USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 802 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 ASN : amide:sc= -2.77 K(o=-2.8,f=-9.2!) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 52 SER OG : rot 180:sc= -0.286 USER MOD Set 2.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -119:sc= 0.303 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 108:sc= 0.0522 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ -146:sc= -6.79! (180deg=-11.5!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -0.307 K(o=-0.31,f=-0.95) USER MOD Single : A 37 ASN : amide:sc= -2.53 K(o=-2.5,f=-8.3!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.00171 USER MOD Single : A 49 SER OG : rot 4:sc= 0.494! USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HE2:sc= -3.09 K(o=-3.1,f=-9!) USER MOD Single : A 87 GLN :FLIP amide:sc= -9.17! C(o=-13!,f=-9.2!) USER MOD Single : A 91 SER OG : rot -78:sc= 0.363 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.882 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.058 18.488 -7.479 1.00 0.00 N ATOM 2 CA GLY A 1 -8.729 18.926 -7.865 1.00 0.00 C ATOM 3 C GLY A 1 -7.647 18.347 -6.976 1.00 0.00 C ATOM 4 O GLY A 1 -7.762 18.370 -5.750 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.762 18.911 -8.117 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.113 17.451 -7.541 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.252 18.787 -6.502 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.540 18.635 -8.898 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.683 20.014 -7.826 1.00 0.00 H new ATOM 8 N SER A 2 -6.592 17.825 -7.594 1.00 0.00 N ATOM 9 CA SER A 2 -5.487 17.232 -6.850 1.00 0.00 C ATOM 10 C SER A 2 -4.420 18.277 -6.537 1.00 0.00 C ATOM 11 O SER A 2 -4.078 18.502 -5.376 1.00 0.00 O ATOM 12 CB SER A 2 -4.870 16.080 -7.645 1.00 0.00 C ATOM 13 OG SER A 2 -5.793 15.017 -7.803 1.00 0.00 O ATOM 0 H SER A 2 -6.479 17.801 -8.607 1.00 0.00 H new ATOM 0 HA SER A 2 -5.880 16.846 -5.909 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.553 16.439 -8.624 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.978 15.718 -7.134 1.00 0.00 H new ATOM 0 HG SER A 2 -5.437 14.209 -7.379 1.00 0.00 H new ATOM 19 N SER A 3 -3.899 18.914 -7.581 1.00 0.00 N ATOM 20 CA SER A 3 -2.869 19.933 -7.420 1.00 0.00 C ATOM 21 C SER A 3 -3.303 20.988 -6.407 1.00 0.00 C ATOM 22 O SER A 3 -4.424 21.492 -6.461 1.00 0.00 O ATOM 23 CB SER A 3 -2.562 20.595 -8.764 1.00 0.00 C ATOM 24 OG SER A 3 -1.617 19.838 -9.501 1.00 0.00 O ATOM 0 H SER A 3 -4.174 18.742 -8.548 1.00 0.00 H new ATOM 0 HA SER A 3 -1.967 19.447 -7.049 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.481 20.697 -9.341 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.177 21.601 -8.598 1.00 0.00 H new ATOM 0 HG SER A 3 -1.439 20.281 -10.357 1.00 0.00 H new ATOM 30 N GLY A 4 -2.405 21.318 -5.484 1.00 0.00 N ATOM 31 CA GLY A 4 -2.713 22.312 -4.471 1.00 0.00 C ATOM 32 C GLY A 4 -4.131 22.189 -3.950 1.00 0.00 C ATOM 33 O GLY A 4 -4.830 23.189 -3.790 1.00 0.00 O ATOM 0 H GLY A 4 -1.470 20.915 -5.419 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.014 22.209 -3.641 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.568 23.308 -4.888 1.00 0.00 H new ATOM 37 N SER A 5 -4.558 20.958 -3.687 1.00 0.00 N ATOM 38 CA SER A 5 -5.905 20.706 -3.186 1.00 0.00 C ATOM 39 C SER A 5 -6.066 21.245 -1.768 1.00 0.00 C ATOM 40 O SER A 5 -5.119 21.249 -0.982 1.00 0.00 O ATOM 41 CB SER A 5 -6.210 19.208 -3.213 1.00 0.00 C ATOM 42 OG SER A 5 -7.527 18.947 -2.758 1.00 0.00 O ATOM 0 H SER A 5 -3.991 20.119 -3.812 1.00 0.00 H new ATOM 0 HA SER A 5 -6.611 21.224 -3.835 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.090 18.828 -4.227 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.494 18.676 -2.587 1.00 0.00 H new ATOM 0 HG SER A 5 -8.090 18.689 -3.517 1.00 0.00 H new ATOM 48 N SER A 6 -7.273 21.699 -1.448 1.00 0.00 N ATOM 49 CA SER A 6 -7.560 22.244 -0.126 1.00 0.00 C ATOM 50 C SER A 6 -8.333 21.237 0.721 1.00 0.00 C ATOM 51 O SER A 6 -9.496 20.944 0.449 1.00 0.00 O ATOM 52 CB SER A 6 -8.357 23.544 -0.248 1.00 0.00 C ATOM 53 OG SER A 6 -7.547 24.595 -0.744 1.00 0.00 O ATOM 0 H SER A 6 -8.069 21.700 -2.086 1.00 0.00 H new ATOM 0 HA SER A 6 -6.611 22.454 0.367 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.207 23.392 -0.913 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.760 23.820 0.727 1.00 0.00 H new ATOM 0 HG SER A 6 -8.081 25.414 -0.814 1.00 0.00 H new ATOM 59 N GLY A 7 -7.676 