.029 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.151 2.246 -4.430 1.00 0.00 H new ATOM 0 HB3 TYR A 64 12.273 2.541 -3.117 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.121 0.878 -4.040 1.00 0.00 H new ATOM 0 HD2 TYR A 64 12.087 1.384 -1.034 1.00 0.00 H new ATOM 0 HE1 TYR A 64 8.225 -1.042 -2.833 1.00 0.00 H new ATOM 0 HE2 TYR A 64 11.172 -0.534 0.187 1.00 0.00 H new ATOM 0 HH TYR A 64 8.912 -2.665 -1.242 1.00 0.00 H new ATOM 1033 N TYR A 65 9.809 3.771 -0.797 1.00 0.00 N ATOM 1034 CA TYR A 65 8.920 3.757 0.340 1.00 0.00 C ATOM 1035 C TYR A 65 8.041 4.991 0.324 1.00 0.00 C ATOM 1036 O TYR A 65 6.833 4.894 0.462 1.00 0.00 O ATOM 1037 CB TYR A 65 9.776 3.728 1.594 1.00 0.00 C ATOM 1038 CG TYR A 65 9.052 3.652 2.894 1.00 0.00 C ATOM 1039 CD1 TYR A 65 7.927 2.904 3.038 1.00 0.00 C ATOM 1040 CD2 TYR A 65 9.553 4.285 3.994 1.00 0.00 C ATOM 1041 CE1 TYR A 65 7.314 2.801 4.241 1.00 0.00 C ATOM 1042 CE2 TYR A 65 8.978 4.173 5.208 1.00 0.00 C ATOM 1043 CZ TYR A 65 7.857 3.439 5.344 1.00 0.00 C ATOM 1044 OH TYR A 65 7.300 3.301 6.582 1.00 0.00 O ATOM 0 H TYR A 65 10.794 3.779 -0.533 1.00 0.00 H new ATOM 0 HA TYR A 65 8.269 2.883 0.310 1.00 0.00 H new ATOM 0 HB2 TYR A 65 10.448 2.873 1.528 1.00 0.00 H new ATOM 0 HB3 TYR A 65 10.398 4.623 1.602 1.00 0.00 H new ATOM 0 HD1 TYR A 65 7.517 2.386 2.184 1.00 0.00 H new ATOM 0 HD2 TYR A 65 10.438 4.895 3.889 1.00 0.00 H new ATOM 0 HE1 TYR A 65 6.406 2.224 4.340 1.00 0.00 H new ATOM 0 HE2 TYR A 65 9.412 4.668 6.064 1.00 0.00 H new ATOM 0 HH TYR A 65 7.475 4.107 7.111 1.00 0.00 H new ATOM 1054 N HIS A 66 8.658 6.146 0.113 1.00 0.00 N ATOM 1055 CA HIS A 66 7.938 7.410 0.046 1.00 0.00 C ATOM 1056 C HIS A 66 6.972 7.461 -1.109 1.00 0.00 C ATOM 1057 O HIS A 66 5.818 7.759 -0.912 1.00 0.00 O ATOM 1058 CB HIS A 66 8.870 8.635 0.004 1.00 0.00 C ATOM 1059 CG HIS A 66 9.271 9.159 1.352 1.00 0.00 C ATOM 1060 ND1 HIS A 66 10.560 9.171 1.841 1.00 0.00 N ATOM 1061 CD2 HIS A 66 8.514 9.764 2.300 1.00 0.00 C ATOM 1062 CE1 HIS A 66 10.543 9.764 3.034 1.00 0.00 C ATOM 1063 NE2 HIS A 66 9.322 10.145 3.364 1.00 0.00 N ATOM 0 H HIS A 66 9.666 6.233 -0.016 1.00 0.00 H new ATOM 0 HA HIS A 66 7.369 7.458 0.974 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.770 8.372 -0.552 1.00 0.00 H new ATOM 0 HB3 HIS A 66 8.375 9.433 -0.550 1.00 0.00 H new ATOM 0 HD1 HIS A 66 11.383 8.792 1.372 1.00 0.00 H new ATOM 0 HD2 HIS A 66 7.448 9.925 2.238 1.00 0.00 H new ATOM 0 HE1 HIS A 66 11.416 9.914 3.652 1.00 0.00 H new ATOM 1071 N LEU A 67 7.426 7.137 -2.305 1.00 0.00 N ATOM 1072 CA LEU A 67 6.566 7.253 -3.469 1.00 0.00 C ATOM 1073 C LEU A 67 5.457 6.189 -3.463 1.00 0.00 C ATOM 1074 O LEU A 67 4.347 6.426 -3.975 1.00 0.00 O ATOM 1075 CB LEU A 67 7.386 7.310 -4.792 1.00 0.00 C ATOM 1076 CG LEU A 67 8.050 6.026 -5.306 1.00 0.00 C ATOM 1077 CD1 LEU A 67 7.078 5.214 -6.121 1.00 0.00 C ATOM 1078 CD2 LEU A 67 9.292 6.333 -6.117 1.00 0.00 C ATOM 0 H LEU A 67 8.369 6.797 -2.496 1.00 0.00 H new ATOM 0 HA LEU A 67 6.049 8.211 -3.412 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.723 7.675 -5.576 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.169 8.058 -4.663 1.00 0.00 H new ATOM 0 HG LEU A 67 8.352 5.440 -4.438 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.569 4.308 -6.476 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.221 4.944 -5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.739 5.801 -6.975 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.738 5.402 -6.466 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.023 6.950 -6.974 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.010 6.868 -5.495 1.00 0.00 H new ATOM 1090 N LEU A 68 5.740 5.022 -2.872 1.00 0.00 N ATOM 1091 CA LEU A 68 4.719 4.006 -2.764 1.00 0.00 C ATOM 1092 C LEU A 68 3.698 4.487 -1.755 1.00 0.00 C ATOM 1093 O LEU A 68 2.488 4.368 -1.981 1.00 0.00 O ATOM 1094 CB LEU A 68 5.310 2.605 -2.407 1.00 0.00 C ATOM 1095 CG LEU A 68 5.537 2.217 -0.943 1.00 0.00 C ATOM 1096 CD1 LEU A 68 4.251 1.694 -0.318 1.00 0.00 C ATOM 1097 CD2 LEU A 68 6.608 1.175 -0.850 1.00 0.00 C ATOM 0 H LEU A 68 6.646 4.773 -2.475 1.00 0.00 H new ATOM 0 HA LEU A 68 4.235 3.860 -3.730 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.649 1.855 -2.842 1.00 0.00 H new ATOM 0 HB3 LEU A 68 6.269 2.519 -2.917 1.00 0.00 H new ATOM 0 HG LEU A 68 5.851 3.106 -0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.435 1.424 0.722 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.484 2.468 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.911 0.815 -0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 68 6.763 0.905 0.195 1.00 0.00 H new ATOM 0 HD22 LEU A 68 6.306 0.291 -1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.536 1.569 -1.264 1.00 0.00 H new ATOM 1109 N ALA A 69 4.201 5.048 -0.635 1.00 0.00 N ATOM 1110 CA ALA A 69 3.374 5.665 0.357 1.00 0.00 C ATOM 1111 C ALA A 69 2.498 6.751 -0.266 1.00 0.00 C ATOM 1112 O ALA A 69 1.339 6.837 0.041 1.00 0.00 O ATOM 1113 CB ALA A 69 4.221 6.218 1.466 1.00 0.00 C ATOM 0 H ALA A 69 5.197 5.072 -0.417 1.00 0.00 H new ATOM 0 HA ALA A 69 2.711 4.910 0.779 1.00 0.00 H new ATOM 0 HB1 ALA A 69 3.581 6.685 2.215 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.789 5.410 1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 69 4.909 6.961 1.063 1.00 0.00 H new ATOM 1119 N GLU A 70 3.066 7.533 -1.169 1.00 0.00 N ATOM 1120 CA GLU A 70 2.336 8.571 -1.917 1.00 0.00 C ATOM 1121 C GLU A 70 1.141 7.985 -2.683 1.00 0.00 C ATOM 1122 O GLU A 70 0.010 8.491 -2.589 1.00 0.00 O ATOM 1123 CB GLU A 70 3.279 9.252 -2.910 1.00 0.00 C ATOM 1124 CG GLU A 70 4.348 10.111 -2.274 1.00 0.00 C ATOM 1125 CD GLU A 70 3.838 11.458 -1.849 1.00 0.00 C ATOM 1126 OE1 GLU A 70 3.118 11.562 -0.855 1.00 0.00 O ATOM 1127 OE2 GLU A 70 4.170 12.464 -2.512 1.00 0.00 O ATOM 0 H GLU A 70 4.054 7.473 -1.413 1.00 0.00 H new ATOM 0 HA GLU A 70 1.959 9.295 -1.194 1.00 0.00 H new ATOM 0 HB2 GLU A 70 3.761 8.486 -3.518 1.00 0.00 H new ATOM 0 HB3 GLU A 70 2.689 9.871 -3.586 1.00 0.00 H new ATOM 0 HG2 GLU A 70 4.756 9.592 -1.407 1.00 0.00 H new ATOM 0 HG3 GLU A 70 5.168 10.244 -2.980 1.00 0.00 H new ATOM 1134 N LYS A 71 1.373 6.914 -3.433 1.00 0.00 N ATOM 1135 CA LYS A 71 0.297 6.343 -4.224 1.00 0.00 C ATOM 1136 C LYS A 71 -0.733 5.615 -3.338 1.00 0.00 C ATOM 1137 O LYS A 71 -1.931 5.686 -3.584 1.00 0.00 O ATOM 1138 CB LYS A 71 0.824 5.481 -5.428 1.00 0.00 C ATOM 1139 CG LYS A 71 1.540 4.170 -5.084 1.00 0.00 C ATOM 1140 CD LYS A 71 0.567 3.001 -4.834 1.00 0.00 C ATOM 1141 CE LYS A 71 0.107 2.290 -6.126 1.00 0.00 C ATOM 1142 NZ LYS A 71 -0.563 3.154 -7.126 1.00 0.00 N ATOM 0 H LYS A 71 2.271 6.437 -3.508 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.240 7.169 -4.689 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -0.023 5.245 -6.072 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.507 6.097 -6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.215 3.906 -5.898 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.155 4.320 -4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.048 2.273 -4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -0.309 3.376 -4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.976 1.828 -6.595 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -0.574 1.484 -5.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -1.038 2.560 -7.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.266 3.755 -6.