USER MOD reduce.3.24.130724 H: found=0, std=0, add=793, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 791 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 50 HIS : no HD1:sc= -2.43! C(o=-2.4!,f=-4.4!) USER MOD Set 1.2: A 53 THR OG1 : rot 180:sc=-0.00984 USER MOD Set 2.1: A 27 SER OG : rot -76:sc= 1.2 USER MOD Set 2.2: A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 64:sc= 0.0818 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.07) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 1.18 K(o=1.2,f=-0.15) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.283 X(o=-0.28,f=0) USER MOD Single : A 38 GLN : amide:sc= -0.878! C(o=-0.88!,f=-2!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc=-0.00809 X(o=-0.0081,f=-0.084) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.508 USER MOD Single : A 63 GLN : amide:sc= -0.302 K(o=-0.3,f=-0.9) USER MOD Single : A 65 MET CE :methyl -164:sc= -0.066 (180deg=-0.318) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 71 GLN : amide:sc= -6.71! K(o=-6.7!,f=-1.8) USER MOD Single : A 72 LYS NZ :NH3+ 164:sc= -2.43! (180deg=-2.59!) USER MOD Single : A 73 CYS SG : rot 45:sc= -12.7! USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -3.99 K(o=-4,f=-7.8!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -24.891 -3.508 11.799 1.00 0.00 N ATOM 2 CA GLY A 1 -24.105 -2.435 11.220 1.00 0.00 C ATOM 3 C GLY A 1 -23.844 -2.640 9.741 1.00 0.00 C ATOM 4 O GLY A 1 -24.752 -2.508 8.920 1.00 0.00 O ATOM 0 H1 GLY A 1 -25.042 -3.321 12.811 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.811 -3.564 11.316 1.00 0.00 H new ATOM 0 H3 GLY A 1 -24.385 -4.409 11.685 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.625 -1.488 11.366 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.154 -2.361 11.747 1.00 0.00 H new ATOM 8 N SER A 2 -22.601 -2.962 9.400 1.00 0.00 N ATOM 9 CA SER A 2 -22.222 -3.180 8.008 1.00 0.00 C ATOM 10 C SER A 2 -22.791 -2.084 7.112 1.00 0.00 C ATOM 11 O SER A 2 -23.250 -2.350 6.002 1.00 0.00 O ATOM 12 CB SER A 2 -22.713 -4.549 7.533 1.00 0.00 C ATOM 13 OG SER A 2 -21.866 -5.072 6.525 1.00 0.00 O ATOM 0 H SER A 2 -21.839 -3.078 10.068 1.00 0.00 H new ATOM 0 HA SER A 2 -21.134 -3.149 7.944 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.749 -5.239 8.376 1.00 0.00 H new ATOM 0 HB3 SER A 2 -23.729 -4.461 7.149 1.00 0.00 H new ATOM 0 HG SER A 2 -22.200 -5.948 6.239 1.00 0.00 H new ATOM 19 N SER A 3 -22.756 -0.849 7.604 1.00 0.00 N ATOM 20 CA SER A 3 -23.270 0.288 6.851 1.00 0.00 C ATOM 21 C SER A 3 -22.173 1.319 6.606 1.00 0.00 C ATOM 22 O SER A 3 -21.646 1.916 7.543 1.00 0.00 O ATOM 23 CB SER A 3 -24.437 0.937 7.599 1.00 0.00 C ATOM 24 OG SER A 3 -25.629 0.189 7.431 1.00 0.00 O ATOM 0 H SER A 3 -22.377 -0.611 8.521 1.00 0.00 H new ATOM 0 HA SER A 3 -23.623 -0.077 5.887 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.197 1.011 8.660 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.587 1.953 7.234 1.00 0.00 H new ATOM 0 HG SER A 3 -25.517 -0.699 7.829 1.00 0.00 H new ATOM 30 N GLY A 4 -21.832 1.522 5.336 1.00 0.00 N ATOM 31 CA GLY A 4 -20.799 2.480 4.989 1.00 0.00 C ATOM 32 C GLY A 4 -20.866 2.903 3.535 1.00 0.00 C ATOM 33 O GLY A 4 -19.838 3.018 2.868 1.00 0.00 O ATOM 0 H GLY A 4 -22.253 1.040 4.542 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -20.895 3.360 5.625 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.821 2.045 5.193 1.00 0.00 H new ATOM 37 N SER A 5 -22.079 3.134 3.042 1.00 0.00 N ATOM 38 CA SER A 5 -22.276 3.541 1.656 1.00 0.00 C ATOM 39 C SER A 5 -21.361 4.708 1.297 1.00 0.00 C ATOM 40 O SER A 5 -21.647 5.859 1.626 1.00 0.00 O ATOM 41 CB SER A 5 -23.736 3.931 1.420 1.00 0.00 C ATOM 42 OG SER A 5 -24.613 2.897 1.830 1.00 0.00 O ATOM 0 H SER A 5 -22.940 3.046 3.582 1.00 0.00 H new ATOM 0 HA SER A 5 -22.025 2.695 1.015 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.965 4.845 1.968 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.892 4.146 0.363 1.00 0.00 H new ATOM 0 HG SER A 5 -25.540 3.172 1.670 1.00 0.00 H new ATOM 48 N SER A 6 -20.258 4.401 0.621 1.00 0.00 N ATOM 49 CA SER A 6 -19.298 5.423 0.220 1.00 0.00 C ATOM 50 C SER A 6 -19.720 6.080 -1.090 1.00 0.00 C ATOM 51 O SER A 6 -20.544 5.544 -1.830 1.00 0.00 O ATOM 52 CB SER A 6 -17.903 4.812 0.071 1.00 0.00 C ATOM 53 OG SER A 6 -17.897 3.788 -0.908 1.00 0.00 O ATOM 0 H SER A 6 -20.007 3.453 0.340 1.00 0.00 H new ATOM 0 HA SER A 6 -19.271 6.187 0.997 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.190 5.589 -0.206 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.576 4.406 1.028 1.00 0.00 H new ATOM 0 HG SER A 6 -16.994 3.415 -0.986 1.00 0.00 H new ATOM 59 N GLY A 7 -19.148 7.247 -1.371 1.00 0.00 N ATOM 60 CA GLY A 7 -19.476 7.960 -2.591 1.00 0.00 C ATOM 61 C GLY A 7 -18.421 7.788 -3.665 1.00 0.00 C ATOM 62 O GLY A 7 -17.359 7.216 -3.417 1.00 0.00 O ATOM 0 H GLY A 7 -18.463 7.711 -0.775 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.435 7.606 -2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.593 9.020 -2.368 1.00 0.00 H new ATOM 66 N LEU A 8 -18.712 8.282 -4.864 1.00 0.00 N ATOM 67 CA LEU A 8 -17.781 8.178 -5.981 1.00 0.00 C ATOM 68 C LEU A 8 -16.483 8.921 -5.679 1.00 0.00 C ATOM 69 O LEU A 8 -16.484 10.027 -5.139 1.00 0.00 O ATOM 70 CB LEU A 8 -18.417 8.737 -7.255 1.00 0.00 C ATOM 71 CG LEU A 8 -18.909 10.183 -7.181 1.00 0.00 C ATOM 72 CD1 LEU A 8 -17.797 11.145 -7.570 1.00 0.00 C ATOM 73 CD2 LEU A 8 -20.124 10.380 -8.075 1.00 0.00 C ATOM 0 H LEU A 8 -19.586 8.759 -5.087 1.00 0.00 H new ATOM 0 HA LEU A 8 -17.549 7.124 -6.131 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -17.689 8.663 -8.063 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -19.260 8.101 -7.526 1.00 0.00 H new ATOM 0 HG LEU A 8 -19.202 10.395 -6.153 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -18.165 12.169 -7.512 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -16.955 11.023 -6.889 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -17.473 10.933 -8.589 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -20.460 11.415 -8.009 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -19.858 10.150 -9.107 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -20.926 9.717 -7.750 1.00 0.00 H new ATOM 85 N PRO A 9 -15.349 8.301 -6.037 1.00 0.00 N ATOM 86 CA PRO A 9 -14.023 8.886 -5.817 1.00 0.00 C ATOM 87 C PRO A 9 -13.764 10.090 -6.716 1.00 0.00 C ATOM 88 O PRO A 9 -14.355 10.214 -7.789 1.00 0.00 O ATOM 89 CB PRO A 9 -13.068 7.742 -6.166 1.00 0.00 C ATOM 90 CG PRO A 9 -13.835 6.884 -7.112 1.00 0.00 C ATOM 91 CD PRO A 9 -15.273 6.981 -6.685 1.00 0.00 C ATOM 0 HA PRO A 9 -13.907 9.261 -4.800 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -12.153 8.116 -6.624 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -12.775 7.186 -5.276 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.709 7.226 -8.139 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -13.485 5.852 -7.074 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -15.950 6.912 -7.536 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -15.543 6.180 -5.997 1.00 0.00 H new ATOM 99 N SER A 10 -12.877 10.975 -6.271 1.00 0.00 N ATOM 100 CA SER A 10 -12.543 12.171 -7.035 1.00 0.00 C ATOM 101 C SER A 10 -11.058 12.194 -7.387 1.00 0.00 C ATOM 102 O SER A 10 -10.688 12.267 -8.558 1.00 0.00 O ATOM 103 CB SER A 10 -12.910 13.427 -6.242 1.00 0.00 C ATOM 104 OG SER A 10 -14.315 13.598 -6.178 1.00 0.00 O ATOM 0 H SER A 10 -12.377 10.886 -5.386 1.00 0.00 H new ATOM 0 HA SER A 10 -13.118 12.153 -7.961 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.503 13.356 -5.233 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.455 14.301 -6.708 1.00 0.00 H new ATOM 0 HG SER A 10 -14.523 14.406 -5.665 1.00 0.00 H new ATOM 110 N ASP A 11 -10.214 12.131 -6.363 1.00 0.00 N ATOM 111 CA ASP A 11 -8.769 12.143 -6.563 1.00 0.00 C ATOM 112 C ASP A 11 -8.366 11.182 -7.678 1.00 0.00 C ATOM 113 O ASP A 11 -8.393 9.964 -7.502 1.00 0.00 O ATOM 114 CB ASP A 11 -8.051 11.768 -5.266 1.00 0.00 C ATOM 115 CG ASP A 11 -6.547 11.932 -5.368 1.00 0.00 C ATOM 116 OD1 ASP A 11 -6.052 13.046 -5.095 1.00 0.00 O ATOM 117 OD2 ASP A 11 -5.866 10.947 -5.720 1.00 0.00 O ATOM 0 H ASP A 11 -10.505 12.071 -5.387 1.00 0.00 H new ATOM 0 HA ASP A 11 -8.476 13.152 -6.854 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -8.427 12.390 -4.453 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -8.284 10.734 -5.011 1.00 0.00 H new ATOM 122 N VAL A 12 -7.995 11.739 -8.826 1.00 0.00 N ATOM 123 CA VAL A 12 -7.586 10.933 -9.970 1.00 0.00 C ATOM 124 C VAL A 12 -6.126 10.512 -9.853 1.00 0.00 C ATOM 125 O VAL A 12 -5.790 9.339 -10.018 1.00 0.00 O ATOM 126 CB VAL A 12 -7.785 11.695 -11.294 1.00 0.00 C ATOM 127 CG1 VAL A 12 -7.274 10.872 -12.466 1.00 0.00 C ATOM 128 CG2 VAL A 12 -9.250 12.058 -11.484 1.00 0.00 C ATOM 0 H VAL A 12 -7.969 12.746 -8.989 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.218 10.045 -9.972 1.00 0.00 H new ATOM 0 HB VAL A 12 -7.208 12.619 -11.252 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.423 11.427 -13.392 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.212 10.668 -12.332 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.821 9.930 -12.515 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.373 12.596 -12.424 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.850 11.149 -11.505 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.578 12.690 -10.659 1.00 0.00 H new ATOM 138 N THR A 13 -5.259 11.478 -9.566 1.00 0.00 N ATOM 139 CA THR A 13 -3.833 11.209 -9.426 1.00 0.00 C ATOM 140 C THR A 13 -3.588 9.974 -8.568 1.00 0.00 C ATOM 141 O THR A 13 -4.455 9.560 -7.798 1.00 0.00 O ATOM 142 CB THR A 13 -3.093 12.408 -8.804 1.00 0.00 C ATOM 143 OG1 THR A 13 -3.613 12.681 -7.498 1.00 0.00 O ATOM 144 CG2 THR A 13 -3.233 13.645 -9.679 1.00 0.00 C ATOM 0 H THR A 13 -5.520 12.454 -9.426 1.00 0.00 H new ATOM 0 HA THR A 13 -3.445 11.033 -10.429 1.00 0.00 H new ATOM 0 HB THR A 13 -2.036 12.154 -8.728 1.00 0.00 H new ATOM 0 HG1 THR A 13 -3.136 13.444 -7.109 1.00 0.00 H new ATOM 0 HG21 THR A 13 -2.702 14.478 -9.219 1.00 0.00 H new ATOM 0 HG22 THR A 13 -2.810 13.444 -10.663 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.288 13.900 -9.783 1.00 0.00 H new ATOM 152 N GLU A 14 -2.402 9.390 -8.704 1.00 0.00 N ATOM 153 CA GLU A 14 -2.044 8.201 -7.939 1.00 0.00 C ATOM 154 C GLU A 14 -2.100 8.481 -6.440 1.00 0.00 C ATOM 155 O GLU A 14 -1.173 9.053 -5.870 1.00 0.00 O ATOM 156 CB GLU A 14 -0.644 7.720 -8.327 1.00 0.00 C ATOM 157 CG GLU A 14 -0.632 6.785 -9.525 1.00 0.00 C ATOM 158 CD GLU A 14 0.731 6.697 -10.184 1.00 0.00 C ATOM 159 OE1 GLU A 14 1.396 7.746 -10.314 1.00 0.00 O ATOM 160 OE2 GLU A 14 1.133 5.579 -10.568 1.00 0.00 O ATOM 0 H GLU A 14 -1.673 9.720 -9.336 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.767 7.419 -8.172 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.019 8.586 -8.546 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.195 7.210 -7.475 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.942 5.790 -9.207 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.363 7.129 -10.256 1.00 0.00 H new ATOM 167 N GLY A 15 -3.197 8.072 -5.809 1.00 0.00 N ATOM 168 CA GLY A 15 -3.355 8.288 -4.382 1.00 0.00 C ATOM 169 C GLY A 15 -3.553 6.994 -3.618 1.00 0.00 C ATOM 170 O GLY A 15 -4.261 6.960 -2.612 1.00 0.00 O ATOM 0 H GLY A 15 -3.978 7.596 -6.260 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.475 8.803 -3.996 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -4.209 8.943 -4.209 1.00 0.00 H new ATOM 174 N LYS A 16 -2.928 5.924 -4.098 1.00 0.00 N ATOM 175 CA LYS A 16 -3.039 4.620 -3.455 1.00 0.00 C ATOM 176 C LYS A 16 -1.676 4.132 -2.975 1.00 0.00 C ATOM 177 O LYS A 16 -0.760 3.932 -3.773 1.00 0.00 O ATOM 178 CB LYS A 16 -3.645 3.601 -4.423 1.00 0.00 C ATOM 179 CG LYS A 16 -4.633 4.207 -5.404 1.00 0.00 C ATOM 180 CD LYS A 16 -4.660 3.438 -6.714 1.00 0.00 C ATOM 181 CE LYS A 16 -5.382 4.217 -7.803 1.00 0.00 C ATOM 182 NZ LYS A 16 -4.465 5.148 -8.519 1.00 0.00 N ATOM 0 H LYS A 16 -2.339 5.934 -4.931 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.693 4.724 -2.590 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -2.841 3.119 -4.980 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -4.147 2.822 -3.850 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.630 4.211 -4.963 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.366 5.246 -5.596 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.640 3.225 -7.033 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.154 2.478 -6.563 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.823 3.521 -8.517 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.202 4.783 -7.