USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 880 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 104 CYS SG : rot 139:sc= -0.685 USER MOD Set 1.2: A 106 GLN :FLIP amide:sc= -6.97! C(o=-8.6!,f=-7.7!) 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 19:sc= 0.645 USER MOD Single : A 5 SER OG : rot 10:sc= 0.28 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 14 LYS NZ :NH3+ 147:sc= -0.21 (180deg=-1.42!) USER MOD Single : A 18 GLN : amide:sc= -3.04 K(o=-3,f=-5!) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 GLN : amide:sc= -4.14! C(o=-4.1!,f=-11!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 30:sc= -0.845 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -3.09! C(o=-3.1!,f=-5.5!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.0922 X(o=-0.092,f=-0.22) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.234 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 162:sc= -0.0378 (180deg=-0.306) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 ASN :FLIP amide:sc= -0.0758 F(o=-0.82,f=-0.076) USER MOD Single : A 71 LYS NZ :NH3+ -123:sc= -0.352 (180deg=-3.56!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0377) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 81 CYS SG : rot 80:sc= -0.29 USER MOD Single : A 85 ASN : amide:sc= -0.0465 K(o=-0.047,f=-1.3) USER MOD Single : A 86 CYS SG : rot 2:sc= -0.0694 USER MOD Single : A 91 HIS : no HE2:sc= -0.588 K(o=-0.59,f=-1.3) USER MOD Single : A 92 THR OG1 : rot 98:sc= 1.19 USER MOD Single : A 93 TYR OH : rot 59:sc= 0.626 USER MOD Single : A 101 ASN : amide:sc= -3.09! C(o=-3.1!,f=-4.8!) USER MOD Single : A 109 TYR OH : rot -123:sc= -0.207 USER MOD Single : A 110 ASN :FLIP amide:sc= -4.93! C(o=-6.1!,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.115 -12.384 22.034 1.00 0.00 N ATOM 2 CA GLY A 1 24.085 -10.954 21.792 1.00 0.00 C ATOM 3 C GLY A 1 22.682 -10.384 21.855 1.00 0.00 C ATOM 4 O GLY A 1 21.740 -10.977 21.329 1.00 0.00 O ATOM 0 H1 GLY A 1 25.096 -12.725 21.980 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.730 -12.584 22.979 1.00 0.00 H new ATOM 0 H3 GLY A 1 23.540 -12.870 21.316 1.00 0.00 H new ATOM 0 HA2 GLY A 1 24.711 -10.451 22.529 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.515 -10.745 20.812 1.00 0.00 H new ATOM 8 N SER A 2 22.542 -9.231 22.501 1.00 0.00 N ATOM 9 CA SER A 2 21.242 -8.583 22.635 1.00 0.00 C ATOM 10 C SER A 2 21.348 -7.088 22.350 1.00 0.00 C ATOM 11 O SER A 2 21.873 -6.326 23.161 1.00 0.00 O ATOM 12 CB SER A 2 20.680 -8.807 24.041 1.00 0.00 C ATOM 13 OG SER A 2 19.962 -10.027 24.114 1.00 0.00 O ATOM 0 H SER A 2 23.312 -8.726 22.940 1.00 0.00 H new ATOM 0 HA SER A 2 20.565 -9.027 21.905 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.495 -8.817 24.765 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.025 -7.979 24.310 1.00 0.00 H new ATOM 0 HG SER A 2 19.614 -10.148 25.022 1.00 0.00 H new ATOM 19 N SER A 3 20.845 -6.676 21.191 1.00 0.00 N ATOM 20 CA SER A 3 20.886 -5.273 20.795 1.00 0.00 C ATOM 21 C SER A 3 19.801 -4.967 19.767 1.00 0.00 C ATOM 22 O SER A 3 19.366 -5.848 19.026 1.00 0.00 O ATOM 23 CB SER A 3 22.261 -4.922 20.223 1.00 0.00 C ATOM 24 OG SER A 3 23.205 -4.712 21.258 1.00 0.00 O ATOM 0 H SER A 3 20.404 -7.294 20.509 1.00 0.00 H new ATOM 0 HA SER A 3 20.704 -4.665 21.681 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.604 -5.726 19.572 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.185 -4.025 19.609 1.00 0.00 H new ATOM 0 HG SER A 3 22.880 -5.124 22.086 1.00 0.00 H new ATOM 30 N GLY A 4 19.369 -3.710 19.727 1.00 0.00 N ATOM 31 CA GLY A 4 18.339 -3.309 18.787 1.00 0.00 C ATOM 32 C GLY A 4 17.951 -1.851 18.939 1.00 0.00 C ATOM 33 O GLY A 4 18.737 -1.041 19.432 1.00 0.00 O ATOM 0 H GLY A 4 19.714 -2.962 20.329 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.691 -3.484 17.770 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.457 -3.933 18.931 1.00 0.00 H new ATOM 37 N SER A 5 16.738 -1.516 18.513 1.00 0.00 N ATOM 38 CA SER A 5 16.249 -0.145 18.600 1.00 0.00 C ATOM 39 C SER A 5 14.734 -0.117 18.772 1.00 0.00 C ATOM 40 O SER A 5 14.000 -0.746 18.009 1.00 0.00 O ATOM 41 CB SER A 5 16.646 0.640 17.347 1.00 0.00 C ATOM 42 OG SER A 5 18.013 1.009 17.388 1.00 0.00 O ATOM 0 H SER A 5 16.075 -2.175 18.104 1.00 0.00 H new ATOM 0 HA SER A 5 16.704 0.322 19.473 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.456 0.036 16.460 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.027 1.533 17.263 1.00 0.00 H new ATOM 0 HG SER A 5 18.455 0.544 18.129 1.00 0.00 H new ATOM 48 N SER A 6 14.272 0.615 19.780 1.00 0.00 N ATOM 49 CA SER A 6 12.844 0.722 20.057 1.00 0.00 C ATOM 50 C SER A 6 12.442 2.176 20.283 1.00 0.00 C ATOM 51 O SER A 6 13.205 2.963 20.842 1.00 0.00 O ATOM 52 CB SER A 6 12.476 -0.117 21.282 1.00 0.00 C ATOM 53 OG SER A 6 11.078 -0.337 21.348 1.00 0.00 O ATOM 0 H SER A 6 14.866 1.143 20.419 1.00 0.00 H new ATOM 0 HA SER A 6 12.302 0.344 19.190 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.996 -1.074 21.241 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.811 0.389 22.187 1.00 0.00 H new ATOM 0 HG SER A 6 10.869 -0.877 22.139 1.00 0.00 H new ATOM 59 N GLY A 7 11.237 2.526 19.843 1.00 0.00 N ATOM 60 CA GLY A 7 10.753 3.884 20.006 1.00 0.00 C ATOM 61 C GLY A 7 10.062 4.406 18.762 1.00 0.00 C ATOM 62 O GLY A 7 8.866 4.700 18.784 1.00 0.00 O ATOM 0 H GLY A 7 10.587 1.893 19.376 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.059 3.921 20.846 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.589 4.537 20.255 1.00 0.00 H new ATOM 66 N HIS A 8 10.816 4.525 17.673 1.00 0.00 N ATOM 67 CA HIS A 8 10.269 5.017 16.414 1.00 0.00 C ATOM 68 C HIS A 8 10.024 3.867 15.442 1.00 0.00 C ATOM 69 O HIS A 8 10.938 3.107 15.124 1.00 0.00 O ATOM 70 CB HIS A 8 11.217 6.038 15.786 1.00 0.00 C ATOM 71 CG HIS A 8 11.438 7.252 16.635 1.00 0.00 C ATOM 72 ND1 HIS A 8 12.676 7.835 16.807 1.00 0.00 N ATOM 73 CD2 HIS A 8 10.570 7.994 17.361 1.00 0.00 C ATOM 74 CE1 HIS A 8 12.560 8.882 17.604 1.00 0.00 C ATOM 75 NE2 HIS A 8 11.291 9.001 17.954 1.00 0.00 N ATOM 0 H HIS A 8 11.807 4.287 17.638 1.00 0.00 H new ATOM 0 HA HIS A 8 9.315 5.500 16.625 1.00 0.00 H new ATOM 0 HB2 HIS A 8 12.177 5.560 15.594 1.00 0.00 H new ATOM 0 HB3 HIS A 8 10.816 6.348 14.821 1.00 0.00 H new ATOM 0 HD2 HIS A 8 9.507 7.825 17.456 1.00 0.00 H new ATOM 0 HE1 HIS A 8 13.365 9.530 17.916 1.00 0.00 H new ATOM 0 HE2 HIS A 8 10.909 9.723 18.565 1.00 0.00 H new ATOM 83 N GLU A 9 8.785 3.746 14.975 1.00 0.00 N ATOM 84 CA GLU A 9 8.422 2.687 14.041 1.00 0.00 C ATOM 85 C GLU A 9 8.478 3.189 12.601 1.00 0.00 C ATOM 86 O GLU A 9 8.292 4.377 12.340 1.00 0.00 O ATOM 87 CB GLU A 9 7.020 2.159 14.354 1.00 0.00 C ATOM 88 CG GLU A 9 6.630 0.943 13.531 1.00 0.00 C ATOM 89 CD GLU A 9 5.240 0.436 13.862 1.00 0.00 C ATOM 90 OE1 GLU A 9 4.266 0.949 13.272 1.00 0.00 O ATOM 91 OE2 GLU A 9 5.125 -0.473 14.710 1.00 0.00 O ATOM 0 H GLU A 9 8.017 4.368 15.228 1.00 0.00 H new ATOM 0 HA GLU A 9 9.142 1.876 14.153 1.00 0.00 H new ATOM 0 HB2 GLU A 9 6.965 1.904 15.412 1.00 0.00 H new ATOM 0 HB3 GLU A 9 6.294 2.953 14.179 1.00 0.00 H new ATOM 0 HG2 GLU A 9 6.678 1.195 12.472 1.00 0.00 H new ATOM 0 HG3 GLU A 9 7.354 0.146 13.702 1.00 0.00 H new ATOM 98 N GLU A 10 8.737 2.275 11.671 1.00 0.00 N ATOM 99 CA GLU A 10 8.820 2.625 10.258 1.00 0.00 C ATOM 100 C GLU A 10 7.815 1.821 9.438 1.00 0.00 C ATOM 101 O GLU A 10 7.056 2.379 8.647 1.00 0.00 O ATOM 102 CB GLU A 10 10.235 2.382 9.731 1.00 0.00 C ATOM 103 CG GLU A 10 10.593 3.238 8.528 1.00 0.00 C ATOM 104 CD GLU A 10 11.170 4.584 8.922 1.00 0.00 C ATOM 105 OE1 GLU A 10 10.390 5.463 9.344 1.00 0.00 O ATOM 106 OE2 GLU A 10 12.401 4.759 8.808 1.00 0.00 O ATOM 0 H GLU A 10 8.893 1.287 11.871 1.00 0.00 H new ATOM 0 HA GLU A 10 8.580 3.684 10.158 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.950 2.577 10.531 1.00 0.00 H new ATOM 0 HB3 GLU A 10 10.337 1.331 9.461 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.314 2.705 7.909 1.00 0.00 H new ATOM 0 HG3 GLU A 10 9.703 3.393 7.919 1.00 0.00 H new ATOM 113 N GLU A 11 7.817 0.506 9.635 1.00 0.00 N ATOM 114 CA GLU A 11 6.907 -0.376 8.913 1.00 0.00 C ATOM 115 C GLU A 11 7.206 -0.359 7.416 1.00 0.00 C ATOM 116 O GLU A 11 6.312 -0.552 6.593 1.00 0.00 O ATOM 117 CB GLU A 11 5.456 0.041 9.159 1.00 0.00 C ATOM 118 CG GLU A 11 4.467 -1.108 9.059 1.00 0.00 C ATOM 119 CD GLU A 11 3.027 -0.636 9.011 1.00 0.00 C ATOM 120 OE1 GLU A 11 2.762 0.399 8.363 1.00 0.00 O ATOM 121 OE2 GLU A 11 2.164 -1.302 9.620 1.00 0.00 O ATOM 0 H GLU A 11 8.438 0.028 10.288 1.00 0.00 H new ATOM 0 HA GLU A 11 7.054 -1.390 9.284 1.00 0.00 H new ATOM 0 HB2 GLU A 11 5.379 0.490 10.149 1.00 0.00 H new ATOM 0 HB3 GLU A 11 5.181 0.810 8.437 1.00 0.00 H new ATOM 0 HG2 GLU A 11 4.684 -1.692 8.165 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.599 -1.772 9.913 1.00 0.00 H new ATOM 128 N GLU A 12 8.469 -0.126 7.074 1.00 0.00 N ATOM 129 CA GLU A 12 8.886 -0.082 5.677 1.00 0.00 C ATOM 130 C GLU A 12 8.160 1.032 4.928 1.00 0.00 C ATOM 131 O GLU A 12 7.617 0.815 3.843 1.00 0.00 O ATOM 132 CB GLU A 12 8.616 -1.427 4.999 1.00 0.00 C ATOM 133 CG GLU A 12 9.448 -2.569 5.559 1.00 0.00 C ATOM 134 CD GLU A 12 9.547 -3.742 4.605 1.00 0.00 C ATOM 135 OE1 GLU A 12 10.332 -3.656 3.638 1.00 0.00 O ATOM 136 OE2 GLU A 12 8.838 -4.747 4.824 1.00 0.00 O ATOM 0 H GLU A 12 9.221 0.035 7.744 1.00 0.00 H new ATOM 0 HA GLU A 12 9.956 0.122 5.650 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.559 -1.672 5.105 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.815 -1.333 3.932 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.450 -2.206 5.787 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.010 -2.906 6.498 1.00 0.00 H new ATOM 143 N LEU A 13 8.154 2.224 5.513 1.00 0.00 N ATOM 144 CA LEU A 13 7.495 3.373 4.902 1.00 0.00 C ATOM 145 C LEU A 13 8.486 4.200 4.088 1.00 0.00 C ATOM 146 O LEU A 13 9.529 4.613 4.594 1.00 0.00 O ATOM 147 CB LEU A 13 6.848 4.246 5.978 1.00 0.00 C ATOM 148 CG LEU A 13 7.775 5.230 6.692 1.00 0.00 C ATOM 149 CD1 LEU A 13 7.946 6.497 5.868 1.00 0.00 C ATOM 150 CD2 LEU A 13 7.238 5.561 8.077 1.00 0.00 C ATOM 0 H LEU A 13 8.598 2.421 6.410 1.00 0.00 H new ATOM 0 HA LEU A 13 6.721 3.002 4.230 1.00 0.00 H new ATOM 0 HB2 LEU A 13 6.036 4.810 5.520 1.00 0.00 H new ATOM 0 HB3 LEU A 13 6.399 3.593 6.726 1.00 0.00 H new ATOM 0 HG LEU A 13 8.752 4.761 6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 13 8.609 7.185 6.392 1.00 0.00 H new ATOM 0 HD12 LEU A 13 8.377 6.245 4.899 1.00 0.00 H new ATOM 0 HD13 LEU A 13 6.975 6.970 5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 13 7.911 6.263 8.570 1.00 0.00 H new ATOM 0 HD22 LEU A 13 6.249 6.010 7.986 1.00 0.00 H new ATOM 0 HD23 LEU A 13 7.169 4.648 8.668 1.00 0.00 H new ATOM 162 N LYS A 14 8.151 4.440 2.825 1.00 0.00 N ATOM 163 CA LYS A 14 9.008 5.220 1.941 1.00 0.00 C ATOM 164 C LYS A 14 8.176 6.044 0.964 1.00 0.00 C ATOM 165 O LYS A 14 7.286 5.533 0.284 1.00 0.00 O ATOM 166 CB LYS A 14 9.954 4.298 1.169 1.00 0.00 C ATOM 167 CG LYS A 14 10.792 5.019 0.128 1.00 0.00 C ATOM 168 CD LYS A 14 11.990 4.187 -0.299 1.00 0.00 C ATOM 169 CE LYS A 14 13.171 4.388 0.638 1.00 0.00 C ATOM 170 NZ LYS A 14 13.155 3.418 1.768 1.00 0.00 N ATOM 0 H LYS A 14 7.291 4.105 2.390 1.00 0.00 H new ATOM 0 HA LYS A 14 9.596 5.902 2.556 1.00 0.00 H new ATOM 0 HB2 LYS A 14 10.618 3.799 1.875 1.00 0.00 H new ATOM 0 HB3 LYS A 14 9.369 3.521 0.677 1.00 0.00 H new ATOM 0 HG2 LYS A 14 10.176 5.245 -0.743 1.00 0.00 H new ATOM 0 HG3 LYS A 14 11.135 5.971 0.532 1.00 0.00 H new ATOM 0 HD2 LYS A 14 11.714 3.133 -0.317 1.00 0.00 H new ATOM 0 HD3 LYS A 14 12.279 4.458 -1.314 1.00 0.00 H new ATOM 0 HE2 LYS A 14 14.100 4.279 0.079 1.00 0.00 H new ATOM 0 HE3 LYS A 14 13.153 5.404 1.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 14.132 3.181 2.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 12.665 3.841 2.