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.144 3.754 -7.596 1.00 0.00 H new ATOM 1156 N ILE A 72 -0.275 4.959 -2.282 1.00 0.00 N ATOM 1157 CA ILE A 72 -1.195 4.276 -1.390 1.00 0.00 C ATOM 1158 C ILE A 72 -2.021 5.320 -0.610 1.00 0.00 C ATOM 1159 O ILE A 72 -3.204 5.140 -0.383 1.00 0.00 O ATOM 1160 CB ILE A 72 -0.469 3.261 -0.432 1.00 0.00 C ATOM 1161 CG1 ILE A 72 -1.456 2.458 0.370 1.00 0.00 C ATOM 1162 CG2 ILE A 72 0.485 3.928 0.490 1.00 0.00 C ATOM 1163 CD1 ILE A 72 -0.822 1.578 1.429 1.00 0.00 C ATOM 0 H ILE A 72 0.710 4.886 -2.026 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.871 3.670 -1.994 1.00 0.00 H new ATOM 0 HB ILE A 72 0.097 2.593 -1.081 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.157 3.140 0.851 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.035 1.832 -0.308 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.957 3.181 1.128 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.249 4.446 -0.089 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.050 4.648 1.109 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.600 1.033 1.963 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.143 0.870 0.955 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.266 2.198 2.132 1.00 0.00 H new ATOM 1175 N TYR A 73 -1.372 6.427 -0.279 1.00 0.00 N ATOM 1176 CA TYR A 73 -1.970 7.580 0.381 1.00 0.00 C ATOM 1177 C TYR A 73 -3.141 8.108 -0.425 1.00 0.00 C ATOM 1178 O TYR A 73 -4.256 8.259 0.109 1.00 0.00 O ATOM 1179 CB TYR A 73 -0.867 8.656 0.551 1.00 0.00 C ATOM 1180 CG TYR A 73 -1.274 10.097 0.784 1.00 0.00 C ATOM 1181 CD1 TYR A 73 -1.588 10.912 -0.290 1.00 0.00 C ATOM 1182 CD2 TYR A 73 -1.281 10.655 2.049 1.00 0.00 C ATOM 1183 CE1 TYR A 73 -1.896 12.228 -0.120 1.00 0.00 C ATOM 1184 CE2 TYR A 73 -1.600 11.985 2.226 1.00 0.00 C ATOM 1185 CZ TYR A 73 -1.900 12.766 1.128 1.00 0.00 C ATOM 1186 OH TYR A 73 -2.226 14.096 1.289 1.00 0.00 O ATOM 0 H TYR A 73 -0.378 6.552 -0.469 1.00 0.00 H new ATOM 0 HA TYR A 73 -2.361 7.300 1.359 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.238 8.353 1.388 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -0.243 8.631 -0.342 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -1.589 10.495 -1.286 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -1.035 10.045 2.905 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -2.136 12.842 -0.975 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -1.615 12.413 3.218 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.617 14.649 0.756 1.00 0.00 H new ATOM 1196 N LYS A 74 -2.901 8.368 -1.709 1.00 0.00 N ATOM 1197 CA LYS A 74 -3.933 8.924 -2.552 1.00 0.00 C ATOM 1198 C LYS A 74 -5.047 7.925 -2.747 1.00 0.00 C ATOM 1199 O LYS A 74 -6.181 8.308 -2.841 1.00 0.00 O ATOM 1200 CB LYS A 74 -3.395 9.419 -3.902 1.00 0.00 C ATOM 1201 CG LYS A 74 -2.943 8.327 -4.855 1.00 0.00 C ATOM 1202 CD LYS A 74 -2.437 8.897 -6.177 1.00 0.00 C ATOM 1203 CE LYS A 74 -1.281 9.862 -5.984 1.00 0.00 C ATOM 1204 NZ LYS A 74 -0.832 10.442 -7.261 1.00 0.00 N ATOM 0 H LYS A 74 -2.009 8.202 -2.175 1.00 0.00 H new ATOM 0 HA LYS A 74 -4.328 9.800 -2.038 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -4.171 10.008 -4.391 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -2.555 10.089 -3.717 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.152 7.741 -4.386 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -3.773 7.647 -5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -2.121 8.080 -6.825 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -3.254 9.409 -6.686 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -1.584 10.662 -5.309 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -0.449 9.342 -5.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.042 11.095 -7.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -0.518 9.681 -7.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -1.618 10.960 -7.703 1.00 0.00 H new ATOM 1218 N ILE A 75 -4.707 6.635 -2.763 1.00 0.00 N ATOM 1219 CA ILE A 75 -5.694 5.586 -2.900 1.00 0.00 C ATOM 1220 C ILE A 75 -6.614 5.554 -1.696 1.00 0.00 C ATOM 1221 O ILE A 75 -7.841 5.470 -1.853 1.00 0.00 O ATOM 1222 CB ILE A 75 -5.026 4.182 -3.167 1.00 0.00 C ATOM 1223 CG1 ILE A 75 -4.966 3.869 -4.662 1.00 0.00 C ATOM 1224 CG2 ILE A 75 -5.714 3.047 -2.427 1.00 0.00 C ATOM 1225 CD1 ILE A 75 -4.259 4.897 -5.501 1.00 0.00 C ATOM 0 H ILE A 75 -3.747 6.300 -2.682 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.301 5.813 -3.776 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.011 4.257 -2.777 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -4.469 2.908 -4.797 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -5.984 3.756 -5.035 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -5.209 2.108 -2.651 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -5.673 3.234 -1.354 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -6.755 2.984 -2.744 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -4.270 4.584 -6.545 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -4.766 5.857 -5.404 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.228 4.996 -5.163 1.00 0.00 H new ATOM 1237 N GLN A 76 -6.027 5.690 -0.507 1.00 0.00 N ATOM 1238 CA GLN A 76 -6.795 5.628 0.718 1.00 0.00 C ATOM 1239 C GLN A 76 -7.783 6.743 0.777 1.00 0.00 C ATOM 1240 O GLN A 76 -8.976 6.507 0.935 1.00 0.00 O ATOM 1241 CB GLN A 76 -5.923 5.645 1.970 1.00 0.00 C ATOM 1242 CG GLN A 76 -4.938 4.508 2.029 1.00 0.00 C ATOM 1243 CD GLN A 76 -4.403 4.251 3.426 1.00 0.00 C ATOM 1244 OE1 GLN A 76 -5.071 4.504 4.429 1.00 0.00 O ATOM 1245 NE2 GLN A 76 -3.213 3.723 3.506 1.00 0.00 N ATOM 0 H GLN A 76 -5.027 5.843 -0.375 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.319 4.672 0.702 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -5.380 6.589 2.012 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -6.564 5.606 2.851 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.417 3.602 1.658 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.104 4.724 1.362 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.685 3.525 2.656 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.811 3.508 4.418 1.00 0.00 H new ATOM 1254 N LYS A 77 -7.316 7.958 0.592 1.00 0.00 N ATOM 1255 CA LYS A 77 -8.197 9.054 0.683 1.00 0.00 C ATOM 1256 C LYS A 77 -9.142 9.150 -0.496 1.00 0.00 C ATOM 1257 O LYS A 77 -10.236 9.627 -0.331 1.00 0.00 O ATOM 1258 CB LYS A 77 -7.446 10.320 0.939 1.00 0.00 C ATOM 1259 CG LYS A 77 -6.316 10.588 -0.018 1.00 0.00 C ATOM 1260 CD LYS A 77 -5.642 11.886 0.325 1.00 0.00 C ATOM 1261 CE LYS A 77 -5.199 11.967 1.788 1.00 0.00 C ATOM 1262 NZ LYS A 77 -4.795 13.338 2.177 1.00 0.00 N ATOM 0 H LYS A 77 -6.345 8.189 0.382 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.843 8.884 1.544 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -8.145 11.155 0.897 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -7.046 10.290 1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -5.594 9.773 0.023 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -6.696 10.626 -1.039 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.773 12.018 -0.319 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -6.324 12.709 0.112 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.014 11.634 2.431 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.365 11.285 1.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.847 13.435 3.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.820 13.515 1.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.434 14.028 1.732 1.00 0.00 H new ATOM 1276 N GLU A 78 -8.725 8.649 -1.669 1.00 0.00 N ATOM 1277 CA GLU A 78 -9.575 8.646 -2.867 1.00 0.00 C ATOM 1278 C GLU A 78 -10.847 7.898 -2.542 1.00 0.00 C ATOM 1279 O GLU A 78 -11.947 8.439 -2.667 1.00 0.00 O ATOM 1280 CB GLU A 78 -8.855 7.931 -4.030 1.00 0.00 C ATOM 1281 CG GLU A 78 -9.452 8.143 -5.419 1.00 0.00 C ATOM 1282 CD GLU A 78 -9.413 9.575 -5.907 1.00 0.00 C ATOM 1283 OE1 GLU A 78 -8.633 10.413 -5.378 1.00 0.00 O ATOM 1284 OE2 GLU A 78 -10.143 9.899 -6.858 1.00 0.00 O ATOM 0 H GLU A 78 -7.802 8.240 -1.812 1.00 0.00 H new ATOM 0 HA GLU A 78 -9.793 9.672 -3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.817 8.264 -4.048 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.843 6.861 -3.821 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.916 7.515 -6.131 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -10.488 7.803 -5.411 1.00 0.00 H new ATOM 1291 N LEU A 79 -10.686 6.677 -2.031 1.00 0.00 N ATOM 1292 CA LEU A 79 -11.823 5.852 -1.704 1.00 0.00 C ATOM 1293 C LEU A 79 -12.596 6.408 -0.509 1.00 0.00 C ATOM 1294 O LEU A 79 -13.817 6.496 -0.561 1.00 0.00 O ATOM 1295 CB LEU A 79 -11.429 4.353 -1.554 1.00 0.00 C ATOM 1296 CG LEU A 79 -10.446 3.955 -0.434 1.00 0.00 C ATOM 1297 CD1 LEU A 79 -11.155 3.691 0.887 1.00 0.00 C ATOM 1298 CD2 LEU A 79 -9.617 2.763 -0.851 1.00 0.00 C ATOM 0 H LEU A 79 -9.780 6.249 -1.840 1.00 0.00 H new ATOM 0 HA LEU A 79 -12.515 