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.012 5.940 -8.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.754 5.515 -7.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.988 4.640 -9.291 1.00 0.00 H new ATOM 196 N THR A 17 -1.548 3.941 -1.665 1.00 0.00 N ATOM 197 CA THR A 17 -0.298 3.477 -1.079 1.00 0.00 C ATOM 198 C THR A 17 -0.554 2.466 0.033 1.00 0.00 C ATOM 199 O THR A 17 -1.658 2.387 0.571 1.00 0.00 O ATOM 200 CB THR A 17 0.527 4.648 -0.513 1.00 0.00 C ATOM 201 OG1 THR A 17 1.027 5.458 -1.583 1.00 0.00 O ATOM 202 CG2 THR A 17 1.687 4.137 0.328 1.00 0.00 C ATOM 0 H THR A 17 -2.296 4.101 -0.990 1.00 0.00 H new ATOM 0 HA THR A 17 0.267 2.998 -1.879 1.00 0.00 H new ATOM 0 HB THR A 17 -0.124 5.248 0.122 1.00 0.00 H new ATOM 0 HG1 THR A 17 1.549 6.201 -1.214 1.00 0.00 H new ATOM 0 HG21 THR A 17 2.255 4.982 0.717 1.00 0.00 H new ATOM 0 HG22 THR A 17 1.301 3.546 1.159 1.00 0.00 H new ATOM 0 HG23 THR A 17 2.337 3.516 -0.288 1.00 0.00 H new ATOM 210 N VAL A 18 0.474 1.695 0.374 1.00 0.00 N ATOM 211 CA VAL A 18 0.361 0.691 1.425 1.00 0.00 C ATOM 212 C VAL A 18 1.711 0.427 2.081 1.00 0.00 C ATOM 213 O VAL A 18 2.662 0.003 1.423 1.00 0.00 O ATOM 214 CB VAL A 18 -0.198 -0.635 0.875 1.00 0.00 C ATOM 215 CG1 VAL A 18 -1.471 -0.389 0.080 1.00 0.00 C ATOM 216 CG2 VAL A 18 0.846 -1.340 0.021 1.00 0.00 C ATOM 0 H VAL A 18 1.394 1.747 -0.063 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.329 1.088 2.169 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.443 -1.283 1.717 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.851 -1.337 -0.301 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.220 0.070 0.725 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -1.255 0.277 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.434 -2.275 -0.359 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.125 -0.699 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.728 -1.551 0.625 1.00 0.00 H new ATOM 226 N PHE A 19 1.790 0.680 3.383 1.00 0.00 N ATOM 227 CA PHE A 19 3.025 0.471 4.130 1.00 0.00 C ATOM 228 C PHE A 19 2.868 -0.670 5.131 1.00 0.00 C ATOM 229 O PHE A 19 1.962 -0.659 5.964 1.00 0.00 O ATOM 230 CB PHE A 19 3.428 1.753 4.860 1.00 0.00 C ATOM 231 CG PHE A 19 4.622 1.583 5.756 1.00 0.00 C ATOM 232 CD1 PHE A 19 5.851 1.219 5.231 1.00 0.00 C ATOM 233 CD2 PHE A 19 4.514 1.787 7.122 1.00 0.00 C ATOM 234 CE1 PHE A 19 6.952 1.062 6.052 1.00 0.00 C ATOM 235 CE2 PHE A 19 5.611 1.632 7.948 1.00 0.00 C ATOM 236 CZ PHE A 19 6.831 1.268 7.413 1.00 0.00 C ATOM 0 H PHE A 19 1.013 1.030 3.943 1.00 0.00 H new ATOM 0 HA PHE A 19 3.808 0.204 3.421 1.00 0.00 H new ATOM 0 HB2 PHE A 19 3.643 2.528 4.124 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.584 2.103 5.455 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.950 1.056 4.168 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.562 2.070 7.546 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.905 0.779 5.630 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.514 1.795 9.011 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.689 1.145 8.057 1.00 0.00 H new ATOM 246 N ILE A 20 3.757 -1.654 5.041 1.00 0.00 N ATOM 247 CA ILE A 20 3.718 -2.802 5.939 1.00 0.00 C ATOM 248 C ILE A 20 4.714 -2.640 7.082 1.00 0.00 C ATOM 249 O ILE A 20 5.866 -2.262 6.866 1.00 0.00 O ATOM 250 CB ILE A 20 4.021 -4.113 5.190 1.00 0.00 C ATOM 251 CG1 ILE A 20 3.242 -4.166 3.874 1.00 0.00 C ATOM 252 CG2 ILE A 20 3.682 -5.312 6.062 1.00 0.00 C ATOM 253 CD1 ILE A 20 3.993 -3.571 2.703 1.00 0.00 C ATOM 0 H ILE A 20 4.512 -1.679 4.356 1.00 0.00 H new ATOM 0 HA ILE A 20 2.708 -2.851 6.345 1.00 0.00 H new ATOM 0 HB ILE A 20 5.086 -4.145 4.961 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.996 -5.204 3.648 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.298 -3.635 3.998 1.00 0.00 H new ATOM 0 HG21 ILE A 20 3.902 -6.231 5.518 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.278 -5.279 6.974 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.623 -5.287 6.319 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.381 -3.643 1.804 1.00 0.00 H new ATOM 0 HD12 ILE A 20 4.216 -2.524 2.908 1.00 0.00 H new ATOM 0 HD13 ILE A 20 4.924 -4.117 2.553 1.00 0.00 H new ATOM 265 N ARG A 21 4.264 -2.930 8.298 1.00 0.00 N ATOM 266 CA ARG A 21 5.116 -2.818 9.475 1.00 0.00 C ATOM 267 C ARG A 21 5.283 -4.172 10.158 1.00 0.00 C ATOM 268 O ARG A 21 4.387 -5.015 10.113 1.00 0.00 O ATOM 269 CB ARG A 21 4.529 -1.807 10.462 1.00 0.00 C ATOM 270 CG ARG A 21 4.972 -0.376 10.204 1.00 0.00 C ATOM 271 CD ARG A 21 4.582 0.543 11.351 1.00 0.00 C ATOM 272 NE ARG A 21 5.145 0.100 12.624 1.00 0.00 N ATOM 273 CZ ARG A 21 5.046 0.794 13.752 1.00 0.00 C ATOM 274 NH1 ARG A 21 4.409 1.956 13.766 1.00 0.00 N ATOM 275 NH2 ARG A 21 5.585 0.324 14.870 1.00 0.00 N ATOM 0 H ARG A 21 3.314 -3.244 8.494 1.00 0.00 H new ATOM 0 HA ARG A 21 6.097 -2.471 9.149 1.00 0.00 H new ATOM 0 HB2 ARG A 21 3.441 -1.856 10.415 1.00 0.00 H new ATOM 0 HB3 ARG A 21 4.817 -2.091 11.474 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.053 -0.348 10.065 1.00 0.00 H new ATOM 0 HG3 ARG A 21 4.522 -0.016 9.279 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.924 1.556 11.136 1.00 0.00 H new ATOM 0 HD3 ARG A 21 3.496 0.583 11.430 1.00 0.00 H new ATOM 0 HE ARG A 21 5.641 -0.791 12.648 1.00 0.00 H new ATOM 0 HH11 ARG A 21 3.993 2.320 12.909 1.00 0.00 H new ATOM 0 HH12 ARG A 21 4.335 2.486 14.634 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.075 -0.570 14.863 1.00 0.00 H new ATOM 0 HH22 ARG A 21 5.509 0.857 15.736 1.00 0.00 H new ATOM 289 N ASN A 22 6.436 -4.374 10.788 1.00 0.00 N ATOM 290 CA ASN A 22 6.720 -5.627 11.478 1.00 0.00 C ATOM 291 C ASN A 22 6.968 -6.754 10.480 1.00 0.00 C ATOM 292 O ASN A 22 6.387 -7.835 10.590 1.00 0.00 O ATOM 293 CB ASN A 22 5.560 -5.997 12.405 1.00 0.00 C ATOM 294 CG ASN A 22 5.975 -6.976 13.487 1.00 0.00 C ATOM 295 OD1 ASN A 22 6.948 -6.749 14.205 1.00 0.00 O ATOM 296 ND2 ASN A 22 5.235 -8.072 13.607 1.00 0.00 N ATOM 0 H ASN A 22 7.188 -3.687 10.835 1.00 0.00 H new ATOM 0 HA ASN A 22 7.622 -5.489 12.074 1.00 0.00 H new ATOM 0 HB2 ASN A 22 5.166 -5.093 12.869 1.00 0.00 H new ATOM 0 HB3 ASN A 22 4.752 -6.431 11.816 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.465 -8.767 14.317 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.437 -8.219 12.989 1.00 0.00 H new ATOM 303 N LEU A 23 7.834 -6.495 9.507 1.00 0.00 N ATOM 304 CA LEU A 23 8.161 -7.488 8.489 1.00 0.00 C ATOM 305 C LEU A 23 9.220 -8.461 8.997 1.00 0.00 C ATOM 306 O LEU A 23 10.054 -8.107 9.830 1.00 0.00 O ATOM 307 CB LEU A 23 8.654 -6.799 7.216 1.00 0.00 C ATOM 308 CG LEU A 23 7.574 -6.188 6.322 1.00 0.00 C ATOM 309 CD1 LEU A 23 8.200 -5.285 5.270 1.00 0.00 C ATOM 310 CD2 LEU A 23 6.746 -7.282 5.664 1.00 0.00 C ATOM 0 H LEU A 23 8.323 -5.606 9.401 1.00 0.00 H new ATOM 0 HA LEU A 23 7.256 -8.051 8.263 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.351 -6.011 7.500 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.216 -7.525 6.628 1.00 0.00 H new ATOM 0 HG LEU A 23 6.913 -5.583 6.943 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.417 -4.859 4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 23 8.749 -4.481 5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 23 8.884 -5.867 4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.982 -6.830 5.031 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.394 -7.913 5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.268 -7.889 6.433 1.00 0.00 H new ATOM 322 N SER A 24 9.181 -9.688 8.488 1.00 0.00 N ATOM 323 CA SER A 24 10.137 -10.714 8.891 1.00 0.00 C ATOM 324 C SER A 24 11.365 -10.697 7.987 1.00 0.00 C ATOM 325 O SER A 24 11.255 -10.526 6.773 1.00 0.00 O ATOM 326 CB SER A 24 9.481 -12.095 8.853 1.00 0.00 C ATOM 327 OG SER A 24 10.386 -13.101 9.272 1.00 0.00 O ATOM 0 H SER A 24 8.498 -9.996 7.796 1.00 0.00 H new ATOM 0 HA SER A 24 10.455 -10.499 9.911 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.602 -12.101 9.497 1.00 0.00 H new ATOM 0 HB3 SER A 24 9.137 -12.310 7.841 1.00 0.00 H new ATOM 0 HG SER A 24 9.942 -13.974 9.240 1.00 0.00 H new ATOM 333 N PHE A 25 12.537 -10.875 8.588 1.00 0.00 N ATOM 334 CA PHE A 25 13.788 -10.880 7.838 1.00 0.00 C ATOM 335 C PHE A 25 13.709 -11.841 6.655 1.00 0.00 C ATOM 336 O PHE A 25 14.183 -11.534 5.561 1.00 0.00 O ATOM 337 CB PHE A 25 14.952 -11.271 8.751 1.00 0.00 C ATOM 338 CG PHE A 25 15.589 -10.101 9.445 1.00 0.00 C ATOM 339 CD1 PHE A 25 15.990 -8.987 8.726 1.00 0.00 C ATOM 340 CD2 PHE A 25 15.784 -10.115 10.817 1.00 0.00 C ATOM 341 CE1 PHE A 25 16.577 -7.909 9.363 1.00 0.00 C ATOM 342 CE2 PHE A 25 16.370 -9.040 11.459 1.00 0.00 C ATOM 343 CZ PHE A 25 16.766 -7.935 10.731 1.00 0.00 C ATOM 0 H PHE A 25 12.647 -11.018 9.592 1.00 0.00 H new ATOM 0 HA PHE A 25 13.958 -9.874 7.455 1.00 0.00 H new ATOM 0 HB2 PHE A 25 14.594 -11.977 9.500 1.00 0.00 H new ATOM 0 HB3 PHE A 25 15.708 -11.789 8.161 1.00 0.00 H new ATOM 0 HD1 PHE A 25 15.843 -8.960 7.656 1.00 0.00 H new ATOM 0 HD2 PHE A 25 15.475 -10.976 11.391 1.00 0.00 H new ATOM 0 HE1 PHE A 25 16.888 -7.047 8.791 1.00 0.00 H new ATOM 0 HE2 PHE A 25 16.518 -9.064 12.529 1.00 0.00 H new ATOM 0 HZ PHE A 25 17.222 -7.093 11.230 1.00 0.00 H new ATOM 353 N ASP A 26 13.109 -13.003 6.884 1.00 0.00 N ATOM 354 CA ASP A 26 12.967 -14.009 5.838 1.00 0.00 C ATOM 355 C ASP A 26 12.114 -13.482 4.689 1.00 0.00 C ATOM 356 O ASP A 26 12.296 -13.874 3.536 1.00 0.00 O ATOM 357 CB ASP A 26 12.345 -15.285 6.408 1.00 0.00 C ATOM 358 CG ASP A 26 11.821 -16.207 5.325 1.00 0.00 C ATOM 359 OD1 ASP A 26 10.665 -16.017 4.892 1.00 0.00 O ATOM 360 OD2 ASP A 26 12.565 -17.121 4.912 1.00 0.00 O ATOM 0 H ASP A 26 12.713 -13.272 7.785 1.00 0.00 H new ATOM 0 HA ASP A 26 13.960 -14.239 5.453 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.089 -15.814 7.003 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.530 -15.019 7.081 1.00 0.00 H new ATOM 365 N SER A 27 11.181 -12.592 5.011 1.00 0.00 N ATOM 366 CA SER A 27 10.295 -12.015 4.007 1.00 0.00 C ATOM 367 C SER A 27 11.081 -11.586 2.771 1.00 0.00 C ATOM 368 O SER A 27 12.264 -11.257 2.859 1.00 0.00 O ATOM 369 CB SER A 27 9.543 -10.816 4.588 1.00 0.00 C ATOM 370 OG SER A 27 10.332 -9.640 4.527 1.00 0.00 O ATOM 0 H SER A 27 11.019 -12.255 5.960 1.00 0.00 H new ATOM 0 HA SER A 27 9.575 -12.778 3.712 1.00 0.00 H new ATOM 0 HB2 SER A 27 8.615 -10.664 4.038 1.00 0.00 H new ATOM 0 HB3 SER A 27 9.270 -11.021 5.623 1.00 0.00 H new ATOM 0 HG SER A 27 11.018 -9.669 5.227 1.00 0.00 H new ATOM 376 N GLU A 28 10.415 -11.592 1.621 1.00 0.00 N ATOM 377 CA GLU A 28 11.051 -11.205 0.368 1.00 0.00 C ATOM 378 C GLU A 28 10.107 -10.362 -0.484 1.00 0.00 C ATOM 379 O GLU A 28 8.923 -10.673 -0.609 1.00 0.00 O ATOM 380 CB GLU A 28 11.489 -12.446 -0.412 1.00 0.00 C ATOM 381 CG GLU A 28 12.414 -13.363 0.370 1.00 0.00 C ATOM 382 CD GLU A 28 13.202 -14.299 -0.525 1.00 0.00 C ATOM 383 OE1 GLU A 28 12.583 -15.192 -1.139 1.00 0.00 O ATOM 384 OE2 GLU A 28 14.438 -14.138 -0.611 1.00 0.00 O ATOM 0 H GLU A 28 9.435 -11.861 1.531 1.00 0.00 H new ATOM 0 HA GLU A 28 11.930 -10.606 