20.711 1.750 1.00 0.00 N ATOM 60 CA GLY A 7 -8.315 19.743 2.622 1.00 0.00 C ATOM 61 C GLY A 7 -7.316 18.839 3.316 1.00 0.00 C ATOM 62 O GLY A 7 -6.112 18.900 3.065 1.00 0.00 O ATOM 0 H GLY A 7 -6.712 20.938 1.995 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.906 20.269 3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.007 19.135 2.039 1.00 0.00 H new ATOM 66 N PRO A 8 -7.817 17.976 4.213 1.00 0.00 N ATOM 67 CA PRO A 8 -6.976 17.040 4.966 1.00 0.00 C ATOM 68 C PRO A 8 -6.401 15.939 4.082 1.00 0.00 C ATOM 69 O PRO A 8 -7.069 15.447 3.173 1.00 0.00 O ATOM 70 CB PRO A 8 -7.939 16.449 5.998 1.00 0.00 C ATOM 71 CG PRO A 8 -9.288 16.588 5.380 1.00 0.00 C ATOM 72 CD PRO A 8 -9.241 17.849 4.562 1.00 0.00 C ATOM 0 HA PRO A 8 -6.109 17.533 5.406 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -7.704 15.405 6.206 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.881 16.984 6.946 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -9.522 15.726 4.755 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -10.063 16.647 6.144 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -9.868 17.775 3.673 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.594 18.710 5.130 1.00 0.00 H new ATOM 80 N GLY A 9 -5.158 15.555 4.355 1.00 0.00 N ATOM 81 CA GLY A 9 -4.514 14.514 3.576 1.00 0.00 C ATOM 82 C GLY A 9 -3.005 14.535 3.713 1.00 0.00 C ATOM 83 O GLY A 9 -2.380 13.498 3.939 1.00 0.00 O ATOM 0 H GLY A 9 -4.585 15.947 5.102 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.891 13.542 3.893 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.782 14.632 2.526 1.00 0.00 H new ATOM 87 N LEU A 10 -2.417 15.718 3.577 1.00 0.00 N ATOM 88 CA LEU A 10 -0.970 15.871 3.686 1.00 0.00 C ATOM 89 C LEU A 10 -0.546 16.014 5.144 1.00 0.00 C ATOM 90 O LEU A 10 0.426 16.703 5.453 1.00 0.00 O ATOM 91 CB LEU A 10 -0.504 17.088 2.885 1.00 0.00 C ATOM 92 CG LEU A 10 -1.329 18.363 3.062 1.00 0.00 C ATOM 93 CD1 LEU A 10 -2.520 18.363 2.117 1.00 0.00 C ATOM 94 CD2 LEU A 10 -1.790 18.505 4.505 1.00 0.00 C ATOM 0 H LEU A 10 -2.920 16.586 3.391 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.503 14.975 3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.528 17.306 3.160 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.503 16.823 1.828 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.698 19.218 2.818 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.096 19.278 2.257 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.167 18.310 1.087 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.152 17.501 2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.376 19.418 4.612 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.404 17.646 4.777 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.921 18.552 5.162 1.00 0.00 H new ATOM 106 N ARG A 11 -1.281 15.357 6.036 1.00 0.00 N ATOM 107 CA ARG A 11 -0.980 15.411 7.461 1.00 0.00 C ATOM 108 C ARG A 11 -0.209 14.169 7.902 1.00 0.00 C ATOM 109 O ARG A 11 -0.363 13.094 7.323 1.00 0.00 O ATOM 110 CB ARG A 11 -2.271 15.536 8.272 1.00 0.00 C ATOM 111 CG ARG A 11 -2.915 16.910 8.183 1.00 0.00 C ATOM 112 CD ARG A 11 -4.259 16.942 8.894 1.00 0.00 C ATOM 113 NE ARG A 11 -4.570 18.270 9.417 1.00 0.00 N ATOM 114 CZ ARG A 11 -5.449 18.490 10.388 1.00 0.00 C ATOM 115 NH1 ARG A 11 -6.100 17.475 10.940 1.00 0.00 N ATOM 116 NH2 ARG A 11 -5.677 19.727 10.810 1.00 0.00 N ATOM 0 H ARG A 11 -2.089 14.782 5.797 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.358 16.288 7.642 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -2.983 14.787 7.924 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -2.057 15.311 9.317 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.251 17.654 8.624 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.049 17.183 7.136 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -5.042 16.632 8.202 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -4.253 16.222 9.713 1.00 0.00 H new ATOM 0 HE ARG A 11 -4.086 19.072 9.014 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -5.926 16.523 10.619 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -6.775 17.647 11.686 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -5.177 20.510 10.389 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -6.352 19.895 11.556 1.00 0.00 H new ATOM 130 N GLU A 12 0.621 14.327 8.928 1.00 0.00 N ATOM 131 CA GLU A 12 1.416 13.220 9.444 1.00 0.00 C ATOM 132 C GLU A 12 0.519 12.092 9.945 1.00 0.00 C ATOM 133 O GLU A 12 -0.211 12.253 10.924 1.00 0.00 