5.887 -2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.346 3.783 -1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -11.000 4.027 -2.502 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.779 4.802 -0.272 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -10.422 3.414 1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -11.682 4.591 1.204 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.870 2.878 0.760 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -8.930 2.498 -0.047 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.274 1.918 -1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.048 3.011 -1.747 1.00 0.00 H new ATOM 1310 N GLU A 80 -11.880 6.848 0.527 1.00 0.00 N ATOM 1311 CA GLU A 80 -12.509 7.389 1.727 1.00 0.00 C ATOM 1312 C GLU A 80 -13.339 8.632 1.444 1.00 0.00 C ATOM 1313 O GLU A 80 -14.520 8.673 1.769 1.00 0.00 O ATOM 1314 CB GLU A 80 -11.490 7.679 2.830 1.00 0.00 C ATOM 1315 CG GLU A 80 -10.927 6.445 3.528 1.00 0.00 C ATOM 1316 CD GLU A 80 -11.990 5.643 4.251 1.00 0.00 C ATOM 1317 OE1 GLU A 80 -12.811 6.245 4.993 1.00 0.00 O ATOM 1318 OE2 GLU A 80 -11.993 4.400 4.153 1.00 0.00 O ATOM 0 H GLU A 80 -10.860 6.839 0.556 1.00 0.00 H new ATOM 0 HA GLU A 80 -13.185 6.610 2.079 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -10.663 8.244 2.400 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.959 8.319 3.578 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.437 5.809 2.791 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -10.163 6.754 4.242 1.00 0.00 H new ATOM 1325 N GLU A 81 -12.760 9.632 0.797 1.00 0.00 N ATOM 1326 CA GLU A 81 -13.491 10.859 0.576 1.00 0.00 C ATOM 1327 C GLU A 81 -14.589 10.672 -0.457 1.00 0.00 C ATOM 1328 O GLU A 81 -15.643 11.298 -0.351 1.00 0.00 O ATOM 1329 CB GLU A 81 -12.608 12.056 0.206 1.00 0.00 C ATOM 1330 CG GLU A 81 -11.940 11.934 -1.130 1.00 0.00 C ATOM 1331 CD GLU A 81 -11.372 13.220 -1.618 1.00 0.00 C ATOM 1332 OE1 GLU A 81 -12.159 14.146 -1.881 1.00 0.00 O ATOM 1333 OE2 GLU A 81 -10.182 13.288 -1.904 1.00 0.00 O ATOM 0 H GLU A 81 -11.810 9.616 0.426 1.00 0.00 H new ATOM 0 HA GLU A 81 -13.941 11.099 1.539 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -13.217 12.960 0.214 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -11.843 12.180 0.973 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.143 11.193 -1.065 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -12.662 11.563 -1.858 1.00 0.00 H new ATOM 1340 N LYS A 82 -14.372 9.802 -1.443 1.00 0.00 N ATOM 1341 CA LYS A 82 -15.382 9.572 -2.454 1.00 0.00 C ATOM 1342 C LYS A 82 -16.553 8.800 -1.869 1.00 0.00 C ATOM 1343 O LYS A 82 -17.689 8.920 -2.328 1.00 0.00 O ATOM 1344 CB LYS A 82 -14.786 9.005 -3.769 1.00 0.00 C ATOM 1345 CG LYS A 82 -14.629 7.502 -3.906 1.00 0.00 C ATOM 1346 CD LYS A 82 -15.793 6.961 -4.697 1.00 0.00 C ATOM 1347 CE LYS A 82 -15.594 5.535 -5.126 1.00 0.00 C ATOM 1348 NZ LYS A 82 -16.678 5.131 -6.026 1.00 0.00 N ATOM 0 H LYS A 82 -13.517 9.257 -1.556 1.00 0.00 H new ATOM 0 HA LYS A 82 -15.799 10.528 -2.769 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -15.413 9.349 -4.592 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -13.803 9.455 -3.908 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -13.690 7.265 -4.406 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -14.592 7.035 -2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -16.699 7.031 -4.095 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -15.947 7.583 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -14.633 5.428 -5.629 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.572 4.883 -4.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -16.336 4.391 -6.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -17.474 4.762 -5.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -16.995 5.953 -6.579 1.00 0.00 H new ATOM 1362 N ARG A 83 -16.254 8.021 -0.852 1.00 0.00 N ATOM 1363 CA ARG A 83 -17.246 7.326 -0.067 1.00 0.00 C ATOM 1364 C ARG A 83 -17.996 8.323 0.837 1.00 0.00 C ATOM 1365 O ARG A 83 -19.219 8.349 0.861 1.00 0.00 O ATOM 1366 CB ARG A 83 -16.543 6.273 0.818 1.00 0.00 C ATOM 1367 CG ARG A 83 -17.425 5.520 1.815 1.00 0.00 C ATOM 1368 CD ARG A 83 -18.406 4.599 1.129 1.00 0.00 C ATOM 1369 NE ARG A 83 -19.184 3.810 2.099 1.00 0.00 N ATOM 1370 CZ ARG A 83 -19.975 2.767 1.791 1.00 0.00 C ATOM 1371 NH1 ARG A 83 -20.046 2.313 0.534 1.00 0.00 N ATOM 1372 NH2 ARG A 83 -20.660 2.163 2.760 1.00 0.00 N ATOM 0 H ARG A 83 -15.297 7.851 -0.544 1.00 0.00 H new ATOM 0 HA ARG A 83 -17.957 6.841 -0.735 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -16.066 5.542 0.165 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -15.748 6.770 1.374 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -16.795 4.939 2.488 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -17.971 6.237 2.428 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -19.085 5.186 0.510 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -17.868 3.926 0.461 1.00 0.00 H new ATOM 0 HE ARG A 83 -19.118 4.075 3.082 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -19.497 2.759 -0.201 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -20.649 1.521 0.311 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -20.581 2.493 3.722 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -21.264 1.371 2.540 1.00 0.00 H new ATOM 1386 N ARG A 84 -17.249 9.145 1.562 1.00 0.00 N ATOM 1387 CA ARG A 84 -17.846 10.003 2.576 1.00 0.00 C ATOM 1388 C ARG A 84 -18.321 11.398 2.107 1.00 0.00 C ATOM 1389 O ARG A 84 -19.488 11.727 2.288 1.00 0.00 O ATOM 1390 CB ARG A 84 -16.949 10.131 3.831 1.00 0.00 C ATOM 1391 CG ARG A 84 -15.631 10.862 3.614 1.00 0.00 C ATOM 1392 CD ARG A 84 -14.807 10.965 4.882 1.00 0.00 C ATOM 1393 NE ARG A 84 -14.255 9.678 5.300 1.00 0.00 N ATOM 1394 CZ ARG A 84 -13.523 9.484 6.406 1.00 0.00 C ATOM 1395 NH1 ARG A 84 -13.365 10.472 7.294 1.00 0.00 N ATOM 1396 NH2 ARG A 84 -12.956 8.317 6.624 1.00 0.00 N ATOM 0 H ARG A 84 -16.237 9.236 1.468 1.00 0.00 H new ATOM 0 HA ARG A 84 -18.763 9.471 2.830 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -17.510 10.650 4.608 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -16.734 9.131 4.208 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -15.053 10.342 2.850 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -15.833 11.863 3.234 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -13.992 11.672 4.725 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -15.428 11.367 5.683 1.00 0.00 H new ATOM 0 HE ARG A 84 -14.440 8.869 4.707 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -13.803 11.379 7.131 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -12.807 10.318 8.134 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -13.073 7.559 5.951 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -12.399 8.170 7.466 1.00 0.00 H new ATOM 1410 N SER A 85 -17.459 12.217 1.513 1.00 0.00 N ATOM 1411 CA SER A 85 -17.853 13.613 1.331 1.00 0.00 C ATOM 1412 C SER A 85 -17.617 14.268 -0.019 1.00 0.00 C ATOM 1413 O SER A 85 -18.069 15.383 -0.227 1.00 0.00 O ATOM 1414 CB SER A 85 -17.345 14.474 2.485 1.00 0.00 C ATOM 1415 OG SER A 85 -15.953 14.224 2.745 1.00 0.00 O ATOM 0 H SER A 85 -16.534 11.962 1.166 1.00 0.00 H new ATOM 0 HA SER A 85 -18.941 13.555 1.343 1.00 0.00 H new ATOM 0 HB2 SER A 85 -17.490 15.528 2.247 1.00 0.00 H new ATOM 0 HB3 SER A 85 -17.929 14.266 3.382 1.00 0.00 H new ATOM 0 HG SER A 85 -15.652 14.789 3.487 1.00 0.00 H new ATOM 1421 N ARG A 86 -16.955 13.633 -0.933 1.00 0.00 N ATOM 1422 CA ARG A 86 -16.801 14.305 -2.234 1.00 0.00 C ATOM 1423 C ARG A 86 -17.993 13.982 -3.128 1.00 0.00 C ATOM 1424 O ARG A 86 -18.239 14.654 -4.122 1.00 0.00 O ATOM 1425 CB ARG A 86 -15.452 14.085 -2.965 1.00 0.00 C ATOM 1426 CG ARG A 86 -15.245 12.703 -3.476 1.00 0.00 C ATOM 1427 CD ARG A 86 -14.259 12.635 -4.636 1.00 0.00 C ATOM 1428 NE ARG A 86 -12.861 12.779 -4.246 1.00 0.00 N ATOM 1429 CZ ARG A 86 -11.844 12.136 -4.874 1.00 0.00 C ATOM 1430 NH1 ARG A 86 -12.080 11.481 -6.006 1.00 0.00 N ATOM 1431 NH2 ARG A 86 -10.601 12.161 -4.378 1.00 0.00 N ATOM 0 H ARG A 86 -16.529 12.711 -0.841 1.00 0.00 H new ATOM 0 HA ARG A 86 -16.780 