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 12.657 2.553 1.476 1.00 0.00 H new ATOM 184 N PRO A 15 8.470 7.351 0.890 1.00 0.00 N ATOM 185 CA PRO A 15 7.761 8.272 -0.003 1.00 0.00 C ATOM 186 C PRO A 15 8.080 8.017 -1.472 1.00 0.00 C ATOM 187 O PRO A 15 9.167 7.560 -1.826 1.00 0.00 O ATOM 188 CB PRO A 15 8.278 9.648 0.425 1.00 0.00 C ATOM 189 CG PRO A 15 9.617 9.381 1.022 1.00 0.00 C ATOM 190 CD PRO A 15 9.519 8.028 1.671 1.00 0.00 C ATOM 0 HA PRO A 15 6.679 8.164 0.075 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.352 10.325 -0.426 1.00 0.00 H new ATOM 0 HB3 PRO A 15 7.609 10.115 1.147 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.394 9.392 0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 15 9.878 10.146 1.753 1.00 0.00 H new ATOM 0 HD2 PRO A 15 10.466 7.490 1.624 1.00 0.00 H new ATOM 0 HD3 PRO A 15 9.249 8.106 2.724 1.00 0.00 H new ATOM 198 N PRO A 16 7.111 8.318 -2.349 1.00 0.00 N ATOM 199 CA PRO A 16 7.266 8.130 -3.795 1.00 0.00 C ATOM 200 C PRO A 16 8.259 9.113 -4.405 1.00 0.00 C ATOM 201 O PRO A 16 8.535 10.166 -3.831 1.00 0.00 O ATOM 202 CB PRO A 16 5.858 8.386 -4.339 1.00 0.00 C ATOM 203 CG PRO A 16 5.217 9.272 -3.327 1.00 0.00 C ATOM 204 CD PRO A 16 5.790 8.867 -1.998 1.00 0.00 C ATOM 0 HA PRO A 16 7.659 7.143 -4.037 1.00 0.00 H new ATOM 0 HB2 PRO A 16 5.893 8.864 -5.318 1.00 0.00 H new ATOM 0 HB3 PRO A 16 5.304 7.455 -4.458 1.00 0.00 H new ATOM 0 HG2 PRO A 16 5.426 10.321 -3.539 1.00 0.00 H new ATOM 0 HG3 PRO A 16 4.133 9.155 -3.337 1.00 0.00 H new ATOM 0 HD2 PRO A 16 5.875 9.717 -1.321 1.00 0.00 H new ATOM 0 HD3 PRO A 16 5.166 8.125 -1.501 1.00 0.00 H new ATOM 212 N GLU A 17 8.793 8.762 -5.570 1.00 0.00 N ATOM 213 CA GLU A 17 9.756 9.615 -6.256 1.00 0.00 C ATOM 214 C GLU A 17 9.063 10.494 -7.293 1.00 0.00 C ATOM 215 O GLU A 17 9.453 11.642 -7.508 1.00 0.00 O ATOM 216 CB GLU A 17 10.834 8.764 -6.932 1.00 0.00 C ATOM 217 CG GLU A 17 11.871 8.217 -5.966 1.00 0.00 C ATOM 218 CD GLU A 17 12.916 7.361 -6.655 1.00 0.00 C ATOM 219 OE1 GLU A 17 12.594 6.213 -7.026 1.00 0.00 O ATOM 220 OE2 GLU A 17 14.057 7.840 -6.824 1.00 0.00 O ATOM 0 H GLU A 17 8.575 7.893 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 17 10.225 10.260 -5.513 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.357 7.932 -7.449 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.337 9.364 -7.690 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.363 9.047 -5.459 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.371 7.626 -5.199 1.00 0.00 H new ATOM 227 N GLN A 18 8.034 9.946 -7.932 1.00 0.00 N ATOM 228 CA GLN A 18 7.288 10.680 -8.947 1.00 0.00 C ATOM 229 C GLN A 18 5.989 9.959 -9.295 1.00 0.00 C ATOM 230 O GLN A 18 5.927 8.731 -9.279 1.00 0.00 O ATOM 231 CB GLN A 18 8.138 10.859 -10.206 1.00 0.00 C ATOM 232 CG GLN A 18 8.355 9.570 -10.982 1.00 0.00 C ATOM 233 CD GLN A 18 7.280 9.326 -12.023 1.00 0.00 C ATOM 234 OE1 GLN A 18 6.699 10.268 -12.563 1.00 0.00 O ATOM 235 NE2 GLN A 18 7.010 8.058 -12.310 1.00 0.00 N ATOM 0 H GLN A 18 7.698 8.997 -7.765 1.00 0.00 H new ATOM 0 HA GLN A 18 7.041 11.661 -8.542 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.658 11.589 -10.858 1.00 0.00 H new ATOM 0 HB3 GLN A 18 9.107 11.271 -9.925 1.00 0.00 H new ATOM 0 HG2 GLN A 18 9.328 9.605 -11.472 1.00 0.00 H new ATOM 0 HG3 GLN A 18 8.378 8.731 -10.286 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.517 7.309 -11.838 1.00 0.00 H new ATOM 0 HE22 GLN A 18 6.296 7.833 -13.003 1.00 0.00 H new ATOM 244 N GLU A 19 4.954 10.733 -9.608 1.00 0.00 N ATOM 245 CA GLU A 19 3.657 10.167 -9.958 1.00 0.00 C ATOM 246 C GLU A 19 3.812 9.031 -10.964 1.00 0.00 C ATOM 247 O GLU A 19 4.542 9.155 -11.948 1.00 0.00 O ATOM 248 CB GLU A 19 2.741 11.251 -10.532 1.00 0.00 C ATOM 249 CG GLU A 19 1.479 10.702 -11.175 1.00 0.00 C ATOM 250 CD GLU A 19 0.544 11.797 -11.651 1.00 0.00 C ATOM 251 OE1 GLU A 19 -0.241 12.307 -10.824 1.00 0.00 O ATOM 252 OE2 GLU A 19 0.596 12.144 -12.850 1.00 0.00 O ATOM 0 H GLU A 19 4.989 11.752 -9.626 1.00 0.00 H new ATOM 0 HA GLU A 19 3.208 9.765 -9.050 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.462 11.940 -9.734 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.295 11.828 -11.272 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.752 10.069 -12.020 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.956 10.069 -10.458 1.00 0.00 H new ATOM 259 N ILE A 20 3.122 7.924 -10.709 1.00 0.00 N ATOM 260 CA ILE A 20 3.183 6.766 -11.593 1.00 0.00 C ATOM 261 C ILE A 20 1.924 6.660 -12.446 1.00 0.00 C ATOM 262 O ILE A 20 1.052 7.526 -12.394 1.00 0.00 O ATOM 263 CB ILE A 20 3.362 5.460 -10.797 1.00 0.00 C ATOM 264 CG1 ILE A 20 2.243 5.309 -9.765 1.00 0.00 C ATOM 265 CG2 ILE A 20 4.723 5.436 -10.118 1.00 0.00 C ATOM 266 CD1 ILE A 20 1.888 3.869 -9.465 1.00 0.00 C ATOM 0 H ILE A 20 2.515 7.805 -9.898 1.00 0.00 H new ATOM 0 HA ILE A 20 4.048 6.908 -12.241 1.00 0.00 H new ATOM 0 HB ILE A 20 3.308 4.620 -11.489 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.544 5.801 -8.840 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.354 5.826 -10.126 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.835 4.507 -9.559 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.507 5.502 -10.872 1.00 0.00 H new ATOM 0 HG23 ILE A 20 4.804 6.282 -9.435 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.088 3.838 -8.725 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.556 3.378 -10.380 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.764 3.352 -9.073 1.00 0.00 H new ATOM 278 N GLU A 21 1.837 5.590 -13.231 1.00 0.00 N ATOM 279 CA GLU A 21 0.683 5.370 -14.096 1.00 0.00 C ATOM 280 C GLU A 21 -0.111 4.148 -13.643 1.00 0.00 C ATOM 281 O GLU A 21 0.447 3.066 -13.458 1.00 0.00 O ATOM 282 CB GLU A 21 1.133 5.191 -15.547 1.00 0.00 C ATOM 283 CG GLU A 21 1.956 3.935 -15.779 1.00 0.00 C ATOM 284 CD GLU A 21 2.933 4.082 -16.930 1.00 0.00 C ATOM 285 OE1 GLU A 21 2.523 4.587 -17.996 1.00 0.00 O ATOM 286 OE2 GLU A 21 4.107 3.692 -16.764 1.00 0.00 O ATOM 0 H GLU A 21 2.551 4.863 -13.286 1.00 0.00 H new ATOM 0 HA GLU A 21 0.038 6.246 -14.029 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.254 5.163 -16.190 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.719 6.060 -15.846 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.506 3.692 -14.870 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.287 3.098 -15.980 1.00 0.00 H new ATOM 293 N ILE A 22 -1.415 4.330 -13.466 1.00 0.00 N ATOM 294 CA ILE A 22 -2.286 3.243 -13.036 1.00 0.00 C ATOM 295 C ILE A 22 -3.440 3.043 -14.012 1.00 0.00 C ATOM 296 O ILE A 22 -3.967 4.005 -14.570 1.00 0.00 O ATOM 297 CB ILE A 22 -2.857 3.503 -11.629 1.00 0.00 C ATOM 298 CG1 ILE A 22 -1.725 3.595 -10.604 1.00 0.00 C ATOM 299 CG2 ILE A 22 -3.839 2.406 -11.246 1.00 0.00 C ATOM 300 CD1 ILE A 22 -0.920 2.320 -10.477 1.00 0.00 C ATOM 0 H ILE A 22 -1.892 5.220 -13.614 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.675 2.341 -13.011 1.00 0.00 H new ATOM 0 HB ILE A 22 -3.390 4.454 -11.639 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -1.058 4.410 -10.884 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -2.146 3.848 -9.631 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -4.234 2.603 -10.249 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -4.659 2.385 -11.964 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -3.328 1.443 -11.250 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.135 2.458 -9.733 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.575 1.506 -10.167 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.469 2.077 -11.439 1.00 0.00 H new ATOM 312 N ASP A 23 -3.827 1.789 -14.212 1.00 0.00 N ATOM 313 CA ASP A 23 -4.922 1.462 -15.120 1.00 0.00 C ATOM 314 C ASP A 23 -6.082 0.823 -14.363 1.00 0.00 C ATOM 315 O ASP A 23 -5.897 -0.144 -13.624 1.00 0.00 O ATOM 316 CB ASP A 23 -4.435 0.521 -16.222 1.00 0.00 C ATOM 317 CG ASP A 23 -3.918 1.268 -17.436 1.00 0.00 C ATOM 318 OD1 ASP A 23 -2.789 1.797 -17.371 1.00 0.00 O ATOM 319 OD2 ASP A 23 -4.643 1.323 -18.451 1.00 0.00 O ATOM 0 H ASP A 23 -3.400 0.981 -13.758 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.274 2.388 -15.574 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.644 -0.117 -15.828 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.252 -0.134 -16.523 1.00 0.00 H new ATOM 324 N ARG A 24 -7.278 1.370 -14.553 1.00 0.00 N ATOM 325 CA ARG A 24 -8.468 0.855 -13.887 1.00 0.00 C ATOM 326 C ARG A 24 -8.946 -0.435 -14.548 1.00 0.00 C ATOM 327 O ARG A 24 -9.861 -1.093 -14.056 1.00 0.00 O ATOM 328 CB ARG A 24 -9.586 1.899 -13.915 1.00 0.00 C ATOM 329 CG ARG A 24 -9.165 3.258 -13.379 1.00 0.00 C ATOM 330 CD ARG A 24 -9.398 3.362 -11.880 1.00 0.00 C ATOM 331 NE ARG A 24 -9.679 4.733 -11.464 1.00 0.00 N ATOM 332 CZ ARG A 24 -8.774 5.705 -11.474 1.00 0.00 C ATOM 333 NH1 ARG A 24 -7.535 5.457 -11.878 1.00 0.00 N ATOM 334 NH2 ARG A 24 -9.107 6.928 -11.081 1.00 0.00 N ATOM 0 H ARG A 24 -7.449 2.170 -15.163 1.00 0.00 H new ATOM 0 HA ARG A 24 -8.208 0.638 -12.851 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -9.937 2.015 -14.940 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -10.429 1.532 -13.329 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -8.110 3.425 -13.597 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -9.724 4.041 -13.891 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -10.232 2.719 -11.597 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.519 2.995 -11.350 1.00 0.00 H new ATOM 0 HE ARG A 24 -10.623 4.957 -11.148 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.276 4.518 -12.182 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.842 6.205 -11.885 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.059 7.122 -10.771 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -8.411 7.674 -11.089 1.00 0.00 H new ATOM 348 N ASN A 25 -8.319 -0.788 -15.665 1.00 0.00 N ATOM 349 CA ASN A 25 -8.680 -1.999 -16.394 1.00 0.00 C ATOM 350 C ASN A 25 -7.474 -2.920 -16.551 1.00 0.00 C ATOM 351 O ASN A 25 -7.542 -3.935 -17.245 1.00 0.00 O ATOM 352 CB ASN A 25 -9.245 -1.641 -17.770 1.00 0.00 C ATOM 353 CG ASN A 25 -10.563 -0.897 -17.678 1.00 0.00 C ATOM 354 OD1 ASN A 25 -11.583 -1.464 -17.284 1.00 0.00 O ATOM 355 ND2 ASN A 25 -10.549 0.380 -18.043 1.00 0.00 N ATOM 0 H ASN A 25 -7.559 -0.253 -16.085 1.00 0.00 H new ATOM 0 HA ASN A 25 -9.443 -2.525 -15.820 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -8.522 -1.028 -18.308 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -9.385 -2.553 -18.351 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.406 0.931 -18.003 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -9.681 0.809 -18.363 1.00 0.00 H new ATOM 362 N ILE A 26 -6.372 -2.559 -15.901 1.00 0.00 N ATOM 363 CA ILE A 26 -5.152 -3.353 -15.967 1.00 0.00 C ATOM 364 C ILE A 26 -4.430 -3.364 -14.625 1.00 0.00 C ATOM 365 O ILE A 26 -4.236 -2.318 -14.005 1.00 0.00 O ATOM 366 CB ILE A 26 -4.193 -2.823 -17.049 1.00 0.00 C ATOM 367 CG1 ILE A 26 -4.838 -2.934 -18.432 1.00 0.00 C ATOM 368 CG2 ILE A 26 -2.877 -3.586 -17.011 1.00 0.00 C ATOM 369 CD1 ILE A 26 -5.718 -1.755 -18.784 1.00 0.00 C ATOM 0 H ILE A 26 -6.300 -1.722 -15.323 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.451 -4.369 -16.224 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.987 -1.772 -16.847 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.054 -3.029 -19.183 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.433 -3.847 -18.475 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.210 -3.200 -17.782 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.412 -3.461 -16.033 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.065 -4.644 -17.191 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -6.142 -1.901 -19.777 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -6.524 -1.672 -18.054 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.123 -0.841 -18.774 1.00 0.00 H new ATOM 381 N ILE A 27 -4.033 -4.552 -14.182 1.00 0.00 N ATOM 382 CA ILE A 27 -3.329 -4.698 -12.914 1.00 0.00 C ATOM 383 C ILE A 27 -1.904 -5.199 -13.131 1.00 0.00 C ATOM 384 O ILE A 27 -1.689 -6.368 -13.446 1.00 0.00 O ATOM 385 CB ILE A 27 -4.064 -5.669 -11.971 1.00 0.00 C ATOM 386 CG1 ILE A 27 -5.490 -5.180 -11.711 1.00 0.00 C ATOM 387 CG2 ILE A 27 -3.301 -5.815 -10.663 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.312 -6.132 -10.871 1.00 0.00 C ATOM 0 H ILE A 27 -4.187 -5.427 -14.682 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.299 -3.710 -12.454 1.00 0.00 H new ATOM 0 HB ILE A 27 -4.117 -6.647 -12.449 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -5.448 -4.212 -11.212 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.992 -5.025 -12.666 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.832 -6.504 -10.007 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.303 -6.204 -10.865 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.220 -4.842 -10.178 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.311 -5.721 -10.727 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.385 -7.094 -11.378 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.833 -6.268 -9.901 1.00 0.00 H new ATOM 400 N GLN A 28 -0.936 -4.304 -12.957 1.00 0.00 N ATOM 401 CA GLN A 28 0.468 -4.656 -13.133 1.00 0.00 C ATOM 402 C GLN A 28 1.092 -5.083 -11.808 1.00 0.00 C ATOM 403 O GLN A 28 0.754 -4.549 -10.752 1.00 0.00 O ATOM 404 CB GLN A 28 1.242 -3.473 -13.717 1.00 0.00 C ATOM 405 CG GLN A 28 0.429 -2.635 -14.690 1.00 0.00 C ATOM 406 CD GLN A 28 -0.464 -1.630 -13.990 1.00 0.00 C ATOM 407 OE1 GLN A 28 -0.573 -1.628 -12.763 1.00 0.00 O ATOM 408 NE2 GLN A 28 -1.110 -0.769 -14.767 1.00 0.00 N ATOM 0 H GLN A 28 -1.098 -3.332 -12.695 1.00 0.00 H new ATOM 0 HA GLN A 28 0.523 -5.495 -13.827 1.00 0.00 H new ATOM 0 HB2 GLN A 28 1.586 -2.837 -12.902 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.130 -3.847 -14.226 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.105 -2.108 -15.363 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -0.184 -3.293 -15.306 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.990 -0.806 -15.779 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.726 -0.070 -14.352 1.00 0.00 H new ATOM 417 N GLU A 29 2.003 -6.049 -11.873 1.00 0.00 N ATOM 418 CA GLU A 29 2.673 -6.547 -10.677 1.00 0.00 C ATOM 419 C GLU A 29 2.881 -5.426 -9.663 1.00 0.00 C ATOM 420 O GLU A 29 2.740 -5.632 -8.458 1.00 0.00 O ATOM 421 CB GLU A 29 4.019 -7.175 -11.044 1.00 0.00 C ATOM 422 CG GLU A 29 4.962 -6.219 -11.756 1.00 0.00 C ATOM 423 CD GLU A 29 6.320 -6.837 -12.031 1.00 0.00 C ATOM 424 OE1 GLU A 29 6.438 -7.598 -13.014 1.00 0.00 O ATOM 425 OE2 GLU A 29 7.264 -6.558 -11.262 1.00 0.00 O ATOM 0 H GLU A 29 2.294 -6.502 -12.740 1.00 0.00 H new ATOM 0 HA GLU A 29 2.037 -7.308 -10.225 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.501 -7.538 -10.136 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.844 -8.042 -11.681 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.512 -5.905 -12.698 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.091 -5.322 -11.150 1.00 0.00 H new ATOM 432 N GLU A 30 3.219 -4.241 -10.161 1.00 0.00 N ATOM 433 CA GLU A 30 3.448 -3.088 -9.298 1.00 0.00 C ATOM 434 C GLU A 30 2.502 -3.108 -8.101 1.00 0.00 C ATOM 435 O GLU A 30 2.932 -2.984 -6.955 1.00 0.00 O ATOM 436 CB GLU A 30 3.265 -1.789 -10.085 1.00 0.00 C ATOM 437 CG GLU A 30 4.539 -1.298 -10.754 1.00 0.00 C ATOM 438 CD GLU A 30 4.264 -0.466 -11.991 1.00 0.00 C ATOM 439 OE1 GLU A 30 3.533 -0.948 -12.881 1.00 0.00 O ATOM 440 OE2 GLU A 30 4.781 0.668 -12.069 1.00 0.00 O ATOM 0 H GLU A 30 3.340 -4.054 -11.156 1.00 0.00 H new ATOM 0 HA GLU A 30 4.473 -3.140 -8.930 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.500 -1.940 -10.846 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.897 -1.015 -9.412 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.114 -0.705 -10.042 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.155 -2.155 -11.026 1.00 0.00 H new ATOM 447 N GLU A 31 1.211 -3.263 -8.377 1.00 0.00 N ATOM 448 CA GLU A 31 0.203 -3.298 -7.324 1.00 0.00 C ATOM 449 C GLU A 31 0.223 -4.638 -6.595 1.00 0.00 C ATOM 450 O GLU A 31 0.226 -4.690 -5.365 1.00 0.00 O ATOM 451 CB GLU A 31 -1.188 -3.043 -7.909 1.00 0.00 C ATOM 452 CG GLU A 31 -1.274 -1.777 -8.744 1.00 0.00 C ATOM 453 CD GLU A 31 -0.680 -1.949 -10.128 1.00 0.00 C ATOM 454 OE1 GLU A 31 -1.030 -2.937 -10.806 1.00 0.00 O ATOM 455 OE2 GLU A 31 0.135 -1.094 -10.533 1.00 0.00 O ATOM 0 H GLU A 31 0.839 -3.366 -9.321 1.00 0.00 H new ATOM 0 HA GLU A 31 0.437 -2.511 -6.607 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.476 -3.895 -8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.910 -2.981 -7.095 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.318 -1.477 -8.836 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.755 -0.970 -8.228 1.00 0.00 H new ATOM 462 N LYS A 32 0.236 -5.722 -7.363 1.00 0.00 N ATOM 463 CA LYS A 32 0.256 -7.064 -6.794 1.00 0.00 C ATOM 464 C LYS A 32 1.391 -7.210 -5.784 1.00 0.00 C ATOM 465 O LYS A 32 1.330 -8.049 -4.887 1.00 0.00 O ATOM 466 CB LYS A 32 0.409 -8.109 -7.902 1.00 0.00 C ATOM 467 CG LYS A 32 -0.690 -8.049 -8.949 1.00 0.00 C ATOM 468 CD LYS A 32 -0.615 -9.229 -9.904 1.00 0.00 C ATOM 469 CE LYS A 32 -1.685 -9.142 -10.982 1.00 0.00 C ATOM 470 NZ LYS A 32 -1.760 -10.390 -11.790 1.00 0.00 N ATOM 0 H LYS A 32 0.233 -5.697 -8.383 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.690 -7.226 -6.278 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.373 -7.970 -8.391 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.419 -9.103 -7.454 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.663 -8.039 -8.457 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.608 -7.119 -9.511 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.370 -9.260 -10.369 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -0.733 -10.158 -9.346 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.653 -8.951 -10.519 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -1.473 -8.297 -11.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -2.501 -10.291 -12.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.844 -10.559 -12.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.988 -11.192 -11.169 1.00 0.00 H new ATOM 484 N GLN A 33 2.423 -6.386 -5.938 1.00 0.00 N ATOM 485 CA GLN A 33 3.569 -6.424 -5.038 1.00 0.00 C ATOM 486 C GLN A 33 3.229 -5.788 -3.695 1.00 0.00 C ATOM 487 O GLN A 33 3.821 -6.124 -2.670 1.00 0.00 O ATOM 488 CB GLN A 33 4.763 -5.704 -5.669 1.00 0.00 C ATOM 489 CG GLN A 33 5.530 -6.557 -6.666 1.00 0.00 C ATOM 490 CD GLN A 33 6.586 -7.420 -6.005 1.00 0.00 C ATOM 491 OE1 GLN A 33 6.283 -8.230 -5.128 1.00 0.00 O ATOM 492 NE2 GLN A 33 7.835 -7.251 -6.423 1.00 0.00 N ATOM 0 H GLN A 33 2.489 -5.685 -6.676 1.00 0.00 H new ATOM 0 HA GLN A 33 3.831 -7.468 -4.868 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.410 -4.803 -6.170 1.00 0.00 H new ATOM 0 HB3 GLN A 33 5.442 -5.384 -4.879 1.00 0.00 H new ATOM 0 HG2 GLN A 33 4.831 -7.195 -7.206 1.00 0.00 H new ATOM 0 HG3 GLN A 33 6.005 -5.909 -7.403 1.00 0.00 H new ATOM 0 HE21 GLN A 33 8.041 -6.568 -7.152 1.00 0.00 H new ATOM 0 HE22 GLN A 33 8.589 -7.804 -6.015 1.00 0.00 H new ATOM 501 N ALA A 34 2.271 -4.866 -3.708 1.00 0.00 N ATOM 502 CA ALA A 34 1.851 -4.184 -2.490 1.00 0.00 C ATOM 503 C ALA A 34 0.471 -4.657 -2.044 1.00 0.00 C ATOM 504 O ALA A 34 0.039 -4.374 -0.927 1.00 0.00 O ATOM 505 CB ALA A 34 1.851 -2.678 -2.702 1.00 0.00 C ATOM 0 H ALA A 34 1.772 -4.575 -4.548 1.00 0.00 H new ATOM 0 HA ALA A 34 2.563 -4.429 -1.702 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.535 -2.181 -1.784 1.00 0.00 H new ATOM 0 HB2 ALA A 34 2.856 -2.348 -2.966 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.162 -2.424 -3.508 1.00 0.00 H new ATOM 511 N ILE A 35 -0.215 -5.378 -2.925 1.00 0.00 N ATOM 512 CA ILE A 35 -1.546 -5.890 -2.621 1.00 0.00 C ATOM 513 C ILE A 35 -1.669 -7.361 -3.003 1.00 0.00 C ATOM 514 O ILE A 35 -2.649 -7.790 -3.612 1.00 0.00 O ATOM 515 CB ILE A 35 -2.638 -5.088 -3.352 1.00 0.00 C ATOM 516 CG1 ILE A 35 -2.297 -3.596 -3.346 1.00 0.00 C ATOM 517 CG2 ILE A 35 -3.994 -5.329 -2.705 1.00 0.00 C ATOM 518 CD1 ILE A 35 -2.373 -2.964 -1.974 1.00 0.00 C ATOM 0 H ILE A 35 0.129 -5.621 -3.854 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.687 -5.783 -1.545 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.685 -5.426 -4.387 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.292 -3.460 -3.745 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.979 -3.073 -4.016 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.756 -4.755 -3.233 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.238 -6.390 -2.756 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.961 -5.014 -1.662 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -2.119 -1.906 -2.046 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.384 -3.068 -1.581 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.671 -3.461 -1.305 1.00 0.00 H new ATOM 530 N PRO A 36 -0.653 -8.155 -2.636 1.00 0.00 N ATOM 531 CA PRO A 36 -0.625 -9.591 -2.928 1.00 0.00 C ATOM 532 C PRO A 36 -1.654 -10.368 -2.114 1.00 0.00 C ATOM 533 O PRO A 36 -1.948 -11.526 -2.411 1.00 0.00 O ATOM 534 CB PRO A 36 0.794 -10.007 -2.531 1.00 0.00 C ATOM 535 CG PRO A 36 1.212 -9.002 -1.513 1.00 0.00 C ATOM 536 CD PRO A 36 0.548 -7.712 -1.907 1.00 0.00 C ATOM 0 HA PRO A 36 -0.869 -9.799 -3.970 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.810 -11.017 -2.121 1.00 0.00 H new ATOM 0 HB3 PRO A 36 1.464 -10.001 -3.391 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.906 -9.309 -0.513 1.00 0.00 H new ATOM 0 HG3 PRO A 36 2.296 -8.893 -1.495 1.00 0.00 H new ATOM 0 HD2 PRO A 36 0.290 -7.110 -1.035 1.00 0.00 H new ATOM 0 HD3 PRO A 36 1.197 -7.101 -2.535 1.00 0.00 H new ATOM 544 N GLU A 37 -2.199 -9.724 -1.087 1.00 0.00 N ATOM 545 CA GLU A 37 -3.196 -10.356 -0.231 1.00 0.00 C ATOM 546 C GLU A 37 -4.411 -10.794 -1.043 1.00 0.00 C ATOM 547 O GLU A 37 -4.845 -11.943 -0.962 1.00 0.00 O ATOM 548 CB GLU A 37 -3.629 -9.397 0.880 1.00 0.00 C ATOM 549 CG GLU A 37 -5.057 -9.615 1.350 1.00 0.00 C ATOM 550 CD GLU A 37 -5.286 -9.127 2.767 1.00 0.00 C ATOM 551 OE1 GLU A 37 -4.914 -7.973 3.065 1.00 0.00 O ATOM 552 OE2 GLU A 37 -5.837 -9.901 3.578 1.00 0.00 O ATOM 0 H GLU A 37 -1.967 -8.765 -0.828 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.744 -11.240 0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -2.955 -9.510 1.729 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -3.525 -8.372 0.524 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -5.740 -9.097 0.677 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.296 -10.677 1.292 1.00 0.00 H new ATOM 559 N PHE A 38 -4.957 -9.868 -1.825 1.00 0.00 N ATOM 560 CA PHE A 38 -6.124 -10.156 -2.650 1.00 0.00 C ATOM 561 C PHE A 38 -5.784 -11.174 -3.735 1.00 0.00 C ATOM 562 O PHE A 38 -6.647 -11.927 -4.188 1.00 0.00 O ATOM 563 CB PHE A 38 -6.654 -8.871 -3.289 1.00 0.00 C ATOM 564 CG PHE A 38 -7.622 -8.123 -2.417 1.00 0.00 C ATOM 565 CD1 PHE A 38 -8.745 -8.754 -1.908 1.00 0.00 C ATOM 566 CD2 PHE A 38 -7.409 -6.789 -2.109 1.00 0.00 C ATOM 567 CE1 PHE A 38 -9.638 -8.069 -1.105 1.00 0.00 C ATOM 568 CE2 PHE A 38 -8.298 -6.099 -1.306 1.00 0.00 C ATOM 569 CZ PHE A 38 -9.414 -6.739 -0.805 1.00 0.00 C ATOM 0 H PHE A 38 -4.610 -8.912 -1.904 1.00 0.00 H new ATOM 0 HA PHE A 38 -6.897 -10.579 -2.008 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -5.813 -8.219 -3.527 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -7.142 -9.118 -4.232 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -8.925 -9.793 -2.141 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -6.539 -6.283 -2.500 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.509 -8.573 -0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -8.120 -5.060 -1.071 1.00 0.00 H new ATOM 0 HZ PHE A 38 -10.111 -6.201 -0.180 1.00 0.00 H new ATOM 579 N PHE A 39 -4.522 -11.190 -4.149 1.00 0.00 N ATOM 580 CA PHE A 39 -4.067 -12.113 -5.182 1.00 0.00 C ATOM 581 C PHE A 39 -3.505 -13.389 -4.562 1.00 0.00 C ATOM 582 O PHE A 39 -2.717 -14.099 -5.185 1.00 0.00 O ATOM 583 CB PHE A 39 -3.004 -11.448 -6.058 1.00 0.00 C ATOM 584 CG PHE A 39 -3.433 -10.122 -6.619 1.00 0.00 C ATOM 585 CD1 PHE A 39 -4.408 -10.053 -7.600 1.00 0.00 C ATOM 586 CD2 PHE A 39 -2.859 -8.945 -6.165 1.00 0.00 C ATOM 587 CE1 PHE A 39 -4.806 -8.835 -8.118 1.00 0.00 C ATOM 588 CE2 PHE A 39 -3.253 -7.724 -6.679 1.00 0.00 C ATOM 589 CZ PHE A 39 -4.226 -7.669 -7.658 1.00 0.00 C ATOM 0 H PHE A 39 -3.795 -10.574 -3.785 1.00 0.00 H new ATOM 0 HA PHE A 39 -4.925 -12.377 -5.801 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.096 -11.309 -5.471 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -2.752 -12.117 -6.881 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -4.863 -10.962 -7.965 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.096 -8.982 -5.402 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -5.569 -8.795 -8.881 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.800 -6.813 -6.315 1.00 0.00 H new ATOM 0 HZ PHE A 39 -4.533 -6.716 -8.063 1.00 0.00 H new ATOM 599 N GLU A 40 -3.917 -13.673 -3.330 1.00 0.00 N ATOM 600 CA GLU A 40 -3.454 -14.862 -2.625 1.00 0.00 C ATOM 601 C GLU A 40 -3.965 -16.130 -3.303 1.00 0.00 C ATOM 602 O GLU A 40 -3.212 -17.079 -3.518 1.00 0.00 O ATOM 603 CB GLU A 40 -3.915 -14.829 -1.166 1.00 0.00 C ATOM 604 CG GLU A 40 -2.984 -14.053 -0.251 1.00 0.00 C ATOM 605 CD GLU A 40 -1.646 -14.739 -0.061 1.00 0.00 C ATOM 606 OE1 GLU A 40 -0.798 -14.648 -0.974 1.00 0.00 O ATOM 607 OE2 GLU A 40 -1.446 -15.369 0.999 1.00 0.00 O ATOM 0 H GLU A 40 -4.570 -13.096 -2.800 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.364 -14.869 -2.654 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.910 -14.386 -1.118 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.003 -15.851 -0.798 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.822 -13.057 -0.664 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.462 -13.922 0.720 1.00 0.00 H new ATOM 614 N GLY A 41 -5.252 -16.138 -3.637 1.00 0.00 N ATOM 615 CA GLY A 41 -5.842 -17.293 -4.287 1.00 0.00 C ATOM 616 C GLY A 41 -6.901 -17.961 -3.431 1.00 0.00 C ATOM 617 O GLY A 41 -7.051 -19.183 -3.459 1.00 0.00 O ATOM 0 H GLY A 41 -5.896 -15.365 -3.469 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.285 -16.986 -5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.059 -18.015 -4.520 1.00 0.00 H new ATOM 621 N ARG A 42 -7.635 -17.159 -2.668 1.00 0.00 N ATOM 622 CA ARG A 42 -8.683 -17.680 -1.798 1.00 0.00 C ATOM 623 C ARG A 42 -10.065 -17.338 -2.347 1.00 0.00 C ATOM 624 O ARG A 42 -10.198 -16.511 -3.248 1.00 0.00 O ATOM 625 CB ARG A 42 -8.530 -17.116 -0.385 1.00 0.00 C ATOM 626 CG ARG A 42 -7.402 -17.756 0.408 1.00 0.00 C ATOM 627 CD ARG A 42 -7.829 -19.084 1.012 1.00 0.00 C ATOM 628 NE ARG A 42 -8.464 -18.913 2.316 1.00 0.00 N ATOM 629 CZ ARG A 42 -8.896 -19.924 3.062 1.00 0.00 C ATOM 630 NH1 ARG A 42 -8.761 -21.172 2.635 1.00 0.00 N ATOM 631 NH2 ARG A 42 -9.463 -19.687 4.238 1.00 0.00 N ATOM 0 H ARG A 42 -7.524 -16.146 -2.634 1.00 0.00 H new ATOM 0 HA ARG A 42 -8.584 -18.765 -1.761 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.354 -16.042 -0.449 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -9.466 -17.254 0.155 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.541 -17.911 -0.242 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.084 -17.080 1.202 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.521 -19.585 0.335 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -6.959 -19.732 1.115 1.00 0.00 H new ATOM 0 HE ARG A 42 -8.582 -17.965 2.674 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -8.325 -21.358 1.732 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.093 -21.946 3.210 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -9.567 -18.728 4.570 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -9.794 -20.464 4.810 1.00 0.00 H new ATOM 645 N GLN A 43 -11.090 -17.981 -1.797 1.00 0.00 N ATOM 646 CA GLN A 43 -12.461 -17.746 -2.232 1.00 0.00 C ATOM 647 C GLN A 43 -12.959 -16.386 -1.754 1.00 0.00 C ATOM 648 O GLN A 43 -13.624 -15.662 -2.493 1.00 0.00 O ATOM 649 CB GLN A 43 -13.381 -18.851 -1.711 1.00 0.00 C ATOM 650 CG GLN A 43 -13.432 -18.935 -0.194 1.00 0.00 C ATOM 651 CD GLN A 43 -14.072 -20.218 0.298 1.00 0.00 C ATOM 652 OE1 GLN A 43 -15.291 -20.295 0.459 1.00 0.00 O ATOM 653 NE2 GLN A 43 -13.253 -21.234 0.540 1.00 0.00 N ATOM 0 H GLN A 43 -10.997 -18.669 -1.049 1.00 0.00 H new ATOM 0 HA GLN A 43 -12.475 -17.755 -3.322 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -14.389 -18.683 -2.091 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -13.046 -19.809 -2.109 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -12.420 -18.862 0.204 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -13.990 -18.083 0.195 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -12.249 -21.126 0.393 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -13.627 -22.123 0.873 1.00 0.00 H new ATOM 662 N ALA A 44 -12.631 -16.045 -0.511 1.00 0.00 N ATOM 663 CA ALA A 44 -13.043 -14.772 0.065 1.00 0.00 C ATOM 664 C ALA A 44 -12.348 -13.605 -0.628 1.00 0.00 C ATOM 665 O ALA A 44 -12.991 -12.630 -1.020 1.00 0.00 O ATOM 666 CB ALA A 44 -12.752 -14.750 1.559 1.00 0.00 C ATOM 0 H ALA A 44 -12.081 -16.633 0.115 1.00 0.00 H new ATOM 0 HA ALA A 44 -14.117 -14.663 -0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -13.065 -13.793 1.977 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.299 -15.556 2.048 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -11.683 -14.886 1.724 1.00 0.00 H new ATOM 672 N LYS A 45 -11.032 -13.709 -0.776 1.00 0.00 N ATOM 673 CA LYS A 45 -10.249 -12.663 -1.423 1.00 0.00 C ATOM 674 C LYS A 45 -10.245 -12.844 -2.937 1.00 0.00 C ATOM 675 O LYS A 45 -10.062 -13.953 -3.441 1.00 0.00 O ATOM 676 CB LYS A 45 -8.813 -12.672 -0.894 1.00 0.00 C ATOM 677 CG LYS A 45 -8.713 -12.407 0.598 1.00 0.00 C ATOM 678 CD LYS A 45 -7.280 -12.129 1.020 1.00 0.00 C ATOM 679 CE LYS A 45 -6.502 -13.419 1.234 1.00 0.00 C ATOM 680 NZ LYS A 45 -6.757 -14.004 2.579 1.00 0.00 N ATOM 0 H LYS A 45 -10.485 -14.508 -0.456 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.710 -11.703 -1.191 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.360 -13.639 -1.114 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.233 -11.919 -1.428 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.342 -11.556 0.860 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -9.095 -13.267 1.148 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.785 -11.527 0.258 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.277 -11.544 1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.778 -14.141 0.466 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.436 -13.223 1.