O ATOM 134 CB GLU A 12 2.329 13.701 10.574 1.00 0.00 C ATOM 135 CG GLU A 12 3.481 12.755 10.870 1.00 0.00 C ATOM 136 CD GLU A 12 4.432 13.304 11.915 1.00 0.00 C ATOM 137 OE1 GLU A 12 5.153 14.277 11.610 1.00 0.00 O ATOM 138 OE2 GLU A 12 4.456 12.761 13.040 1.00 0.00 O ATOM 0 H GLU A 12 0.760 15.211 9.418 1.00 0.00 H new ATOM 0 HA GLU A 12 2.030 12.837 8.629 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.732 14.680 10.313 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.735 13.832 11.479 1.00 0.00 H new ATOM 0 HG2 GLU A 12 3.083 11.800 11.212 1.00 0.00 H new ATOM 0 HG3 GLU A 12 4.032 12.560 9.950 1.00 0.00 H new ATOM 145 N LEU A 13 0.577 10.951 9.267 1.00 0.00 N ATOM 146 CA LEU A 13 -0.231 9.796 9.642 1.00 0.00 C ATOM 147 C LEU A 13 0.654 8.620 10.044 1.00 0.00 C ATOM 148 O LEU A 13 1.863 8.631 9.808 1.00 0.00 O ATOM 149 CB LEU A 13 -1.143 9.389 8.484 1.00 0.00 C ATOM 150 CG LEU A 13 -2.466 10.150 8.373 1.00 0.00 C ATOM 151 CD1 LEU A 13 -3.003 10.082 6.952 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.484 9.594 9.357 1.00 0.00 C ATOM 0 H LEU A 13 1.175 10.801 8.455 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.844 10.076 10.499 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.593 9.518 7.552 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.365 8.326 8.579 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.284 11.196 8.621 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.944 10.629 6.892 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.280 10.528 6.268 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.170 9.041 6.676 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.419 10.147 9.265 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.662 8.541 9.140 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.101 9.696 10.373 1.00 0.00 H new ATOM 164 N CYS A 14 0.045 7.607 10.649 1.00 0.00 N ATOM 165 CA CYS A 14 0.777 6.423 11.082 1.00 0.00 C ATOM 166 C CYS A 14 -0.090 5.173 10.962 1.00 0.00 C ATOM 167 O CYS A 14 -1.318 5.259 10.924 1.00 0.00 O ATOM 168 CB CYS A 14 1.252 6.591 12.526 1.00 0.00 C ATOM 169 SG CYS A 14 -0.073 6.951 13.702 1.00 0.00 S ATOM 0 H CYS A 14 -0.955 7.582 10.851 1.00 0.00 H new ATOM 0 HA CYS A 14 1.645 6.306 10.433 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.762 5.680 12.838 1.00 0.00 H new ATOM 0 HB3 CYS A 14 1.986 7.396 12.564 1.00 0.00 H new ATOM 0 HG CYS A 14 0.428 7.073 14.896 1.00 0.00 H new ATOM 175 N ILE A 15 0.557 4.014 10.902 1.00 0.00 N ATOM 176 CA ILE A 15 -0.155 2.748 10.785 1.00 0.00 C ATOM 177 C ILE A 15 0.261 1.780 11.887 1.00 0.00 C ATOM 178 O ILE A 15 1.357 1.221 11.854 1.00 0.00 O ATOM 179 CB ILE A 15 0.092 2.087 9.416 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.376 3.009 8.288 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.620 0.744 9.340 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.345 2.358 6.923 1.00 0.00 C ATOM 0 H ILE A 15 1.573 3.926 10.932 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.217 2.973 10.884 1.00 0.00 H new ATOM 0 HB ILE A 15 1.162 1.916 9.299 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.392 3.342 8.500 1.00 0.00 H new ATOM 0 HG13 ILE A 15 0.254 3.898 8.272 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.436 0.289 8.367 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.243 0.088 10.124 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.691 0.892 9.475 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.690 3.070 6.173 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.674 2.050 6.690 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.997 1.485 6.921 1.00 0.00 H new ATOM 194 N GLN A 16 -0.622 1.585 12.861 1.00 0.00 N ATOM 195 CA GLN A 16 -0.346 0.682 13.973 1.00 0.00 C ATOM 196 C GLN A 16 -0.615 -0.766 13.578 1.00 0.00 C ATOM 197 O GLN A 16 -1.767 -1.179 13.438 1.00 0.00 O ATOM 198 CB GLN A 16 -1.197 1.059 15.186 1.00 0.00 C ATOM 199 CG GLN A 16 -0.505 2.019 16.141 1.00 0.00 C ATOM 200 CD GLN A 16 -1.485 2.840 16.955 1.00 0.00 C ATOM 201 OE1 GLN A 16 -1.894 2.438 18.045 1.00 0.00 O ATOM 202 NE2 GLN A 16 -1.867 3.999 16.430 1.00 0.00 N ATOM 0 H GLN A 16 -1.534 2.040 12.903 1.00 0.00 H new ATOM 0 HA GLN A 16 0.708 0.778 14.234 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.127 1.511 14.841 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.465 0.152 15.727 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.138 1.454 16.816 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.140 2.689 15.573 