0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.604 -13.007 -0.712 1.00 0.00 H new ATOM 0 HB3 GLU A 28 11.992 -12.131 -1.326 1.00 0.00 H new ATOM 0 HG2 GLU A 28 13.106 -12.760 0.957 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.826 -13.950 1.075 1.00 0.00 H new ATOM 391 N GLU A 29 10.640 -9.293 -1.067 1.00 0.00 N ATOM 392 CA GLU A 29 9.844 -8.404 -1.906 1.00 0.00 C ATOM 393 C GLU A 29 8.830 -9.194 -2.727 1.00 0.00 C ATOM 394 O GLU A 29 7.664 -8.813 -2.825 1.00 0.00 O ATOM 395 CB GLU A 29 10.752 -7.597 -2.836 1.00 0.00 C ATOM 396 CG GLU A 29 10.122 -6.306 -3.331 1.00 0.00 C ATOM 397 CD GLU A 29 11.117 -5.403 -4.035 1.00 0.00 C ATOM 398 OE1 GLU A 29 11.948 -4.781 -3.342 1.00 0.00 O ATOM 399 OE2 GLU A 29 11.065 -5.321 -5.280 1.00 0.00 O ATOM 0 H GLU A 29 11.619 -9.021 -0.974 1.00 0.00 H new ATOM 0 HA GLU A 29 9.302 -7.719 -1.254 1.00 0.00 H new ATOM 0 HB2 GLU A 29 11.678 -7.362 -2.312 1.00 0.00 H new ATOM 0 HB3 GLU A 29 11.019 -8.214 -3.694 1.00 0.00 H new ATOM 0 HG2 GLU A 29 9.306 -6.543 -4.014 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.686 -5.772 -2.487 1.00 0.00 H new ATOM 406 N GLU A 30 9.283 -10.298 -3.314 1.00 0.00 N ATOM 407 CA GLU A 30 8.415 -11.141 -4.127 1.00 0.00 C ATOM 408 C GLU A 30 7.252 -11.682 -3.301 1.00 0.00 C ATOM 409 O GLU A 30 6.087 -11.464 -3.633 1.00 0.00 O ATOM 410 CB GLU A 30 9.211 -12.301 -4.728 1.00 0.00 C ATOM 411 CG GLU A 30 10.669 -11.966 -4.994 1.00 0.00 C ATOM 412 CD GLU A 30 11.320 -12.926 -5.971 1.00 0.00 C ATOM 413 OE1 GLU A 30 10.746 -13.143 -7.059 1.00 0.00 O ATOM 414 OE2 GLU A 30 12.401 -13.460 -5.648 1.00 0.00 O ATOM 0 H GLU A 30 10.245 -10.629 -3.241 1.00 0.00 H new ATOM 0 HA GLU A 30 8.011 -10.530 -4.934 1.00 0.00 H new ATOM 0 HB2 GLU A 30 9.161 -13.154 -4.051 1.00 0.00 H new ATOM 0 HB3 GLU A 30 8.741 -12.607 -5.663 1.00 0.00 H new ATOM 0 HG2 GLU A 30 10.739 -10.951 -5.386 1.00 0.00 H new ATOM 0 HG3 GLU A 30 11.219 -11.983 -4.053 1.00 0.00 H new ATOM 421 N ALA A 31 7.577 -12.388 -2.223 1.00 0.00 N ATOM 422 CA ALA A 31 6.561 -12.959 -1.348 1.00 0.00 C ATOM 423 C ALA A 31 5.621 -11.880 -0.821 1.00 0.00 C ATOM 424 O ALA A 31 4.400 -12.000 -0.927 1.00 0.00 O ATOM 425 CB ALA A 31 7.216 -13.701 -0.193 1.00 0.00 C ATOM 0 H ALA A 31 8.537 -12.578 -1.935 1.00 0.00 H new ATOM 0 HA ALA A 31 5.970 -13.666 -1.931 1.00 0.00 H new ATOM 0 HB1 ALA A 31 6.445 -14.122 0.453 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.841 -14.504 -0.584 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.832 -13.009 0.381 1.00 0.00 H new ATOM 431 N LEU A 32 6.197 -10.826 -0.254 1.00 0.00 N ATOM 432 CA LEU A 32 5.410 -9.725 0.291 1.00 0.00 C ATOM 433 C LEU A 32 4.302 -9.318 -0.675 1.00 0.00 C ATOM 434 O LEU A 32 3.127 -9.288 -0.311 1.00 0.00 O ATOM 435 CB LEU A 32 6.311 -8.524 0.585 1.00 0.00 C ATOM 436 CG LEU A 32 5.645 -7.341 1.287 1.00 0.00 C ATOM 437 CD1 LEU A 32 6.682 -6.299 1.678 1.00 0.00 C ATOM 438 CD2 LEU A 32 4.577 -6.724 0.396 1.00 0.00 C ATOM 0 H LEU A 32 7.206 -10.710 -0.160 1.00 0.00 H new ATOM 0 HA LEU A 32 4.952 -10.064 1.220 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.145 -8.863 1.200 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.732 -8.172 -0.357 1.00 0.00 H new ATOM 0 HG LEU A 32 5.166 -7.706 2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.189 -5.464 2.176 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.410 -6.747 2.354 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.191 -5.938 0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.114 -5.883 0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.033 -6.374 -0.530 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.818 -7.472 0.167 1.00 0.00 H new ATOM 450 N GLY A 33 4.684 -9.007 -1.910 1.00 0.00 N ATOM 451 CA GLY A 33 3.711 -8.608 -2.910 1.00 0.00 C ATOM 452 C GLY A 33 2.685 -9.689 -3.184 1.00 0.00 C ATOM 453 O GLY A 33 1.485 -9.421 -3.215 1.00 0.00 O ATOM 0 H GLY A 33 5.650 -9.024 -2.236 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.202 -7.704 -2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.228 -8.359 -3.837 1.00 0.00 H new ATOM 457 N GLU A 34 3.159 -10.915 -3.385 1.00 0.00 N ATOM 458 CA GLU A 34 2.273 -12.040 -3.661 1.00 0.00 C ATOM 459 C GLU A 34 1.162 -12.126 -2.618 1.00 0.00 C ATOM 460 O GLU A 34 0.108 -12.714 -2.864 1.00 0.00 O ATOM 461 CB GLU A 34 3.066 -13.348 -3.686 1.00 0.00 C ATOM 462 CG GLU A 34 3.918 -13.520 -4.932 1.00 0.00 C ATOM 463 CD GLU A 34 4.862 -14.703 -4.835 1.00 0.00 C ATOM 464 OE1 GLU A 34 4.435 -15.830 -5.162 1.00 0.00 O ATOM 465 OE2 GLU A 34 6.027 -14.502 -4.432 1.00 0.00 O ATOM 0 H GLU A 34 4.150 -11.154 -3.362 1.00 0.00 H new ATOM 0 HA GLU A 34 1.819 -11.880 -4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 34 3.710 -13.389 -2.807 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.372 -14.185 -3.612 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.268 -13.649 -5.797 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.496 -12.611 -5.100 1.00 0.00 H new ATOM 472 N VAL A 35 1.406 -11.536 -1.452 1.00 0.00 N ATOM 473 CA VAL A 35 0.427 -11.544 -0.371 1.00 0.00 C ATOM 474 C VAL A 35 -0.638 -10.474 -0.586 1.00 0.00 C ATOM 475 O VAL A 35 -1.836 -10.755 -0.534 1.00 0.00 O ATOM 476 CB VAL A 35 1.099 -11.318 0.996 1.00 0.00 C ATOM 477 CG1 VAL A 35 0.056 -11.272 2.102 1.00 0.00 C ATOM 478 CG2 VAL A 35 2.129 -12.403 1.269 1.00 0.00 C ATOM 0 H VAL A 35 2.273 -11.046 -1.232 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.044 -12.527 -0.377 1.00 0.00 H new ATOM 0 HB VAL A 35 1.614 -10.357 0.974 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.549 -11.112 3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.641 -10.456 1.911 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.489 -12.216 2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.594 -12.227 2.239 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.639 -13.377 1.272 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.893 -12.383 0.492 1.00 0.00 H new ATOM 488 N LEU A 36 -0.193 -9.246 -0.826 1.00 0.00 N ATOM 489 CA LEU A 36 -1.108 -8.131 -1.049 1.00 0.00 C ATOM 490 C LEU A 36 -1.800 -8.257 -2.403 1.00 0.00 C ATOM 491 O LEU A 36 -2.876 -7.698 -2.614 1.00 0.00 O ATOM 492 CB LEU A 36 -0.353 -6.803 -0.972 1.00 0.00 C ATOM 493 CG LEU A 36 0.567 -6.623 0.236 1.00 0.00 C ATOM 494 CD1 LEU A 36 1.363 -5.333 0.114 1.00 0.00 C ATOM 495 CD2 LEU A 36 -0.239 -6.635 1.527 1.00 0.00 C ATOM 0 H LEU A 36 0.795 -8.997 -0.871 1.00 0.00 H new ATOM 0 HA LEU A 36 -1.869 -8.156 -0.269 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.244 -6.694 -1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.082 -5.993 -0.972 1.00 0.00 H new ATOM 0 HG LEU A 36 1.268 -7.457 0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.012 -5.222 0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.970 -5.364 -0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.678 -4.486 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.432 -6.506 2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.964 -5.822 1.511 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.763 -7.586 1.620 1.00 0.00 H new ATOM 507 N GLN A 37 -1.177 -8.998 -3.314 1.00 0.00 N ATOM 508 CA GLN A 37 -1.735 -9.199 -4.646 1.00 0.00 C ATOM 509 C GLN A 37 -3.138 -9.792 -4.565 1.00 0.00 C ATOM 510 O GLN A 37 -3.938 -9.642 -5.488 1.00 0.00 O ATOM 511 CB GLN A 37 -0.828 -10.115 -5.469 1.00 0.00 C ATOM 512 CG GLN A 37 0.327 -9.387 -6.138 1.00 0.00 C ATOM 513 CD GLN A 37 0.752 -10.039 -7.439 1.00 0.00 C ATOM 514 OE1 GLN A 37 0.216 -9.733 -8.504 1.00 0.00 O ATOM 515 NE2 GLN A 37 1.721 -10.943 -7.359 1.00 0.00 N ATOM 0 H GLN A 37 -0.286 -9.469 -3.154 1.00 0.00 H new ATOM 0 HA GLN A 37 -1.799 -8.227 -5.136 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -0.428 -10.894 -4.820 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.425 -10.612 -6.234 1.00 0.00 H new ATOM 0 HG2 GLN A 37 0.037 -8.354 -6.331 1.00 0.00 H new ATOM 0 HG3 GLN A 37 1.177 -9.358 -5.456 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.137 -11.166 -6.455 1.00 0.00 H new ATOM 0 HE22 GLN A 37 2.049 -11.415 -8.202 1.00 0.00 H new ATOM 524 N GLN A 38 -3.427 -10.464 -3.456 1.00 0.00 N ATOM 525 CA GLN A 38 -4.734 -11.080 -3.256 1.00 0.00 C ATOM 526 C GLN A 38 -5.826 -10.020 -3.156 1.00 0.00 C ATOM 527 O GLN A 38 -6.965 -10.248 -3.562 1.00 0.00 O ATOM 528 CB GLN A 38 -4.726 -11.943 -1.993 1.00 0.00 C ATOM 529 CG GLN A 38 -5.007 -11.161 -0.720 1.00 0.00 C ATOM 530 CD GLN A 38 -4.893 -12.016 0.527 1.00 0.00 C ATOM 531 OE1 GLN A 38 -5.877 -12.590 0.992 1.00 0.00 O ATOM 532 NE2 GLN A 38 -3.686 -12.104 1.075 1.00 0.00 N ATOM 0 H GLN A 38 -2.775 -10.596 -2.683 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.946 -11.712 -4.118 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -5.471 -12.732 -2.097 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -3.756 -12.431 -1.903 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.309 -10.327 -0.649 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.009 -10.735 -0.773 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.898 -11.611 0.655 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -3.547 -12.665 1.916 1.00 0.00 H new ATOM 541 N PHE A 39 -5.471 -8.862 -2.611 1.00 0.00 N ATOM 542 CA PHE A 39 -6.421 -7.767 -2.455 1.00 0.00 C ATOM 543 C PHE A 39 -6.344 -6.807 -3.639 1.00 0.00 C ATOM 544 O PHE A 39 -6.729 -5.644 -3.536 1.00 0.00 O ATOM 545 CB PHE A 39 -6.151 -7.010 -1.153 1.00 0.00 C ATOM 546 CG PHE A 39 -6.134 -7.893 0.062 1.00 0.00 C ATOM 547 CD1 PHE A 39 -7.313 -8.225 0.709 1.00 0.00 C ATOM 548 CD2 PHE A 39 -4.939 -8.391 0.556 1.00 0.00 C ATOM 549 CE1 PHE A 39 -7.302 -9.039 1.827 1.00 0.00 C ATOM 550 CE2 PHE A 39 -4.922 -9.205 1.673 1.00 0.00 C ATOM 551 CZ PHE A 39 -6.104 -9.528 2.310 1.00 0.00 C ATOM 0 H PHE A 39 -4.532 -8.657 -2.270 1.00 0.00 H new ATOM 0 HA PHE A 39 -7.424 -8.193 -2.419 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -5.193 -6.497 -1.233 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -6.914 -6.242 -1.024 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -8.252 -7.844 0.336 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -4.011 -8.141 0.063 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -8.228 -9.292 2.321 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -3.984 -9.588 2.048 1.00 0.00 H new ATOM 0 HZ PHE A 39 -6.092 -10.162 3.184 1.00 0.00 H new ATOM 561 N GLY A 40 -5.843 -7.306 -4.766 1.00 0.00 N ATOM 562 CA GLY A 40 -5.723 -6.481 -5.953 1.00 0.00 C ATOM 563 C GLY A 40 -4.309 -6.449 -6.497 1.00 0.00 C ATOM 564 O GLY A 40 -3.348 -6.673 -5.761 1.00 0.00 O ATOM 0 H GLY A 40 -5.519 -8.267 -4.877 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -6.397 -6.858 -6.723 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -6.042 -5.465 -5.719 1.00 0.00 H new ATOM 568 N ASP A 41 -4.180 -6.171 -7.790 1.00 0.00 N ATOM 569 CA ASP A 41 -2.872 -6.111 -8.432 1.00 0.00 C ATOM 570 C ASP A 41 -2.003 -5.030 -7.796 1.00 0.00 C ATOM 571 O ASP A 41 -2.490 -3.956 -7.441 1.00 0.00 O ATOM 572 CB ASP A 41 -3.027 -5.842 -9.930 1.00 0.00 C ATOM 573 CG ASP A 41 -4.095 -6.709 -10.566 1.00 0.00 C ATOM 574 OD1 ASP A 41 -5.291 -6.479 -10.288 1.00 0.00 O ATOM 575 OD2 ASP A 41 -3.736 -7.618 -11.343 1.00 0.00 O ATOM 0 H ASP A 41 -4.965 -5.984 -8.414 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.382 -7.075 -8.292 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -3.276 -4.792 -10.084 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.074 -6.020 -10.429 1.00 0.00 H new ATOM 580 N LEU A 42 -0.715 -5.322 -7.653 1.00 0.00 N ATOM 581 CA LEU A 42 0.223 -4.376 -7.059 1.00 0.00 C ATOM 582 C LEU A 42 1.029 -3.658 -8.136 1.00 0.00 C ATOM 583 O LEU A 42 1.596 -4.290 -9.028 1.00 0.00 O ATOM 584 CB LEU A 42 1.167 -5.100 -6.097 1.00 0.00 C ATOM 585 CG LEU A 42 0.575 -5.491 -4.742 1.00 0.00 C ATOM 586 CD1 LEU A 42 1.244 -6.748 -4.210 1.00 0.00 C ATOM 587 CD2 LEU A 42 0.717 -4.347 -3.748 1.00 0.00 C ATOM 0 H