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.209 -14.881 2.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -6.470 -13.325 3.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.770 -14.215 2.679 1.00 0.00 H new ATOM 694 N THR A 46 -10.448 -11.746 -3.660 1.00 0.00 N ATOM 695 CA THR A 46 -10.467 -11.784 -5.117 1.00 0.00 C ATOM 696 C THR A 46 -9.876 -10.509 -5.708 1.00 0.00 C ATOM 697 O THR A 46 -9.948 -9.431 -5.118 1.00 0.00 O ATOM 698 CB THR A 46 -11.899 -11.969 -5.655 1.00 0.00 C ATOM 699 OG1 THR A 46 -12.696 -10.825 -5.331 1.00 0.00 O ATOM 700 CG2 THR A 46 -12.538 -13.221 -5.072 1.00 0.00 C ATOM 0 H THR A 46 -10.601 -10.820 -3.260 1.00 0.00 H new ATOM 0 HA THR A 46 -9.859 -12.637 -5.419 1.00 0.00 H new ATOM 0 HB THR A 46 -11.845 -12.078 -6.738 1.00 0.00 H new ATOM 0 HG1 THR A 46 -13.604 -10.950 -5.678 1.00 0.00 H new ATOM 0 HG21 THR A 46 -13.548 -13.331 -5.466 1.00 0.00 H new ATOM 0 HG22 THR A 46 -11.945 -14.093 -5.346 1.00 0.00 H new ATOM 0 HG23 THR A 46 -12.579 -13.137 -3.986 1.00 0.00 H new ATOM 708 N PRO A 47 -9.276 -10.632 -6.901 1.00 0.00 N ATOM 709 CA PRO A 47 -8.661 -9.498 -7.599 1.00 0.00 C ATOM 710 C PRO A 47 -9.696 -8.503 -8.111 1.00 0.00 C ATOM 711 O PRO A 47 -9.435 -7.302 -8.178 1.00 0.00 O ATOM 712 CB PRO A 47 -7.928 -10.158 -8.769 1.00 0.00 C ATOM 713 CG PRO A 47 -8.665 -11.430 -9.009 1.00 0.00 C ATOM 714 CD PRO A 47 -9.153 -11.886 -7.662 1.00 0.00 C ATOM 0 HA PRO A 47 -8.011 -8.919 -6.943 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -7.940 -9.521 -9.653 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.882 -10.346 -8.525 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -9.499 -11.275 -9.694 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -8.015 -12.178 -9.462 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -10.108 -12.407 -7.736 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -8.450 -12.574 -7.192 1.00 0.00 H new ATOM 722 N GLU A 48 -10.871 -9.010 -8.471 1.00 0.00 N ATOM 723 CA GLU A 48 -11.945 -8.163 -8.978 1.00 0.00 C ATOM 724 C GLU A 48 -12.382 -7.150 -7.925 1.00 0.00 C ATOM 725 O GLU A 48 -12.761 -6.025 -8.250 1.00 0.00 O ATOM 726 CB GLU A 48 -13.140 -9.018 -9.406 1.00 0.00 C ATOM 727 CG GLU A 48 -12.952 -9.695 -10.753 1.00 0.00 C ATOM 728 CD GLU A 48 -14.263 -9.915 -11.484 1.00 0.00 C ATOM 729 OE1 GLU A 48 -15.051 -10.776 -11.041 1.00 0.00 O ATOM 730 OE2 GLU A 48 -14.500 -9.226 -12.497 1.00 0.00 O ATOM 0 H GLU A 48 -11.103 -10.002 -8.421 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.567 -7.620 -9.844 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -13.321 -9.780 -8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -14.030 -8.390 -9.445 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.293 -9.087 -11.372 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -12.456 -10.655 -10.607 1.00 0.00 H new ATOM 737 N ARG A 49 -12.326 -7.557 -6.661 1.00 0.00 N ATOM 738 CA ARG A 49 -12.718 -6.686 -5.559 1.00 0.00 C ATOM 739 C ARG A 49 -11.712 -5.553 -5.378 1.00 0.00 C ATOM 740 O ARG A 49 -12.087 -4.383 -5.305 1.00 0.00 O ATOM 741 CB ARG A 49 -12.835 -7.490 -4.263 1.00 0.00 C ATOM 742 CG ARG A 49 -13.695 -6.818 -3.205 1.00 0.00 C ATOM 743 CD ARG A 49 -13.496 -7.454 -1.838 1.00 0.00 C ATOM 744 NE ARG A 49 -14.167 -8.747 -1.733 1.00 0.00 N ATOM 745 CZ ARG A 49 -15.481 -8.883 -1.592 1.00 0.00 C ATOM 746 NH1 ARG A 49 -16.260 -7.812 -1.540 1.00 0.00 N ATOM 747 NH2 ARG A 49 -16.017 -10.094 -1.504 1.00 0.00 N ATOM 0 H ARG A 49 -12.013 -8.485 -6.374 1.00 0.00 H new ATOM 0 HA ARG A 49 -13.689 -6.252 -5.799 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -13.253 -8.471 -4.490 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -11.837 -7.656 -3.857 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -13.448 -5.758 -3.153 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -14.745 -6.887 -3.490 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -12.430 -7.582 -1.650 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -13.877 -6.784 -1.067 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.596 -9.591 -1.770 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -15.851 -6.880 -1.608 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -17.269 -7.920 -1.432 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -15.420 -10.920 -1.545 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -17.026 -10.199 -1.396 1.00 0.00 H new ATOM 761 N TYR A 50 -10.434 -5.909 -5.306 1.00 0.00 N ATOM 762 CA TYR A 50 -9.375 -4.923 -5.131 1.00 0.00 C ATOM 763 C TYR A 50 -9.519 -3.784 -6.136 1.00 0.00 C ATOM 764 O TYR A 50 -9.184 -2.635 -5.843 1.00 0.00 O ATOM 765 CB TYR A 50 -8.004 -5.583 -5.284 1.00 0.00 C ATOM 766 CG TYR A 50 -6.903 -4.614 -5.652 1.00 0.00 C ATOM 767 CD1 TYR A 50 -6.419 -3.698 -4.727 1.00 0.00 C ATOM 768 CD2 TYR A 50 -6.346 -4.616 -6.925 1.00 0.00 C ATOM 769 CE1 TYR A 50 -5.414 -2.810 -5.059 1.00 0.00 C ATOM 770 CE2 TYR A 50 -5.339 -3.734 -7.266 1.00 0.00 C ATOM 771 CZ TYR A 50 -4.877 -2.832 -6.330 1.00 0.00 C ATOM 772 OH TYR A 50 -3.874 -1.951 -6.664 1.00 0.00 O ATOM 0 H TYR A 50 -10.107 -6.873 -5.366 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.461 -4.510 -4.126 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.743 -6.079 -4.349 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -8.066 -6.357 -6.049 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -6.836 -3.680 -3.731 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.707 -5.319 -7.661 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -5.051 -2.103 -4.328 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -4.916 -3.750 -8.260 1.00 0.00 H new ATOM 0 HH TYR A 50 -3.345 -1.740 -5.866 1.00 0.00 H new ATOM 782 N LEU A 51 -10.020 -4.111 -7.322 1.00 0.00 N ATOM 783 CA LEU A 51 -10.209 -3.117 -8.373 1.00 0.00 C ATOM 784 C LEU A 51 -11.394 -2.210 -8.056 1.00 0.00 C ATOM 785 O LEU A 51 -11.343 -1.001 -8.285 1.00 0.00 O ATOM 786 CB LEU A 51 -10.426 -3.806 -9.721 1.00 0.00 C ATOM 787 CG LEU A 51 -9.166 -4.095 -10.537 1.00 0.00 C ATOM 788 CD1 LEU A 51 -9.521 -4.799 -11.837 1.00 0.00 C ATOM 789 CD2 LEU A 51 -8.405 -2.807 -10.817 1.00 0.00 C ATOM 0 H LEU A 51 -10.303 -5.056 -7.580 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.309 -2.504 -8.426 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -10.945 -4.748 -9.545 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -11.089 -3.184 -10.322 1.00 0.00 H new ATOM 0 HG LEU A 51 -8.523 -4.755 -9.955 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.611 -4.996 -12.404 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -10.022 -5.741 -11.615 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -10.185 -4.165 -12.425 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -7.511 -3.032 -11.399 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.041 -2.123 -11.379 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.117 -2.342 -9.874 1.00 0.00 H new ATOM 801 N LYS A 52 -12.460 -2.800 -7.527 1.00 0.00 N ATOM 802 CA LYS A 52 -13.658 -2.046 -7.175 1.00 0.00 C ATOM 803 C LYS A 52 -13.346 -0.993 -6.116 1.00 0.00 C ATOM 804 O LYS A 52 -13.779 0.155 -6.223 1.00 0.00 O ATOM 805 CB LYS A 52 -14.748 -2.991 -6.664 1.00 0.00 C ATOM 806 CG LYS A 52 -15.977 -2.272 -6.135 1.00 0.00 C ATOM 807 CD LYS A 52 -16.763 -1.613 -7.256 1.00 0.00 C ATOM 808 CE LYS A 52 -17.996 -0.897 -6.726 1.00 0.00 C ATOM 809 NZ LYS A 52 -19.106 -1.847 -6.436 1.00 0.00 N ATOM 0 H LYS A 52 -12.519 -3.799 -7.332 1.00 0.00 H new ATOM 0 HA LYS A 52 -14.015 -1.540 -8.072 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -15.047 -3.658 -7.473 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -14.334 -3.616 -5.872 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -16.616 -2.981 -5.609 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -15.674 -1.517 -5.409 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -16.125 -0.901 -7.780 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -17.063 -2.367 -7.983 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -17.738 -0.352 -5.818 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -18.330 -0.160 -7.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -19.928 -1.321 -6.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -19.370 -2.349 -7.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -18.796 -2.535 -5.721 1.00 0.00 H new ATOM 823 N ILE A 53 -12.592 -1.390 -5.097 1.00 0.00 N ATOM 824 CA ILE A 53 -12.220 -0.479 -4.022 1.00 0.00 C ATOM 825 C ILE A 53 -11.158 0.512 -4.484 1.00 0.00 C ATOM 826 O ILE A 53 -11.275 1.716 -4.253 1.00 0.00 O ATOM 827 CB ILE A 53 -11.693 -1.244 -2.793 1.00 0.00 C ATOM 828 CG1 ILE A 53 -12.652 -2.376 -2.420 1.00 0.00 C ATOM 829 CG2 ILE A 53 -11.504 -0.294 -1.620 1.00 0.00 C ATOM 830 CD1 ILE A 53 -12.009 -3.464 -1.589 1.00 0.00 C ATOM 0 H ILE A 53 -12.227 -2.337 -4.993 1.00 0.00 H new ATOM 0 HA ILE A 53 -13.123 0.064 -3.742 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.726 -1.680 -3.042 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -13.495 -1.960 -1.869 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.054 -2.817 -3.333 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -11.131 -0.849 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.786 0.480 -1.891 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -12.459 0.168 -1.368 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.748 -4.233 -1.362 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -11.183 -3.907 -2.146 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -11.632 -3.037 -0.660 1.00 0.00 H new ATOM 842 N ARG A 54 -10.122 -0.001 -5.138 1.00 0.00 N ATOM 843 CA ARG A 54 -9.038 0.839 -5.634 1.00 0.00 C ATOM 844 C ARG A 54 -9.563 1.878 -6.621 1.00 0.00 C ATOM 845 O ARG A 54 -9.571 3.074 -6.333 1.00 0.00 O ATOM 846 CB ARG A 54 -7.964 -0.019 -6.304 1.00 0.00 C ATOM 847 CG ARG A 54 -6.640 0.702 -6.497 1.00 0.00 C ATOM 848 CD ARG A 54 -5.898 0.187 -7.720 1.00 0.00 C ATOM 849 NE ARG A 54 -6.293 0.890 -8.937 1.00 0.00 N ATOM 850 CZ ARG A 54 -6.167 0.378 -10.156 1.00 0.00 C ATOM 851 NH1 ARG A 54 -5.659 -0.836 -10.319 1.00 0.00 N ATOM 852 NH2 ARG A 54 -6.550 1.080 -11.215 1.00 0.00 N ATOM 0 H ARG A 54 -10.010 -0.995 -5.337 1.00 0.00 H new ATOM 0 HA ARG A 54 -8.598 1.360 -4.784 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.797 -0.912 -5.702 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.331 -0.353 -7.275 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -6.819 1.772 -6.603 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -6.019 0.569 -5.611 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -4.825 0.302 -7.568 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -6.091 -0.879 -7.839 1.00 0.00 H new ATOM 0 HE ARG A 54 -6.688 1.826 -8.846 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -5.364 -1.379 -9.507 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -5.563 -1.227 -11.256 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -6.942 2.014 -11.093 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -6.453 0.686 -12.151 1.00 0.00 H new ATOM 866 N ASN A 55 -10.001 1.411 -7.786 1.00 0.00 N ATOM 867 CA ASN A 55 -10.527 2.299 -8.816 1.00 0.00 C ATOM 868 C ASN A 55 -11.329 3.439 -8.194 1.00 0.00 C ATOM 869 O ASN A 55 -11.313 4.566 -8.690 1.00 0.00 O ATOM 870 CB ASN A 55 -11.405 1.517 -9.794 1.00 0.00 C ATOM 871 CG ASN A 55 -10.600 0.571 -10.665 1.00 0.00 C ATOM 872 OD1 ASN A 55 -9.432 0.297 -10.388 1.00 0.00 O ATOM 873 ND2 ASN A 55 -11.223 0.069 -11.725 1.00 0.00 N ATOM 0 H ASN A 55 -10.002 0.423 -8.040 1.00 0.00 H new ATOM 0 HA ASN A 55 -9.683 2.726 -9.358 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -12.149 0.948 -9.236 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -11.949 2.216 -10.429 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -10.732 -0.572 -12.349 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -12.192 0.324 -11.915 1.00 0.00 H new ATOM 880 N TYR A 56 -12.029 3.137 -7.106 1.00 0.00 N ATOM 881 CA TYR A 56 -12.839 4.134 -6.418 1.00 0.00 C ATOM 882 C TYR A 