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.503 4.293 15.524 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.524 4.595 16.933 1.00 0.00 H new ATOM 211 N LYS A 17 0.454 -1.534 13.399 1.00 0.00 N ATOM 212 CA LYS A 17 0.335 -2.937 13.021 1.00 0.00 C ATOM 213 C LYS A 17 0.945 -3.841 14.087 1.00 0.00 C ATOM 214 O LYS A 17 1.569 -3.365 15.035 1.00 0.00 O ATOM 215 CB LYS A 17 1.019 -3.184 11.675 1.00 0.00 C ATOM 216 CG LYS A 17 2.506 -3.468 11.791 1.00 0.00 C ATOM 217 CD LYS A 17 3.258 -3.022 10.548 1.00 0.00 C ATOM 218 CE LYS A 17 3.406 -1.509 10.498 1.00 0.00 C ATOM 219 NZ LYS A 17 2.219 -0.856 9.882 1.00 0.00 N ATOM 0 H LYS A 17 1.414 -1.208 13.510 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.725 -3.175 12.931 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.535 -4.026 11.180 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.873 -2.312 11.037 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.908 -2.955 12.664 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.662 -4.535 11.948 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.244 -3.486 10.532 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.730 -3.366 9.659 1.00 0.00 H new ATOM 0 HE2 LYS A 17 3.549 -1.125 11.508 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.299 -1.250 9.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 2.522 -0.015 9.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.752 -1.524 9.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 1.553 -0.572 10.628 1.00 0.00 H new ATOM 233 N ALA A 18 0.763 -5.148 13.924 1.00 0.00 N ATOM 234 CA ALA A 18 1.299 -6.118 14.870 1.00 0.00 C ATOM 235 C ALA A 18 2.773 -5.851 15.154 1.00 0.00 C ATOM 236 O ALA A 18 3.444 -5.109 14.437 1.00 0.00 O ATOM 237 CB ALA A 18 1.109 -7.532 14.341 1.00 0.00 C ATOM 0 H ALA A 18 0.248 -5.559 13.145 1.00 0.00 H new ATOM 0 HA ALA A 18 0.751 -6.016 15.807 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.514 -8.246 15.058 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.046 -7.726 14.196 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.630 -7.638 13.390 1.00 0.00 H new ATOM 243 N PRO A 19 3.292 -6.470 16.225 1.00 0.00 N ATOM 244 CA PRO A 19 4.693 -6.314 16.628 1.00 0.00 C ATOM 245 C PRO A 19 5.654 -6.985 15.654 1.00 0.00 C ATOM 246 O PRO A 19 6.867 -6.977 15.859 1.00 0.00 O ATOM 247 CB PRO A 19 4.748 -7.004 17.994 1.00 0.00 C ATOM 248 CG PRO A 19 3.632 -7.991 17.964 1.00 0.00 C ATOM 249 CD PRO A 19 2.551 -7.369 17.125 1.00 0.00 C ATOM 0 HA PRO A 19 4.996 -5.267 16.651 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.708 -7.496 18.151 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.621 -6.287 18.805 1.00 0.00 H new ATOM 0 HG2 PRO A 19 3.961 -8.939 17.537 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.271 -8.203 18.971 1.00 0.00 H new ATOM 0 HD2 PRO A 19 1.991 -8.121 16.570 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.832 -6.823 17.736 1.00 0.00 H new ATOM 257 N GLY A 20 5.104 -7.564 14.590 1.00 0.00 N ATOM 258 CA GLY A 20 5.929 -8.230 13.599 1.00 0.00 C ATOM 259 C GLY A 20 5.157 -8.578 12.342 1.00 0.00 C ATOM 260 O GLY A 20 5.441 -9.582 11.690 1.00 0.00 O ATOM 0 H GLY A 20 4.103 -7.583 14.397 1.00 0.00 H new ATOM 0 HA2 GLY A 20 6.770 -7.587 13.339 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.345 -9.141 14.030 1.00 0.00 H new ATOM 264 N GLU A 21 4.176 -7.747 12.002 1.00 0.00 N ATOM 265 CA GLU A 21 3.360 -7.974 10.816 1.00 0.00 C ATOM 266 C GLU A 21 3.862 -7.138 9.642 1.00 0.00 C ATOM 267 O GLU A 21 4.468 -6.083 9.831 1.00 0.00 O ATOM 268 CB GLU A 21 1.895 -7.638 11.106 1.00 0.00 C ATOM 269 CG GLU A 21 0.963 -7.928 9.942 1.00 0.00 C ATOM 270 CD GLU A 21 0.986 -9.386 9.525 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.090 -10.256 10.414 1.00 0.00 O ATOM 272 OE2 GLU A 21 0.900 -9.656 8.308 1.00 0.00 O ATOM 0 H GLU A 21 3.928 -6.911 12.531 1.00 0.00 H new ATOM 0 HA GLU A 21 3.438 -9.028 10.549 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.565 -8.207 11.975 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.818 -6.583 11.368 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.054 -7.649 10.218 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.245 -7.306 9.092 1.00 0.00 H new ATOM 279 N ARG A 22 3.606 -7.618 8.429 1.00 0.00 N ATOM 280 CA ARG A 22 4.032 -6.917 7.224 1.00 0.00 C ATOM 281 C ARG A 22 2.949 -5.957 6.741 1.00 0.00 C ATOM 282 O ARG A 22 1.802 -6.355 6.529 1.00 0.00 O ATOM 283 CB ARG A 22 4.372 -7.919 6.119 1.00 0.00 C ATOM 284 CG