LEU A 42 -0.296 -6.207 -7.940 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.351 -3.633 -6.505 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.530 -6.004 -6.587 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.034 -4.463 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.486 -5.699 -4.877 1.00 0.00 H new ATOM 0 HD11 LEU A 42 0.810 -7.011 -3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.090 -7.567 -4.912 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.312 -6.569 -4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.290 -4.643 -2.790 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.772 -4.108 -3.617 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.190 -3.470 -4.125 1.00 0.00 H new ATOM 599 N LYS A 43 1.076 -2.333 -8.048 1.00 0.00 N ATOM 600 CA LYS A 43 1.815 -1.527 -9.012 1.00 0.00 C ATOM 601 C LYS A 43 3.319 -1.670 -8.801 1.00 0.00 C ATOM 602 O LYS A 43 4.066 -1.930 -9.745 1.00 0.00 O ATOM 603 CB LYS A 43 1.411 -0.056 -8.895 1.00 0.00 C ATOM 604 CG LYS A 43 2.310 0.886 -9.676 1.00 0.00 C ATOM 605 CD LYS A 43 1.992 0.857 -11.162 1.00 0.00 C ATOM 606 CE LYS A 43 2.931 1.756 -11.951 1.00 0.00 C ATOM 607 NZ LYS A 43 2.539 1.846 -13.385 1.00 0.00 N ATOM 0 H LYS A 43 0.610 -1.794 -7.318 1.00 0.00 H new ATOM 0 HA LYS A 43 1.570 -1.886 -10.011 1.00 0.00 H new ATOM 0 HB2 LYS A 43 0.386 0.059 -9.246 1.00 0.00 H new ATOM 0 HB3 LYS A 43 1.422 0.233 -7.844 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.191 1.901 -9.297 1.00 0.00 H new ATOM 0 HG3 LYS A 43 3.352 0.608 -9.521 1.00 0.00 H new ATOM 0 HD2 LYS A 43 2.069 -0.165 -11.532 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.962 1.176 -11.321 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.933 2.754 -11.512 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.949 1.373 -11.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.204 2.468 -13.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 2.562 0.898 -13.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 1.577 2.236 -13.458 1.00 0.00 H new ATOM 621 N TYR A 44 3.757 -1.499 -7.559 1.00 0.00 N ATOM 622 CA TYR A 44 5.172 -1.608 -7.225 1.00 0.00 C ATOM 623 C TYR A 44 5.357 -2.055 -5.778 1.00 0.00 C ATOM 624 O TYR A 44 4.690 -1.557 -4.872 1.00 0.00 O ATOM 625 CB TYR A 44 5.875 -0.268 -7.451 1.00 0.00 C ATOM 626 CG TYR A 44 5.897 0.618 -6.226 1.00 0.00 C ATOM 627 CD1 TYR A 44 6.820 0.408 -5.209 1.00 0.00 C ATOM 628 CD2 TYR A 44 4.994 1.665 -6.086 1.00 0.00 C ATOM 629 CE1 TYR A 44 6.843 1.215 -4.088 1.00 0.00 C ATOM 630 CE2 TYR A 44 5.010 2.478 -4.969 1.00 0.00 C ATOM 631 CZ TYR A 44 5.936 2.249 -3.973 1.00 0.00 C ATOM 632 OH TYR A 44 5.955 3.055 -2.858 1.00 0.00 O ATOM 0 H TYR A 44 3.152 -1.284 -6.766 1.00 0.00 H new ATOM 0 HA TYR A 44 5.617 -2.359 -7.878 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.900 -0.454 -7.773 1.00 0.00 H new ATOM 0 HB3 TYR A 44 5.377 0.262 -8.263 1.00 0.00 H new ATOM 0 HD1 TYR A 44 7.532 -0.400 -5.296 1.00 0.00 H new ATOM 0 HD2 TYR A 44 4.267 1.846 -6.864 1.00 0.00 H new ATOM 0 HE1 TYR A 44 7.567 1.038 -3.306 1.00 0.00 H new ATOM 0 HE2 TYR A 44 4.302 3.288 -4.876 1.00 0.00 H new ATOM 0 HH TYR A 44 5.253 3.735 -2.934 1.00 0.00 H new ATOM 642 N VAL A 45 6.271 -2.998 -5.570 1.00 0.00 N ATOM 643 CA VAL A 45 6.547 -3.513 -4.234 1.00 0.00 C ATOM 644 C VAL A 45 8.026 -3.381 -3.889 1.00 0.00 C ATOM 645 O VAL A 45 8.869 -4.086 -4.445 1.00 0.00 O ATOM 646 CB VAL A 45 6.131 -4.990 -4.104 1.00 0.00 C ATOM 647 CG1 VAL A 45 6.569 -5.778 -5.329 1.00 0.00 C ATOM 648 CG2 VAL A 45 6.709 -5.596 -2.835 1.00 0.00 C ATOM 0 H VAL A 45 6.832 -3.421 -6.309 1.00 0.00 H new ATOM 0 HA VAL A 45 5.959 -2.915 -3.537 1.00 0.00 H new ATOM 0 HB VAL A 45 5.044 -5.039 -4.040 1.00 0.00 H new ATOM 0 HG11 VAL A 45 6.266 -6.819 -5.219 1.00 0.00 H new ATOM 0 HG12 VAL A 45 6.102 -5.356 -6.219 1.00 0.00 H new ATOM 0 HG13 VAL A 45 7.653 -5.724 -5.428 1.00 0.00 H new ATOM 0 HG21 VAL A 45 6.405 -6.640 -2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.797 -5.536 -2.866 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.340 -5.047 -1.969 1.00 0.00 H new ATOM 658 N ARG A 46 8.336 -2.473 -2.969 1.00 0.00 N ATOM 659 CA ARG A 46 9.714 -2.248 -2.551 1.00 0.00 C ATOM 660 C ARG A 46 9.857 -2.412 -1.041 1.00 0.00 C ATOM 661 O ARG A 46 9.037 -1.912 -0.271 1.00 0.00 O ATOM 662 CB ARG A 46 10.174 -0.850 -2.969 1.00 0.00 C ATOM 663 CG ARG A 46 11.664 -0.760 -3.256 1.00 0.00 C ATOM 664 CD ARG A 46 12.032 -1.506 -4.530 1.00 0.00 C ATOM 665 NE ARG A 46 13.388 -1.194 -4.974 1.00 0.00 N ATOM 666 CZ ARG A 46 14.474 -1.792 -4.496 1.00 0.00 C ATOM 667 NH1 ARG A 46 14.363 -2.728 -3.564 1.00 0.00 N ATOM 668 NH2 ARG A 46 15.674 -1.454 -4.951 1.00 0.00 N ATOM 0 H ARG A 46 7.651 -1.881 -2.499 1.00 0.00 H new ATOM 0 HA ARG A 46 10.343 -2.992 -3.041 1.00 0.00 H new ATOM 0 HB2 ARG A 46 9.622 -0.546 -3.858 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.921 -0.142 -2.180 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.955 0.286 -3.349 1.00 0.00 H new ATOM 0 HG3 ARG A 46 12.223 -1.173 -2.417 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.944 -2.579 -4.360 1.00 0.00 H new ATOM 0 HD3 ARG A 46 11.324 -1.249 -5.318 1.00 0.00 H new ATOM 0 HE ARG A 46 13.508 -0.478 -5.690 1.00 0.00 H new ATOM 0 HH11 ARG A 46 13.442 -2.991 -3.212 1.00 0.00 H new ATOM 0 HH12 ARG A 46 15.198 -3.186 -3.199 1.00 0.00 H new ATOM 0 HH21 ARG A 46 15.763 -0.734 -5.668 1.00 0.00 H new ATOM 0 HH22 ARG A 46 16.507 -1.914 -4.583 1.00 0.00 H new ATOM 682 N VAL A 47 10.905 -3.116 -0.624 1.00 0.00 N ATOM 683 CA VAL A 47 11.156 -3.346 0.794 1.00 0.00 C ATOM 684 C VAL A 47 12.459 -2.687 1.235 1.00 0.00 C ATOM 685 O VAL A 47 13.546 -3.115 0.846 1.00 0.00 O ATOM 686 CB VAL A 47 11.220 -4.850 1.116 1.00 0.00 C ATOM 687 CG1 VAL A 47 12.261 -5.539 0.247 1.00 0.00 C ATOM 688 CG2 VAL A 47 11.517 -5.067 2.592 1.00 0.00 C ATOM 0 H VAL A 47 11.594 -3.537 -1.248 1.00 0.00 H new ATOM 0 HA VAL A 47 10.324 -2.901 1.339 1.00 0.00 H new ATOM 0 HB VAL A 47 10.248 -5.292 0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 47 12.292 -6.601 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 47 11.999 -5.414 -0.804 1.00 0.00 H new ATOM 0 HG13 VAL A 47 13.240 -5.096 0.432 1.00 0.00 H new ATOM 0 HG21 VAL A 47 11.559 -6.136 2.801 1.00 0.00 H new ATOM 0 HG22 VAL A 47 12.475 -4.611 2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 47 10.730 -4.610 3.192 1.00 0.00 H new ATOM 698 N VAL A 48 12.342 -1.644 2.050 1.00 0.00 N ATOM 699 CA VAL A 48 13.510 -0.926 2.546 1.00 0.00 C ATOM 700 C VAL A 48 14.417 -1.846 3.356 1.00 0.00 C ATOM 701 O VAL A 48 13.946 -2.630 4.181 1.00 0.00 O ATOM 702 CB VAL A 48 13.102 0.275 3.419 1.00 0.00 C ATOM 703 CG1 VAL A 48 12.196 -0.174 4.555 1.00 0.00 C ATOM 704 CG2 VAL A 48 14.335 0.984 3.959 1.00 0.00 C ATOM 0 H VAL A 48 11.450 -1.277 2.381 1.00 0.00 H new ATOM 0 HA VAL A 48 14.053 -0.562 1.673 1.00 0.00 H new ATOM 0 HB VAL A 48 12.547 0.980 2.800 1.00 0.00 H new ATOM 0 HG11 VAL A 48 11.918 0.688 5.161 1.00 0.00 H new ATOM 0 HG12 VAL A 48 11.297 -0.633 4.144 1.00 0.00 H new ATOM 0 HG13 VAL A 48 12.723 -0.899 5.175 1.00 0.00 H new ATOM 0 HG21 VAL A 48 14.028 1.830 4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 48 14.919 0.289 4.563 1.00 0.00 H new ATOM 0 HG23 VAL A 48 14.943 1.341 3.128 1.00 0.00 H new ATOM 714 N LEU A 49 15.719 -1.745 3.117 1.00 0.00 N ATOM 715 CA LEU A 49 16.694 -2.567 3.825 1.00 0.00 C ATOM 716 C LEU A 49 17.329 -1.791 4.974 1.00 0.00 C ATOM 717 O LEU A 49 17.225 -0.565 5.041 1.00 0.00 O ATOM 718 CB LEU A 49 17.778 -3.053 2.861 1.00 0.00 C ATOM 719 CG LEU A 49 17.286 -3.776 1.607 1.00 0.00 C ATOM 720 CD1 LEU A 49 18.360 -3.769 0.531 1.00 0.00 C ATOM 721 CD2 LEU A 49 16.873 -5.202 1.941 1.00 0.00 C ATOM 0 H LEU A 49 16.125 -1.101 2.438 1.00 0.00 H new ATOM 0 HA LEU A 49 16.172 -3.430 4.239 1.00 0.00 H new ATOM 0 HB2 LEU A 49 18.372 -2.193 2.551 1.00 0.00 H new ATOM 0 HB3 LEU A 49 18.445 -3.723 3.404 1.00 0.00 H new ATOM 0 HG LEU A 49 16.414 -3.246 1.224 1.00 0.00 H new ATOM 0 HD11 LEU A 49 17.992 -4.288 -0.354 1.00 0.00 H new ATOM 0 HD12 LEU A 49 18.608 -2.740 0.271 1.00 0.00 H new ATOM 0 HD13 LEU A 49 19.251 -4.274 0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 49 16.526 -5.701 1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 49 17.727 -5.742 2.348 1.00 0.00 H new ATOM 0 HD23 LEU A 49 16.070 -5.185 2.678 1.00 0.00 H new ATOM 733 N HIS A 50 17.989 -2.511 5.875 1.00 0.00 N ATOM 734 CA HIS A 50 18.645 -1.889 7.020 1.00 0.00 C ATOM 735 C HIS A 50 19.648 -0.834 6.565 1.00 0.00 C ATOM 736 O HIS A 50 20.386 -1.021 5.597 1.00 0.00 O ATOM 737 CB HIS A 50 19.350 -2.948 7.868 1.00 0.00 C ATOM 738 CG HIS A 50 19.383 -2.621 9.329 1.00 0.00 C ATOM 739 ND1 HIS A 50 20.345 -1.813 9.898 1.00 0.00 N ATOM 740 CD2 HIS A 50 18.564 -2.996 10.340 1.00 0.00 C ATOM 741 CE1 HIS A 50 20.118 -1.706 11.195 1.00 0.00 C ATOM 742 NE2 HIS A 50 19.042 -2.415 11.489 1.00 0.00 N ATOM 0 H HIS A 50 18.084 -3.526 5.835 1.00 0.00 H new ATOM 0 HA HIS A 50 17.880 -1.401 7.624 1.00 0.00 H new ATOM 0 HB2 HIS A 50 18.848 -3.906 7.730 1.00 0.00 H new ATOM 0 HB3 HIS A 50 20.372 -3.069 7.508 1.00 0.00 H new ATOM 0 HD2 HIS A 50 17.696 -3.634 10.258 1.00 0.00 H new ATOM 0 HE1 HIS A 50 20.711 -1.136 11.896 1.00 0.00 H new ATOM 0 HE2 HIS A 50 18.633 -2.514 12.418 1.00 0.00 H new ATOM 751 N PRO A 51 19.679 0.301 7.278 1.00 0.00 N ATOM 752 CA PRO A 51 20.587 1.408 6.965 1.00 0.00 C ATOM 753 C PRO A 51 22.043 1.066 7.265 1.00 0.00 C ATOM 754 O PRO A 51 22.931 1.905 7.116 1.00 0.00 O ATOM 755 CB PRO A 51 20.103 2.534 7.882 1.00 0.00 C ATOM 756 CG PRO A 51 19.442 1.838 9.021 1.00 0.00 C ATOM 757 CD PRO A 51 18.828 0.592 8.444 1.00 0.00 C ATOM 0 HA PRO A 51 20.567 1.664 5.906 1.00 0.00 H new ATOM 0 HB2 PRO A 51 20.934 3.151 8.224 1.00 0.00 H new ATOM 0 HB3 PRO A 51 19.407 3.195 7.364 1.00 0.00 H new ATOM 0 HG2 PRO A 51 20.164 1.593 9.800 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.682 2.472 9.478 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.835 -0.229 9.161 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.790 0.753 8.154 1.00 0.00 H new ATOM 765 N ASP A 52 22.279 -0.171 7.688 1.00 0.00 N ATOM 766 CA ASP A 52 23.628 -0.624 8.008 1.00 0.00 C ATOM 767 C ASP A 52 23.910 -1.982 7.372 1.00 0.00 C ATOM 768 O ASP A 52 24.837 -2.126 6.574 1.00 0.00 O ATOM 769 CB ASP A 52 23.815 -0.709 9.524 1.00 0.00 C ATOM 770 CG ASP A 52 25.222 -1.116 9.912 1.00 0.00 C ATOM 771 OD1 ASP A 52 26.080 -0.221 10.060 1.00 0.00 O ATOM 772 OD2 ASP A 52 25.466 -2.331 10.068 1.00 0.00 O ATOM 0 H ASP A 52 21.555 -0.877 7.817 1.00 0.00 H new ATOM 0 HA ASP A 52 24.334 0.101 7.603 1.00 0.00 H new ATOM 0 HB2 ASP A 52 23.584 0.258 9.970 1.00 0.00 H new ATOM 0 HB3 ASP A 52 23.106 -1.428 9.935 1.00 0.00 H new ATOM 777 N THR A 53 23.104 -2.977 7.730 1.00 0.00 N ATOM 778 CA THR A 53 23.268 -4.323 7.197 1.00 0.00 C ATOM 779 C THR A 53 22.524 -4.485 5.876 1.00 0.00 C ATOM 780 O THR A 53 21.751 -3.615 5.479 1.00 0.00 O ATOM 781 CB THR A 53 22.764 -5.386 8.191 1.00 0.00 C ATOM 782 OG1 THR A 53 21.357 -5.231 8.403 1.00 0.00 O ATOM 783 CG2 THR A 53 23.498 -5.276 9.519 1.00 0.00 C ATOM 0 H THR A 53 22.331 -2.875 8.387 1.00 0.00 H new ATOM 0 HA THR A 53 24.335 -4.470 7.030 1.00 0.00 H new ATOM 0 HB THR A 53 22.960 -6.371 7.766 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.044 -5.912 9.035 1.00 0.00 H new ATOM 0 HG21 THR A 53 23.125 -6.037 10.205 1.00 0.00 H new ATOM 0 HG22 THR A 53 24.566 -5.425 9.358 1.00 0.00 H new ATOM 0 HG23 THR A 53 23.330 -4.288 9.947 1.00 0.00 H new ATOM 791 N GLU A 54 22.763 -5.605 5.201 1.00 0.00 N ATOM 792 CA GLU A 54 22.115 -5.880 3.924 1.00 0.00 C ATOM 793 C GLU A 54 20.978 -6.884 4.096 1.00 0.00 C ATOM 794 O GLU A 54 20.758 -7.742 3.241 1.00 0.00 O ATOM 795 CB GLU A 54 23.133 -6.413 2.914 1.00 0.00 C ATOM 796 CG GLU A 54 22.611 -6.452 1.488 1.00 0.00 C ATOM 797 CD GLU A 54 22.882 -5.166 0.732 1.00 0.00 C