15.370 -2.005 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -15.389 14.781 -3.801 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -14.639 14.332 -2.282 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -14.885 12.072 -2.664 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -16.203 12.294 -3.797 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -14.384 11.681 -5.148 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.506 13.417 -5.354 1.00 0.00 H new ATOM 0 HE ARG A 86 -12.637 13.393 -3.463 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.021 11.463 -6.398 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.320 10.996 -6.483 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.406 12.669 -3.515 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -9.848 11.672 -4.863 1.00 0.00 H new ATOM 1445 N LEU A 87 -18.721 12.943 -2.747 1.00 0.00 N ATOM 1446 CA LEU A 87 -19.986 12.566 -3.376 1.00 0.00 C ATOM 1447 C LEU A 87 -21.048 12.500 -2.296 1.00 0.00 C ATOM 1448 O LEU A 87 -20.703 12.315 -1.100 1.00 0.00 O ATOM 1449 CB LEU A 87 -19.932 11.198 -4.119 1.00 0.00 C ATOM 1450 CG LEU A 87 -19.269 11.120 -5.519 1.00 0.00 C ATOM 1451 CD1 LEU A 87 -19.891 12.106 -6.488 1.00 0.00 C ATOM 1452 CD2 LEU A 87 -17.774 11.293 -5.464 1.00 0.00 C ATOM 0 H LEU A 87 -18.449 12.327 -1.981 1.00 0.00 H new ATOM 0 HA LEU A 87 -20.212 13.319 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -19.412 10.493 -3.470 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -20.956 10.840 -4.221 1.00 0.00 H new ATOM 0 HG LEU A 87 -19.460 10.113 -5.889 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -19.400 12.022 -7.458 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -20.953 11.887 -6.598 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -19.767 13.119 -6.106 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -17.363 11.229 -6.472 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -17.536 12.267 -5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -17.339 10.508 -4.845 1.00 0.00 H new TER 1464 LEU A 87 ATOM 1465 N GLY B 101 -3.450 26.547 -6.880 1.00 0.00 N ATOM 1466 CA GLY B 101 -3.861 25.321 -7.543 1.00 0.00 C ATOM 1467 C GLY B 101 -3.388 24.097 -6.795 1.00 0.00 C ATOM 1468 O GLY B 101 -3.734 22.960 -7.140 1.00 0.00 O ATOM 0 HA2 GLY B 101 -4.948 25.299 -7.627 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -3.463 25.304 -8.557 1.00 0.00 H new ATOM 1472 N SER B 102 -2.602 24.322 -5.776 1.00 0.00 N ATOM 1473 CA SER B 102 -2.107 23.256 -4.962 1.00 0.00 C ATOM 1474 C SER B 102 -3.139 22.933 -3.880 1.00 0.00 C ATOM 1475 O SER B 102 -3.076 23.453 -2.757 1.00 0.00 O ATOM 1476 CB SER B 102 -0.732 23.625 -4.363 1.00 0.00 C ATOM 1477 OG SER B 102 -0.157 22.556 -3.629 1.00 0.00 O ATOM 0 H SER B 102 -2.290 25.250 -5.491 1.00 0.00 H new ATOM 0 HA SER B 102 -1.956 22.363 -5.569 1.00 0.00 H new ATOM 0 HB2 SER B 102 -0.055 23.916 -5.166 1.00 0.00 H new ATOM 0 HB3 SER B 102 -0.844 24.491 -3.711 1.00 0.00 H new ATOM 0 HG SER B 102 0.711 22.835 -3.271 1.00 0.00 H new ATOM 1483 N MET B 103 -4.143 22.155 -4.259 1.00 0.00 N ATOM 1484 CA MET B 103 -5.194 21.762 -3.341 1.00 0.00 C ATOM 1485 C MET B 103 -4.766 20.529 -2.573 1.00 0.00 C ATOM 1486 O MET B 103 -4.813 20.505 -1.333 1.00 0.00 O ATOM 1487 CB MET B 103 -6.505 21.491 -4.087 1.00 0.00 C ATOM 1488 CG MET B 103 -7.657 21.101 -3.169 1.00 0.00 C ATOM 1489 SD MET B 103 -9.173 20.687 -4.056 1.00 0.00 S ATOM 1490 CE MET B 103 -8.663 19.226 -4.968 1.00 0.00 C ATOM 0 H MET B 103 -4.249 21.783 -5.203 1.00 0.00 H new ATOM 0 HA MET B 103 -5.367 22.581 -2.643 1.00 0.00 H new ATOM 0 HB2 MET B 103 -6.785 22.382 -4.649 1.00 0.00 H new ATOM 0 HB3 MET B 103 -6.343 20.694 -4.812 1.00 0.00 H new ATOM 0 HG2 MET B 103 -7.355 20.247 -2.562 1.00 0.00 H new ATOM 0 HG3 MET B 103 -7.859 21.924 -2.483 1.00 0.00 H new ATOM 0 HE1 MET B 103 -9.545 18.669 -5.285 1.00 0.00 H new ATOM 0 HE2 MET B 103 -8.089 19.526 -5.845 1.00 0.00 H new ATOM 0 HE3 MET B 103 -8.046 18.595 -4.329 1.00 0.00 H new ATOM 1500 N SER B 104 -4.347 19.524 -3.312 1.00 0.00 N ATOM 1501 CA SER B 104 -3.861 18.295 -2.755 1.00 0.00 C ATOM 1502 C SER B 104 -2.480 18.580 -2.197 1.00 0.00 C ATOM 1503 O SER B 104 -1.566 18.933 -2.937 1.00 0.00 O ATOM 1504 CB SER B 104 -3.810 17.229 -3.858 1.00 0.00 C ATOM 1505 OG SER B 104 -3.465 15.937 -3.361 1.00 0.00 O ATOM 0 H SER B 104 -4.337 19.545 -4.332 1.00 0.00 H new ATOM 0 HA SER B 104 -4.509 17.920 -1.963 1.00 0.00 H new ATOM 0 HB2 SER B 104 -4.780 17.176 -4.352 1.00 0.00 H new ATOM 0 HB3 SER B 104 -3.084 17.529 -4.614 1.00 0.00 H new ATOM 0 HG SER B 104 -3.448 15.295 -4.102 1.00 0.00 H new ATOM 1511 N HIS B 105 -2.345 18.472 -0.912 1.00 0.00 N ATOM 1512 CA HIS B 105 -1.133 18.853 -0.251 1.00 0.00 C ATOM 1513 C HIS B 105 -0.174 17.666 -0.135 1.00 0.00 C ATOM 1514 O HIS B 105 -0.573 16.509 -0.296 1.00 0.00 O ATOM 1515 CB HIS B 105 -1.500 19.444 1.122 1.00 0.00 C ATOM 1516 CG HIS B 105 -0.366 20.025 1.906 1.00 0.00 C ATOM 1517 ND1 HIS B 105 0.330 21.144 1.532 1.00 0.00 N ATOM 1518 CD2 HIS B 105 0.195 19.608 3.058 1.00 0.00 C ATOM 1519 CE1 HIS B 105 1.266 21.367 2.440 1.00 0.00 C ATOM 1520 NE2 HIS B 105 1.230 20.461 3.393 1.00 0.00 N ATOM 0 H HIS B 105 -3.071 18.117 -0.290 1.00 0.00 H new ATOM 0 HA HIS B 105 -0.606 19.609 -0.833 1.00 0.00 H new ATOM 0 HB2 HIS B 105 -2.250 20.221 0.973 1.00 0.00 H new ATOM 0 HB3 HIS B 105 -1.967 18.661 1.720 1.00 0.00 H new ATOM 0 HD2 HIS B 105 -0.115 18.745 3.629 1.00 0.00 H new ATOM 0 HE1 HIS B 105 1.968 22.187 2.404 1.00 0.00 H new ATOM 0 HE2 HIS B 105 1.839 20.400 4.209 1.00 0.00 H new ATOM 1528 N TYR B 106 1.079 17.964 0.170 1.00 0.00 N ATOM 1529 CA TYR B 106 2.142 16.975 0.343 1.00 0.00 C ATOM 1530 C TYR B 106 2.097 16.418 1.776 1.00 0.00 C ATOM 1531 O TYR B 106 3.094 15.897 2.297 1.00 0.00 O ATOM 1532 CB TYR B 106 3.508 17.655 0.110 1.00 0.00 C ATOM 1533 CG TYR B 106 3.691 18.274 -1.267 1.00 0.00 C ATOM 1534 CD1 TYR B 106 3.287 19.581 -1.527 1.00 0.00 C ATOM 1535 CD2 TYR B 106 4.275 17.554 -2.301 1.00 0.00 C ATOM 1536 CE1 TYR B 106 3.454 20.143 -2.777 1.00 0.00 C ATOM 1537 CE2 TYR B 106 4.447 18.111 -3.551 1.00 0.00 C ATOM 1538 CZ TYR B 106 4.033 19.405 -3.786 1.00 0.00 C ATOM 1539 OH TYR B 106 4.199 19.964 -5.041 1.00 0.00 O ATOM 0 H TYR B 106 1.397 18.923 0.308 1.00 0.00 H new ATOM 0 HA TYR B 106 2.003 16.162 -0.370 1.00 0.00 H new ATOM 0 HB2 TYR B 106 3.643 18.432 0.862 1.00 0.00 H new ATOM 0 HB3 TYR B 106 4.295 16.918 0.268 1.00 0.00 H new ATOM 0 HD1 TYR B 106 2.836 20.164 -0.738 1.00 0.00 H new ATOM 0 HD2 TYR B 106 4.600 16.540 -2.123 1.00 0.00 H new ATOM 0 HE1 TYR B 106 3.132 21.157 -2.963 1.00 0.00 H new ATOM 0 HE2 TYR B 106 4.904 17.536 -4.343 1.00 0.00 H new ATOM 0 HH TYR B 106 4.623 19.311 -5.636 1.00 0.00 H new ATOM 1549 N GLY B 107 0.916 16.464 2.374 1.00 0.00 N ATOM 1550 CA GLY B 107 0.727 16.100 3.756 1.00 0.00 C ATOM 1551 C GLY B 107 0.620 14.618 3.958 1.00 0.00 C ATOM 1552 O GLY B 107 -0.337 14.127 4.531 1.00 0.00 O ATOM 0 H GLY B 107 0.060 16.758 1.904 1.00 0.00 H new ATOM 0 HA2 GLY B 107 1.560 16.483 4.345 1.00 0.00 H new ATOM 0 HA3 GLY B 107 -0.176 16.579 4.133 1.00 0.00 H new ATOM 1556 N ASN B 108 1.627 13.909 3.530 1.00 0.00 N ATOM 1557 CA ASN B 108 1.646 12.464 3.653 1.00 0.00 C ATOM 1558 C ASN B 108 2.126 12.024 5.011 1.00 0.00 C ATOM 1559 O ASN B 108 2.155 10.850 5.305 1.00 0.00 O ATOM 1560 CB ASN B 108 2.463 11.778 2.543 1.00 0.00 C ATOM 1561 CG ASN B 108 3.920 12.245 2.459 1.00 0.00 C ATOM 1562 OD1 ASN B 108 4.506 12.710 3.426 1.00 0.00 O ATOM 1563 ND2 ASN B 108 4.503 12.109 1.324 1.00 0.00 N ATOM 0 H ASN B 108 2.456 14.306 3.088 1.00 0.00 H new ATOM 0 HA ASN B 108 0.611 12.144 3.534 1.00 0.00 H new ATOM 0 HB2 ASN B 108 2.447 10.701 2.708 1.00 0.00 H new ATOM 0 HB3 ASN B 108 1.978 11.961 1.584 1.00 0.00 H new ATOM 0 HD21 ASN B 108 5.477 12.392 1.214 1.00 0.00 H new ATOM 0 HD22 ASN B 108 3.993 11.718 0.532 1.00 0.00 H new ATOM 1570 N GLN B 109 2.429 12.991 5.839 1.00 0.00 N ATOM 1571 CA GLN B 109 2.980 12.800 7.176 1.00 0.00 C ATOM 1572 C GLN B 109 2.189 11.797 8.023 1.00 0.00 C ATOM 1573 O GLN B 109 2.785 10.925 8.637 1.00 0.00 O ATOM 1574 CB GLN B 109 3.107 14.160 7.857 1.00 0.00 C ATOM 1575 CG GLN