ARG A 22 3.426 -9.107 6.063 1.00 0.00 C ATOM 285 CD ARG A 22 3.890 -10.232 6.975 1.00 0.00 C ATOM 286 NE ARG A 22 4.788 -11.157 6.289 1.00 0.00 N ATOM 287 CZ ARG A 22 5.452 -12.129 6.905 1.00 0.00 C ATOM 288 NH1 ARG A 22 5.319 -12.302 8.213 1.00 0.00 N ATOM 289 NH2 ARG A 22 6.251 -12.931 6.212 1.00 0.00 N ATOM 0 H ARG A 22 3.106 -8.490 8.255 1.00 0.00 H new ATOM 0 HA ARG A 22 4.923 -6.338 7.466 1.00 0.00 H new ATOM 0 HB2 ARG A 22 4.355 -7.406 5.157 1.00 0.00 H new ATOM 0 HB3 ARG A 22 5.389 -8.282 6.269 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.425 -8.790 6.355 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.359 -9.472 5.038 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.398 -9.810 7.842 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.023 -10.778 7.348 1.00 0.00 H new ATOM 0 HE ARG A 22 4.912 -11.051 5.282 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.706 -11.688 8.749 1.00 0.00 H new ATOM 0 HH12 ARG A 22 5.830 -13.049 8.683 1.00 0.00 H new ATOM 0 HH21 ARG A 22 6.356 -12.801 5.206 1.00 0.00 H new ATOM 0 HH22 ARG A 22 6.760 -13.677 6.686 1.00 0.00 H new ATOM 303 N LEU A 23 3.319 -4.693 6.569 1.00 0.00 N ATOM 304 CA LEU A 23 2.379 -3.676 6.111 1.00 0.00 C ATOM 305 C LEU A 23 1.423 -4.248 5.069 1.00 0.00 C ATOM 306 O LEU A 23 0.206 -4.131 5.199 1.00 0.00 O ATOM 307 CB LEU A 23 3.135 -2.482 5.526 1.00 0.00 C ATOM 308 CG LEU A 23 2.460 -1.119 5.682 1.00 0.00 C ATOM 309 CD1 LEU A 23 0.979 -1.215 5.350 1.00 0.00 C ATOM 310 CD2 LEU A 23 2.659 -0.584 7.093 1.00 0.00 C ATOM 0 H LEU A 23 4.263 -4.348 6.740 1.00 0.00 H new ATOM 0 HA LEU A 23 1.795 -3.343 6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.118 -2.434 5.995 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.297 -2.665 4.464 1.00 0.00 H new ATOM 0 HG LEU A 23 2.923 -0.423 4.982 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.516 -0.235 5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.858 -1.553 4.321 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.500 -1.925 6.024 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.172 0.387 7.186 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.223 -1.279 7.811 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.725 -0.476 7.294 1.00 0.00 H new ATOM 322 N GLY A 24 1.985 -4.868 4.036 1.00 0.00 N ATOM 323 CA GLY A 24 1.168 -5.451 2.987 1.00 0.00 C ATOM 324 C GLY A 24 0.670 -4.416 1.998 1.00 0.00 C ATOM 325 O GLY A 24 -0.482 -4.464 1.566 1.00 0.00 O ATOM 0 H GLY A 24 2.991 -4.977 3.907 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.748 -6.207 2.457 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.315 -5.960 3.436 1.00 0.00 H new ATOM 329 N ILE A 25 1.539 -3.477 1.638 1.00 0.00 N ATOM 330 CA ILE A 25 1.180 -2.426 0.694 1.00 0.00 C ATOM 331 C ILE A 25 2.098 -2.445 -0.524 1.00 0.00 C ATOM 332 O ILE A 25 3.216 -2.956 -0.464 1.00 0.00 O ATOM 333 CB ILE A 25 1.245 -1.034 1.350 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.510 -0.905 2.200 1.00 0.00 C ATOM 335 CG2 ILE A 25 0.004 -0.789 2.195 1.00 0.00 C ATOM 336 CD1 ILE A 25 2.850 0.523 2.565 1.00 0.00 C ATOM 0 H ILE A 25 2.496 -3.423 1.986 1.00 0.00 H new ATOM 0 HA ILE A 25 0.156 -2.622 0.378 1.00 0.00 H new ATOM 0 HB ILE A 25 1.280 -0.279 0.564 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.384 -1.485 3.114 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.348 -1.342 1.658 1.00 0.00 H new ATOM 0 HG21 ILE A 25 0.064 0.199 2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.883 -0.843 1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.060 -1.547 2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.758 0.538 3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.008 1.103 1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.029 0.958 3.135 1.00 0.00 H new ATOM 348 N SER A 26 1.617 -1.883 -1.629 1.00 0.00 N ATOM 349 CA SER A 26 2.394 -1.837 -2.862 1.00 0.00 C ATOM 350 C SER A 26 2.582 -0.398 -3.332 1.00 0.00 C ATOM 351 O SER A 26 1.690 0.437 -3.182 1.00 0.00 O ATOM 352 CB SER A 26 1.703 -2.655 -3.955 1.00 0.00 C ATOM 353 OG SER A 26 2.155 -3.998 -3.949 1.00 0.00 O ATOM 0 H SER A 26 0.694 -1.454 -1.695 1.00 0.00 H new ATOM 0 HA SER A 26 3.375 -2.267 -2.661 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.624 -2.631 -3.805 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.899 -2.206 -4.929 1.00 0.00 H new ATOM 0 HG SER A 26 1.697 -4.500 -4.655 1.00 0.00 H new ATOM 359 N ILE A 27 3.750 -0.116 -3.900 1.00 0.00 N ATOM 360 CA ILE A 27 4.056 1.221 -4.392 