ATOM 798 OE1 GLU A 54 24.021 -4.986 0.254 1.00 0.00 O ATOM 799 OE2 GLU A 54 21.953 -4.339 0.619 1.00 0.00 O ATOM 0 H GLU A 54 23.400 -6.336 5.517 1.00 0.00 H new ATOM 0 HA GLU A 54 21.698 -4.946 3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 54 24.027 -5.790 2.948 1.00 0.00 H new ATOM 0 HB3 GLU A 54 23.434 -7.418 3.210 1.00 0.00 H new ATOM 0 HG2 GLU A 54 23.074 -7.285 0.958 1.00 0.00 H new ATOM 0 HG3 GLU A 54 21.538 -6.641 1.503 1.00 0.00 H new ATOM 806 N HIS A 55 20.260 -6.771 5.209 1.00 0.00 N ATOM 807 CA HIS A 55 19.146 -7.669 5.495 1.00 0.00 C ATOM 808 C HIS A 55 17.816 -7.013 5.139 1.00 0.00 C ATOM 809 O HIS A 55 17.782 -5.907 4.599 1.00 0.00 O ATOM 810 CB HIS A 55 19.152 -8.070 6.970 1.00 0.00 C ATOM 811 CG HIS A 55 20.104 -9.183 7.284 1.00 0.00 C ATOM 812 ND1 HIS A 55 20.059 -10.411 6.658 1.00 0.00 N ATOM 813 CD2 HIS A 55 21.131 -9.248 8.164 1.00 0.00 C ATOM 814 CE1 HIS A 55 21.017 -11.183 7.140 1.00 0.00 C ATOM 815 NE2 HIS A 55 21.682 -10.501 8.055 1.00 0.00 N ATOM 0 H HIS A 55 20.429 -6.067 5.927 1.00 0.00 H new ATOM 0 HA HIS A 55 19.266 -8.563 4.883 1.00 0.00 H new ATOM 0 HB2 HIS A 55 19.411 -7.200 7.574 1.00 0.00 H new ATOM 0 HB3 HIS A 55 18.145 -8.371 7.260 1.00 0.00 H new ATOM 0 HD2 HIS A 55 21.456 -8.461 8.828 1.00 0.00 H new ATOM 0 HE1 HIS A 55 21.222 -12.199 6.837 1.00 0.00 H new ATOM 0 HE2 HIS A 55 22.476 -10.849 8.593 1.00 0.00 H new ATOM 824 N SER A 56 16.721 -7.703 5.444 1.00 0.00 N ATOM 825 CA SER A 56 15.388 -7.190 5.152 1.00 0.00 C ATOM 826 C SER A 56 14.795 -6.493 6.373 1.00 0.00 C ATOM 827 O SER A 56 14.459 -7.135 7.368 1.00 0.00 O ATOM 828 CB SER A 56 14.468 -8.327 4.703 1.00 0.00 C ATOM 829 OG SER A 56 13.311 -7.822 4.059 1.00 0.00 O ATOM 0 H SER A 56 16.731 -8.619 5.893 1.00 0.00 H new ATOM 0 HA SER A 56 15.474 -6.462 4.345 1.00 0.00 H new ATOM 0 HB2 SER A 56 15.007 -8.988 4.024 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.176 -8.925 5.566 1.00 0.00 H new ATOM 0 HG SER A 56 12.740 -8.568 3.780 1.00 0.00 H new ATOM 835 N LYS A 57 14.669 -5.173 6.289 1.00 0.00 N ATOM 836 CA LYS A 57 14.116 -4.385 7.385 1.00 0.00 C ATOM 837 C LYS A 57 12.697 -4.837 7.717 1.00 0.00 C ATOM 838 O LYS A 57 12.024 -5.456 6.894 1.00 0.00 O ATOM 839 CB LYS A 57 14.118 -2.898 7.023 1.00 0.00 C ATOM 840 CG LYS A 57 14.243 -1.980 8.227 1.00 0.00 C ATOM 841 CD LYS A 57 14.505 -0.543 7.807 1.00 0.00 C ATOM 842 CE LYS A 57 14.242 0.428 8.948 1.00 0.00 C ATOM 843 NZ LYS A 57 14.415 1.844 8.521 1.00 0.00 N ATOM 0 H LYS A 57 14.942 -4.626 5.473 1.00 0.00 H new ATOM 0 HA LYS A 57 14.743 -4.539 8.263 1.00 0.00 H new ATOM 0 HB2 LYS A 57 14.943 -2.700 6.338 1.00 0.00 H new ATOM 0 HB3 LYS A 57 13.197 -2.661 6.490 1.00 0.00 H new ATOM 0 HG2 LYS A 57 13.328 -2.026 8.818 1.00 0.00 H new ATOM 0 HG3 LYS A 57 15.054 -2.327 8.867 1.00 0.00 H new ATOM 0 HD2 LYS A 57 15.538 -0.443 7.473 1.00 0.00 H new ATOM 0 HD3 LYS A 57 13.870 -0.289 6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 57 13.229 0.283 9.323 1.00 0.00 H new ATOM 0 HE3 LYS A 57 14.921 0.212 9.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 14.227 2.475 9.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 15.389 1.989 8.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 13.750 2.058 7.751 1.00 0.00 H new ATOM 857 N GLY A 58 12.249 -4.521 8.928 1.00 0.00 N ATOM 858 CA GLY A 58 10.912 -4.901 9.347 1.00 0.00 C ATOM 859 C GLY A 58 9.851 -3.947 8.835 1.00 0.00 C ATOM 860 O GLY A 58 8.875 -3.663 9.530 1.00 0.00 O ATOM 0 H GLY A 58 12.788 -4.009 9.626 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.695 -5.907 8.989 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.871 -4.934 10.436 1.00 0.00 H new ATOM 864 N CYS A 59 10.042 -3.451 7.618 1.00 0.00 N ATOM 865 CA CYS A 59 9.094 -2.521 7.014 1.00 0.00 C ATOM 866 C CYS A 59 9.285 -2.455 5.502 1.00 0.00 C ATOM 867 O CYS A 59 10.399 -2.602 5.000 1.00 0.00 O ATOM 868 CB CYS A 59 9.258 -1.127 7.622 1.00 0.00 C ATOM 869 SG CYS A 59 10.970 -0.679 7.991 1.00 0.00 S ATOM 0 H CYS A 59 10.844 -3.677 7.030 1.00 0.00 H new ATOM 0 HA CYS A 59 8.087 -2.883 7.219 1.00 0.00 H new ATOM 0 HB2 CYS A 59 8.841 -0.391 6.934 1.00 0.00 H new ATOM 0 HB3 CYS A 59 8.673 -1.072 8.540 1.00 0.00 H new ATOM 0 HG CYS A 59 11.006 0.517 8.499 1.00 0.00 H new ATOM 875 N ALA A 60 8.190 -2.234 4.782 1.00 0.00 N ATOM 876 CA ALA A 60 8.236 -2.149 3.328 1.00 0.00 C ATOM 877 C ALA A 60 7.108 -1.274 2.793 1.00 0.00 C ATOM 878 O ALA A 60 6.108 -1.048 3.474 1.00 0.00 O ATOM 879 CB ALA A 60 8.165 -3.539 2.715 1.00 0.00 C ATOM 0 H ALA A 60 7.260 -2.111 5.182 1.00 0.00 H new ATOM 0 HA ALA A 60 9.183 -1.688 3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.200 -3.460 1.628 1.00 0.00 H new ATOM 0 HB2 ALA A 60 9.010 -4.134 3.063 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.234 -4.021 3.013 1.00 0.00 H new ATOM 885 N PHE A 61 7.275 -0.783 1.569 1.00 0.00 N ATOM 886 CA PHE A 61 6.271 0.069 0.944 1.00 0.00 C ATOM 887 C PHE A 61 5.787 -0.536 -0.371 1.00 0.00 C ATOM 888 O PHE A 61 6.585 -1.006 -1.181 1.00 0.00 O ATOM 889 CB PHE A 61 6.840 1.467 0.695 1.00 0.00 C ATOM 890 CG PHE A 61 7.403 2.114 1.929 1.00 0.00 C ATOM 891 CD1 PHE A 61 8.710 1.872 2.319 1.00 0.00 C ATOM 892 CD2 PHE A 61 6.624 2.963 2.699 1.00 0.00 C ATOM 893 CE1 PHE A 61 9.230 2.465 3.454 1.00 0.00 C ATOM 894 CE2 PHE A 61 7.139 3.559 3.835 1.00 0.00 C ATOM 895 CZ PHE A 61 8.444 3.310 4.212 1.00 0.00 C ATOM 0 H PHE A 61 8.096 -0.961 0.991 1.00 0.00 H new ATOM 0 HA PHE A 61 5.422 0.146 1.624 1.00 0.00 H new ATOM 0 HB2 PHE A 61 7.623 1.403 -0.061 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.054 2.103 0.287 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.330 1.213 1.730 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.603 3.161 2.408 1.00 0.00 H new ATOM 0 HE1 PHE A 61 10.250 2.268 3.748 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.522 4.218 4.427 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.849 3.775 5.098 1.00 0.00 H new ATOM 905 N ALA A 62 4.473 -0.521 -0.574 1.00 0.00 N ATOM 906 CA ALA A 62 3.882 -1.066 -1.789 1.00 0.00 C ATOM 907 C ALA A 62 2.832 -0.120 -2.362 1.00 0.00 C ATOM 908 O ALA A 62 2.550 0.930 -1.784 1.00 0.00 O ATOM 909 CB ALA A 62 3.270 -2.431 -1.512 1.00 0.00 C ATOM 0 H ALA A 62 3.798 -0.137 0.088 1.00 0.00 H new ATOM 0 HA ALA A 62 4.674 -1.178 -2.529 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.832 -2.826 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.044 -3.111 -1.157 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.495 -2.335 -0.752 1.00 0.00 H new ATOM 915 N GLN A 63 2.258 -0.499 -3.499 1.00 0.00 N ATOM 916 CA GLN A 63 1.240 0.318 -4.149 1.00 0.00 C ATOM 917 C GLN A 63 0.235 -0.555 -4.894 1.00 0.00 C ATOM 918 O GLN A 63 0.606 -1.543 -5.527 1.00 0.00 O ATOM 919 CB GLN A 63 1.891 1.307 -5.118 1.00 0.00 C ATOM 920 CG GLN A 63 0.980 2.457 -5.517 1.00 0.00 C ATOM 921 CD GLN A 63 1.298 3.002 -6.895 1.00 0.00 C ATOM 922 OE1 GLN A 63 0.516 2.844 -7.833 1.00 0.00 O ATOM 923 NE2 GLN A 63 2.451 3.648 -7.025 1.00 0.00 N ATOM 0 H GLN A 63 2.480 -1.366 -3.989 1.00 0.00 H new ATOM 0 HA GLN A 63 0.709 0.874 -3.376 1.00 0.00 H new ATOM 0 HB2 GLN A 63 2.793 1.712 -4.659 1.00 0.00 H new ATOM 0 HB3 GLN A 63 2.202 0.772 -6.016 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.056 2.119 -5.494 1.00 0.00 H new ATOM 0 HG3 GLN A 63 1.070 3.258 -4.784 1.00 0.00 H new ATOM 0 HE21 GLN A 63 3.069 3.756 -6.221 1.00 0.00 H new ATOM 0 HE22 GLN A 63 2.719 4.037 -7.929 1.00 0.00 H new ATOM 932 N PHE A 64 -1.038 -0.184 -4.813 1.00 0.00 N ATOM 933 CA PHE A 64 -2.097 -0.934 -5.479 1.00 0.00 C ATOM 934 C PHE A 64 -2.522 -0.244 -6.772 1.00 0.00 C ATOM 935 O PHE A 64 -2.097 0.875 -7.060 1.00 0.00 O ATOM 936 CB PHE A 64 -3.303 -1.089 -4.550 1.00 0.00 C ATOM 937 CG PHE A 64 -3.224 -2.297 -3.662 1.00 0.00 C ATOM 938 CD1 PHE A 64 -3.373 -3.570 -4.187 1.00 0.00 C ATOM 939 CD2 PHE A 64 -3.000 -2.160 -2.301 1.00 0.00 C ATOM 940 CE1 PHE A 64 -3.301 -4.685 -3.372 1.00 0.00 C ATOM 941 CE2 PHE A 64 -2.926 -3.270 -1.482 1.00 0.00 C ATOM 942 CZ PHE A 64 -3.078 -4.534 -2.017 1.00 0.00 C ATOM 0 H PHE A 64 -1.362 0.631 -4.293 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.708 -1.922 -5.726 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.391 -0.197 -3.930 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -4.210 -1.149 -5.152 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.548 -3.693 -5.246 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.882 -1.174 -1.876 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.419 -5.672 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.749 -3.149 -0.423 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.023 -5.403 -1.378 1.00 0.00 H new ATOM 952 N MET A 65 -3.363 -0.920 -7.547 1.00 0.00 N ATOM 953 CA MET A 65 -3.846 -0.373 -8.810 1.00 0.00 C ATOM 954 C MET A 65 -5.020 0.574 -8.578 1.00 0.00 C ATOM 955 O MET A 65 -5.186 1.561 -9.294 1.00 0.00 O ATOM 956 CB MET A 65 -4.265 -1.502 -9.753 1.00 0.00 C ATOM 957 CG MET A 65 -3.131 -2.019 -10.623 1.00 0.00 C ATOM 958 SD MET A 65 -2.656 -0.850 -11.911 1.00 0.00 S ATOM 959 CE MET A 65 -0.883 -1.103 -11.961 1.00 0.00 C ATOM 0 H MET A 65 -3.724 -1.847 -7.323 1.00 0.00 H new ATOM 0 HA MET A 65 -3.033 0.190 -9.268 1.00 0.00 H new ATOM 0 HB2 MET A 65 -4.665 -2.327 -9.164 1.00 0.00 H new ATOM 0 HB3 MET A 65 -5.072 -1.148 -10.395 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.266 -2.234 -9.996 1.00 0.00 H new ATOM 0 HG3 MET A 65 -3.432 -2.960 -11.084 1.00 0.00 H new ATOM 0 HE1 MET A 65 -0.412 -0.274 -12.488 1.00 0.00 H new ATOM 0 HE2 MET A 65 -0.494 -1.154 -10.944 1.00 0.00 H new ATOM 0 HE3 MET A 65 -0.663 -2.035 -12.481 1.00 0.00 H new ATOM 969 N THR A 66 -5.833 0.266 -7.572 1.00 0.00 N ATOM 970 CA THR A 66 -6.992 1.087 -7.247 1.00 0.00 C ATOM 971 C THR A 66 -7.061 1.373 -5.751 1.00 0.00 C ATOM 972 O THR A 66 -6.732 0.516 -4.931 1.00 0.00 O ATOM 973 CB THR A 66 -8.303 0.411 -7.690 1.00 0.00 C ATOM 974 OG1 THR A 66 -8.583 -0.713 -6.847 1.00 0.00 O ATOM 975 CG2 THR A 66 -8.214 -0.045 -9.138 1.00 0.00 C ATOM 0 H THR A 66 -5.710 -0.547 -6.968 1.00 0.00 H new ATOM 0 HA THR A 66 -6.876 2.026 -7.789 1.00 0.00 H new ATOM 0 HB THR A 66 -9.109 1.140 -7.604 1.00 0.00 H new ATOM 0 HG1 THR A 66 -9.419 -1.137 -7.134 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.151 -0.519 -9.428 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.029 0.816 -9.780 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.398 -0.759 -9.245 1.00 0.00 H new ATOM 983 N GLN A 67 -7.492 2.581 -5.403 1.00 0.00 N ATOM 984 CA GLN A 67 -7.604 2.979 -4.005 1.00 0.00 C ATOM 985 C GLN A 67 -8.311 1.902 -3.188 1.00 0.00 C ATOM 986 O GLN A 67 -7.805 1.461 -2.157 1.00 0.00 O ATOM 987 CB GLN A 67 -8.360 4.303 -3.888 1.00 0.00 C ATOM 988 CG GLN A 67 -7.556 5.506 -4.353 1.00 0.00 C ATOM 989 CD GLN A 67 -8.346 6.798 -4.286 1.00 0.00 C ATOM 990 OE1 GLN A 67 -9.529 6.835 -4.626 1.00 0.00 O ATOM 991 NE2 GLN A 67 -7.695 7.868 -3.844 1.00 0.00 N ATOM 0 H GLN A 67 -7.769 3.301 -6.070 1.00 0.00 H new ATOM 0 HA GLN A 67 -6.597 3.108 -3.608 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -9.277 4.241 -4.474 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -8.655 4.453 -2.849 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -6.661 5.600 -3.738 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -7.223 5.341 -5.378 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -6.715 7.793 -3.573 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -8.175 8.765 -3.776 1.00 0.00 H new ATOM 1000 N GLU A 68 -9.483 1.485 -3.656 1.00 0.00 N ATOM 1001 CA GLU A 68 -10.259 0.461 -2.967 1.00 0.00 C ATOM 1002 C GLU A 68 -9.372 -0.712 -2.559 1.00 0.00 C ATOM 1003 O GLU A 68 -9.497 -1.244 -1.457 1.00 0.00 O ATOM 1004 CB GLU A 68 -11.399 -0.034 -3.861 1.00 0.00 C ATOM 1005 CG GLU A 68 -12.621 -0.498 -3.087 1.00 0.00 C ATOM 1006 CD GLU A 68 -13.070 0.509 -2.046 1.00 0.00 C ATOM 1007 OE1 GLU A 68 -13.033 1.722 -2.341 1.00 0.00 O ATOM 1008 OE2 GLU A 68 -13.457 0.085 -0.937 1.00 0.00 O ATOM 0 H GLU A 68 -9.916 1.840 -4.509 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.680 0.906 -2.066 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.692 0.767 -4.539 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.036 -0.856 -4.477 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.439 -0.684 -3.784 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.398 -1.446 -2.597 1.00 0.00 H new ATOM 1015 N ALA A 69 -8.476 -1.109 -3.457 1.00 0.00 N ATOM 1016 CA ALA A 69 -7.567 -2.217 -3.191 1.00 0.00 C ATOM 1017 C ALA A 69 -6.802 -1.998 -1.890 1.00 0.00 C ATOM 1018 O ALA A 69 -6.907 -2.793 -0.956 1.00 0.00 O ATOM 1019 CB ALA A 69 -6.599 -2.396 -4.352 1.00 0.00 C ATOM 0 H ALA A 69 -8.360 -0.680 -4.375 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.161 -3.125 -3.085 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.926 -3.227 -4.140 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.159 -2.606 -5.263 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -6.018 -1.483 -4.485 1.00 0.00 H new ATOM 1025 N ALA A 70 -6.031 -0.917 -1.837 1.00 0.00 N ATOM 1026 CA ALA A 70 -5.249 -0.594 -0.650 1.00 0.00 C ATOM 1027 C ALA A 70 -6.085 -0.745 0.616 1.00 0.00 C ATOM 1028 O ALA A 70 -5.579 -1.159 1.658 1.00 0.00 O ATOM 1029 CB ALA A 70 -4.693 0.819 -0.753 1.00 0.00 C ATOM 0 H ALA A 70 -5.931 -0.250 -2.602 1.00 0.00 H new ATOM 0 HA ALA A 70 -4.418 -1.296 -0.590 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -4.111 1.047 0.140 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.053 0.895 -1.632 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.516 1.528 -0.841 1.00 0.00 H new ATOM 1035 N GLN A 71 -7.366 -0.405 0.518 1.00 0.00 N ATOM 1036 CA GLN A 71 -8.271 -0.502 1.657 1.00 0.00 C ATOM 1037 C GLN A 71 -8.521 -1.959 2.031 1.00 0.00 C ATOM 1038 O GLN A 71 -8.575 -2.308 3.210 1.00 0.00 O ATOM 1039 CB GLN A 71 -9.598 0.191 1.341 1.00 0.00 C ATOM 1040 CG GLN A 71 -9.435 1.611 0.824 1.00 0.00 C ATOM 1041 CD GLN A 71 -8.267 2.334 1.464 1.00 0.00 C ATOM 1042 OE1 GLN A 71 -8.438 3.091 2.420 1.00 0.00 O ATOM 1043 NE2 GLN A 71 -7.069 2.105 0.939 1.00 0.00 N ATOM 0 H GLN A 71 -7.800 -0.060 -0.338 1.00 0.00 H new ATOM 0 HA GLN A 71 -7.802 -0.004 2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -10.138 -0.397 0.599 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -10.212 0.209 2.241 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.294 1.586 -0.257 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -10.351 2.170 1.013 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -6.972 1.470 0.147 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -6.245 2.564 1.328 1.00 0.00 H new ATOM 1052 N LYS A 72 -8.674 -2.807 1.019 1.00 0.00 N ATOM 1053 CA LYS A 72 -8.917 -4.227 1.241 1.00 0.00 C ATOM 1054 C LYS A 72 -7.723 -4.884 1.925 1.00 0.00 C ATOM 1055 O LYS A 72 -7.880 -5.831 2.696 1.00 0.00 O ATOM 1056 CB LYS A 72 -9.207 -4.929 -0.088 1.00 0.00 C ATOM 1057 CG LYS A 72 -10.382 -4.336 -0.846 1.00 0.00 C ATOM 1058 CD LYS A 72 -10.604 -5.042 -2.173 1.00 0.00 C ATOM 1059 CE LYS A 72 -11.532 -4.248 -3.079 1.00 0.00 C ATOM 1060 NZ LYS A 72 -10.781 -3.296 -3.944 1.00 0.00 N ATOM 0 H LYS A 72 -8.634 -2.535 0.037 1.00 0.00 H new ATOM 0 HA LYS A 72 -9.785 -4.324 1.894 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -8.318 -4.880 -0.717 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.404 -5.984 0.103 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -11.283 -4.411 -0.238 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.204 -3.275 -1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -9.646 -5.190 -2.672 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.027 -6.031 -1.994 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -12.103 -4.934 -3.704 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -12.250 -3.698 -2.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -11.393 -2.976 -4.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.482 -2.476 -3.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.943 -3.771 -4.336 1.00 0.00 H new ATOM 1074 N CYS A 73 -6.530 -4.375 1.639 1.00 0.00 N ATOM 1075 CA CYS A 73 -5.308 -4.912 2.228 1.00 0.00 C ATOM 1076 C CYS A 73 -5.219 -4.562 3.710 1.00 0.00 C ATOM 1077 O CYS A 73 -4.683 -5.331 4.509 1.00 0.00 O ATOM 1078 CB CYS A 73 -4.082 -4.372 1.490 1.00 0.00 C ATOM 1079 SG CYS A 73 -2.514 -4.689 2.333 1.00 0.00 S ATOM 0 H CYS A 73 -6.383 -3.591 1.003 1.00 0.00 H new ATOM 0 HA CYS A 73 -5.334 -5.997 2.131 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -4.044 -4.817 0.496 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -4.198 -3.297 1.353 1.00 0.00 H new ATOM 0 HG CYS A 73 -2.487 -5.919 2.752 1.00 0.00 H new ATOM 1085 N LEU A 74 -5.747 -3.398 4.070 1.00 0.00 N ATOM 1086 CA LEU A 74 -5.727 -2.945 5.457 1.00 0.00 C ATOM 1087 C LEU A 74 -6.639 -3.807 6.324 1.00 0.00 C ATOM 1088 O LEU A 74 -6.171 -4.557 7.180 1.00 0.00 O ATOM 1089 CB LEU A 74 -6.158 -1.480 5.542 1.00 0.00 C ATOM 1090 CG LEU A 74 -5.289 -0.480 4.779 1.00 0.00 C ATOM 1091 CD1 LEU A 74 -6.002 0.858 4.652 1.00 0.00 C ATOM 1092 CD2 LEU A 74 -3.944 -0.306 5.468 1.00 0.00 C ATOM 0 H LEU A 74 -6.194 -2.750 3.421 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.707 -3.039 5.830 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -7.180 -1.400 5.171 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.177 -1.188 6.592 1.00 0.00 H new ATOM 0 HG LEU A 74 -5.113 -0.872 3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.369 1.557 4.106 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -6.940 0.721 4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -6.209 1.256 5.646 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -3.339 0.409 4.910 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -4.100 0.063 6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -3.428 -1.265 5.506 1.00 0.00 H new ATOM 1104 N ALA A 75 -7.944 -3.694 6.096 1.00 0.00 N ATOM 1105 CA ALA A 75 -8.921 -4.466 6.853 1.00 0.00 C ATOM 1106 C ALA A 75 -8.454 -5.904 7.047 1.00 0.00 C ATOM 1107 O ALA A 75 -8.667 -6.499 8.103 1.00 0.00 O ATOM 1108 CB ALA A 75 -10.272 -4.437 6.154 1.00 0.00 C ATOM 0 H ALA A 75 -8.348 -3.075 5.393 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.024 -4.010 7.838 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -10.992 -5.018 6.730 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -10.618 -3.406 6.073 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -10.175 -4.866 5.157 1.00 0.00 H new ATOM 1114 N ALA A 76 -7.817 -6.458 6.021 1.00 0.00 N ATOM 1115 CA ALA A 76 -7.319 -7.827 6.079 1.00 0.00 C ATOM 1116 C ALA A 76 -6.073 -7.921 6.953 1.00 0.00 C ATOM 1117 O ALA A 76 -5.832 -8.939 7.600 1.00 0.00 O ATOM 1118 CB ALA A 76 -7.023 -8.341 4.678 1.00 0.00 C ATOM 0 H ALA A 76 -7.633 -5.980 5.139 1.00 0.00 H new ATOM 0 HA ALA A 76 -8.093 -8.450 6.527 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -6.652 -9.364 4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -7.936 -8.320 4.082 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.269 -7.708 4.210 1.00 0.00 H new ATOM 1124 N ALA A 77 -5.284 -6.852 6.967 1.00 0.00 N ATOM 1125 CA ALA A 77 -4.063 -6.813 7.762 1.00 0.00 C ATOM 1126 C ALA A 77 -4.379 -6.651 9.245 1.00 0.00 C ATOM 1127 O ALA A 77 -3.668 -7.175 10.102 1.00 0.00 O ATOM 1128 CB ALA A 77 -3.158 -5.686 7.287 1.00 0.00 C ATOM 0 H ALA A 77 -5.469 -6.001 6.436 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.543 -7.761 7.629 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.250 -5.670 7.890 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.896 -5.846 6.241 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -3.679 -4.734 7.389 1.00 0.00 H new ATOM 1134 N SER A 78 -5.450 -5.921 9.541 1.00 0.00 N ATOM 1135 CA SER A 78 -5.858 -5.686 10.921 1.00 0.00 C ATOM 1136 C SER A 78 -6.771 -6.804 11.416 1.00 0.00 C ATOM 1137 O SER A 78 -7.948 -6.864 11.059 1.00 0.00 O ATOM 1138 CB SER A 78 -6.571 -4.338 11.042 1.00 0.00 C ATOM 1139 OG SER A 78 -6.540 -3.863 12.377 1.00 0.00 O ATOM 0 H SER A 78 -6.051 -5.482 8.843 1.00 0.00 H new ATOM 0 HA SER A 78 -4.962 -5.672 11.541 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.096 -3.611 10.383 1.00 0.00 H new ATOM 0 HB3 SER A 78 -7.605 -4.439 10.712 1.00 0.00 H new ATOM 0 HG SER A 78 -7.001 -2.999 12.428 1.00 0.00 H new ATOM 1145 N LEU A 79 -6.220 -7.688 12.240 1.00 0.00 N ATOM 1146 CA LEU A 79 -6.984 -8.806 12.785 1.00 0.00 C ATOM 1147 C LEU A 79 -8.204 -8.308 13.552 1.00 0.00 C ATOM 1148 O LEU A 79 -9.209 -9.010 13.660 1.00 0.00 O ATOM 1149 CB LEU A 79 -6.101 -9.653 13.703 1.00 0.00 C ATOM 1150 CG LEU A 79 -5.816 -9.068 15.087 1.00 0.00 C ATOM 1151 CD1 LEU A 79 -5.144 -10.104 15.976 1.00 0.00 C ATOM 1152 CD2 LEU A 79 -4.952 -7.821 14.971 1.00 0.00 C ATOM 0 H LEU A 79 -5.248 -7.653 12.546 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.327 -9.421 11.953 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.574 -10.626 13.832 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -5.149 -9.826 13.201 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.765 -8.787 15.544 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.949 -9.670 16.957 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.798 -10.969 16.086 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -4.203 -10.416 15.523 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.759 -7.418 15.965 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.006 -8.077 14.493 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.471 -7.073 14.371 1.00 0.00 H new ATOM 1164 N GLU A 80 -8.109 -7.092 14.081 1.00 0.00 N ATOM 1165 CA GLU A 80 -9.207 -6.501 14.837 1.00 0.00 C ATOM 1166 C GLU A 80 -10.407 -6.231 13.933 1.00 0.00 C ATOM 1167 O GLU A 80 -11.532 -6.619 14.246 1.00 0.00 O ATOM 1168 CB GLU A 80 -8.754 -5.200 15.503 1.00 0.00 C ATOM 1169 CG GLU A 80 -9.614 -4.792 16.688 1.00 0.00 C ATOM 1170 CD GLU A 80 -9.366 -3.360 17.123 1.00 0.00 C ATOM 1171 OE1 GLU A 80 -8.390 -3.128 17.868 1.00 0.00 O ATOM 1172 OE2 GLU A 80 -10.146 -2.473 16.719 1.00 0.00 O ATOM 0 H GLU A 80 -7.284 -6.498 14.000 1.00 0.00 H new ATOM 0 HA GLU A 80 -9.507 -7.211 15.608 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.722 -5.312 15.835 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.766 -4.400 14.763 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.666 -4.912 16.427 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -9.415 -5.462 17.525 1.00 0.00 H new ATOM 1179 N ALA A 81 -10.157 -5.564 12.811 1.00 0.00 N ATOM 1180 CA ALA A 81 -11.215 -5.244 11.861 1.00 0.00 C ATOM 1181 C ALA A 81 -12.117 -6.449 11.617 1.00 0.00 C ATOM 1182 O ALA A 81 -11.769 -7.576 11.968 1.00 0.00 O ATOM 1183 CB ALA A 81 -10.617 -4.755 10.550 1.00 0.00 C ATOM 0 H ALA A 81 -9.231 -5.235 12.538 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.825 -4.448 12.289 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.419 -4.520 9.850 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.021 -3.861 10.733 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.982 -5.534 10.127 1.00 0.00 H new ATOM 1189 N GLU A 82 -13.276 -6.203 11.013 1.00 0.00 N ATOM 1190 CA GLU A 82 -14.227 -7.269 10.724 1.00 0.00 C ATOM 1191 C GLU A 82 -13.835 -8.018 9.453 1.00 0.00 C ATOM 1192 O GLU A 82 -14.676 -8.297 8.600 1.00 0.00 O ATOM 1193 CB GLU A 82 -15.639 -6.698 10.578 1.00 0.00 C ATOM 1194 CG GLU A 82 -15.806 -5.791 9.370 1.00 0.00 C ATOM 1195 CD GLU A 82 -15.473 -4.344 9.676 1.00 0.00 C ATOM 1196 OE1 GLU A 82 -16.390 -3.596 10.077 1.00 0.00 O ATOM 1197 OE2 GLU A 82 -14.296 -3.958 9.515 1.00 0.00 O ATOM 0 H GLU A 82 -13.578 -5.275 10.715 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.212 -7.971 11.558 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -16.349 -7.522 10.505 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -15.891 -6.139 11.479 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -15.164 -6.145 8.563 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -16.833 -5.855 9.011 1.00 0.00 H new ATOM 1204 N GLY A 83 -12.551 -8.340 9.335 1.00 0.00 N ATOM 1205 CA GLY A 83 -12.069 -9.052 8.166 1.00 0.00 C ATOM 1206 C GLY A 83 -11.075 -10.141 8.519 1.00 0.00 C ATOM 1207 O GLY A 83 -11.280 -11.308 8.189 1.00 0.00 O ATOM 0 H GLY A 83 -11.836 -8.121 10.028 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -12.915 -9.493 7.639 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -11.601 -8.345 7.481 1.00 0.00 H new ATOM 1211 N GLY A 84 -9.994 -9.758 9.192 1.00 0.00 N ATOM 1212 CA GLY A 84 -8.980 -10.722 9.577 1.00 0.00 C ATOM 1213 C GLY A 84 -7.601 -10.102 9.684 1.00 0.00 C ATOM 1214 O GLY A 84 -7.451 -8.885 9.584 1.00 0.00 O ATOM 0 H GLY A 84 -9.803 -8.798 9.477 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.251 -11.166 10.535 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -8.956 -11.530 8.846 1.00 0.00 H new ATOM 1218 N GLY A 85 -6.590 -10.941 9.890 1.00 0.00 N ATOM 1219 CA GLY A 85 -5.230 -10.449 10.009 1.00 0.00 C ATOM 1220 C GLY A 85 -4.243 -11.274 9.207 1.00 0.00 C ATOM 1221 O GLY A 85 -4.360 -12.498 9.135 1.00 0.00 O ATOM 0 H GLY A 85 -6.689 -11.953 9.977 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.191 -9.413 9.672 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.935 -10.455 11.058 1.00 0.00 H new ATOM 1225 N LEU A 86 -3.268 -10.604 8.602 1.00 0.00 N ATOM 1226 CA LEU A 86 -2.257 -11.283 7.800 1.00 0.00 C ATOM 1227 C LEU A 86 -1.009 -11.574 8.629 1.00 0.00 C ATOM 1228 O LEU A 86 -0.641 -10.797 9.510 1.00 0.00 O ATOM 1229 CB LEU A 86 -1.888 -10.433 6.583 1.00 0.00 C ATOM 1230 CG LEU A 86 -2.721 -10.668 5.323 1.00 0.00 C ATOM 1231 CD1 LEU A 86 -4.130 -10.124 5.506 1.00 0.00 C ATOM 1232 CD2 LEU A 86 -2.053 -10.028 4.115 1.00 0.00 C ATOM 0 H LEU A 86 -3.157 -9.591 8.652 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.674 -12.231 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.973 -9.382 6.860 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -0.841 -10.615 6.341 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.788 -11.742 5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -4.709 -10.300 4.599 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.609 -10.628 6.345 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.084 -9.053 5.705 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.660 -10.205 3.227 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -1.955 -8.955 4.279 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.065 -10.465 3.972 1.00 0.00 H new ATOM 1244 N LYS A 87 -0.361 -12.696 8.338 1.00 0.00 N ATOM 1245 CA LYS A 87 0.848 -13.089 9.053 1.00 0.00 C ATOM 1246 C LYS A 87 1.864 -13.713 8.102 1.00 0.00 C ATOM 1247 O LYS A 87 1.540 -14.627 7.342 1.00 0.00 O ATOM 1248 CB LYS A 87 0.506 -14.078 10.170 1.00 0.00 C ATOM 1249 CG LYS A 87 -0.104 -13.422 11.397 1.00 0.00 C ATOM 1250 CD LYS A 87 0.227 -14.193 12.664 1.00 0.00 C ATOM 1251 CE LYS A 87 -0.818 -13.964 13.745 1.00 0.00 C ATOM 1252 NZ LYS A 87 -0.656 -14.912 14.883 1.00 0.00 N ATOM 0 H LYS A 87 -0.653 -13.350 7.612 1.00 0.00 H new ATOM 0 HA LYS A 87 1.288 -12.193 9.491 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -0.189 -14.824 9.784 1.00 0.00 H new ATOM 0 HB3 LYS A 87 1.412 -14.608 10.464 1.00 0.00 H new ATOM 0 HG2 LYS A 87 0.264 -12.400 11.485 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -1.186 -13.362 11.279 1.00 0.00 H new ATOM 0 HD2 LYS A 87 0.290 -15.257 12.437 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.206 -13.887 13.032 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -0.743 -12.940 14.112 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -1.814 -14.077 13.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -1.387 -14.724 15.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.753 -15.888 14.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.285 -14.787 15.308 1.00 0.00 H new ATOM 1266 N LEU A 88 3.095 -13.215 8.149 1.00 0.00 N ATOM 1267 CA LEU A 88 4.160 -13.724 7.292 1.00 0.00 C ATOM 1268 C LEU A 88 5.269 -14.361 8.123 1.00 0.00 C ATOM 1269 O LEU A 88 5.740 -13.777 9.099 1.00 0.00 O ATOM 1270 CB LEU A 88 4.734 -12.596 6.433 1.00 0.00 C ATOM 1271 CG LEU A 88 5.317 -13.011 5.082 1.00 0.00 C ATOM 1272 CD1 LEU A 88 4.207 -13.223 4.064 1.00 0.00 C ATOM 1273 CD2 LEU A 88 6.307 -11.968 4.585 1.00 0.00 C ATOM 0 H LEU A 88 3.380 -12.459 8.772 1.00 0.00 H new ATOM 0 HA LEU A 88 3.735 -14.487 6.640 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.946 -11.864 6.257 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.515 -12.093 7.004 1.00 0.00 H new ATOM 0 HG LEU A 88 5.848 -13.954 5.212 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.641 -13.518 3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 88 3.536 -14.007 4.415 1.00 0.00 H new ATOM 0 HD13 LEU A 88 3.647 -12.296 3.938 1.00 0.00 H new ATOM 0 HD21 LEU A 88 6.712 -12.280 3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.800 -11.010 4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 88 7.120 -11.866 5.304 1.00 0.00 H new ATOM 1285 N ASP A 89 5.684 -15.559 7.728 1.00 0.00 N ATOM 1286 CA ASP A 89 6.741 -16.274 8.434 1.00 0.00 C ATOM 1287 C ASP A 89 6.478 -16.287 9.936 1.00 0.00 C ATOM 1288 O ASP A 89 7.409 -16.335 10.739 1.00 0.00 O ATOM 1289 CB ASP A 89 8.099 -15.633 8.146 1.00 0.00 C ATOM 1290 CG ASP A 89 8.568 -15.882 6.726 1.00 0.00 C ATOM 1291 OD1 ASP A 89 9.030 -17.007 6.444 1.00 0.00 O ATOM 1292 OD2 ASP A 89 8.474 -14.952 5.898 1.00 0.00 O ATOM 0 H ASP A 89 5.305 -16.056 6.922 1.00 0.00 H new ATOM 0 HA ASP A 89 6.751 -17.304 8.077 1.00 0.00 H new ATOM 0 HB2 ASP A 89 8.035 -14.559 8.321 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.838 -16.026 8.844 1.00 0.00 H new ATOM 1297 N GLY A 90 5.203 -16.243 10.310 1.00 0.00 N ATOM 1298 CA GLY A 90 4.840 -16.249 11.715 1.00 0.00 C ATOM 1299 C GLY A 90 5.006 -14.888 12.362 1.00 0.00 C ATOM 1300 O GLY A 90 5.368 -14.791 13.535 1.00 0.00 O ATOM 0 H GLY A 90 4.414 -16.203 9.664 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.804 -16.573 11.818 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.456 -16.977 12.243 1.00 0.00 H new ATOM 1304 N ARG A 91 4.741 -13.834 11.597 1.00 0.00 N ATOM 1305 CA ARG A 91 4.866 -12.473 12.103 1.00 0.00 C ATOM 1306 C ARG A 91 3.707 -11.605 11.620 1.00 0.00 C ATOM 1307 O ARG A 91 3.405 -11.565 10.428 1.00 0.00 O ATOM 1308 CB ARG A 91 6.195 -11.860 11.657 1.00 0.00 C ATOM 1309 CG ARG A 91 7.414 -12.602 12.181 1.00 0.00 C ATOM 1310 CD ARG A 91 8.595 -11.665 12.378 1.00 0.00 C ATOM 1311 NE ARG A 91 9.537 -12.173 13.371 1.00 0.00 N ATOM 1312 CZ ARG A 91 9.286 -12.204 14.675 1.00 0.00 C ATOM 1313 NH1 ARG A 91 8.128 -11.759 15.141 1.00 0.00 N ATOM 1314 NH2 ARG A 91 10.195 -12.682 15.515 1.00 0.00 N ATOM 0 H ARG A 91 4.439 -13.897 10.625 1.00 0.00 H new ATOM 0 HA ARG A 91 4.839 -12.513 13.192 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.231 -11.844 10.568 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.239 -10.824 11.993 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.169 -13.084 13.127 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.688 -13.393 11.482 1.00 0.00 H new ATOM 0 HD2 ARG A 91 9.110 -11.526 11.427 1.00 0.00 H new ATOM 0 HD3 ARG A 91 8.232 -10.686 12.690 1.00 0.00 H new ATOM 0 HE ARG A 91 10.438 -12.524 13.045 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.427 -11.392 14.498 1.00 0.00 H new ATOM 0 HH12 ARG A 91 7.938 -11.784 16.143 1.00 0.00 H new ATOM 0 HH21 ARG A 91 11.087 -13.026 15.160 1.00 0.00 H new ATOM 0 HH22 ARG A 91 10.002 -12.706 16.516 1.00 0.00 H new ATOM 1328 N GLN A 92 3.062 -10.915 12.555 1.00 0.00 N ATOM 1329 CA GLN A 92 1.936 -10.050 12.224 1.00 0.00 C ATOM 1330 C GLN A 92 2.379 -8.897 11.329 1.00 0.00 C ATOM 1331 O GLN A 92 3.450 -8.321 11.525 1.00 0.00 O ATOM 1332 CB GLN A 92 1.294 -9.503 13.501 1.00 0.00 C ATOM 1333 CG GLN A 92 -0.194 -9.224 13.362 1.00 0.00 C ATOM 1334 CD GLN A 92 -0.498 -8.201 12.285 1.00 0.00 C ATOM 1335 OE1 GLN A 92 0.203 -7.197 12.151 1.00 0.00 O ATOM 1336 NE2 GLN A 92 -1.548 -8.450 11.511 1.00 0.00 N ATOM 0 H GLN A 92 3.300 -10.938 13.547 1.00 0.00 H new ATOM 0 HA GLN A 92 1.201 -10.644 11.681 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.447 -10.218 14.310 1.00 0.00 H new ATOM 0 HB3 GLN A 92 1.803 -8.583 13.788 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -0.714 -10.154 13.132 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.584 -8.869 14.316 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -2.101 -9.295 11.658 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -1.802 -7.797 10.770 1.00 0.00 H new ATOM 1345 N LEU A 93 1.549 -8.565 10.347 1.00 0.00 N ATOM 1346 CA LEU A 93 1.855 -7.481 9.420 1.00 0.00 C ATOM 1347 C LEU A 93 0.881 -6.321 9.599 1.00 0.00 C ATOM 1348 O LEU A 93 -0.332 -6.519 9.665 1.00 0.00 O ATOM 1349 CB LEU A 93 1.805 -7.987 7.977 1.00 0.00 C ATOM 1350 CG LEU A 93 2.598 -9.261 7.685 1.00 0.00 C ATOM 1351 CD1 LEU A 93 2.207 -9.833 6.331 1.00 0.00 C ATOM 1352 CD2 LEU A 93 4.093 -8.982 7.737 1.00 0.00 C ATOM 0 H LEU A 93 0.659 -9.031 10.172 1.00 0.00 H new ATOM 0 HA LEU A 93 2.861 -7.123 9.637 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.763 -8.163 7.711 1.00 0.00 H new ATOM 0 HB3 LEU A 93 2.172 -7.196 7.323 1.00 0.00 H new ATOM 0 HG LEU A 93 2.360 -9.999 8.451 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.781 -10.739 6.139 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.143 -10.070 6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.416 -9.100 5.552 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.642 -9.900 7.527 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.348 -8.228 6.993 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.361 -8.618 8.729 1.00 0.00 H new ATOM 1364 N LYS A 94 1.420 -5.109 9.674 1.00 0.00 N ATOM 1365 CA LYS A 94 0.600 -3.915 9.841 1.00 0.00 C ATOM 1366 C LYS A 94 0.600 -3.072 8.570 1.00 0.00 C ATOM 1367 O LYS A 94 1.582 -2.397 8.261 1.00 0.00 O ATOM 1368 CB LYS A 94 1.110 -3.081 11.019 1.00 0.00 C ATOM 1369 CG LYS A 94 0.467 -3.445 12.346 1.00 0.00 C ATOM 1370 CD LYS A 94 0.380 -2.243 13.271 1.00 0.00 C ATOM 1371 CE LYS A 94 -0.894 -1.447 13.033 1.00 0.00 C ATOM 1372 NZ LYS A 94 -2.063 -2.048 13.732 1.00 0.00 N ATOM 0 H LYS A 94 2.422 -4.928 9.622 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.422 -4.233 10.045 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.190 -3.206 11.102 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.926 -2.026 10.813 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.532 -3.843 12.170 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.045 -4.234 12.827 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.413 -2.578 14.308 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.246 -1.600 13.116 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.752 -0.423 13.378 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.097 -1.398 11.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.911 -1.476 13.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.215 -3.017 13.