56 -11.959 5.211 -5.789 1.00 0.00 C ATOM 883 O TYR A 56 -12.162 6.404 -6.016 1.00 0.00 O ATOM 884 CB TYR A 56 -13.698 3.469 -5.341 1.00 0.00 C ATOM 885 CG TYR A 56 -14.611 4.431 -4.615 1.00 0.00 C ATOM 886 CD1 TYR A 56 -14.134 5.225 -3.579 1.00 0.00 C ATOM 887 CD2 TYR A 56 -15.951 4.546 -4.964 1.00 0.00 C ATOM 888 CE1 TYR A 56 -14.964 6.105 -2.912 1.00 0.00 C ATOM 889 CE2 TYR A 56 -16.788 5.424 -4.304 1.00 0.00 C ATOM 890 CZ TYR A 56 -16.291 6.201 -3.279 1.00 0.00 C ATOM 891 OH TYR A 56 -17.122 7.076 -2.618 1.00 0.00 O ATOM 0 H TYR A 56 -12.051 2.210 -6.682 1.00 0.00 H new ATOM 0 HA TYR A 56 -13.491 4.606 -7.153 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -14.301 2.686 -5.801 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -13.045 2.984 -4.616 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -13.096 5.153 -3.290 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -16.345 3.938 -5.765 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -14.577 6.714 -2.108 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -17.827 5.502 -4.589 1.00 0.00 H new ATOM 0 HH TYR A 56 -18.023 7.022 -2.999 1.00 0.00 H new ATOM 901 N ILE A 57 -10.981 4.780 -4.999 1.00 0.00 N ATOM 902 CA ILE A 57 -10.069 5.705 -4.339 1.00 0.00 C ATOM 903 C ILE A 57 -9.442 6.668 -5.342 1.00 0.00 C ATOM 904 O ILE A 57 -9.524 7.887 -5.183 1.00 0.00 O ATOM 905 CB ILE A 57 -8.949 4.956 -3.594 1.00 0.00 C ATOM 906 CG1 ILE A 57 -9.528 4.162 -2.422 1.00 0.00 C ATOM 907 CG2 ILE A 57 -7.891 5.935 -3.107 1.00 0.00 C ATOM 908 CD1 ILE A 57 -8.695 2.960 -2.036 1.00 0.00 C ATOM 0 H ILE A 57 -10.800 3.796 -4.801 1.00 0.00 H new ATOM 0 HA ILE A 57 -10.659 6.269 -3.617 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.478 4.256 -4.284 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -9.622 4.821 -1.559 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.533 3.829 -2.680 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.106 5.391 -2.582 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -7.461 6.460 -3.960 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -8.347 6.657 -2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -9.166 2.445 -1.199 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.622 2.280 -2.885 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -7.697 3.287 -1.746 1.00 0.00 H new ATOM 920 N LEU A 58 -8.818 6.114 -6.375 1.00 0.00 N ATOM 921 CA LEU A 58 -8.179 6.924 -7.406 1.00 0.00 C ATOM 922 C LEU A 58 -9.165 7.922 -8.005 1.00 0.00 C ATOM 923 O LEU A 58 -8.795 9.044 -8.349 1.00 0.00 O ATOM 924 CB LEU A 58 -7.611 6.027 -8.508 1.00 0.00 C ATOM 925 CG LEU A 58 -6.231 5.427 -8.240 1.00 0.00 C ATOM 926 CD1 LEU A 58 -5.951 4.281 -9.200 1.00 0.00 C ATOM 927 CD2 LEU A 58 -5.153 6.495 -8.355 1.00 0.00 C ATOM 0 H LEU A 58 -8.741 5.107 -6.521 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.364 7.480 -6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.312 5.211 -8.682 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.561 6.606 -9.430 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.219 5.034 -7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.964 3.867 -8.994 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.705 3.505 -9.070 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.983 4.649 -10.225 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.177 6.050 -8.161 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -5.166 6.918 -9.360 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.343 7.284 -7.627 1.00 0.00 H new ATOM 939 N ASP A 59 -10.420 7.506 -8.124 1.00 0.00 N ATOM 940 CA ASP A 59 -11.461 8.364 -8.678 1.00 0.00 C ATOM 941 C ASP A 59 -11.711 9.567 -7.775 1.00 0.00 C ATOM 942 O ASP A 59 -11.657 10.713 -8.222 1.00 0.00 O ATOM 943 CB ASP A 59 -12.757 7.574 -8.866 1.00 0.00 C ATOM 944 CG ASP A 59 -13.874 8.422 -9.441 1.00 0.00 C ATOM 945 OD1 ASP A 59 -13.601 9.215 -10.367 1.00 0.00 O ATOM 946 OD2 ASP A 59 -15.022 8.293 -8.966 1.00 0.00 O ATOM 0 H ASP A 59 -10.742 6.579 -7.844 1.00 0.00 H new ATOM 0 HA ASP A 59 -11.121 8.725 -9.649 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -12.570 6.728 -9.527 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.072 7.165 -7.906 1.00 0.00 H new ATOM 951 N GLN A 60 -11.984 9.299 -6.502 1.00 0.00 N ATOM 952 CA GLN A 60 -12.244 10.360 -5.537 1.00 0.00 C ATOM 953 C GLN A 60 -11.071 11.333 -5.468 1.00 0.00 C ATOM 954 O GLN A 60 -11.263 12.546 -5.381 1.00 0.00 O ATOM 955 CB GLN A 60 -12.511 9.766 -4.153 1.00 0.00 C ATOM 956 CG GLN A 60 -13.573 8.679 -4.151 1.00 0.00 C ATOM 957 CD GLN A 60 -14.762 9.024 -5.027 1.00 0.00 C ATOM 958 OE1 GLN A 60 -15.346 10.101 -4.905 1.00 0.00 O ATOM 959 NE2 GLN A 60 -15.127 8.109 -5.917 1.00 0.00 N ATOM 0 H GLN A 60 -12.031 8.356 -6.115 1.00 0.00 H new ATOM 0 HA GLN A 60 -13.127 10.907 -5.866 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -11.582 9.355 -3.758 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -12.819 10.564 -3.478 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -13.131 7.744 -4.496 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -13.915 8.512 -3.130 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -14.614 7.230 -5.984 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -15.920 8.285 -6.534 1.00 0.00 H new ATOM 968 N TRP A 61 -9.859 10.793 -5.508 1.00 0.00 N ATOM 969 CA TRP A 61 -8.655 11.614 -5.450 1.00 0.00 C ATOM 970 C TRP A 61 -8.761 12.805 -6.396 1.00 0.00 C ATOM 971 O TRP A 61 -8.715 13.956 -5.966 1.00 0.00 O ATOM 972 CB TRP A 61 -7.424 10.776 -5.801 1.00 0.00 C ATOM 973 CG TRP A 61 -6.315 11.577 -6.412 1.00 0.00 C ATOM 974 CD1 TRP A 61 -5.687 11.335 -7.600 1.00 0.00 C ATOM 975 CD2 TRP A 61 -5.701 12.749 -5.864 1.00 0.00 C ATOM 976 NE1 TRP A 61 -4.720 12.285 -7.824 1.00 0.00 N ATOM 977 CE2 TRP A 61 -4.709 13.165 -6.774 1.00 0.00 C ATOM 978 CE3 TRP A 61 -5.895 13.489 -4.694 1.00 0.00 C ATOM 979 CZ2 TRP A 61 -3.915 14.286 -6.547 1.00 0.00 C ATOM 980 CZ3 TRP A 61 -5.105 14.601 -4.471 1.00 0.00 C ATOM 981 CH2 TRP A 61 -4.126 14.991 -5.394 1.00 0.00 C ATOM 0 H TRP A 61 -9.683 9.791 -5.580 1.00 0.00 H new ATOM 0 HA TRP A 61 -8.552 11.991 -4.432 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.056 10.289 -4.898 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -7.716 9.986 -6.493 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -5.917 10.517 -8.266 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.109 12.328 -8.640 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.648 13.197 -3.977 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -3.159 14.588 -7.256 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -5.245 15.179 -3.570 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -3.526 15.866 -5.191 1.00 0.00 H new ATOM 992 N GLU A 62 -8.905 12.519 -7.687 1.00 0.00 N ATOM 993 CA GLU A 62 -9.018 13.568 -8.693 1.00 0.00 C ATOM 994 C GLU A 62 -10.261 14.420 -8.454 1.00 0.00 C ATOM 995 O GLU A 62 -10.240 15.636 -8.646 1.00 0.00 O ATOM 996 CB GLU A 62 -9.066 12.958 -10.095 1.00 0.00 C ATOM 997 CG GLU A 62 -8.297 11.653 -10.218 1.00 0.00 C ATOM 998 CD GLU A 62 -7.890 11.348 -11.646 1.00 0.00 C ATOM 999 OE1 GLU A 62 -7.829 12.294 -12.460 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -7.632 10.165 -11.951 1.00 0.00 O ATOM 0 H GLU A 62 -8.946 11.570 -8.060 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.139 14.208 -8.613 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.106 12.784 -10.371 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.662 13.676 -10.809 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.406 11.701 -9.592 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.911 10.837 -9.837 1.00 0.00 H new ATOM 1007 N ILE A 63 -11.343 13.772 -8.035 1.00 0.00 N ATOM 1008 CA ILE A 63 -12.595 14.469 -7.769 1.00 0.00 C ATOM 1009 C ILE A 63 -12.400 15.579 -6.741 1.00 0.00 C ATOM 1010 O ILE A 63 -13.216 16.495 -6.639 1.00 0.00 O ATOM 1011 CB ILE A 63 -13.682 13.502 -7.263 1.00 0.00 C ATOM 1012 CG1 ILE A 63 -14.184 12.621 -8.408 1.00 0.00 C ATOM 1013 CG2 ILE A 63 -14.833 14.278 -6.640 1.00 0.00 C ATOM 1014 CD1 ILE A 63 -14.967 11.413 -7.943 1.00 0.00 C ATOM 0 H ILE A 63 -11.378 12.766 -7.873 1.00 0.00 H new ATOM 0 HA ILE A 63 -12.919 14.905 -8.714 1.00 0.00 H new ATOM 0 HB ILE A 63 -13.248 12.858 -6.498 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.813 13.219 -9.067 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -13.331 12.286 -8.998 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -15.593 13.581 -6.287 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -14.463 14.867 -5.801 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -15.269 14.943 -7.385 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -15.291 10.835 -8.808 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -14.335 10.792 -7.308 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -15.840 11.740 -7.378 1.00 0.00 H new ATOM 1026 N CYS A 64 -11.312 15.490 -5.984 1.00 0.00 N ATOM 1027 CA CYS A 64 -11.008 16.487 -4.964 1.00 0.00 C ATOM 1028 C CYS A 64 -9.774 17.298 -5.347 1.00 0.00 C ATOM 1029 O CYS A 64 -9.671 18.482 -5.026 1.00 0.00 O ATOM 1030 CB CYS A 64 -10.788 15.812 -3.609 1.00 0.00 C ATOM 1031 SG CYS A 64 -11.245 16.835 -2.191 1.00 0.00 S ATOM 0 H CYS A 64 -10.626 14.738 -6.057 1.00 0.00 H new ATOM 0 HA CYS A 64 -11.858 17.165 -4.890 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -11.365 14.888 -3.578 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -9.738 15.535 -3.520 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.025 16.177 -1.092 1.00 0.00 H new ATOM 1037 N LYS A 65 -8.839 16.653 -6.035 1.00 0.00 N ATOM 1038 CA LYS A 65 -7.611 17.312 -6.463 1.00 0.00 C ATOM 1039 C LYS A 65 -7.905 18.701 -7.020 1.00 0.00 C ATOM 1040 O LYS A 65 -9.001 18.983 -7.504 1.00 0.00 O ATOM 1041 CB LYS A 65 -6.896 16.468 -7.521 1.00 0.00 C ATOM 1042 CG LYS A 65 -7.288 16.819 -8.946 1.00 0.00 C ATOM 1043 CD LYS A 65 -6.569 15.940 -9.955 1.00 0.00 C ATOM 1044 CE LYS A 65 -5.188 16.485 -10.285 1.00 0.00 C ATOM 1045 NZ LYS A 65 -4.751 16.098 -11.655 1.00 0.00 N ATOM 0 H LYS A 65 -8.908 15.673 -6.309 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.963 17.418 -5.593 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.819 16.594 -7.408 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -7.114 15.415 -7.342 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.365 16.706 -9.066 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -7.054 17.865 -9.141 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.477 14.929 -9.558 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -7.162 15.872 -10.867 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.197 17.572 -10.200 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -4.468 16.114 -9.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -3.805 16.489 -11.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -4.718 15.061 -11.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.424 16.473 -12.353 1.00 0.00 H new ATOM 1059 N PRO A 66 -6.903 19.591 -6.952 1.00 0.00 N ATOM 1060 CA PRO A 66 -5.594 19.267 -6.377 1.00 0.00 C ATOM 1061 C PRO A 66 -5.656 19.074 -4.866 1.00 0.00 C ATOM 1062 O PRO A 66 -4.649 18.771 -4.226 1.00 0.00 O ATOM 1063 CB PRO A 66 -4.742 20.490 -6.726 1.00 0.00 C ATOM 1064 CG PRO A 66 -5.720 21.603 -6.876 1.00 0.00 C ATOM 1065 CD PRO A 66 -6.972 20.982 -7.430 1.00 0.00 C ATOM 0 HA PRO A 66 -5.198 18.329 -6.766 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.016 20.704 -5.941 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -4.179 20.331 -7.646 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.914 22.084 -5.917 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.336 22.372 -7.546 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.866 21.488 -7.066 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -6.998 21.032 -8.519 1.00 0.00 H new ATOM 1073 N LYS A 67 -6.845 19.252 -4.300 1.00 0.00 N ATOM 1074 CA LYS A 67 -7.040 19.095 -2.863 1.00 0.00 C ATOM 1075 C LYS A 67 -6.641 17.695 -2.409 1.00 0.00 C ATOM 1076 O LYS A 67 -6.758 16.730 -3.164 1.00 0.00 O ATOM 1077 CB LYS A 67 -8.500 19.366 -2.493 1.00 0.00 C ATOM 1078 CG LYS A 67 -9.026 20.689 -3.022 1.00 0.00 C ATOM 1079 CD LYS A 67 -8.452 21.866 -2.252 1.00 0.00 C ATOM 1080 CE LYS A 67 -9.217 23.148 -2.541 1.00 0.00 C ATOM 1081 NZ LYS A 67 -10.596 23.110 -1.979 1.00 0.00 N ATOM 0 H LYS A 67 -7.689 19.505 -4.815 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.402 19.818 -2.354 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -9.120 18.557 -2.880 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -8.599 19.353 -1.408 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.773 20.786 -4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.114 20.703 -2.952 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -8.486 21.654 -1.183 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -7.403 21.999 -2.518 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.677 23.996 -2.120 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -9.268 23.305 -3.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -10.974 24.077 -1.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.206 22.536 -2.