1.00 0.00 C ATOM 361 C ILE A 27 4.720 1.163 -5.764 1.00 0.00 C ATOM 362 O ILE A 27 5.429 0.209 -6.082 1.00 0.00 O ATOM 363 CB ILE A 27 4.977 1.982 -3.421 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.389 1.392 -3.455 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.412 1.936 -2.009 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.380 2.147 -2.596 1.00 0.00 C ATOM 0 H ILE A 27 4.499 -0.796 -4.031 1.00 0.00 H new ATOM 0 HA ILE A 27 3.108 1.752 -4.471 1.00 0.00 H new ATOM 0 HB ILE A 27 5.031 3.024 -3.736 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.349 0.355 -3.123 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.746 1.383 -4.485 1.00 0.00 H new ATOM 0 HG21 ILE A 27 5.074 2.478 -1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.425 2.398 -1.997 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.332 0.899 -1.683 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.359 1.673 -2.668 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.449 3.178 -2.942 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.046 2.134 -1.558 1.00 0.00 H new ATOM 378 N ARG A 28 4.486 2.192 -6.573 1.00 0.00 N ATOM 379 CA ARG A 28 5.061 2.259 -7.910 1.00 0.00 C ATOM 380 C ARG A 28 5.767 3.593 -8.133 1.00 0.00 C ATOM 381 O ARG A 28 5.241 4.650 -7.789 1.00 0.00 O ATOM 382 CB ARG A 28 3.973 2.063 -8.967 1.00 0.00 C ATOM 383 CG ARG A 28 2.950 3.187 -9.004 1.00 0.00 C ATOM 384 CD ARG A 28 2.010 3.047 -10.191 1.00 0.00 C ATOM 385 NE ARG A 28 0.706 3.651 -9.931 1.00 0.00 N ATOM 386 CZ ARG A 28 -0.374 3.413 -10.667 1.00 0.00 C ATOM 387 NH1 ARG A 28 -0.306 2.587 -11.702 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.525 4.001 -10.367 1.00 0.00 N ATOM 0 H ARG A 28 3.902 2.990 -6.325 1.00 0.00 H new ATOM 0 HA ARG A 28 5.796 1.459 -8.002 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.442 1.977 -9.947 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.459 1.121 -8.776 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.373 3.185 -8.079 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.464 4.147 -9.057 1.00 0.00 H new ATOM 0 HD2 ARG A 28 2.459 3.517 -11.066 1.00 0.00 H new ATOM 0 HD3 ARG A 28 1.880 1.991 -10.428 1.00 0.00 H new ATOM 0 HE ARG A 28 0.620 4.291 -9.141 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.577 2.133 -11.935 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.137 2.406 -12.265 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.581 4.636 -9.571 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.354 3.818 -10.933 1.00 0.00 H new ATOM 402 N GLY A 29 6.964 3.535 -8.710 1.00 0.00 N ATOM 403 CA GLY A 29 7.722 4.745 -8.967 1.00 0.00 C ATOM 404 C GLY A 29 9.202 4.572 -8.687 1.00 0.00 C ATOM 405 O GLY A 29 9.779 3.526 -8.983 1.00 0.00 O ATOM 0 H GLY A 29 7.422 2.672 -9.004 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.584 5.042 -10.007 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.331 5.553 -8.350 1.00 0.00 H new ATOM 409 N GLY A 30 9.819 5.602 -8.116 1.00 0.00 N ATOM 410 CA GLY A 30 11.236 5.539 -7.807 1.00 0.00 C ATOM 411 C GLY A 30 12.052 6.516 -8.630 1.00 0.00 C ATOM 412 O GLY A 30 11.852 6.640 -9.838 1.00 0.00 O ATOM 0 H GLY A 30 9.363 6.479 -7.862 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.384 5.749 -6.748 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.599 4.527 -7.985 1.00 0.00 H new ATOM 416 N ALA A 31 12.974 7.213 -7.974 1.00 0.00 N ATOM 417 CA ALA A 31 13.824 8.184 -8.653 1.00 0.00 C ATOM 418 C ALA A 31 14.679 7.513 -9.723 1.00 0.00 C ATOM 419 O ALA A 31 15.548 6.697 -9.414 1.00 0.00 O ATOM 420 CB ALA A 31 14.706 8.908 -7.647 1.00 0.00 C ATOM 0 H ALA A 31 13.151 7.124 -6.974 1.00 0.00 H new ATOM 0 HA ALA A 31 13.179 8.912 -9.145 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.335 9.630 -8.168 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.080 9.429 -6.923 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.336 8.185 -7.129 1.00 0.00 H new ATOM 426 N ARG A 32 14.426 7.860 -10.980 1.00 0.00 N ATOM 427 CA ARG A 32 15.172 7.289 -12.095 1.00 0.00 C ATOM 428 C ARG A 32 14.924 5.787 -12.203 1.00 0.00 C ATOM 429 O ARG A 32 15.757 5.045 -12.720 1.00 0.00 O ATOM 430 CB ARG A 32 16.668 7.559 -11.927 1.00 0.00 C ATOM 431 CG ARG A 32 17.025 9.036 -11.924 1.00 0.00 C ATOM 432 CD ARG A 32 17.021 9.613 -13.331 1.00 0.00 C ATOM 433 NE ARG A 32 18.157 9.140 -14.119 1.00 0.00 N ATOM 434 CZ ARG A 32 18.556 9.713 -15.249 1.00 0.00 C ATOM 435 NH1 ARG A 32 17.916 10.774 -15.721 1.00 0.00 N ATOM 436 NH2 ARG