B 109 1.815 14.958 7.858 1.00 0.00 C ATOM 1576 CD GLN B 109 2.064 16.427 7.984 1.00 0.00 C ATOM 1577 OE1 GLN B 109 2.243 17.061 6.856 1.00 0.00 O flip ATOM 1578 NE2 GLN B 109 2.104 16.986 9.071 1.00 0.00 N flip ATOM 0 H GLN B 109 2.297 13.974 5.601 1.00 0.00 H new ATOM 0 HA GLN B 109 3.968 12.352 7.076 1.00 0.00 H new ATOM 0 HB2 GLN B 109 3.435 14.013 8.886 1.00 0.00 H new ATOM 0 HB3 GLN B 109 3.882 14.739 7.354 1.00 0.00 H new ATOM 0 HG2 GLN B 109 1.267 14.761 6.937 1.00 0.00 H new ATOM 0 HG3 GLN B 109 1.184 14.625 8.682 1.00 0.00 H new ATOM 0 HE21 GLN B 109 1.958 16.449 9.926 1.00 0.00 H new ATOM 0 HE22 GLN B 109 2.283 17.989 9.122 1.00 0.00 H new ATOM 1587 N THR B 110 0.859 11.868 7.991 1.00 0.00 N ATOM 1588 CA THR B 110 0.052 10.943 8.766 1.00 0.00 C ATOM 1589 C THR B 110 0.188 9.504 8.210 1.00 0.00 C ATOM 1590 O THR B 110 0.250 8.531 8.975 1.00 0.00 O ATOM 1591 CB THR B 110 -1.452 11.394 8.854 1.00 0.00 C ATOM 1592 OG1 THR B 110 -2.202 10.493 9.681 1.00 0.00 O ATOM 1593 CG2 THR B 110 -2.106 11.491 7.473 1.00 0.00 C ATOM 0 H THR B 110 0.329 12.547 7.444 1.00 0.00 H new ATOM 0 HA THR B 110 0.433 10.949 9.787 1.00 0.00 H new ATOM 0 HB THR B 110 -1.460 12.389 9.300 1.00 0.00 H new ATOM 0 HG1 THR B 110 -3.135 10.790 9.726 1.00 0.00 H new ATOM 0 HG21 THR B 110 -3.144 11.806 7.583 1.00 0.00 H new ATOM 0 HG22 THR B 110 -1.568 12.220 6.866 1.00 0.00 H new ATOM 0 HG23 THR B 110 -2.072 10.517 6.985 1.00 0.00 H new ATOM 1601 N LEU B 111 0.305 9.396 6.890 1.00 0.00 N ATOM 1602 CA LEU B 111 0.458 8.118 6.218 1.00 0.00 C ATOM 1603 C LEU B 111 1.858 7.557 6.440 1.00 0.00 C ATOM 1604 O LEU B 111 2.016 6.379 6.767 1.00 0.00 O ATOM 1605 CB LEU B 111 0.176 8.255 4.710 1.00 0.00 C ATOM 1606 CG LEU B 111 -1.105 7.591 4.164 1.00 0.00 C ATOM 1607 CD1 LEU B 111 -1.091 6.097 4.424 1.00 0.00 C ATOM 1608 CD2 LEU B 111 -2.375 8.237 4.725 1.00 0.00 C ATOM 0 H LEU B 111 0.296 10.197 6.258 1.00 0.00 H new ATOM 0 HA LEU B 111 -0.268 7.426 6.645 1.00 0.00 H new ATOM 0 HB2 LEU B 111 0.133 9.318 4.471 1.00 0.00 H new ATOM 0 HB3 LEU B 111 1.027 7.841 4.169 1.00 0.00 H new ATOM 0 HG LEU B 111 -1.117 7.752 3.086 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -2.004 5.651 4.030 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -0.227 5.650 3.932 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -1.032 5.915 5.497 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -3.251 7.736 4.312 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -2.382 8.143 5.811 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -2.398 9.292 4.452 1.00 0.00 H new ATOM 1620 N GLN B 112 2.866 8.416 6.281 1.00 0.00 N ATOM 1621 CA GLN B 112 4.265 8.010 6.441 1.00 0.00 C ATOM 1622 C GLN B 112 4.523 7.586 7.870 1.00 0.00 C ATOM 1623 O GLN B 112 5.226 6.609 8.117 1.00 0.00 O ATOM 1624 CB GLN B 112 5.248 9.135 6.093 1.00 0.00 C ATOM 1625 CG GLN B 112 5.031 9.804 4.758 1.00 0.00 C ATOM 1626 CD GLN B 112 5.180 8.888 3.565 1.00 0.00 C ATOM 1627 OE1 GLN B 112 4.522 9.081 2.563 1.00 0.00 O ATOM 1628 NE2 GLN B 112 6.074 7.928 3.637 1.00 0.00 N ATOM 0 H GLN B 112 2.740 9.399 6.041 1.00 0.00 H new ATOM 0 HA GLN B 112 4.427 7.182 5.751 1.00 0.00 H new ATOM 0 HB2 GLN B 112 5.193 9.895 6.873 1.00 0.00 H new ATOM 0 HB3 GLN B 112 6.259 8.729 6.115 1.00 0.00 H new ATOM 0 HG2 GLN B 112 4.032 10.240 4.743 1.00 0.00 H new ATOM 0 HG3 GLN B 112 5.739 10.627 4.659 1.00 0.00 H new ATOM 0 HE21 GLN B 112 6.610 7.793 4.494 1.00 0.00 H new ATOM 0 HE22 GLN B 112 6.232 7.317 2.835 1.00 0.00 H new ATOM 1637 N ASP B 113 3.956 8.325 8.812 1.00 0.00 N ATOM 1638 CA ASP B 113 4.112 8.013 10.222 1.00 0.00 C ATOM 1639 C ASP B 113 3.414 6.715 10.561 1.00 0.00 C ATOM 1640 O ASP B 113 3.960 5.900 11.298 1.00 0.00 O ATOM 1641 CB ASP B 113 3.615 9.147 11.117 1.00 0.00 C ATOM 1642 CG ASP B 113 3.760 8.831 12.589 1.00 0.00 C ATOM 1643 OD1 ASP B 113 4.883 8.487 13.033 1.00 0.00 O ATOM 1644 OD2 ASP B 113 2.759 8.905 13.328 1.00 0.00 O ATOM 0 H ASP B 113 3.382 9.147 8.623 1.00 0.00 H new ATOM 0 HA ASP B 113 5.179 7.895 10.414 1.00 0.00 H new ATOM 0 HB2 ASP B 113 4.171 10.056 10.888 1.00 0.00 H new ATOM 0 HB3 ASP B 113 2.567 9.349 10.894 1.00 0.00 H new ATOM 1649 N LEU B 114 2.224 6.515 9.993 1.00 0.00 N ATOM 1650 CA LEU B 114 1.469 5.265 10.168 1.00 0.00 C ATOM 1651 C LEU B 114 2.333 4.095 9.726 1.00 0.00 C ATOM 1652 O LEU B 114 2.575 3.153 10.505 1.00 0.00 O ATOM 1653 CB LEU B 114 0.166 5.303 9.348 1.00 0.00 C ATOM 1654 CG LEU B 114 -0.718 4.048 9.395 1.00 0.00 C ATOM 1655 CD1 LEU B 114 -1.224 3.781 10.804 1.00 0.00 C ATOM 1656 CD2 LEU B 114 -1.878 4.179 8.419 1.00 0.00 C ATOM 0 H LEU B 114 1.757 7.204 9.404 1.00 0.00 H new ATOM 0 HA LEU B 114 1.206 5.148 11.219 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -0.428 6.150 9.692 1.00 0.00 H new ATOM 0 HB3 LEU B 114 0.425 5.497 8.307 1.00 0.00 H new ATOM 0 HG LEU B 114 -0.109 3.195 9.097 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -1.847 2.886 10.804 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -0.376 3.633 11.473 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -1.812 4.632 11.147 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -2.495 3.281 8.464 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -2.481 5.047 8.685 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -1.490 4.302 7.408 1.00 0.00 H new ATOM 1668 N LEU B 115 2.834 4.201 8.491 1.00 0.00 N ATOM 1669 CA LEU B 115 3.741 3.224 7.915 1.00 0.00 C ATOM 1670 C LEU B 115 4.906 2.953 8.831 1.00 0.00 C ATOM 1671 O LEU B 115 5.031 1.881 9.367 1.00 0.00 O ATOM 1672 CB LEU B 115 4.343 3.740 6.617 1.00 0.00 C ATOM 1673 CG LEU B 115 3.566 3.668 5.331 1.00 0.00 C ATOM 1674 CD1 LEU B 115 4.392 4.345 4.247 1.00 0.00 C ATOM 1675 CD2 LEU B 115 3.278 2.220 4.951 1.00 0.00 C ATOM 0 H LEU B 115 2.615 4.976 7.865 1.00 0.00 H new ATOM 0 HA LEU B 115 3.151 2.322 7.751 1.00 0.00 H new ATOM 0 HB2 LEU B 115 4.603 4.786 6.777 1.00 0.00 H new ATOM 0 HB3 LEU B 115 5.277 3.200 6.459 1.00 0.00 H new ATOM 0 HG LEU B 115 2.607 4.172 5.449 1.00 0.00 H new ATOM 0 HD11 LEU B 115 3.852 4.308 3.301 1.00 0.00 H new ATOM 0 HD12 LEU B 115 4.571 5.385 4.522 1.00 0.00 H new ATOM 0 HD13 LEU B 115 5.346 3.829 4.141 1.00 0.00 H new ATOM 0 HD21 LEU B 115 2.715 2.194 4.018 1.00 0.00 H new ATOM 0 HD22 LEU B 115 4.218 1.684 4.823 1.00 0.00 H new ATOM 0 HD23 LEU B 115 2.694 1.746 5.740 1.00 0.00 H new ATOM 1687 N THR B 116 5.715 3.978 9.029 1.00 0.00 N ATOM 1688 CA THR B 116 6.977 3.882 9.734 1.00 0.00 C ATOM 1689 C THR B 116 6.820 3.383 11.179 1.00 0.00 C ATOM 1690 O THR B 116 7.686 2.664 11.693 1.00 0.00 O ATOM 1691 CB THR B 116 7.702 5.235 9.655 1.00 0.00 C ATOM 1692 OG1 THR B 116 7.741 5.629 8.263 1.00 0.00 O ATOM 1693 CG2 THR B 116 9.128 5.137 10.175 1.00 0.00 C ATOM 0 H THR B 116 5.507 4.920 8.696 1.00 0.00 H new ATOM 0 HA THR B 116 7.588 3.124 9.244 1.00 0.00 H new ATOM 0 HB THR B 116 7.170 5.961 10.269 1.00 0.00 H new ATOM 0 HG1 THR B 116 6.910 6.094 8.031 1.00 0.00 H new ATOM 0 HG21 THR B 116 9.609 6.112 10.104 1.00 0.00 H new ATOM 0 HG22 THR B 116 9.114 4.815 11.216 1.00 0.00 H new ATOM 0 HG23 THR B 116 9.684 4.414 9.578 1.00 0.00 H new ATOM 1701 N SER B 117 5.702 3.712 11.801 1.00 0.00 N ATOM 1702 CA SER B 117 5.440 3.235 13.130 1.00 0.00 C ATOM 1703 C SER B 117 5.192 1.740 13.108 1.00 0.00 C ATOM 1704 O SER B 117 5.787 1.007 13.864 1.00 0.00 O ATOM 1705 CB SER B 117 4.246 3.957 13.760 1.00 0.00 C ATOM 1706 OG SER B 117 4.488 5.354 13.853 1.00 0.00 O ATOM 0 H SER B 117 4.972 4.303 11.404 1.00 0.00 H new ATOM 0 HA SER B 117 6.318 3.446 13.740 1.00 0.00 H new ATOM 0 HB2 SER B 117 3.352 3.778 13.163 1.00 0.00 H new ATOM 0 HB3 SER B 117 4.053 3.551 14.753 1.00 0.00 H new ATOM 0 HG SER B 117 4.459 5.751 12.958 1.00 0.00 H new ATOM 1712 N ASP B 118 4.356 1.294 12.210 1.00 0.00 N ATOM 1713 CA ASP B 118 3.991 -0.111 12.165 1.00 0.00 C ATOM 1714 C ASP B 118 5.110 -0.977 11.542 1.00 0.00 C ATOM 1715 O ASP B 118 5.357 -2.099 11.987 1.00 0.00 O ATOM 1716 CB ASP B 118 2.655 -0.277 11.421 1.00 0.00 C ATOM 1717 CG ASP B 118 2.089 -1.684 11.466 1.00 0.00 C ATOM 1718 OD1 ASP B 118 2.221 -2.366 12.495 1.00 0.00 O ATOM 1719 OD2 ASP B 118 1.411 -2.106 10.493 1.00 0.00 O ATOM 0 H ASP B 118 3.912 