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -10.572 22.690 -1.028 1.00 0.00 H new ATOM 1095 N TYR A 68 -6.170 17.591 -1.171 1.00 0.00 N ATOM 1096 CA TYR A 68 -5.753 16.309 -0.617 1.00 0.00 C ATOM 1097 C TYR A 68 -6.962 15.461 -0.236 1.00 0.00 C ATOM 1098 O TYR A 68 -7.871 15.928 0.452 1.00 0.00 O ATOM 1099 CB TYR A 68 -4.861 16.524 0.607 1.00 0.00 C ATOM 1100 CG TYR A 68 -4.734 15.301 1.487 1.00 0.00 C ATOM 1101 CD1 TYR A 68 -5.649 15.056 2.504 1.00 0.00 C ATOM 1102 CD2 TYR A 68 -3.700 14.392 1.302 1.00 0.00 C ATOM 1103 CE1 TYR A 68 -5.537 13.940 3.311 1.00 0.00 C ATOM 1104 CE2 TYR A 68 -3.582 13.273 2.103 1.00 0.00 C ATOM 1105 CZ TYR A 68 -4.502 13.051 3.106 1.00 0.00 C ATOM 1106 OH TYR A 68 -4.387 11.939 3.907 1.00 0.00 O ATOM 0 H TYR A 68 -6.068 18.380 -0.532 1.00 0.00 H new ATOM 0 HA TYR A 68 -5.187 15.779 -1.382 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -3.868 16.826 0.274 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -5.263 17.347 1.199 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -6.461 15.749 2.666 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -2.976 14.563 0.519 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.256 13.765 4.098 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -2.773 12.575 1.945 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.606 11.416 3.630 1.00 0.00 H new ATOM 1116 N LEU A 69 -6.966 14.211 -0.687 1.00 0.00 N ATOM 1117 CA LEU A 69 -8.062 13.295 -0.393 1.00 0.00 C ATOM 1118 C LEU A 69 -7.942 12.737 1.021 1.00 0.00 C ATOM 1119 O LEU A 69 -6.864 12.324 1.446 1.00 0.00 O ATOM 1120 CB LEU A 69 -8.080 12.149 -1.406 1.00 0.00 C ATOM 1121 CG LEU A 69 -9.179 11.103 -1.217 1.00 0.00 C ATOM 1122 CD1 LEU A 69 -10.548 11.712 -1.478 1.00 0.00 C ATOM 1123 CD2 LEU A 69 -8.942 9.908 -2.130 1.00 0.00 C ATOM 0 H LEU A 69 -6.222 13.809 -1.258 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.997 13.851 -0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.179 12.575 -2.404 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.115 11.643 -1.370 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.149 10.757 -0.184 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.317 10.952 -1.338 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.719 12.534 -0.782 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.590 12.087 -2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.734 9.174 -1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.943 10.238 -3.169 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.979 9.455 -1.894 1.00 0.00 H new ATOM 1135 N ASN A 70 -9.057 12.726 1.744 1.00 0.00 N ATOM 1136 CA ASN A 70 -9.077 12.216 3.110 1.00 0.00 C ATOM 1137 C ASN A 70 -9.247 10.700 3.123 1.00 0.00 C ATOM 1138 O ASN A 70 -10.157 10.161 2.494 1.00 0.00 O ATOM 1139 CB ASN A 70 -10.207 12.874 3.905 1.00 0.00 C ATOM 1140 CG ASN A 70 -10.460 14.306 3.475 1.00 0.00 C ATOM 1141 OD1 ASN A 70 -11.672 14.577 3.004 1.00 0.00 O flip ATOM 1142 ND2 ASN A 70 -9.576 15.158 3.564 1.00 0.00 N flip ATOM 0 H ASN A 70 -9.958 13.064 1.407 1.00 0.00 H new ATOM 0 HA ASN A 70 -8.123 12.460 3.577 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -11.121 12.293 3.780 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -9.960 12.855 4.966 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.659 14.905 3.932 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -9.761 16.117 3.270 1.00 0.00 H new ATOM 1149 N LYS A 71 -8.365 10.018 3.845 1.00 0.00 N ATOM 1150 CA LYS A 71 -8.416 8.564 3.943 1.00 0.00 C ATOM 1151 C LYS A 71 -9.684 8.112 4.662 1.00 0.00 C ATOM 1152 O LYS A 71 -10.116 6.968 4.519 1.00 0.00 O ATOM 1153 CB LYS A 71 -7.183 8.038 4.682 1.00 0.00 C ATOM 1154 CG LYS A 71 -7.431 6.740 5.431 1.00 0.00 C ATOM 1155 CD LYS A 71 -7.795 5.610 4.483 1.00 0.00 C ATOM 1156 CE LYS A 71 -8.666 4.567 5.168 1.00 0.00 C ATOM 1157 NZ LYS A 71 -7.850 3.537 5.867 1.00 0.00 N ATOM 0 H LYS A 71 -7.605 10.449 4.372 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.427 8.157 2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.377 7.885 3.964 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.842 8.796 5.388 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.539 6.469 5.996 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.235 6.883 6.153 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.321 6.014 3.618 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.885 5.139 4.111 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.324 5.058 5.885 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.304 4.084 4.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.097 2.594 5.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.840 3.720 5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.042 3.577 6.888 1.00 0.00 H new ATOM 1171 N THR A 72 -10.276 9.018 5.434 1.00 0.00 N ATOM 1172 CA THR A 72 -11.494 8.712 6.174 1.00 0.00 C ATOM 1173 C THR A 72 -12.734 9.057 5.358 1.00 0.00 C ATOM 1174 O THR A 72 -13.857 8.743 5.754 1.00 0.00 O ATOM 1175 CB THR A 72 -11.545 9.474 7.511 1.00 0.00 C ATOM 1176 OG1 THR A 72 -10.264 9.428 8.151 1.00 0.00 O ATOM 1177 CG2 THR A 72 -12.599 8.880 8.433 1.00 0.00 C ATOM 0 H THR A 72 -9.932 9.969 5.563 1.00 0.00 H new ATOM 0 HA THR A 72 -11.481 7.641 6.375 1.00 0.00 H new ATOM 0 HB THR A 72 -11.810 10.511 7.303 1.00 0.00 H new ATOM 0 HG1 THR A 72 -10.305 9.916 9.000 1.00 0.00 H new ATOM 0 HG21 THR A 72 -12.616 9.435 9.371 1.00 0.00 H new ATOM 0 HG22 THR A 72 -13.577 8.943 7.956 1.00 0.00 H new ATOM 0 HG23 THR A 72 -12.360 7.836 8.634 1.00 0.00 H new ATOM 1185 N SER A 73 -12.525 9.703 4.215 1.00 0.00 N ATOM 1186 CA SER A 73 -13.627 10.093 3.345 1.00 0.00 C ATOM 1187 C SER A 73 -14.103 8.910 2.507 1.00 0.00 C ATOM 1188 O SER A 73 -15.293 8.777 2.218 1.00 0.00 O ATOM 1189 CB SER A 73 -13.200 11.242 2.429 1.00 0.00 C ATOM 1190 OG SER A 73 -14.060 11.347 1.307 1.00 0.00 O ATOM 0 H SER A 73 -11.602 9.967 3.870 1.00 0.00 H new ATOM 0 HA SER A 73 -14.453 10.426 3.974 1.00 0.00 H new ATOM 0 HB2 SER A 73 -13.209 12.178 2.987 1.00 0.00 H new ATOM 0 HB3 SER A 73 -12.176 11.081 2.092 1.00 0.00 H new ATOM 0 HG SER A 73 -13.767 12.089 0.738 1.00 0.00 H new ATOM 1196 N VAL A 74 -13.165 8.052 2.120 1.00 0.00 N ATOM 1197 CA VAL A 74 -13.487 6.878 1.317 1.00 0.00 C ATOM 1198 C VAL A 74 -13.907 5.707 2.198 1.00 0.00 C ATOM 1199 O VAL A 74 -14.596 4.793 1.746 1.00 0.00 O ATOM 1200 CB VAL A 74 -12.290 6.448 0.447 1.00 0.00 C ATOM 1201 CG1 VAL A 74 -11.577 7.667 -0.119 1.00 0.00 C ATOM 1202 CG2 VAL A 74 -11.331 5.584 1.251 1.00 0.00 C ATOM 0 H VAL A 74 -12.176 8.148 2.349 1.00 0.00 H new ATOM 0 HA VAL A 74 -14.317 7.157 0.668 1.00 0.00 H new ATOM 0 HB VAL A 74 -12.663 5.855 -0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -10.734 7.344 -0.731 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -12.271 8.242 -0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -11.214 8.289 0.699 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -10.492 5.289 0.621 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -10.962 6.150 2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -11.851 4.693 1.602 1.00 0.00 H new ATOM 1212 N ARG A 75 -13.487 5.742 3.458 1.00 0.00 N ATOM 1213 CA ARG A 75 -13.820 4.683 4.404 1.00 0.00 C ATOM 1214 C ARG A 75 -15.284 4.274 4.269 1.00 0.00 C ATOM 1215 O ARG A 75 -15.608 3.123 3.976 1.00 0.00 O ATOM 1216 CB ARG A 75 -13.536 5.141 5.836 1.00 0.00 C ATOM 1217 CG ARG A 75 -12.159 4.744 6.341 1.00 0.00 C ATOM 1218 CD ARG A 75 -12.157 4.533 7.847 1.00 0.00 C ATOM 1219 NE ARG A 75 -13.180 3.579 8.267 1.00 0.00 N ATOM 1220 CZ ARG A 75 -13.328 3.166 9.521 1.00 0.00 C ATOM 1221 NH1 ARG A 75 -12.524 3.621 10.472 1.00 0.00 N ATOM 1222 NH2 ARG A 75 -14.282 2.295 9.826 1.00 0.00 N ATOM 0 H ARG A 75 -12.916 6.492 3.848 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.197 3.818 4.177 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -13.634 6.225 5.888 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -14.292 4.721 6.499 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -11.838 3.829 5.844 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -11.437 5.518 6.080 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -11.177 4.175 8.162 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -12.324 5.487 8.347 1.00 0.00 H new ATOM 0 HE ARG A 75 -13.815 3.210 7.559 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -11.789 4.290 10.242 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -12.640 3.302 11.434 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -14.902 1.942 9.097 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -14.395 1.979 10.789 1.00 0.00 H new ATOM 1236 N PRO A 76 -16.190 5.238 4.489 1.00 0.00 N ATOM 1237 CA PRO A 76 -17.634 5.002 4.398 1.00 0.00 C ATOM 1238 C PRO A 76 -18.093 4.761 2.964 1.00 0.00 C ATOM 1239 O PRO A 76 -19.105 4.103 2.728 1.00 0.00 O ATOM 1240 CB PRO A 76 -18.240 6.298 4.943 1.00 0.00 C ATOM 1241 CG PRO A 76 -17.198 7.334 4.702 1.00 0.00 C ATOM 1242 CD PRO A 76 -15.875 6.632 4.842 1.00 0.00 C ATOM 0 HA PRO A 76 -17.937 4.110 4.947 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -19.170 6.546 4.432 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -18.473 6.210 6.004 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -17.305 7.771 3.709 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -17.285 8.149 5.420 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -15.123 7.055 4.176 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -15.483 6.711 5.856 1.00 0.00 H new ATOM 1250 N GLY A 77 -17.341 5.299 2.008 1.00 0.00 N ATOM 1251 CA GLY A 77 -17.687 5.131 0.609 1.00 0.00 C ATOM 1252 C GLY A 77 -17.653 3.679 0.174 1.00 0.00 C ATOM 1253 O GLY A 77 -18.376 3.280 -0.740 1.00 0.00 O ATOM 0 H GLY A 77 -16.498 5.848 2.178 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -18.683 5.537 0.433 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -16.995 5.707 -0.005 1.00 0.00 H new ATOM 1257 N LEU A 78 -16.810 2.887 0.827 1.00 0.00 N ATOM 1258 CA LEU A 78 -16.682 1.471 0.501 1.00 0.00 C ATOM 1259 C LEU A 78 -16.694 0.618 1.766 1.00 0.00 C ATOM 1260 O LEU A 78 -15.672 0.051 2.155 1.00 0.00 O ATOM 1261 CB LEU A 78 -15.393 1.222 -0.284 1.00 0.00 C ATOM 1262 CG LEU A 78 -15.195 2.076 -1.536 1.00 0.00 C ATOM 1263 CD1 LEU A 78 -13.715 2.314 -1.791 1.00 0.00 C ATOM 1264 CD2 LEU A 78 -15.846 1.414 -2.742 1.00 0.00 C ATOM 0 H LEU A 78 -16.205 3.201 1.586 1.00 0.00 H new ATOM 0 HA LEU A 78 -17.535 1.187 -0.115 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.547 1.389 0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -15.366 0.172 -0.576 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.675 3.041 -1.374 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -13.593 2.924 -2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.277 2.832 -0.937 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -13.212 1.358 -1.932 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -15.695 2.036 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.396 0.435 -2.907 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.914 1.296 -2.560 1.00 0.00 H new ATOM 1276 N LYS A 79 -17.856 0.530 2.404 1.00 0.00 N ATOM 1277 CA LYS A 79 -18.003 -0.256 3.623 1.00 0.00 C ATOM 1278 C LYS A 79 -18.455 -1.677 3.302 1.00 0.00 C ATOM 1279 O LYS A 79 -17.924 -2.645 3.846 1.00 0.00 O ATOM 1280 CB LYS A 79 -19.008 0.410 4.565 1.00 0.00 C ATOM 1281 CG LYS A 79 -18.413 1.538 5.390 1.00 0.00 C ATOM 1282 CD LYS A 79 -17.779 1.020 6.669 1.00 0.00 C ATOM 1283 CE LYS A 79 -17.407 2.157 7.608 1.00 0.00 C ATOM 1284 NZ LYS A 79 -18.606 2.746 8.268 1.00 0.00 N ATOM 0 H LYS A 79 -18.711 0.994 2.097 1.00 0.00 H new ATOM 0 HA LYS A 79 -17.031 -0.305 4.114 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -19.840 0.800 3.978 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -19.418 -0.344 5.237 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -17.664 2.066 4.800 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -19.192 2.260 5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -18.471 0.344 7.171 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -16.888 0.441 6.426 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.718 1.789 8.368 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.882 2.932 7.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -18.303 3.397 9.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -19.168 3.267 7.