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.881 -2.072 14.756 1.00 0.00 H new ATOM 1386 N VAL A 95 -0.508 -3.115 7.837 1.00 0.00 N ATOM 1387 CA VAL A 95 -0.636 -2.353 6.601 1.00 0.00 C ATOM 1388 C VAL A 95 -1.379 -1.043 6.837 1.00 0.00 C ATOM 1389 O VAL A 95 -2.441 -1.023 7.459 1.00 0.00 O ATOM 1390 CB VAL A 95 -1.375 -3.161 5.517 1.00 0.00 C ATOM 1391 CG1 VAL A 95 -1.361 -2.415 4.192 1.00 0.00 C ATOM 1392 CG2 VAL A 95 -0.754 -4.542 5.368 1.00 0.00 C ATOM 0 H VAL A 95 -1.330 -3.669 8.078 1.00 0.00 H new ATOM 0 HA VAL A 95 0.375 -2.137 6.257 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.413 -3.285 5.825 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.888 -3.001 3.439 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.855 -1.451 4.312 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.330 -2.258 3.874 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.288 -5.100 4.598 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.293 -4.441 5.083 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.822 -5.076 6.316 1.00 0.00 H new ATOM 1402 N ASP A 96 -0.815 0.050 6.336 1.00 0.00 N ATOM 1403 CA ASP A 96 -1.424 1.366 6.490 1.00 0.00 C ATOM 1404 C ASP A 96 -1.169 2.231 5.260 1.00 0.00 C ATOM 1405 O ASP A 96 -0.092 2.179 4.664 1.00 0.00 O ATOM 1406 CB ASP A 96 -0.880 2.060 7.740 1.00 0.00 C ATOM 1407 CG ASP A 96 -1.710 3.263 8.141 1.00 0.00 C ATOM 1408 OD1 ASP A 96 -2.953 3.186 8.047 1.00 0.00 O ATOM 1409 OD2 ASP A 96 -1.116 4.283 8.551 1.00 0.00 O ATOM 0 H ASP A 96 0.064 0.051 5.819 1.00 0.00 H new ATOM 0 HA ASP A 96 -2.500 1.231 6.599 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -0.855 1.348 8.565 1.00 0.00 H new ATOM 0 HB3 ASP A 96 0.148 2.375 7.559 1.00 0.00 H new ATOM 1414 N LEU A 97 -2.166 3.025 4.885 1.00 0.00 N ATOM 1415 CA LEU A 97 -2.050 3.902 3.725 1.00 0.00 C ATOM 1416 C LEU A 97 -0.927 4.916 3.918 1.00 0.00 C ATOM 1417 O LEU A 97 -1.103 5.930 4.593 1.00 0.00 O ATOM 1418 CB LEU A 97 -3.372 4.629 3.476 1.00 0.00 C ATOM 1419 CG LEU A 97 -3.501 5.349 2.133 1.00 0.00 C ATOM 1420 CD1 LEU A 97 -2.156 5.909 1.697 1.00 0.00 C ATOM 1421 CD2 LEU A 97 -4.058 4.408 1.075 1.00 0.00 C ATOM 0 H LEU A 97 -3.063 3.080 5.367 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.812 3.286 2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.182 3.904 3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.517 5.359 4.272 1.00 0.00 H new ATOM 0 HG LEU A 97 -4.196 6.180 2.253 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.267 6.418 0.739 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.797 6.616 2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -1.439 5.095 1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.143 4.937 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.388 3.556 0.957 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.042 4.056 1.383 1.00 0.00 H new ATOM 1433 N ALA A 98 0.226 4.636 3.321 1.00 0.00 N ATOM 1434 CA ALA A 98 1.376 5.526 3.424 1.00 0.00 C ATOM 1435 C ALA A 98 1.260 6.689 2.444 1.00 0.00 C ATOM 1436 O ALA A 98 0.314 6.760 1.659 1.00 0.00 O ATOM 1437 CB ALA A 98 2.664 4.754 3.179 1.00 0.00 C ATOM 0 H ALA A 98 0.389 3.799 2.761 1.00 0.00 H new ATOM 0 HA ALA A 98 1.397 5.936 4.434 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.515 5.431 3.259 1.00 0.00 H new ATOM 0 HB2 ALA A 98 2.760 3.961 3.921 1.00 0.00 H new ATOM 0 HB3 ALA A 98 2.641 4.316 2.181 1.00 0.00 H new ATOM 1443 N VAL A 99 2.227 7.600 2.497 1.00 0.00 N ATOM 1444 CA VAL A 99 2.233 8.760 1.614 1.00 0.00 C ATOM 1445 C VAL A 99 3.631 9.358 1.502 1.00 0.00 C ATOM 1446 O VAL A 99 4.257 9.697 2.507 1.00 0.00 O ATOM 1447 CB VAL A 99 1.260 9.847 2.110 1.00 0.00 C ATOM 1448 CG1 VAL A 99 1.639 10.305 3.510 1.00 0.00 C ATOM 1449 CG2 VAL A 99 1.238 11.021 1.143 1.00 0.00 C ATOM 0 H VAL A 99 3.016 7.557 3.142 1.00 0.00 H new ATOM 0 HA VAL A 99 1.910 8.413 0.633 1.00 0.00 H new ATOM 0 HB VAL A 99 0.257 9.422 2.153 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.941 11.073 3.843 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.599 9.457 4.194 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.649 10.714 3.498 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.546 11.780 1.508 1.00 0.00 H new ATOM 0 HG22 VAL A 99 2.238 11.448 1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.914 10.677 0.161 1.00 0.00 H new ATOM 1459 N THR A 100 4.117 9.485 0.271 1.00 0.00 N ATOM 1460 CA THR A 100 5.441 10.041 0.026 1.00 0.00 C ATOM 1461 C THR A 100 5.576 11.430 0.638 1.00 0.00 C ATOM 1462 O THR A 100 4.839 12.350 0.282 1.00 0.00 O ATOM 1463 CB THR A 100 5.745 10.125 -1.482 1.00 0.00 C ATOM 1464 OG1 THR A 100 5.521 8.852 -2.099 1.00 0.00 O ATOM 1465 CG2 THR A 100 7.182 10.564 -1.721 1.00 0.00 C ATOM 0 H THR A 100 3.613 9.210 -0.572 1.00 0.00 H new ATOM 0 HA THR A 100 6.158 9.368 0.497 1.00 0.00 H new ATOM 0 HB THR A 100 5.077 10.865 -1.924 1.00 0.00 H new ATOM 0 HG1 THR A 100 5.715 8.914 -3.058 1.00 0.00 H new ATOM 0 HG21 THR A 100 7.373 10.616 -2.793 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.341 11.546 -1.276 1.00 0.00 H new ATOM 0 HG23 THR A 100 7.863 9.845 -1.266 1.00 0.00 H new ATOM 1473 N ARG A 101 6.523 11.576 1.559 1.00 0.00 N ATOM 1474 CA ARG A 101 6.754 12.854 2.221 1.00 0.00 C ATOM 1475 C ARG A 101 7.619 13.766 1.357 1.00 0.00 C ATOM 1476 O ARG A 101 8.780 13.460 1.083 1.00 0.00 O ATOM 1477 CB ARG A 101 7.423 12.636 3.580 1.00 0.00 C ATOM 1478 CG ARG A 101 7.117 13.728 4.592 1.00 0.00 C ATOM 1479 CD ARG A 101 8.090 14.889 4.469 1.00 0.00 C ATOM 1480 NE ARG A 101 7.579 16.101 5.105 1.00 0.00 N ATOM 1481 CZ ARG A 101 7.555 16.287 6.420 1.00 0.00 C ATOM 1482 NH1 ARG A 101 8.010 15.345 7.234 1.00 0.00 N ATOM 1483 NH2 ARG A 101 7.074 17.417 6.922 1.00 0.00 N ATOM 0 H ARG A 101 7.142 10.825 1.864 1.00 0.00 H new ATOM 0 HA ARG A 101 5.788 13.335 2.372 1.00 0.00 H new ATOM 0 HB2 ARG A 101 7.100 11.677 3.985 1.00 0.00 H new ATOM 0 HB3 ARG A 101 8.502 12.575 3.439 1.00 0.00 H new ATOM 0 HG2 ARG A 101 6.099 14.088 4.444 1.00 0.00 H new ATOM 0 HG3 ARG A 101 7.166 13.316 5.600 1.00 0.00 H new ATOM 0 HD2 ARG A 101 9.042 14.614 4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 101 8.286 15.088 3.415 1.00 0.00 H new ATOM 0 HE ARG A 101 7.221 16.845 4.506 1.00 0.00 H new ATOM 0 HH11 ARG A 101 8.380 14.475 6.851 1.00 0.00 H new ATOM 0 HH12 ARG A 101 7.991 15.490 8.243 1.00 0.00 H new ATOM 0 HH21 ARG A 101 6.722 18.143 6.298 1.00 0.00 H new ATOM 0 HH22 ARG A 101 7.056 17.559 7.932 1.00 0.00 H new ATOM 1497 N ASP A 102 7.046 14.886 0.929 1.00 0.00 N ATOM 1498 CA ASP A 102 7.765 15.842 0.095 1.00 0.00 C ATOM 1499 C ASP A 102 8.662 16.737 0.945 1.00 0.00 C ATOM 1500 O ASP A 102 8.202 17.720 1.525 1.00 0.00 O ATOM 1501 CB ASP A 102 6.780 16.697 -0.703 1.00 0.00 C ATOM 1502 CG ASP A 102 5.620 15.887 -1.249 1.00 0.00 C ATOM 1503 OD1 ASP A 102 5.854 14.745 -1.698 1.00 0.00 O ATOM 1504 OD2 ASP A 102 4.480 16.395 -1.225 1.00 0.00 O ATOM 0 H ASP A 102 6.086 15.154 1.146 1.00 0.00 H new ATOM 0 HA ASP A 102 8.393 15.282 -0.598 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.395 17.493 -0.066 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.306 17.176 -1.529 1.00 0.00 H new ATOM 1509 N GLU A 103 9.943 16.388 1.014 1.00 0.00 N ATOM 1510 CA GLU A 103 10.903 17.160 1.795 1.00 0.00 C ATOM 1511 C GLU A 103 11.108 18.545 1.190 1.00 0.00 C ATOM 1512 O GLU A 103 12.051 18.770 0.432 1.00 0.00 O ATOM 1513 CB GLU A 103 12.241 16.422 1.873 1.00 0.00 C ATOM 1514 CG GLU A 103 13.184 16.980 2.926 1.00 0.00 C ATOM 1515 CD GLU A 103 12.880 16.458 4.317 1.00 0.00 C ATOM 1516 OE1 GLU A 103 13.258 15.306 4.615 1.00 0.00 O ATOM 1517 OE2 GLU A 103 12.264 17.203 5.107 1.00 0.00 O ATOM 0 H GLU A 103 10.340 15.577 0.539 1.00 0.00 H new ATOM 0 HA GLU A 103 10.502 17.278 2.802 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.054 15.370 2.086 1.00 0.00 H new ATOM 0 HB3 GLU A 103 12.729 16.468 0.899 1.00 0.00 H new ATOM 0 HG2 GLU A 103 14.210 16.724 2.662 1.00 0.00 H new ATOM 0 HG3 GLU A 103 13.118 18.068 2.928 1.00 0.00 H new ATOM 1524 N ALA A 104 10.218 19.471 1.531 1.00 0.00 N ATOM 1525 CA ALA A 104 10.301 20.835 1.024 1.00 0.00 C ATOM 1526 C ALA A 104 9.451 21.785 1.860 1.00 0.00 C ATOM 1527 O ALA A 104 8.632 21.351 2.669 1.00 0.00 O ATOM 1528 CB ALA A 104 9.870 20.883 -0.435 1.00 0.00 C ATOM 0 H ALA A 104 9.431 19.301 2.157 1.00 0.00 H new ATOM 0 HA ALA A 104 11.339 21.160 1.096 1.00 0.00 H new ATOM 0 HB1 ALA A 104 9.937 21.908 -0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 104 10.523 20.243 -1.028 1.00 0.00 H new ATOM 0 HB3 ALA A 104 8.841 20.533 -0.522 1.00 0.00 H new ATOM 1534 N ALA A 105 9.653 23.084 1.661 1.00 0.00 N ATOM 1535 CA ALA A 105 8.904 24.095 2.396 1.00 0.00 C ATOM 1536 C ALA A 105 8.363 25.168 1.457 1.00 0.00 C ATOM 1537 O ALA A 105 9.052 25.604 0.535 1.00 0.00 O ATOM 1538 CB ALA A 105 9.780 24.723 3.470 1.00 0.00 C ATOM 0 H ALA A 105 10.329 23.460 0.997 1.00 0.00 H new ATOM 0 HA ALA A 105 8.055 23.607 2.875 1.00 0.00 H new ATOM 0 HB1 ALA A 105 9.208 25.477 4.011 1.00 0.00 H new ATOM 0 HB2 ALA A 105 10.113 23.952 4.165 1.00 0.00 H new ATOM 0 HB3 ALA A 105 10.647 25.191 3.004 1.00 0.00 H new ATOM 1544 N SER A 106 7.126 25.589 1.698 1.00 0.00 N ATOM 1545 CA SER A 106 6.490 26.608 0.871 1.00 0.00 C ATOM 1546 C SER A 106 6.291 27.900 1.658 1.00 0.00 C ATOM 1547 O SER A 106 5.278 28.078 2.334 1.00 0.00 O ATOM 1548 CB SER A 106 5.145 26.104 0.347 1.00 0.00 C ATOM 1549 OG SER A 106 5.302 25.413 -0.881 1.00 0.00 O ATOM 0 H SER A 106 6.544 25.240 2.459 1.00 0.00 H new ATOM 0 HA SER A 106 7.146 26.816 0.025 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.689 25.443 1.084 1.00 0.00 H new ATOM 0 HB3 SER A 106 4.466 26.946 0.210 1.00 0.00 H new ATOM 0 HG SER A 106 4.428 25.099 -1.194 1.00 0.00 H new ATOM 1555 N GLY A 107 7.266 28.799 1.565 1.00 0.00 N ATOM 1556 CA GLY A 107 7.179 30.063 2.273 1.00 0.00 C ATOM 1557 C GLY A 107 7.562 31.243 1.402 1.00 0.00 C ATOM 1558 O GLY A 107 8.700 31.714 1.423 1.00 0.00 O ATOM 0 H GLY A 107 8.114 28.675 1.012 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.162 30.201 2.640 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.831 30.033 3.146 1.00 0.00 H new ATOM 1562 N PRO A 108 6.598 31.738 0.611 1.00 0.00 N ATOM 1563 CA PRO A 108 6.817 32.876 -0.287 1.00 0.00 C ATOM 1564 C PRO A 108 7.004 34.185 0.471 1.00 0.00 C ATOM 1565 O PRO A 108 6.182 34.550 1.311 1.00 0.00 O ATOM 1566 CB PRO A 108 5.535 32.920 -1.122 1.00 0.00 C ATOM 1567 CG PRO A 108 4.501 32.279 -0.263 1.00 0.00 C ATOM 1568 CD PRO A 108 5.220 31.226 0.535 1.00 0.00 C ATOM 0 HA PRO A 108 7.724 32.759 -0.879 1.00 0.00 H new ATOM 0 HB2 PRO A 108 5.261 33.945 -1.373 1.00 0.00 H new ATOM 0 HB3 PRO A 108 5.657 32.383 -2.063 1.00 0.00 H new ATOM 0 HG2 PRO A 108 4.030 33.011 0.392 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.710 31.837 -0.869 1.00 0.00 H new ATOM 0 HD2 PRO A 108 4.782 31.103 1.525 1.00 0.00 H new ATOM 0 HD3 PRO A 108 5.179 30.253 0.045 1.00 0.00 H new ATOM 1576 N SER A 109 8.091 34.889 0.169 1.00 0.00 N ATOM 1577 CA SER A 109 8.387 36.157 0.825 1.00 0.00 C ATOM 1578 C SER A 109 7.633 37.303 0.158 1.00 0.00 C ATOM 1579 O SER A 109 6.831 37.987 0.795 1.00 0.00 O ATOM 1580 CB SER A 109 9.892 36.434 0.790 1.00 0.00 C ATOM 1581 OG SER A 109 10.552 35.796 1.870 1.00 0.00 O ATOM 0 H SER A 109 8.781 34.602 -0.526 1.00 0.00 H new ATOM 0 HA SER A 109 8.061 36.086 1.863 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.308 36.082 -0.154 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.069 37.509 0.835 1.00 0.00 H new ATOM 0 HG SER A 109 11.512 35.986 1.825 1.00 0.00 H new ATOM 1587 N SER A 110 7.895 37.506 -1.129 1.00 0.00 N ATOM 1588 CA SER A 110 7.244 38.571 -1.883 1.00 0.00 C ATOM 1589 C SER A 110 6.009 38.047 -2.609 1.00 0.00 C ATOM 1590 O SER A 110 6.046 36.988 -3.235 1.00 0.00 O ATOM 1591 CB SER A 110 8.221 39.182 -2.890 1.00 0.00 C ATOM 1592 OG SER A 110 7.827 40.495 -3.251 1.00 0.00 O ATOM 0 H SER A 110 8.554 36.947 -1.671 1.00 0.00 H new ATOM 0 HA SER A 110 6.930 39.341 -1.179 1.00 0.00 H new ATOM 0 HB2 SER A 110 9.223 39.205 -2.462 1.00 0.00 H new ATOM 0 HB3 SER A 110 8.269 38.556 -3.781 1.00 0.00 H new ATOM 0 HG SER A 110 8.468 40.864 -3.894 1.00 0.00 H new ATOM 1598 N GLY A 111 4.915 38.797 -2.520 1.00 0.00 N ATOM 1599 CA GLY A 111 3.683 38.392 -3.173 1.00 0.00 C ATOM 1600 C GLY A 111 2.737 39.555 -3.398 1.00 0.00 C ATOM 1601 O GLY A 111 3.162 40.710 -3.441 1.00 0.00 O ATOM 0 H GLY A 111 4.859 39.677 -2.008 1.00 0.00 H new ATOM 0 HA2 GLY A 111 3.919 37.929 -4.131 1.00 0.00 H new ATOM 0 HA3 GLY A 111 3.186 37.635 -2.566 1.00 0.00 H new TER 1605 GLY A 111