A 32 19.599 9.225 -15.909 1.00 0.00 N ATOM 0 H ARG A 32 13.710 8.534 -11.252 1.00 0.00 H new ATOM 0 HA ARG A 32 14.825 7.764 -13.013 1.00 0.00 H new ATOM 0 HB2 ARG A 32 17.007 7.110 -10.993 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.210 7.065 -12.733 1.00 0.00 H new ATOM 0 HG2 ARG A 32 16.314 9.582 -11.304 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.009 9.173 -11.476 1.00 0.00 H new ATOM 0 HD2 ARG A 32 16.093 9.339 -13.833 1.00 0.00 H new ATOM 0 HD3 ARG A 32 17.045 10.701 -13.277 1.00 0.00 H new ATOM 0 HE ARG A 32 18.671 8.326 -13.783 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.115 11.153 -15.216 1.00 0.00 H new ATOM 0 HH12 ARG A 32 18.225 11.212 -16.589 1.00 0.00 H new ATOM 0 HH21 ARG A 32 20.095 8.410 -15.549 1.00 0.00 H new ATOM 0 HH22 ARG A 32 19.905 9.665 -16.777 1.00 0.00 H new ATOM 450 N GLY A 33 13.770 5.346 -11.710 1.00 0.00 N ATOM 451 CA GLY A 33 13.433 3.936 -11.760 1.00 0.00 C ATOM 452 C GLY A 33 12.336 3.637 -12.762 1.00 0.00 C ATOM 453 O GLY A 33 12.609 3.387 -13.936 1.00 0.00 O ATOM 0 H GLY A 33 13.063 5.940 -11.277 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.323 3.362 -12.018 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.117 3.606 -10.770 1.00 0.00 H new ATOM 457 N HIS A 34 11.090 3.661 -12.298 1.00 0.00 N ATOM 458 CA HIS A 34 9.947 3.389 -13.163 1.00 0.00 C ATOM 459 C HIS A 34 9.161 4.667 -13.441 1.00 0.00 C ATOM 460 O HIS A 34 8.500 5.206 -12.554 1.00 0.00 O ATOM 461 CB HIS A 34 9.034 2.343 -12.523 1.00 0.00 C ATOM 462 CG HIS A 34 9.693 1.013 -12.325 1.00 0.00 C ATOM 463 ND1 HIS A 34 10.842 0.845 -11.581 1.00 0.00 N ATOM 464 CD2 HIS A 34 9.358 -0.217 -12.779 1.00 0.00 C ATOM 465 CE1 HIS A 34 11.185 -0.430 -11.587 1.00 0.00 C ATOM 466 NE2 HIS A 34 10.300 -1.097 -12.306 1.00 0.00 N ATOM 0 H HIS A 34 10.846 3.866 -11.329 1.00 0.00 H new ATOM 0 HA HIS A 34 10.323 3.001 -14.110 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.689 2.715 -11.558 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.151 2.212 -13.148 1.00 0.00 H new ATOM 0 HD2 HIS A 34 8.508 -0.461 -13.398 1.00 0.00 H new ATOM 0 HE1 HIS A 34 12.043 -0.855 -11.089 1.00 0.00 H new ATOM 0 HE2 HIS A 34 10.314 -2.102 -12.481 1.00 0.00 H new ATOM 475 N ALA A 35 9.238 5.146 -14.678 1.00 0.00 N ATOM 476 CA ALA A 35 8.533 6.359 -15.073 1.00 0.00 C ATOM 477 C ALA A 35 7.041 6.247 -14.777 1.00 0.00 C ATOM 478 O ALA A 35 6.300 5.595 -15.511 1.00 0.00 O ATOM 479 CB ALA A 35 8.760 6.645 -16.550 1.00 0.00 C ATOM 0 H ALA A 35 9.782 4.712 -15.424 1.00 0.00 H new ATOM 0 HA ALA A 35 8.932 7.188 -14.489 1.00 0.00 H new ATOM 0 HB1 ALA A 35 8.227 7.554 -16.831 1.00 0.00 H new ATOM 0 HB2 ALA A 35 9.826 6.777 -16.735 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.389 5.809 -17.144 1.00 0.00 H new ATOM 485 N GLY A 36 6.607 6.888 -13.696 1.00 0.00 N ATOM 486 CA GLY A 36 5.205 6.847 -13.322 1.00 0.00 C ATOM 487 C GLY A 36 4.359 7.802 -14.140 1.00 0.00 C ATOM 488 O GLY A 36 3.408 7.388 -14.802 1.00 0.00 O ATOM 0 H GLY A 36 7.201 7.435 -13.073 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.828 5.832 -13.449 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.107 7.094 -12.265 1.00 0.00 H new ATOM 492 N ASN A 37 4.704 9.085 -14.093 1.00 0.00 N ATOM 493 CA ASN A 37 3.967 10.102 -14.834 1.00 0.00 C ATOM 494 C ASN A 37 4.560 10.297 -16.226 1.00 0.00 C ATOM 495 O ASN A 37 5.721 10.674 -16.386 1.00 0.00 O ATOM 496 CB ASN A 37 3.980 11.428 -14.071 1.00 0.00 C ATOM 497 CG ASN A 37 3.061 12.462 -14.692 1.00 0.00 C ATOM 498 OD1 ASN A 37 2.140 12.123 -15.436 1.00 0.00 O ATOM 499 ND2 ASN A 37 3.308 13.731 -14.389 1.00 0.00 N ATOM 0 H ASN A 37 5.489 9.445 -13.550 1.00 0.00 H new ATOM 0 HA ASN A 37 2.937 9.763 -14.942 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.679 11.253 -13.038 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.997 11.819 -14.045 1.00 0.00 H new ATOM 0 HD21 ASN A 37 2.723 14.471 -14.777 1.00 0.00 H new ATOM 0 HD22 ASN A 37 4.082 13.966 -13.768 1.00 0.00 H new ATOM 506 N PRO A 38 3.744 10.036 -17.258 1.00 0.00 N ATOM 507 CA PRO A 38 4.166 10.177 -18.655 1.00 0.00 C ATOM 508 C PRO A 38 4.366 11.635 -19.056 1.00 0.00 C ATOM 509 O PRO A 38 5.203 11.946 -19.903 1.00 0.00 O ATOM 510 CB PRO A 38 3.004 9.562 -19.440 1.00 0.00 C ATOM 511 CG PRO A 38 1.823 9.708 -18.545 1.00 0.00 C ATOM 512 CD PRO A 38 2.348 9.583 -17.141 1.00 0.00 C ATOM 0 HA PRO A 38 5.127 9.696 -18.841 1.00 0.00 H new ATOM 0 HB2 PRO A 38 2.849 10.078 -20.387 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.195 