1.874 11.498 1.00 0.00 H new ATOM 0 HA ASP B 118 3.864 -0.468 13.187 1.00 0.00 H new ATOM 0 HB2 ASP B 118 1.925 0.410 11.850 1.00 0.00 H new ATOM 0 HB3 ASP B 118 2.793 0.014 10.380 1.00 0.00 H new ATOM 1724 N SER B 119 5.823 -0.428 10.571 1.00 0.00 N ATOM 1725 CA SER B 119 6.834 -1.171 9.827 1.00 0.00 C ATOM 1726 C SER B 119 8.112 -1.428 10.617 1.00 0.00 C ATOM 1727 O SER B 119 8.550 -2.580 10.779 1.00 0.00 O ATOM 1728 CB SER B 119 7.161 -0.443 8.504 1.00 0.00 C ATOM 1729 OG SER B 119 7.600 0.897 8.733 1.00 0.00 O ATOM 0 H SER B 119 5.719 0.543 10.275 1.00 0.00 H new ATOM 0 HA SER B 119 6.403 -2.151 9.619 1.00 0.00 H new ATOM 0 HB2 SER B 119 7.934 -0.993 7.968 1.00 0.00 H new ATOM 0 HB3 SER B 119 6.277 -0.432 7.866 1.00 0.00 H new ATOM 0 HG SER B 119 7.479 1.425 7.916 1.00 0.00 H new ATOM 1735 N LEU B 120 8.697 -0.381 11.135 1.00 0.00 N ATOM 1736 CA LEU B 120 9.979 -0.496 11.773 1.00 0.00 C ATOM 1737 C LEU B 120 9.894 -0.991 13.215 1.00 0.00 C ATOM 1738 O LEU B 120 10.904 -1.428 13.786 1.00 0.00 O ATOM 1739 CB LEU B 120 10.789 0.791 11.610 1.00 0.00 C ATOM 1740 CG LEU B 120 11.195 1.143 10.154 1.00 0.00 C ATOM 1741 CD1 LEU B 120 11.870 2.496 10.107 1.00 0.00 C ATOM 1742 CD2 LEU B 120 12.142 0.084 9.597 1.00 0.00 C ATOM 0 H LEU B 120 8.305 0.561 11.127 1.00 0.00 H new ATOM 0 HA LEU B 120 10.529 -1.282 11.255 1.00 0.00 H new ATOM 0 HB2 LEU B 120 10.209 1.619 12.018 1.00 0.00 H new ATOM 0 HB3 LEU B 120 11.694 0.709 12.212 1.00 0.00 H new ATOM 0 HG LEU B 120 10.291 1.173 9.546 1.00 0.00 H new ATOM 0 HD11 LEU B 120 12.149 2.728 9.079 1.00 0.00 H new ATOM 0 HD12 LEU B 120 11.184 3.258 10.478 1.00 0.00 H new ATOM 0 HD13 LEU B 120 12.764 2.478 10.730 1.00 0.00 H new ATOM 0 HD21 LEU B 120 12.418 0.344 8.575 1.00 0.00 H new ATOM 0 HD22 LEU B 120 13.039 0.037 10.215 1.00 0.00 H new ATOM 0 HD23 LEU B 120 11.646 -0.887 9.603 1.00 0.00 H new ATOM 1754 N SER B 121 8.684 -0.995 13.788 1.00 0.00 N ATOM 1755 CA SER B 121 8.483 -1.524 15.140 1.00 0.00 C ATOM 1756 C SER B 121 8.657 -3.036 15.190 1.00 0.00 C ATOM 1757 O SER B 121 8.738 -3.629 16.271 1.00 0.00 O ATOM 1758 CB SER B 121 7.150 -1.100 15.738 1.00 0.00 C ATOM 1759 OG SER B 121 7.126 0.302 15.946 1.00 0.00 O ATOM 0 H SER B 121 7.838 -0.641 13.341 1.00 0.00 H new ATOM 0 HA SER B 121 9.263 -1.083 15.760 1.00 0.00 H new ATOM 0 HB2 SER B 121 6.337 -1.389 15.072 1.00 0.00 H new ATOM 0 HB3 SER B 121 6.987 -1.617 16.684 1.00 0.00 H new ATOM 0 HG SER B 121 6.752 0.744 15.155 1.00 0.00 H new ATOM 1765 N HIS B 122 8.718 -3.656 14.012 1.00 0.00 N ATOM 1766 CA HIS B 122 9.022 -5.072 13.886 1.00 0.00 C ATOM 1767 C HIS B 122 10.426 -5.309 14.467 1.00 0.00 C ATOM 1768 O HIS B 122 10.722 -6.361 15.053 1.00 0.00 O ATOM 1769 CB HIS B 122 8.970 -5.473 12.400 1.00 0.00 C ATOM 1770 CG HIS B 122 9.233 -6.924 12.118 1.00 0.00 C ATOM 1771 ND1 HIS B 122 10.365 -7.389 11.488 1.00 0.00 N ATOM 1772 CD2 HIS B 122 8.470 -8.012 12.363 1.00 0.00 C ATOM 1773 CE1 HIS B 122 10.263 -8.707 11.369 1.00 0.00 C ATOM 1774 NE2 HIS B 122 9.123 -9.144 11.886 1.00 0.00 N ATOM 0 H HIS B 122 8.557 -3.186 13.121 1.00 0.00 H new ATOM 0 HA HIS B 122 8.296 -5.678 14.428 1.00 0.00 H new ATOM 0 HB2 HIS B 122 7.987 -5.215 12.005 1.00 0.00 H new ATOM 0 HB3 HIS B 122 9.700 -4.875 11.854 1.00 0.00 H new ATOM 0 HD2 HIS B 122 7.507 -8.004 12.851 1.00 0.00 H new ATOM 0 HE1 HIS B 122 11.010 -9.339 10.912 1.00 0.00 H new ATOM 0 HE2 HIS B 122 8.794 -10.109 11.926 1.00 0.00 H new ATOM 1782 N SER B 123 11.261 -4.306 14.326 1.00 0.00 N ATOM 1783 CA SER B 123 12.573 -4.320 14.873 1.00 0.00 C ATOM 1784 C SER B 123 12.543 -3.610 16.244 1.00 0.00 C ATOM 1785 O SER B 123 12.786 -4.241 17.280 1.00 0.00 O ATOM 1786 CB SER B 123 13.515 -3.630 13.903 1.00 0.00 C ATOM 1787 OG SER B 123 13.332 -4.158 12.589 1.00 0.00 O ATOM 0 H SER B 123 11.033 -3.451 13.819 1.00 0.00 H new ATOM 0 HA SER B 123 12.928 -5.340 15.023 1.00 0.00 H new ATOM 0 HB2 SER B 123 13.328 -2.556 13.902 1.00 0.00 H new ATOM 0 HB3 SER B 123 14.548 -3.773 14.221 1.00 0.00 H new ATOM 0 HG SER B 123 13.941 -3.708 11.968 1.00 0.00 H new ATOM 1793 N ASP B 124 12.186 -2.327 16.260 1.00 0.00 N ATOM 1794 CA ASP B 124 12.095 -1.562 17.510 1.00 0.00 C ATOM 1795 C ASP B 124 11.050 -0.481 17.375 1.00 0.00 C ATOM 1796 O ASP B 124 10.887 0.090 16.303 1.00 0.00 O ATOM 1797 CB ASP B 124 13.447 -0.937 17.942 1.00 0.00 C ATOM 1798 CG ASP B 124 13.990 0.143 17.022 1.00 0.00 C ATOM 1799 OD1 ASP B 124 13.581 1.322 17.135 1.00 0.00 O ATOM 1800 OD2 ASP B 124 14.881 -0.151 16.210 1.00 0.00 O ATOM 0 H ASP B 124 11.954 -1.792 15.423 1.00 0.00 H new ATOM 0 HA ASP B 124 11.810 -2.267 18.291 1.00 0.00 H new ATOM 0 HB2 ASP B 124 13.330 -0.515 18.940 1.00 0.00 H new ATOM 0 HB3 ASP B 124 14.188 -1.733 18.017 1.00 0.00 H new ATOM 1805 N GLY B 125 10.336 -0.222 18.439 1.00 0.00 N ATOM 1806 CA GLY B 125 9.292 0.775 18.415 1.00 0.00 C ATOM 1807 C GLY B 125 8.016 0.241 19.027 1.00 0.00 C ATOM 1808 O GLY B 125 7.937 -0.953 19.365 1.00 0.00 O ATOM 0 H GLY B 125 10.457 -0.689 19.338 1.00 0.00 H new ATOM 0 HA2 GLY B 125 9.618 1.661 18.960 1.00 0.00 H new ATOM 0 HA3 GLY B 125 9.104 1.085 17.387 1.00 0.00 H new ATOM 1812 N GLY B 126 7.026 1.087 19.172 1.00 0.00 N ATOM 1813 CA GLY B 126 5.770 0.672 19.762 1.00 0.00 C ATOM 1814 C GLY B 126 4.603 0.905 18.830 1.00 0.00 C ATOM 1815 O GLY B 126 3.446 0.952 19.266 1.00 0.00 O ATOM 0 H GLY B 126 7.062 2.067 18.891 1.00 0.00 H new ATOM 0 HA2 GLY B 126 5.822 -0.386 20.020 1.00 0.00 H new ATOM 0 HA3 GLY B 126 5.607 1.219 20.691 1.00 0.00 H new ATOM 1819 N GLY B 127 4.905 1.039 17.553 1.00 0.00 N ATOM 1820 CA GLY B 127 3.896 1.297 16.561 1.00 0.00 C ATOM 1821 C GLY B 127 3.005 0.103 16.338 1.00 0.00 C ATOM 1822 O GLY B 127 3.478 -0.976 15.972 1.00 0.00 O ATOM 0 H GLY B 127 5.853 0.971 17.182 1.00 0.00 H new ATOM 0 HA2 GLY B 127 3.290 2.148 16.873 1.00 0.00 H new ATOM 0 HA3 GLY B 127 4.374 1.573 15.621 1.00 0.00 H new ATOM 1826 N SER B 128 1.733 0.283 16.574 1.00 0.00 N ATOM 1827 CA SER B 128 0.775 -0.781 16.428 1.00 0.00 C ATOM 1828 C SER B 128 -0.458 -0.277 15.665 1.00 0.00 C ATOM 1829 O SER B 128 -1.452 -1.008 15.496 1.00 0.00 O ATOM 1830 CB SER B 128 0.389 -1.300 17.828 1.00 0.00 C ATOM 1831 OG SER B 128 -0.483 -2.416 17.771 1.00 0.00 O ATOM 0 H SER B 128 1.331 1.172 16.873 1.00 0.00 H new ATOM 0 HA SER B 128 1.209 -1.600 15.854 1.00 0.00 H new ATOM 0 HB2 SER B 128 1.293 -1.576 18.372 1.00 0.00 H new ATOM 0 HB3 SER B 128 -0.089 -0.498 18.391 1.00 0.00 H new ATOM 0 HG SER B 128 -1.067 -2.335 16.988 1.00 0.00 H new ATOM 1837 N GLY B 129 -0.387 0.964 15.196 1.00 0.00 N ATOM 1838 CA GLY B 129 -1.484 1.569 14.467 1.00 0.00 C ATOM 1839 C GLY B 129 -1.767 0.855 13.166 1.00 0.00 C ATOM 1840 O GLY B 129 -0.863 0.282 12.557 1.00 0.00 O ATOM 0 H GLY B 129 0.426 1.570 15.311 1.00 0.00 H new ATOM 0 HA2 GLY B 129 -2.380 1.559 15.088 1.00 0.00 H new ATOM 0 HA3 GLY B 129 -1.250 2.614 14.263 1.00 0.00 H new ATOM 1844 N GLY B 130 -3.004 0.867 12.748 1.00 0.00 N ATOM 1845 CA GLY B 130 -3.374 0.188 11.542 1.00 0.00 C ATOM 1846 C GLY B 130 -4.435 0.931 10.789 1.00 0.00 C ATOM 1847 O GLY B 130 -4.133 1.690 9.871 1.00 0.00 O ATOM 0 H GLY B 130 -3.770 1.340 13.227 1.00 0.00 H new ATOM 0 HA2 GLY B 130 -2.495 0.067 10.908 1.00 0.00 H new ATOM 0 HA3 GLY B 130 -3.733 -0.813 11.783 1.00 0.00 H new ATOM 1851 N GLY B 131 -5.662 0.754 11.197 1.00 0.00 N ATOM 1852 CA GLY B 131 -6.767 1.390 10.531 1.00 0.00 C ATOM 1853 C GLY B 131 -8.068 0.781 10.962 1.00 0.00 C ATOM 1854 O GLY B 131 -8.079 -0.098 11.827 1.00 0.00 O ATOM 0 H GLY B 131 -5.923 0.171 11.992 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -6.767 2.457 10.755 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -6.653 1.291 9.452 1.00 0.00 H new ATOM 1858 N SER B 132 -9.148 1.230 10.381 1.00 0.00 N ATOM 1859 CA SER B 132 -10.463 0.726 10.714 1.00 0.00 C ATOM 1860 C SER B 132 -10.878 -0.355 9.708 1.00 0.00 C ATOM 1861 O SER B 132 -11.714 -1.230 10.005 1.00 0.00 O ATOM 1862 CB SER B 132 -11.481 1.893 10.694 1.00 0.00 C ATOM 1863 OG SER B 132 -12.797 1.486 11.093 1.00 0.00 O ATOM 0 H SER B 132 -9.146 1.955 9.663 1.00 0.00 H new ATOM 0 HA SER B 132 -10.442 0.286 11.711 1.00 0.00 H new ATOM 0 HB2 SER B 132 -11.133 2.685 