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -19.184 1.986 8.680 1.00 0.00 H new ATOM 1298 N ASN A 80 -19.438 -1.795 2.415 1.00 0.00 N ATOM 1299 CA ASN A 80 -19.960 -3.099 2.022 1.00 0.00 C ATOM 1300 C ASN A 80 -18.893 -3.917 1.301 1.00 0.00 C ATOM 1301 O ASN A 80 -18.781 -5.127 1.505 1.00 0.00 O ATOM 1302 CB ASN A 80 -21.185 -2.930 1.121 1.00 0.00 C ATOM 1303 CG ASN A 80 -22.363 -2.318 1.855 1.00 0.00 C ATOM 1304 OD1 ASN A 80 -22.767 -2.799 2.914 1.00 0.00 O ATOM 1305 ND2 ASN A 80 -22.919 -1.250 1.294 1.00 0.00 N ATOM 0 H ASN A 80 -19.889 -1.004 1.955 1.00 0.00 H new ATOM 0 HA ASN A 80 -20.253 -3.633 2.926 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -20.923 -2.300 0.271 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -21.475 -3.901 0.721 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -23.714 -0.794 1.742 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -22.551 -0.886 0.415 1.00 0.00 H new ATOM 1312 N CYS A 81 -18.113 -3.250 0.458 1.00 0.00 N ATOM 1313 CA CYS A 81 -17.055 -3.915 -0.294 1.00 0.00 C ATOM 1314 C CYS A 81 -16.012 -4.511 0.646 1.00 0.00 C ATOM 1315 O CYS A 81 -15.873 -5.730 0.742 1.00 0.00 O ATOM 1316 CB CYS A 81 -16.389 -2.931 -1.256 1.00 0.00 C ATOM 1317 SG CYS A 81 -15.735 -3.695 -2.759 1.00 0.00 S ATOM 0 H CYS A 81 -18.193 -2.249 0.278 1.00 0.00 H new ATOM 0 HA CYS A 81 -17.505 -4.725 -0.868 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -17.114 -2.166 -1.536 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -15.576 -2.425 -0.736 1.00 0.00 H new ATOM 0 HG CYS A 81 -16.704 -3.893 -3.602 1.00 0.00 H new ATOM 1323 N GLY A 82 -15.280 -3.642 1.337 1.00 0.00 N ATOM 1324 CA GLY A 82 -14.258 -4.102 2.258 1.00 0.00 C ATOM 1325 C GLY A 82 -14.266 -3.332 3.564 1.00 0.00 C ATOM 1326 O GLY A 82 -15.107 -2.456 3.771 1.00 0.00 O ATOM 0 H GLY A 82 -15.377 -2.628 1.275 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.409 -5.162 2.464 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.279 -4.005 1.788 1.00 0.00 H new ATOM 1330 N ASP A 83 -13.331 -3.660 4.448 1.00 0.00 N ATOM 1331 CA ASP A 83 -13.234 -2.993 5.742 1.00 0.00 C ATOM 1332 C ASP A 83 -11.944 -2.185 5.842 1.00 0.00 C ATOM 1333 O ASP A 83 -11.120 -2.196 4.928 1.00 0.00 O ATOM 1334 CB ASP A 83 -13.297 -4.019 6.874 1.00 0.00 C ATOM 1335 CG ASP A 83 -14.720 -4.342 7.285 1.00 0.00 C ATOM 1336 OD1 ASP A 83 -15.387 -5.109 6.559 1.00 0.00 O ATOM 1337 OD2 ASP A 83 -15.168 -3.827 8.331 1.00 0.00 O ATOM 0 H ASP A 83 -12.629 -4.384 4.293 1.00 0.00 H new ATOM 0 HA ASP A 83 -14.078 -2.309 5.835 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -12.796 -4.935 6.559 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -12.751 -3.638 7.737 1.00 0.00 H new ATOM 1342 N VAL A 84 -11.776 -1.484 6.959 1.00 0.00 N ATOM 1343 CA VAL A 84 -10.586 -0.670 7.178 1.00 0.00 C ATOM 1344 C VAL A 84 -9.316 -1.489 6.981 1.00 0.00 C ATOM 1345 O VAL A 84 -8.225 -0.938 6.841 1.00 0.00 O ATOM 1346 CB VAL A 84 -10.577 -0.060 8.593 1.00 0.00 C ATOM 1347 CG1 VAL A 84 -10.848 -1.132 9.638 1.00 0.00 C ATOM 1348 CG2 VAL A 84 -9.252 0.637 8.863 1.00 0.00 C ATOM 0 H VAL A 84 -12.448 -1.463 7.726 1.00 0.00 H new ATOM 0 HA VAL A 84 -10.613 0.135 6.443 1.00 0.00 H new ATOM 0 HB VAL A 84 -11.372 0.683 8.655 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -10.838 -0.683 10.631 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -11.823 -1.582 9.453 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -10.077 -1.900 9.579 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -9.262 1.062 9.867 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -8.439 -0.084 8.783 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -9.104 1.433 8.133 1.00 0.00 H new ATOM 1358 N ASN A 85 -9.465 -2.810 6.971 1.00 0.00 N ATOM 1359 CA ASN A 85 -8.329 -3.706 6.791 1.00 0.00 C ATOM 1360 C ASN A 85 -7.696 -3.513 5.417 1.00 0.00 C ATOM 1361 O ASN A 85 -6.545 -3.089 5.306 1.00 0.00 O ATOM 1362 CB ASN A 85 -8.769 -5.162 6.962 1.00 0.00 C ATOM 1363 CG ASN A 85 -9.492 -5.396 8.275 1.00 0.00 C ATOM 1364 OD1 ASN A 85 -10.722 -5.407 8.325 1.00 0.00 O ATOM 1365 ND2 ASN A 85 -8.729 -5.586 9.345 1.00 0.00 N ATOM 0 H ASN A 85 -10.361 -3.283 7.085 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.585 -3.466 7.551 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -9.423 -5.441 6.135 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.895 -5.811 6.910 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -9.159 -5.749 10.255 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -7.713 -5.568 9.256 1.00 0.00 H new ATOM 1372 N CYS A 86 -8.455 -3.826 4.373 1.00 0.00 N ATOM 1373 CA CYS A 86 -7.969 -3.687 3.004 1.00 0.00 C ATOM 1374 C CYS A 86 -7.925 -2.220 2.590 1.00 0.00 C ATOM 1375 O CYS A 86 -6.966 -1.772 1.960 1.00 0.00 O ATOM 1376 CB CYS A 86 -8.859 -4.475 2.042 1.00 0.00 C ATOM 1377 SG CYS A 86 -10.630 -4.309 2.371 1.00 0.00 S ATOM 0 H CYS A 86 -9.409 -4.178 4.448 1.00 0.00 H new ATOM 0 HA CYS A 86 -6.957 -4.089 2.961 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.657 -4.144 1.023 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -8.588 -5.529 2.094 1.00 0.00 H new ATOM 0 HG CYS A 86 -10.812 -3.490 3.364 1.00 0.00 H new ATOM 1383 N ILE A 87 -8.968 -1.478 2.946 1.00 0.00 N ATOM 1384 CA ILE A 87 -9.047 -0.062 2.610 1.00 0.00 C ATOM 1385 C ILE A 87 -7.699 0.624 2.798 1.00 0.00 C ATOM 1386 O ILE A 87 -7.048 1.014 1.829 1.00 0.00 O ATOM 1387 CB ILE A 87 -10.103 0.661 3.467 1.00 0.00 C ATOM 1388 CG1 ILE A 87 -11.495 0.093 3.188 1.00 0.00 C ATOM 1389 CG2 ILE A 87 -10.071 2.158 3.194 1.00 0.00 C ATOM 1390 CD1 ILE A 87 -12.511 0.429 4.257 1.00 0.00 C ATOM 0 H ILE A 87 -9.770 -1.834 3.467 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.338 -0.002 1.561 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.870 0.498 4.519 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -11.848 0.474 2.230 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.424 -0.991 3.094 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -10.823 2.656 3.807 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -9.084 2.552 3.439 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.283 2.340 2.140 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.475 -0.006 3.993 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -12.180 0.024 5.213 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.611 1.511 4.336 1.00 0.00 H new ATOM 1402 N GLY A 88 -7.283 0.768 4.053 1.00 0.00 N ATOM 1403 CA GLY A 88 -6.013 1.406 4.345 1.00 0.00 C ATOM 1404 C GLY A 88 -4.902 0.934 3.428 1.00 0.00 C ATOM 1405 O GLY A 88 -4.140 1.743 2.898 1.00 0.00 O ATOM 0 H GLY A 88 -7.803 0.454 4.872 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.123 2.486 4.251 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.737 1.202 5.380 1.00 0.00 H new ATOM 1409 N ARG A 89 -4.809 -0.378 3.240 1.00 0.00 N ATOM 1410 CA ARG A 89 -3.781 -0.957 2.383 1.00 0.00 C ATOM 1411 C ARG A 89 -3.836 -0.350 0.984 1.00 0.00 C ATOM 1412 O ARG A 89 -2.822 0.109 0.455 1.00 0.00 O ATOM 1413 CB ARG A 89 -3.952 -2.474 2.298 1.00 0.00 C ATOM 1414 CG ARG A 89 -3.281 -3.227 3.436 1.00 0.00 C ATOM 1415 CD ARG A 89 -2.949 -4.657 3.039 1.00 0.00 C ATOM 1416 NE ARG A 89 -2.542 -5.463 4.186 1.00 0.00 N ATOM 1417 CZ ARG A 89 -2.055 -6.694 4.084 1.00 0.00 C ATOM 1418 NH1 ARG A 89 -1.913 -7.258 2.892 1.00 0.00 N ATOM 1419 NH2 ARG A 89 -1.707 -7.365 5.175 1.00 0.00 N ATOM 0 H ARG A 89 -5.433 -1.061 3.670 1.00 0.00 H new ATOM 0 HA ARG A 89 -2.809 -0.732 2.822 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -5.016 -2.712 2.294 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.543 -2.825 1.350 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.368 -2.708 3.728 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -3.937 -3.233 4.306 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -3.819 -5.113 2.566 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.150 -4.651 2.298 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.637 -5.058 5.117 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.178 -6.746 2.051 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.539 -8.204 2.817 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.814 -6.935 6.094 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.333 -8.311 5.095 1.00 0.00 H new ATOM 1433 N ILE A 90 -5.025 -0.350 0.390 1.00 0.00 N ATOM 1434 CA ILE A 90 -5.211 0.200 -0.947 1.00 0.00 C ATOM 1435 C ILE A 90 -4.904 1.694 -0.973 1.00 0.00 C ATOM 1436 O ILE A 90 -3.976 2.136 -1.651 1.00 0.00 O ATOM 1437 CB ILE A 90 -6.647 -0.026 -1.454 1.00 0.00 C ATOM 1438 CG1 ILE A 90 -7.043 -1.495 -1.292 1.00 0.00 C ATOM 1439 CG2 ILE A 90 -6.769 0.403 -2.908 1.00 0.00 C ATOM 1440 CD1 ILE A 90 -8.485 -1.776 -1.651 1.00 0.00 C ATOM 0 H ILE A 90 -5.874 -0.725 0.814 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.516 -0.324 -1.604 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.327 0.582 -0.858 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.395 -2.109 -1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -6.869 -1.798 -0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -7.790 0.237 -3.252 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.524 1.461 -2.997 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -6.081 -0.181 -3.519 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -8.694 -2.837 -1.512 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -9.141 -1.189 -1.008 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -8.660 -1.505 -2.692 1.00 0.00 H new ATOM 1452 N HIS A 91 -5.689 2.467 -0.230 1.00 0.00 N ATOM 1453 CA HIS A 91 -5.500 3.912 -0.166 1.00 0.00 C ATOM 1454 C HIS A 91 -4.042 4.257 0.120 1.00 0.00 C ATOM 1455 O HIS A 91 -3.403 4.984 -0.642 1.00 0.00 O ATOM 1456 CB HIS A 91 -6.401 4.519 0.910 1.00 0.00 C ATOM 1457 CG HIS A 91 -6.680 5.976 0.706 1.00 0.00 C ATOM 1458 ND1 HIS A 91 -5.802 6.970 1.084 1.00 0.00 N ATOM 1459 CD2 HIS A 91 -7.746 6.605 0.159 1.00 0.00 C ATOM 1460 CE1 HIS A 91 -6.317 8.148 0.779 1.00 0.00 C ATOM 1461 NE2 HIS A 91 -7.497 7.954 0.217 1.00 0.00 N ATOM 0 H HIS A 91 -6.462 2.117 0.336 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.771 4.332 -1.135 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.346 3.976 0.930 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.933 4.380 1.885 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -4.897 6.819 1.529 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.629 6.134 -0.248 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -5.852 9.106 0.959 1.00 0.00 H new ATOM 1469 N THR A 92 -3.520 3.731 1.224 1.00 0.00 N ATOM 1470 CA THR A 92 -2.138 3.985 1.612 1.00 0.00 C ATOM 1471 C THR A 92 -1.182 3.699 0.460 1.00 0.00 C ATOM 1472 O THR A 92 -0.576 4.613 -0.098 1.00 0.00 O ATOM 1473 CB THR A 92 -1.730 3.130 2.827 1.00 0.00 C ATOM 1474 OG1 THR A 92 -2.558 3.450 3.951 1.00 0.00 O ATOM 1475 CG2 THR A 92 -0.270 3.361 3.185 1.00 0.00 C ATOM 0 H THR A 92 -4.034 3.126 1.865 1.00 0.00 H new ATOM 0 HA THR A 92 -2.074 5.039 1.880 1.00 0.00 H new ATOM 0 HB THR A 92 -1.862 2.080 2.566 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.279 2.790 4.025 1.00 0.00 H new ATOM 0 HG21 THR A 92 -0.005 2.747 4.046 1.00 0.00 H new ATOM 0 HG22 THR A 92 0.360 3.090 2.338 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.117 4.412 3.429 1.00 0.00 H new ATOM 1483 N TYR A 93 -1.052 2.424 0.108 1.00 0.00 N ATOM 1484 CA TYR A 93 -0.167 2.018 -0.977 1.00 0.00 C ATOM 1485 C TYR A 93 -0.180 3.046 -2.104 1.00 0.00 C ATOM 1486 O TYR A 93 0.824 3.709 -2.367 1.00 0.00 O ATOM 1487 CB TYR A 93 -0.583 0.648 -1.516 1.00 0.00 C ATOM 1488 CG TYR A 93 0.116 0.265 -2.801 1.00 0.00 C ATOM 1489 CD1 TYR A 93 1.503 0.223 -2.873 1.00 0.00 C ATOM 1490 CD2 TYR A 93 -0.609 -0.054 -3.942 1.00 0.00 C ATOM 1491 CE1 TYR A 93 2.147 -0.126 -4.045 1.00 0.00 C ATOM 1492 CE2 TYR A 93 0.026 -0.406 -5.117 1.00 0.00 C ATOM 1493 CZ TYR A 93 1.404 -0.440 -5.164 1.00 0.00 C ATOM 1494 OH TYR A 93 2.040 -0.788 -6.333 1.00 0.00 O ATOM 0 H TYR A 93 -1.548 1.655 0.558 1.00 0.00 H new ATOM 0 HA TYR A 93 0.846 1.953 -0.581 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.375 -0.109 -0.760 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.660 0.644 -1.683 1.00 0.00 H new ATOM 0 HD1 TYR A 93 2.088 0.467 -1.998 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -1.688 -0.026 -3.910 1.00 0.00 H new ATOM 0 HE1 TYR A 93 3.226 -0.153 -4.085 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -0.553 -0.653 -5.994 1.00 0.00 H new ATOM 0 HH TYR A 93 2.598 -1.579 -6.179 1.00 0.00 H new ATOM 1504 N LEU A 94 -1.324 3.172 -2.767 1.00 0.00 N ATOM 1505 CA LEU A 94 -1.470 4.120 -3.867 1.00 0.00 C ATOM 1506 C LEU A 94 -0.861 5.471 -3.506 1.00 0.00 C ATOM 1507 O LEU A 94 -0.328 6.171 -4.367 1.00 0.00 O ATOM 1508 CB LEU A 94 -2.948 4.294 -4.224 1.00 0.00 C ATOM 1509 CG LEU A 94 -3.697 3.021 -4.619 1.00 0.00 C ATOM 1510 CD1 LEU A 94 -5.166 3.126 -4.238 1.00 0.00 C ATOM 1511 CD2 LEU A 94 -3.548 2.755 -6.109 1.00 0.00 C ATOM 0 H LEU A 94 -2.164 2.630 -2.563 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.938 3.721 -4.731 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.457 4.741 -3.370 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.021 5.005 -5.047 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.261 2.183 -4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.683 2.211 -4.527 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.253 3.268 -3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.616 3.975 -4.753 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.088 1.845 -6.372 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.957 3.595 -6.671 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.493 2.634 -6.353 1.00 0.00 H new ATOM 1523 N GLU A 95 -0.940 5.828 -2.228 1.00 0.00 N ATOM 1524 CA GLU A 95 -0.394 7.095 -1.755 1.00 0.00 C ATOM 1525 C GLU A 95 1.127 7.031 -1.664 1.00 0.00 C ATOM 1526 O GLU A 95 1.815 8.032 -1.869 1.00 0.00 O ATOM 1527 CB GLU A 95 -0.983 7.450 -0.388 1.00 0.00 C ATOM 1528 CG GLU A 95 -1.020 8.943 -0.110 1.00 0.00 C ATOM 1529 CD GLU A 95 -1.986 9.307 1.001 1.00 0.00 C ATOM 1530 OE1 GLU A 95 -3.089 8.723 1.044 1.00 0.00 O ATOM 1531 OE2 GLU A 95 -1.638 10.176 1.828 1.00 0.00 O ATOM 0 H GLU A 95 -1.376 5.259 -1.503 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.666 7.869 -2.472 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.996 7.052 -0.324 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.397 6.959 0.389 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.020 9.284 0.158 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.304 9.471 -1.020 1.00 0.00 H new ATOM 1538 N LEU A 96 1.647 5.848 -1.355 1.00 0.00 N ATOM 1539 CA LEU A 96 3.088 5.653 -1.236 1.00 0.00 C ATOM 1540 C LEU A 96 3.749 5.625 -2.611 1.00 0.00 C ATOM 1541 O LEU A 96 4.906 6.016 -2.761 1.00 0.00 O ATOM 1542 CB LEU A 96 3.386 4.352 -0.488 1.00 0.00 C ATOM 1543 CG LEU A 96 2.648 4.156 0.837 1.00 0.00 C ATOM 1544 CD1 LEU A 96 2.895 2.759 1.383 1.00 0.00 C ATOM 1545 CD2 LEU A 96 3.078 5.210 1.848 1.00 0.00 C ATOM 0 H LEU A 96 1.092 5.010 -1.182 1.00 0.00 H new ATOM 0 HA LEU A 96 3.498 6.491 -0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.143 3.516 -1.143 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.458 4.305 -0.295 1.00 0.00 H new ATOM 0 HG LEU A 96 1.579 4.270 0.656 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.362 2.637 2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.537 