11.358 1.00 0.00 H new ATOM 0 HB3 SER B 132 -11.524 2.315 9.690 1.00 0.00 H new ATOM 0 HG SER B 132 -13.401 2.258 11.065 1.00 0.00 H new ATOM 1869 N GLY B 133 -10.277 -0.316 8.547 1.00 0.00 N ATOM 1870 CA GLY B 133 -10.678 -1.187 7.491 1.00 0.00 C ATOM 1871 C GLY B 133 -11.769 -0.510 6.717 1.00 0.00 C ATOM 1872 O GLY B 133 -11.553 0.582 6.174 1.00 0.00 O ATOM 0 H GLY B 133 -9.508 0.313 8.316 1.00 0.00 H new ATOM 0 HA2 GLY B 133 -9.832 -1.411 6.841 1.00 0.00 H new ATOM 0 HA3 GLY B 133 -11.030 -2.137 7.894 1.00 0.00 H new ATOM 1876 N GLY B 134 -12.934 -1.101 6.672 1.00 0.00 N ATOM 1877 CA GLY B 134 -14.031 -0.435 6.023 1.00 0.00 C ATOM 1878 C GLY B 134 -15.185 -1.337 5.714 1.00 0.00 C ATOM 1879 O GLY B 134 -16.246 -1.235 6.340 1.00 0.00 O ATOM 0 H GLY B 134 -13.145 -2.018 7.066 1.00 0.00 H new ATOM 0 HA2 GLY B 134 -14.378 0.379 6.659 1.00 0.00 H new ATOM 0 HA3 GLY B 134 -13.674 0.015 5.096 1.00 0.00 H new ATOM 1883 N GLY B 135 -14.994 -2.216 4.778 1.00 0.00 N ATOM 1884 CA GLY B 135 -16.055 -3.068 4.344 1.00 0.00 C ATOM 1885 C GLY B 135 -16.194 -2.999 2.851 1.00 0.00 C ATOM 1886 O GLY B 135 -15.184 -2.924 2.150 1.00 0.00 O ATOM 0 H GLY B 135 -14.106 -2.361 4.298 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -15.856 -4.095 4.651 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -16.990 -2.768 4.818 1.00 0.00 H new ATOM 1890 N SER B 136 -17.417 -2.945 2.368 1.00 0.00 N ATOM 1891 CA SER B 136 -17.715 -2.932 0.945 1.00 0.00 C ATOM 1892 C SER B 136 -17.445 -1.568 0.270 1.00 0.00 C ATOM 1893 O SER B 136 -18.336 -0.952 -0.322 1.00 0.00 O ATOM 1894 CB SER B 136 -19.153 -3.386 0.723 1.00 0.00 C ATOM 1895 OG SER B 136 -19.361 -4.668 1.306 1.00 0.00 O ATOM 0 H SER B 136 -18.247 -2.908 2.959 1.00 0.00 H new ATOM 0 HA SER B 136 -17.031 -3.631 0.464 1.00 0.00 H new ATOM 0 HB2 SER B 136 -19.842 -2.663 1.161 1.00 0.00 H new ATOM 0 HB3 SER B 136 -19.369 -3.425 -0.345 1.00 0.00 H new ATOM 0 HG SER B 136 -20.288 -4.948 1.158 1.00 0.00 H new ATOM 1901 N LEU B 137 -16.225 -1.106 0.388 1.00 0.00 N ATOM 1902 CA LEU B 137 -15.777 0.106 -0.281 1.00 0.00 C ATOM 1903 C LEU B 137 -14.910 -0.310 -1.455 1.00 0.00 C ATOM 1904 O LEU B 137 -14.931 0.297 -2.537 1.00 0.00 O ATOM 1905 CB LEU B 137 -14.967 1.035 0.666 1.00 0.00 C ATOM 1906 CG LEU B 137 -15.720 1.779 1.799 1.00 0.00 C ATOM 1907 CD1 LEU B 137 -16.292 0.833 2.845 1.00 0.00 C ATOM 1908 CD2 LEU B 137 -14.802 2.797 2.457 1.00 0.00 C ATOM 0 H LEU B 137 -15.505 -1.557 0.952 1.00 0.00 H new ATOM 0 HA LEU B 137 -16.649 0.672 -0.609 1.00 0.00 H new ATOM 0 HB2 LEU B 137 -14.184 0.434 1.128 1.00 0.00 H new ATOM 0 HB3 LEU B 137 -14.472 1.785 0.050 1.00 0.00 H new ATOM 0 HG LEU B 137 -16.565 2.290 1.338 1.00 0.00 H new ATOM 0 HD11 LEU B 137 -16.808 1.409 3.613 1.00 0.00 H new ATOM 0 HD12 LEU B 137 -16.995 0.149 2.371 1.00 0.00 H new ATOM 0 HD13 LEU B 137 -15.483 0.263 3.301 1.00 0.00 H new ATOM 0 HD21 LEU B 137 -15.341 3.313 3.251 1.00 0.00 H new ATOM 0 HD22 LEU B 137 -13.936 2.287 2.879 1.00 0.00 H new ATOM 0 HD23 LEU B 137 -14.470 3.521 1.713 1.00 0.00 H new ATOM 1920 N GLU B 138 -14.209 -1.409 -1.246 1.00 0.00 N ATOM 1921 CA GLU B 138 -13.306 -1.982 -2.229 1.00 0.00 C ATOM 1922 C GLU B 138 -14.041 -2.490 -3.450 1.00 0.00 C ATOM 1923 O GLU B 138 -13.516 -2.432 -4.538 1.00 0.00 O ATOM 1924 CB GLU B 138 -12.415 -3.083 -1.611 1.00 0.00 C ATOM 1925 CG GLU B 138 -13.040 -3.845 -0.426 1.00 0.00 C ATOM 1926 CD GLU B 138 -14.304 -4.588 -0.777 1.00 0.00 C ATOM 1927 OE1 GLU B 138 -14.232 -5.727 -1.222 1.00 0.00 O ATOM 1928 OE2 GLU B 138 -15.395 -4.020 -0.628 1.00 0.00 O ATOM 0 H GLU B 138 -14.251 -1.938 -0.375 1.00 0.00 H new ATOM 0 HA GLU B 138 -12.652 -1.176 -2.561 1.00 0.00 H new ATOM 0 HB2 GLU B 138 -12.160 -3.801 -2.390 1.00 0.00 H new ATOM 0 HB3 GLU B 138 -11.482 -2.629 -1.278 1.00 0.00 H new ATOM 0 HG2 GLU B 138 -12.309 -4.554 -0.037 1.00 0.00 H new ATOM 0 HG3 GLU B 138 -13.256 -3.138 0.375 1.00 0.00 H new ATOM 1935 N CYS B 139 -15.273 -2.946 -3.252 1.00 0.00 N ATOM 1936 CA CYS B 139 -16.120 -3.476 -4.325 1.00 0.00 C ATOM 1937 C CYS B 139 -16.238 -2.500 -5.504 1.00 0.00 C ATOM 1938 O CYS B 139 -16.312 -2.912 -6.658 1.00 0.00 O ATOM 1939 CB CYS B 139 -17.510 -3.794 -3.776 1.00 0.00 C ATOM 1940 SG CYS B 139 -17.512 -4.958 -2.395 1.00 0.00 S ATOM 0 H CYS B 139 -15.720 -2.960 -2.335 1.00 0.00 H new ATOM 0 HA CYS B 139 -15.649 -4.386 -4.697 1.00 0.00 H new ATOM 0 HB2 CYS B 139 -17.983 -2.866 -3.455 1.00 0.00 H new ATOM 0 HB3 CYS B 139 -18.122 -4.201 -4.581 1.00 0.00 H new ATOM 0 HG CYS B 139 -16.711 -4.530 -1.465 1.00 0.00 H new ATOM 1946 N ASP B 140 -16.224 -1.219 -5.215 1.00 0.00 N ATOM 1947 CA ASP B 140 -16.356 -0.211 -6.257 1.00 0.00 C ATOM 1948 C ASP B 140 -14.983 0.168 -6.790 1.00 0.00 C ATOM 1949 O ASP B 140 -14.790 0.356 -7.994 1.00 0.00 O ATOM 1950 CB ASP B 140 -17.048 1.015 -5.711 1.00 0.00 C ATOM 1951 CG ASP B 140 -17.415 1.993 -6.794 1.00 0.00 C ATOM 1952 OD1 ASP B 140 -16.577 2.815 -7.180 1.00 0.00 O ATOM 1953 OD2 ASP B 140 -18.567 1.969 -7.266 1.00 0.00 O ATOM 0 H ASP B 140 -16.123 -0.845 -4.271 1.00 0.00 H new ATOM 0 HA ASP B 140 -16.954 -0.623 -7.070 1.00 0.00 H new ATOM 0 HB2 ASP B 140 -17.949 0.713 -5.176 1.00 0.00 H new ATOM 0 HB3 ASP B 140 -16.397 1.505 -4.987 1.00 0.00 H new ATOM 1958 N MET B 141 -14.022 0.231 -5.870 1.00 0.00 N ATOM 1959 CA MET B 141 -12.628 0.553 -6.141 1.00 0.00 C ATOM 1960 C MET B 141 -12.030 -0.500 -7.111 1.00 0.00 C ATOM 1961 O MET B 141 -11.058 -0.244 -7.814 1.00 0.00 O ATOM 1962 CB MET B 141 -11.877 0.523 -4.796 1.00 0.00 C ATOM 1963 CG MET B 141 -10.556 1.267 -4.754 1.00 0.00 C ATOM 1964 SD MET B 141 -10.771 3.050 -4.929 1.00 0.00 S ATOM 1965 CE MET B 141 -9.088 3.620 -4.686 1.00 0.00 C ATOM 0 H MET B 141 -14.202 0.053 -4.882 1.00 0.00 H new ATOM 0 HA MET B 141 -12.538 1.535 -6.605 1.00 0.00 H new ATOM 0 HB2 MET B 141 -12.530 0.939 -4.029 1.00 0.00 H new ATOM 0 HB3 MET B 141 -11.694 -0.518 -4.528 1.00 0.00 H new ATOM 0 HG2 MET B 141 -10.051 1.055 -3.812 1.00 0.00 H new ATOM 0 HG3 MET B 141 -9.909 0.901 -5.551 1.00 0.00 H new ATOM 0 HE1 MET B 141 -9.023 4.172 -3.748 1.00 0.00 H new ATOM 0 HE2 MET B 141 -8.415 2.763 -4.650 1.00 0.00 H new ATOM 0 HE3 MET B 141 -8.802 4.272 -5.511 1.00 0.00 H new ATOM 1975 N GLU B 142 -12.654 -1.672 -7.136 1.00 0.00 N ATOM 1976 CA GLU B 142 -12.281 -2.772 -8.003 1.00 0.00 C ATOM 1977 C GLU B 142 -12.222 -2.441 -9.488 1.00 0.00 C ATOM 1978 O GLU B 142 -11.556 -3.133 -10.198 1.00 0.00 O ATOM 1979 CB GLU B 142 -13.081 -4.042 -7.758 1.00 0.00 C ATOM 1980 CG GLU B 142 -12.777 -4.712 -6.433 1.00 0.00 C ATOM 1981 CD GLU B 142 -13.414 -6.069 -6.316 1.00 0.00 C ATOM 1982 OE1 GLU B 142 -14.661 -6.186 -6.429 1.00 0.00 O ATOM 1983 OE2 GLU B 142 -12.677 -7.062 -6.103 1.00 0.00 O ATOM 0 H GLU B 142 -13.452 -1.884 -6.537 1.00 0.00 H new ATOM 0 HA GLU B 142 -11.251 -2.967 -7.704 1.00 0.00 H new ATOM 0 HB2 GLU B 142 -14.144 -3.804 -7.798 1.00 0.00 H new ATOM 0 HB3 GLU B 142 -12.881 -4.747 -8.565 1.00 0.00 H new ATOM 0 HG2 GLU B 142 -11.698 -4.809 -6.318 1.00 0.00 H new ATOM 0 HG3 GLU B 142 -13.128 -4.078 -5.619 1.00 0.00 H new ATOM 1990 N SER B 143 -12.956 -1.448 -9.965 1.00 0.00 N ATOM 1991 CA SER B 143 -12.908 -1.105 -11.388 1.00 0.00 C ATOM 1992 C SER B 143 -11.486 -0.617 -11.793 1.00 0.00 C ATOM 1993 O SER B 143 -10.782 -1.256 -12.628 1.00 0.00 O ATOM 1994 CB SER B 143 -13.974 -0.050 -11.687 1.00 0.00 C ATOM 1995 OG SER B 143 -13.854 1.047 -10.791 1.00 0.00 O ATOM 0 H SER B 143 -13.583 -0.871 -9.404 1.00 0.00 H new ATOM 0 HA SER B 143 -13.120 -1.993 -11.984 1.00 0.00 H new ATOM 0 HB2 SER B 143 -13.870 0.299 -12.714 1.00 0.00 H new ATOM 0 HB3 SER B 143 -14.966 -0.492 -11.599 1.00 0.00 H new ATOM 0 HG SER B 143 -14.298 0.828 -9.945 1.00 0.00 H new ATOM 2001 N ILE B 144 -11.040 0.464 -11.147 1.00 0.00 N ATOM 2002 CA ILE B 144 -9.702 1.008 -11.363 1.00 0.00 C ATOM 2003 C ILE B 144 -8.651 -0.024 -10.965 1.00 0.00 C ATOM 2004 O ILE B 144 -7.616 -0.184 -11.621 1.00 0.00 O ATOM 2005 CB ILE B 144 -9.461 2.352 -10.593 1.00 0.00 C ATOM 2006 CG1 ILE B 144 -9.965 2.261 -9.137 1.00 0.00 C ATOM 2007 CG2 ILE B 144 -10.131 3.507 -11.326 1.00 0.00 C ATOM 2008 CD1 ILE B 144 -9.439 3.327 -8.196 1.00 0.00 C ATOM 0 H ILE B 144 -11.594 0.982 -10.465 1.00 0.00 H new ATOM 0 HA ILE B 144 -9.615 1.234 -12.426 1.00 0.00 H new ATOM 0 HB ILE B 144 -8.387 2.536 -10.559 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -11.054 2.313 -9.144 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -9.695 1.283 -8.738 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -9.956 4.434 -10.781 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -9.714 3.592 -12.330 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -11.203 3.322 -11.393 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -9.855 3.171 -7.201 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -8.352 3.266 -8.149 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -9.732 4.311 -8.561 1.00 0.00 H new ATOM 2020 N ILE B 145 -8.970 -0.767 -9.938 1.00 0.00 N ATOM 2021 CA ILE B 145 -8.122 -1.809 -9.439 1.00 0.00 C ATOM 2022 C ILE B 145 -8.008 -2.968 -10.414 1.00 0.00 C ATOM 2023 O ILE B 145 -6.961 -3.538 -10.545 1.00 0.00 O ATOM 2024 CB ILE B 145 -8.569 -2.239 -8.011 1.00 0.00 C ATOM 2025 CG1 ILE B 145 -7.812 -1.432 -6.949 1.00 0.00 C ATOM 2026 CG2 ILE B 145 -8.448 -3.755 -7.745 1.00 0.00 C ATOM 2027 CD1 ILE B 145 -7.848 0.071 -7.092 1.00 0.00 C ATOM 0 H ILE B 145 -9.841 -0.661 -9.419 1.00 0.00 H new ATOM 0 HA ILE B 145 -7.110 -1.416 -9.347 1.00 0.00 H new ATOM 0 HB ILE B 145 -9.634 -2.016 -7.946 1.00 0.00 H new ATOM 0 HG12 ILE B 145 -8.217 -1.691 -5.971 1.00 0.00 H new ATOM 0 HG13 ILE B 145 -6.770 -1.751 -6.957 1.00 0.00 H new ATOM 0 HG21 ILE B 145 -8.778 -3.974 -6.730 1.00 0.00 H new ATOM 0 HG22 ILE B 145 -9.071 -4.300 -8.454 1.00 0.00 H new ATOM 0 HG23 ILE B 145 -7.409 -4.063 -7.863 1.00 0.00 H new ATOM 0 HD11 ILE B 145 -7.278 0.527 -6.283 1.00 0.00 H new ATOM 0 HD12 ILE B 145 -7.411 0.356 -8.049 1.00 0.00 H new ATOM 0 HD13 ILE B 145 -8.881 0.416 -7.047 1.00 0.00 H new ATOM 2039 N ARG B 146 -9.071 -3.256 -11.132 1.00 0.00 N ATOM 2040 CA ARG B 146 -9.081 -4.321 -12.120 1.00 0.00 C ATOM 2041 C ARG B 146 -8.132 -3.970 -13.229 1.00 0.00 C ATOM 2042 O ARG B 146 -7.282 -4.781 -13.618 1.00 0.00 O ATOM 2043 CB ARG B 146 -10.489 -4.539 -12.679 1.00 0.00 C ATOM 2044 CG ARG B 146 -10.593 -5.667 -13.678 1.00 0.00 C ATOM 2045 CD ARG B 146 -12.020 -5.871 -14.123 1.00 0.00 C ATOM 2046 NE ARG B 146 -12.130 -6.947 -15.104 1.00 0.00 N ATOM 2047 CZ ARG B 146 -12.946 -8.001 -15.007 1.00 0.00 C ATOM 2048 NH1 ARG B 146 -13.657 -8.214 -13.893 1.00 0.00 N ATOM 2049 NH2 ARG B 146 -13.026 -8.864 -16.008 1.00 0.00 N ATOM 0 H ARG B 146 -9.958 -2.759 -11.049 1.00 0.00 H new ATOM 0 HA ARG B 146 -8.765 -5.249 -11.643 1.00 0.00 H new ATOM 0 HB2 ARG B 146 -11.169 -4.739 -11.851 1.00 0.00 H new ATOM 0 HB3 ARG B 146 -10.826 -3.617 -13.153 1.00 0.00 H new ATOM 0 HG2 ARG B 146 -9.967 -5.449 -14.543 1.00 0.00 H new ATOM 0 HG3 ARG B 146 -10.213 -6.587 -13.233 1.00 0.00 H new ATOM 0 HD2 ARG B 146 -12.642 -6.102 -13.258 1.00 0.00 H new ATOM 0 HD3 ARG B 146 -12.403 -4.946 -14.553 1.00 0.00 H new ATOM 0 HE ARG B 146 -11.535 -6.890 -15.931 1.00 0.00 H new ATOM 0 HH11 ARG B 146 -13.579 -7.569 -13.107 1.00 0.00 H new ATOM 0 HH12 ARG B 146 -14.277 -9.022 -13.830 1.00 0.00 H new ATOM 0 HH21 ARG B 146 -12.466 -8.723 -16.849 1.00 0.00 H new ATOM 0 HH22 ARG B 146 -13.647 -9.670 -15.938 1.00 0.00 H new ATOM 2063 N SER B 147 -8.239 -2.742 -13.709 1.00 0.00 N ATOM 2064 CA SER B 147 -7.357 -2.282 -14.750 1.00 0.00 C ATOM 2065 C SER B 147 -5.886 -2.247 -14.287 1.00 0.00 C ATOM 2066 O SER B 147 -4.974 -2.535 -15.064 1.00 0.00 O ATOM 2067 CB SER B 147 -7.836 -0.936 -15.293 1.00 0.00 C ATOM 2068 OG SER B 147 -8.186 -0.036 -14.240 1.00 0.00 O ATOM 0 H SER B 147 -8.924 -2.056 -13.393 1.00 0.00 H new ATOM 0 HA SER B 147 -7.391 -2.999 -15.570 1.00 0.00 H new ATOM 0 HB2 SER B 147 -7.052 -0.491 -15.906 1.00 0.00 H new ATOM 0 HB3 SER B 147 -8.699 -1.091 -15.941 1.00 0.00 H new ATOM 0 HG SER B 147 -7.737 -0.310 -13.413 1.00 0.00 H new ATOM 2074 N GLU B 148 -5.666 -1.941 -13.016 1.00 0.00 N ATOM 2075 CA GLU B 148 -4.322 -1.882 -12.474 1.00 0.00 C ATOM 2076 C GLU B 148 -3.752 -3.259 -12.114 1.00 0.00 C ATOM 2077 O GLU B 148 -2.560 -3.490 -12.294 1.00 0.00 O ATOM 2078 CB GLU B 148 -4.229 -0.902 -11.310 1.00 0.00 C ATOM 2079 CG GLU B 148 -4.413 0.542 -11.750 1.00 0.00 C ATOM 2080 CD GLU B 148 -4.316 1.528 -10.619 1.00 0.00 C ATOM 2081 OE1 GLU B 148 -3.221 1.663 -10.020 1.00 0.00 O ATOM 2082 OE2 GLU B 148 -5.308 2.230 -10.342 1.00 0.00 O ATOM 0 H GLU B 148 -6.403 -1.730 -12.343 1.00 0.00 H new ATOM 0 HA GLU B 148 -3.688 -1.502 -13.275 1.00 0.00 H new ATOM 0 HB2 GLU B 148 -4.987 -1.152 -10.567 1.00 0.00 H new ATOM 0 HB3 GLU B 148 -3.259 -1.010 -10.825 1.00 0.00 H new ATOM 0 HG2 GLU B 148 -3.659 0.785 -12.499 1.00 0.00 H new ATOM 0 HG3 GLU B 148 -5.386 0.646 -12.231 1.00 0.00 H new ATOM 2089 N LEU B 149 -4.593 -4.180 -11.624 1.00 0.00 N ATOM 2090 CA LEU B 149 -4.131 -5.528 -11.275 1.00 0.00 C ATOM 2091 C LEU B 149 -3.885 -6.356 -12.528 1.00 0.00 C ATOM 2092 O LEU B 149 -3.101 -7.300 -12.508 1.00 0.00 O ATOM 2093 CB LEU B 149 -5.053 -6.270 -10.224 1.00 0.00 C ATOM 2094 CG LEU B 149 -6.534 -6.555 -10.577 1.00 0.00 C ATOM 2095 CD1 LEU B 149 -6.696 -7.644 -11.631 1.00 0.00 C ATOM 2096 CD2 LEU B 149 -7.314 -6.918 -9.330 1.00 0.00 C ATOM 0 H LEU B 149 -5.587 -4.018 -11.462 1.00 0.00 H new ATOM 0 HA LEU B 149 -3.178 -5.406 -10.760 1.00 0.00 H new ATOM 0 HB2 LEU B 149 -4.582 -7.226 -9.994 1.00 0.00 H new ATOM 0 HB3 LEU B 149 -5.043 -5.681 -9.307 1.00 0.00 H new ATOM 0 HG LEU B 149 -6.934 -5.636 -11.006 1.00 0.00 H new ATOM 0 HD11 LEU B 149 -7.756 -7.798 -11.835 1.00 0.00 H new ATOM 0 HD12 LEU B 149 -6.190 -7.341 -12.548 1.00 0.00 H new ATOM 0 HD13 LEU B 149 -6.259 -8.573 -11.265 1.00 0.00 H new ATOM 0 HD21 LEU B 149 -8.353 -7.115 -9.595 1.00 0.00 H new ATOM 0 HD22 LEU B 149 -6.880 -7.809 -8.876 1.00 0.00 H new ATOM 0 HD23 LEU B 149 -7.271 -6.091 -8.621 1.00 0.00 H new ATOM 2108 N MET B 150 -4.556 -5.963 -13.619 1.00 0.00 N ATOM 2109 CA MET B 150 -4.401 -6.590 -14.932 1.00 0.00 C ATOM 2110 C MET B 150 -2.934 -6.525 -15.362 1.00 0.00 C ATOM 2111 O MET B 150 -2.405 -7.466 -15.951 1.00 0.00 O ATOM 2112 CB MET B 150 -5.287 -5.864 -15.950 1.00 0.00 C ATOM 2113 CG MET B 150 -5.284 -6.457 -17.349 1.00 0.00 C ATOM 2114 SD MET B 150 -6.381 -5.561 -18.481 1.00 0.00 S ATOM 2115 CE MET B 150 -5.609 -3.940 -18.525 1.00 0.00 C ATOM 0 H MET B 150 -5.226 -5.194 -13.612 1.00 0.00 H new ATOM 0 HA MET B 150 -4.705 -7.635 -14.879 1.00 0.00 H new ATOM 0 HB2 MET B 150 -6.311 -5.858 -15.577 1.00 0.00 H new ATOM 0 HB3 MET B 150 -4.965 -4.825 -16.012 1.00 0.00 H new ATOM 0 HG2 MET B 150 -4.268 -6.443 -17.744 1.00 0.00 H new ATOM 0 HG3 MET B 150 -5.592 -7.501 -17.299 1.00 0.00 H new ATOM 0 HE1 MET B 150 -5.605 -3.567 -19.549 1.00 0.00 H new ATOM 0 HE2 MET B 150 -6.169 -3.253 -17.891 1.00 0.00 H new ATOM 0 HE3 MET B 150 -4.584 -4.015 -18.162 1.00 0.00 H new ATOM 2125 N ASP B 151 -2.308 -5.396 -15.042 1.00 0.00 N ATOM 2126 CA ASP B 151 -0.877 -5.145 -15.247 1.00 0.00 C ATOM 2127 C ASP B 151 -0.512 -5.207 -16.716 1.00 0.00 C ATOM 2128 O ASP B 151 0.045 -6.198 -17.207 1.00 0.00 O ATOM 2129 CB ASP B 151 -0.009 -6.096 -14.416 1.00 0.00 C ATOM 2130 CG ASP B 151 1.402 -5.606 -14.249 1.00 0.00 C ATOM 2131 OD1 ASP B 151 1.622 -4.747 -13.377 1.00 0.00 O ATOM 2132 OD2 ASP B 151 2.313 -6.079 -14.944 1.00 0.00 O ATOM 0 H ASP B 151 -2.793 -4.604 -14.620 1.00 0.00 H new ATOM 0 HA ASP B 151 -0.673 -4.133 -14.897 1.00 0.00 H new ATOM 0 HB2 ASP B 151 -0.461 -6.227 -13.433 1.00 0.00 H new ATOM 0 HB3 ASP B 151 0.006 -7.076 -14.893 1.00 0.00 H new ATOM 2137 N ALA B 152 -0.901 -4.184 -17.418 1.00 0.00 N ATOM 2138 CA ALA B 152 -0.679 -4.059 -18.825 1.00 0.00 C ATOM 2139 C ALA B 152 -0.808 -2.599 -19.193 1.00 0.00 C ATOM 2140 O ALA B 152 0.199 -1.982 -19.594 1.00 0.00 O ATOM 2141 CB ALA B 152 -1.680 -4.903 -19.607 1.00 0.00 C ATOM 2142 OXT ALA B 152 -1.910 -2.027 -18.988 1.00 0.00 O ATOM 0 H ALA B 152 -1.397 -3.390 -17.013 1.00 0.00 H new ATOM 0 HA ALA B 152 0.318 -4.420 -19.078 1.00 0.00 H new ATOM 0 HB1 ALA B 152 -1.493 -4.793 -20.675 1.00 0.00 H new ATOM 0 HB2 ALA B 152 -1.571 -5.950 -19.326 1.00 0.00 H new ATOM 0 HB3 ALA B 152 -2.693 -4.570 -19.380 1.00 0.00 H new TER 2148 ALA B 152