2.020 0.666 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.963 2.617 1.549 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.543 5.055 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.150 5.128 2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.849 6.202 1.459 1.00 0.00 H new ATOM 1557 N ILE A 97 3.005 5.163 -3.610 1.00 0.00 N ATOM 1558 CA ILE A 97 3.518 5.088 -4.972 1.00 0.00 C ATOM 1559 C ILE A 97 3.337 6.414 -5.702 1.00 0.00 C ATOM 1560 O ILE A 97 3.971 6.663 -6.726 1.00 0.00 O ATOM 1561 CB ILE A 97 2.820 3.974 -5.776 1.00 0.00 C ATOM 1562 CG1 ILE A 97 1.304 4.050 -5.585 1.00 0.00 C ATOM 1563 CG2 ILE A 97 3.345 2.609 -5.355 1.00 0.00 C ATOM 1564 CD1 ILE A 97 0.531 3.155 -6.527 1.00 0.00 C ATOM 0 H ILE A 97 2.045 4.835 -3.502 1.00 0.00 H new ATOM 0 HA ILE A 97 4.581 4.860 -4.896 1.00 0.00 H new ATOM 0 HB ILE A 97 3.041 4.116 -6.834 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.061 3.778 -4.558 1.00 0.00 H new ATOM 0 HG13 ILE A 97 0.979 5.081 -5.727 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.843 1.832 -5.932 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.418 2.560 -5.538 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.151 2.456 -4.293 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.537 3.260 -6.335 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.744 3.440 -7.557 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.828 2.118 -6.369 1.00 0.00 H new ATOM 1576 N GLY A 98 2.468 7.265 -5.165 1.00 0.00 N ATOM 1577 CA GLY A 98 2.220 8.558 -5.777 1.00 0.00 C ATOM 1578 C GLY A 98 0.906 8.600 -6.532 1.00 0.00 C ATOM 1579 O GLY A 98 0.310 9.664 -6.694 1.00 0.00 O ATOM 0 H GLY A 98 1.931 7.082 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.216 9.327 -5.005 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.036 8.796 -6.460 1.00 0.00 H new ATOM 1583 N ALA A 99 0.455 7.439 -6.996 1.00 0.00 N ATOM 1584 CA ALA A 99 -0.796 7.348 -7.738 1.00 0.00 C ATOM 1585 C ALA A 99 -1.812 8.365 -7.229 1.00 0.00 C ATOM 1586 O ALA A 99 -2.572 8.940 -8.008 1.00 0.00 O ATOM 1587 CB ALA A 99 -1.364 5.939 -7.643 1.00 0.00 C ATOM 0 H ALA A 99 0.937 6.549 -6.871 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.587 7.575 -8.783 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -2.298 5.885 -8.202 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.650 5.230 -8.061 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -1.551 5.692 -6.598 1.00 0.00 H new ATOM 1593 N ILE A 100 -1.819 8.582 -5.918 1.00 0.00 N ATOM 1594 CA ILE A 100 -2.741 9.530 -5.306 1.00 0.00 C ATOM 1595 C ILE A 100 -2.036 10.385 -4.258 1.00 0.00 C ATOM 1596 O ILE A 100 -1.032 9.972 -3.680 1.00 0.00 O ATOM 1597 CB ILE A 100 -3.933 8.811 -4.648 1.00 0.00 C ATOM 1598 CG1 ILE A 100 -3.437 7.747 -3.667 1.00 0.00 C ATOM 1599 CG2 ILE A 100 -4.826 8.186 -5.710 1.00 0.00 C ATOM 1600 CD1 ILE A 100 -4.394 7.485 -2.525 1.00 0.00 C ATOM 0 H ILE A 100 -1.196 8.114 -5.259 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.111 10.172 -6.106 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.519 9.544 -4.093 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.267 6.816 -4.208 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.475 8.060 -3.260 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.664 7.681 -5.230 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.203 8.965 -6.373 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.251 7.463 -6.289 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.978 6.720 -1.870 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.546 8.404 -1.959 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.349 7.142 -2.922 1.00 0.00 H new ATOM 1612 N ASN A 101 -2.570 11.578 -4.018 1.00 0.00 N ATOM 1613 CA ASN A 101 -1.993 12.491 -3.038 1.00 0.00 C ATOM 1614 C ASN A 101 -0.470 12.397 -3.038 1.00 0.00 C ATOM 1615 O ASN A 101 0.153 12.236 -1.988 1.00 0.00 O ATOM 1616 CB ASN A 101 -2.534 12.181 -1.641 1.00 0.00 C ATOM 1617 CG ASN A 101 -4.024 11.898 -1.647 1.00 0.00 C ATOM 1618 OD1 ASN A 101 -4.733 12.267 -2.584 1.00 0.00 O ATOM 1619 ND2 ASN A 101 -4.506 11.241 -0.599 1.00 0.00 N ATOM 0 H ASN A 101 -3.401 11.935 -4.489 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.277 13.507 -3.313 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -2.005 11.320 -1.233 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.330 13.023 -0.980 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.501 11.023 -0.548 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -3.881 10.955 0.155 1.00 0.00 H new ATOM 1626 N PHE A 102 0.123 12.499 -4.223 1.00 0.00 N ATOM 1627 CA PHE A 102 1.573 12.425 -4.360 1.00 0.00 C ATOM 1628 C PHE A 102 2.249 13.575 -3.618 1.00 0.00 C ATOM 1629 O PHE A 102 1.839 14.729 -3.734 1.00 0.00 O ATOM 1630 CB PHE A 102 1.969 12.455 -5.838 1.00 0.00 C ATOM 1631 CG PHE A 102 3.447 12.599 -6.060 1.00 0.00 C ATOM 1632 CD1 PHE A 102 4.314 11.571 -5.728 1.00 0.00 C ATOM 1633 CD2 PHE A 102 3.970 13.763 -6.601 1.00 0.00 C ATOM 1634 CE1 PHE A 102 5.676 11.700 -5.931 1.00 0.00 C ATOM 1635 CE2 PHE A 102 5.330 13.898 -6.807 1.00 0.00 C ATOM 1636 CZ PHE A 102 6.184 12.866 -6.470 1.00 0.00 C ATOM 0 H PHE A 102 -0.378 12.633 -5.101 1.00 0.00 H new ATOM 0 HA PHE A 102 1.907 11.485 -3.920 1.00 0.00 H new ATOM 0 HB2 PHE A 102 1.626 11.538 -6.317 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.454 13.282 -6.327 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.922 10.658 -5.306 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.307 14.574 -6.865 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.341 10.891 -5.669 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.725 14.810 -7.231 1.00 0.00 H new ATOM 0 HZ PHE A 102 7.247 12.971 -6.628 1.00 0.00 H new ATOM 1646 N GLY A 103 3.287 13.249 -2.854 1.00 0.00 N ATOM 1647 CA GLY A 103 4.003 14.263 -2.103 1.00 0.00 C ATOM 1648 C GLY A 103 3.093 15.370 -1.610 1.00 0.00 C ATOM 1649 O GLY A 103 2.986 16.423 -2.241 1.00 0.00 O ATOM 0 H GLY A 103 3.645 12.300 -2.742 1.00 0.00 H new ATOM 0 HA2 GLY A 103 4.498 13.798 -1.251 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.784 14.692 -2.731 1.00 0.00 H new ATOM 1653 N CYS A 104 2.433 15.133 -0.482 1.00 0.00 N ATOM 1654 CA CYS A 104 1.524 16.118 0.094 1.00 0.00 C ATOM 1655 C CYS A 104 1.950 16.486 1.512 1.00 0.00 C ATOM 1656 O CYS A 104 2.674 15.738 2.167 1.00 0.00 O ATOM 1657 CB CYS A 104 0.093 15.578 0.102 1.00 0.00 C ATOM 1658 SG CYS A 104 -1.178 16.855 -0.053 1.00 0.00 S ATOM 0 H CYS A 104 2.510 14.267 0.052 1.00 0.00 H new ATOM 0 HA CYS A 104 1.562 17.016 -0.522 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.020 14.867 -0.716 1.00 0.00 H new ATOM 0 HB3 CYS A 104 -0.071 15.027 1.028 1.00 0.00 H new ATOM 0 HG CYS A 104 -2.116 16.439 -0.851 1.00 0.00 H new ATOM 1664 N GLU A 105 1.496 17.646 1.978 1.00 0.00 N ATOM 1665 CA GLU A 105 1.832 18.114 3.317 1.00 0.00 C ATOM 1666 C GLU A 105 1.175 17.239 4.380 1.00 0.00 C ATOM 1667 O GLU A 105 1.629 17.189 5.523 1.00 0.00 O ATOM 1668 CB GLU A 105 1.395 19.570 3.497 1.00 0.00 C ATOM 1669 CG GLU A 105 1.541 20.078 4.921 1.00 0.00 C ATOM 1670 CD GLU A 105 2.929 19.841 5.485 1.00 0.00 C ATOM 1671 OE1 GLU A 105 3.908 20.297 4.859 1.00 0.00 O ATOM 1672 OE2 GLU A 105 3.035 19.201 6.551 1.00 0.00 O ATOM 0 H GLU A 105 0.895 18.278 1.448 1.00 0.00 H new ATOM 0 HA GLU A 105 2.914 18.049 3.436 1.00 0.00 H new ATOM 0 HB2 GLU A 105 1.984 20.202 2.833 1.00 0.00 H new ATOM 0 HB3 GLU A 105 0.354 19.668 3.190 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.320 21.145 4.947 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.805 19.584 5.556 1.00 0.00 H new ATOM 1679 N GLN A 106 0.104 16.553 3.995 1.00 0.00 N ATOM 1680 CA GLN A 106 -0.616 15.681 4.916 1.00 0.00 C ATOM 1681 C GLN A 106 -0.517 14.224 4.475 1.00 0.00 C ATOM 1682 O GLN A 106 -1.423 13.429 4.722 1.00 0.00 O ATOM 1683 CB GLN A 106 -2.084 16.101 5.006 1.00 0.00 C ATOM 1684 CG GLN A 106 -2.792 16.130 3.661 1.00 0.00 C ATOM 1685 CD GLN A 106 -3.901 17.163 3.608 1.00 0.00 C ATOM 1686 OE1 GLN A 106 -3.779 18.116 2.691 1.00 0.00 O flip ATOM 1687 NE2 GLN A 106 -4.856 17.105 4.382 1.00 0.00 N flip ATOM 0 H GLN A 106 -0.284 16.584 3.052 1.00 0.00 H new ATOM 0 HA GLN A 106 -0.158 15.775 5.900 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -2.610 15.414 5.669 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -2.143 17.090 5.460 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -2.065 16.342 2.877 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -3.208 15.144 3.452 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.909 16.355 5.071 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -5.594 17.807 4.334 1.00 0.00 H new ATOM 1696 N ALA A 107 0.588 13.882 3.822 1.00 0.00 N ATOM 1697 CA ALA A 107 0.806 12.521 3.348 1.00 0.00 C ATOM 1698 C ALA A 107 1.151 11.587 4.503 1.00 0.00 C ATOM 1699 O ALA A 107 1.734 12.008 5.502 1.00 0.00 O ATOM 1700 CB ALA A 107 1.908 12.497 2.299 1.00 0.00 C ATOM 0 H ALA A 107 1.347 14.529 3.609 1.00 0.00 H new ATOM 0 HA ALA A 107 -0.120 12.168 2.894 1.00 0.00 H new ATOM 0 HB1 ALA A 107 2.060 11.474 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 107 1.621 13.125 1.456 1.00 0.00 H new ATOM 0 HB3 ALA A 107 2.833 12.874 2.735 1.00 0.00 H new ATOM 1706 N VAL A 108 0.787 10.317 4.360 1.00 0.00 N ATOM 1707 CA VAL A 108 1.059 9.322 5.391 1.00 0.00 C ATOM 1708 C VAL A 108 2.559 9.111 5.568 1.00 0.00 C ATOM 1709 O VAL A 108 2.999 8.499 6.542 1.00 0.00 O ATOM 1710 CB VAL A 108 0.397 7.972 5.057 1.00 0.00 C ATOM 1711 CG1 VAL A 108 1.036 7.354 3.823 1.00 0.00 C ATOM 1712 CG2 VAL A 108 0.489 7.027 6.245 1.00 0.00 C ATOM 0 H VAL A 108 0.303 9.952 3.540 1.00 0.00 H new ATOM 0 HA VAL A 108 0.637 9.705 6.320 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.657 8.147 4.841 1.00 0.00 H new ATOM 0 HG11 VAL A 108 0.555 6.401 3.603 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.914 8.027 2.974 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.098 7.191 4.006 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.017 6.078 5.992 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.536 6.856 6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -0.020 7.469 7.102 1.00 0.00 H new ATOM 1722 N TYR A 109 3.339 9.620 4.622 1.00 0.00 N ATOM 1723 CA TYR A 109 4.789 9.486 4.672 1.00 0.00 C ATOM 1724 C TYR A 109 5.447 10.812 5.042 1.00 0.00 C ATOM 1725 O TYR A 109 6.384 10.852 5.838 1.00 0.00 O ATOM 1726 CB TYR A 109 5.324 8.997 3.325 1.00 0.00 C ATOM 1727 CG TYR A 109 4.624 9.614 2.135 1.00 0.00 C ATOM 1728 CD1 TYR A 109 5.078 10.803 1.578 1.00 0.00 C ATOM 1729 CD2 TYR A 109 3.509 9.009 1.569 1.00 0.00 C ATOM 1730 CE1 TYR A 109 4.441 11.371 0.492 1.00 0.00 C ATOM 1731 CE2 TYR A 109 2.867 9.569 0.482 1.00 0.00 C ATOM 1732 CZ TYR A 109 3.337 10.750 -0.053 1.00 0.00 C ATOM 1733 OH TYR A 109 2.699 11.312 -1.136 1.00 0.00 O ATOM 0 H TYR A 109 2.991 10.130 3.810 1.00 0.00 H new ATOM 0 HA TYR A 109 5.034 8.753 5.441 1.00 0.00 H new ATOM 0 HB2 TYR A 109 6.389 9.219 3.264 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.221 7.913 3.275 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.943 11.291 2.001 1.00 0.00 H new ATOM 0 HD2 TYR A 109 3.138 8.085 1.986 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.806 12.297 0.072 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.002 9.085 0.053 1.00 0.00 H new ATOM 0 HH TYR A 109 1.757 11.467 -0.916 1.00 0.00 H new ATOM 1743 N ASN A 110 4.948 11.896 4.457 1.00 0.00 N ATOM 1744 CA ASN A 110 5.486 13.225 4.724 1.00 0.00 C ATOM 1745 C ASN A 110 5.594 13.476 6.225 1.00 0.00 C ATOM 1746 O ASN A 110 6.597 14.004 6.706 1.00 0.00 O ATOM 1747 CB ASN A 110 4.602 14.294 4.079 1.00 0.00 C ATOM 1748 CG ASN A 110 4.983 14.565 2.636 1.00 0.00 C ATOM 1749 OD1 ASN A 110 5.144 15.839 2.296 1.00 0.00 O flip ATOM 1750 ND2 ASN A 110 5.130 13.640 1.838 1.00 0.00 N flip ATOM 0 H ASN A 110 4.172 11.880 3.795 1.00 0.00 H new ATOM 0 HA ASN A 110 6.485 13.280 4.292 1.00 0.00 H new ATOM 0 HB2 ASN A 110 3.560 13.976 4.123 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.678 15.218 4.652 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.996 12.676 2.144 1.00 0.00 H new ATOM 0 HD22 ASN A 110 5.386 13.837 0.870 1.00 0.00 H new ATOM 1757 N ARG A 111 4.555 13.093 6.960 1.00 0.00 N ATOM 1758 CA ARG A 111 4.533 13.278 8.406 1.00 0.00 C ATOM 1759 C ARG A 111 5.096 12.052 9.119 1.00 0.00 C ATOM 1760 O ARG A 111 4.762 11.785 10.274 1.00 0.00 O ATOM 1761 CB ARG A 111 3.106 13.549 8.886 1.00 0.00 C ATOM 1762 CG ARG A 111 2.180 12.351 8.750 1.00 0.00 C ATOM 1763 CD ARG A 111 0.722 12.752 8.916 1.00 0.00 C ATOM 1764 NE ARG A 111 0.427 13.189 10.278 1.00 0.00 N ATOM 1765 CZ ARG A 111 -0.716 13.764 10.634 1.00 0.00 C ATOM 1766 NH1 ARG A 111 -1.667 13.970 9.733 1.00 0.00 N ATOM 1767 NH2 ARG A 111 -0.911 14.134 11.894 1.00 0.00 N ATOM 0 H ARG A 111 3.718 12.653 6.578 1.00 0.00 H new ATOM 0 HA ARG A 111 5.159 14.137 8.646 1.00 0.00 H new ATOM 0 HB2 ARG A 111 3.136 13.858 9.931 1.00 0.00 H new ATOM 0 HB3 ARG A 111 2.693 14.383 8.319 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.322 11.889 7.773 1.00 0.00 H new ATOM 0 HG3 ARG A 111 2.440 11.602 9.498 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.485 13.555 8.218 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.082 11.908 8.659 1.00 0.00 H new ATOM 0 HE ARG A 111 1.138 13.045 10.995 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.522 13.687 8.764 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -2.544 14.412 10.009 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -0.182 13.977 12.590 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -1.789 14.576 12.166 1.00 0.00 H new TER 1781 ARG A 111