8.515 -19.675 1.00 0.00 H new ATOM 0 HG2 PRO A 38 1.337 10.672 -18.695 1.00 0.00 H new ATOM 0 HG3 PRO A 38 1.079 8.939 -18.753 1.00 0.00 H new ATOM 0 HD2 PRO A 38 1.782 10.201 -16.444 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.287 8.557 -16.779 1.00 0.00 H new ATOM 520 N ARG A 39 3.593 12.524 -18.441 1.00 0.00 N ATOM 521 CA ARG A 39 3.686 13.949 -18.734 1.00 0.00 C ATOM 522 C ARG A 39 5.143 14.387 -18.851 1.00 0.00 C ATOM 523 O ARG A 39 5.587 14.824 -19.913 1.00 0.00 O ATOM 524 CB ARG A 39 2.984 14.763 -17.645 1.00 0.00 C ATOM 525 CG ARG A 39 1.495 14.946 -17.887 1.00 0.00 C ATOM 526 CD ARG A 39 0.768 15.342 -16.611 1.00 0.00 C ATOM 527 NE ARG A 39 -0.615 15.735 -16.869 1.00 0.00 N ATOM 528 CZ ARG A 39 -1.620 14.871 -16.959 1.00 0.00 C ATOM 529 NH1 ARG A 39 -1.396 13.572 -16.814 1.00 0.00 N ATOM 530 NH2 ARG A 39 -2.851 15.306 -17.196 1.00 0.00 N ATOM 0 H ARG A 39 2.896 12.283 -17.737 1.00 0.00 H new ATOM 0 HA ARG A 39 3.192 14.130 -19.689 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.129 14.270 -16.684 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.455 15.743 -17.575 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.340 15.711 -18.648 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.072 14.020 -18.276 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.783 14.507 -15.911 1.00 0.00 H new ATOM 0 HD3 ARG A 39 1.296 16.167 -16.134 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.820 16.727 -16.986 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.451 13.235 -16.633 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -2.169 12.910 -16.883 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -3.026 16.304 -17.309 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.622 14.642 -17.265 1.00 0.00 H new ATOM 544 N ASP A 40 5.882 14.266 -17.753 1.00 0.00 N ATOM 545 CA ASP A 40 7.289 14.648 -17.732 1.00 0.00 C ATOM 546 C ASP A 40 8.164 13.475 -17.301 1.00 0.00 C ATOM 547 O ASP A 40 8.059 12.968 -16.184 1.00 0.00 O ATOM 548 CB ASP A 40 7.503 15.833 -16.790 1.00 0.00 C ATOM 549 CG ASP A 40 7.042 17.145 -17.395 1.00 0.00 C ATOM 550 OD1 ASP A 40 5.847 17.250 -17.742 1.00 0.00 O ATOM 551 OD2 ASP A 40 7.876 18.065 -17.523 1.00 0.00 O ATOM 0 H ASP A 40 5.530 13.906 -16.866 1.00 0.00 H new ATOM 0 HA ASP A 40 7.576 14.940 -18.742 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.963 15.656 -15.860 1.00 0.00 H new ATOM 0 HB3 ASP A 40 8.561 15.905 -16.536 1.00 0.00 H new ATOM 556 N PRO A 41 9.048 13.032 -18.208 1.00 0.00 N ATOM 557 CA PRO A 41 9.958 11.913 -17.944 1.00 0.00 C ATOM 558 C PRO A 41 11.034 12.269 -16.924 1.00 0.00 C ATOM 559 O PRO A 41 11.913 11.460 -16.624 1.00 0.00 O ATOM 560 CB PRO A 41 10.588 11.638 -19.312 1.00 0.00 C ATOM 561 CG PRO A 41 10.494 12.935 -20.039 1.00 0.00 C ATOM 562 CD PRO A 41 9.228 13.589 -19.559 1.00 0.00 C ATOM 0 HA PRO A 41 9.437 11.055 -17.519 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.624 11.314 -19.213 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.056 10.848 -19.841 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.360 13.563 -19.831 1.00 0.00 H new ATOM 0 HG3 PRO A 41 10.467 12.777 -21.117 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.320 14.675 -19.537 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.383 13.354 -20.207 1.00 0.00 H new ATOM 570 N THR A 42 10.960 13.486 -16.393 1.00 0.00 N ATOM 571 CA THR A 42 11.928 13.949 -15.407 1.00 0.00 C ATOM 572 C THR A 42 11.348 13.893 -13.998 1.00 0.00 C ATOM 573 O THR A 42 12.082 13.761 -13.019 1.00 0.00 O ATOM 574 CB THR A 42 12.388 15.389 -15.704 1.00 0.00 C ATOM 575 OG1 THR A 42 11.253 16.218 -15.979 1.00 0.00 O ATOM 576 CG2 THR A 42 13.343 15.419 -16.888 1.00 0.00 C ATOM 0 H THR A 42 10.240 14.168 -16.630 1.00 0.00 H new ATOM 0 HA THR A 42 12.787 13.281 -15.470 1.00 0.00 H new ATOM 0 HB THR A 42 12.911 15.768 -14.826 1.00 0.00 H new ATOM 0 HG1 THR A 42 11.553 17.132 -16.165 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.654 16.446 -17.079 1.00 0.00 H new ATOM 0 HG22 THR A 42 14.219 14.810 -16.664 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.841 15.022 -17.770 1.00 0.00 H new ATOM 584 N ASP A 43 10.027 13.995 -13.903 1.00 0.00 N ATOM 585 CA ASP A 43 9.347 13.954 -12.614 1.00 0.00 C ATOM 586 C ASP A 43 9.275 12.526 -12.082 1.00 0.00 C ATOM 587 O ASP A 43 8.524 11.700 -12.598 1.00 0.00 O ATOM 588 CB ASP A 43 7.939 14.538 -12.737 1.00 0.00 C ATOM 589 CG ASP A 43 7.906 16.030 -12.474 1.00 0.00 C ATOM 590 OD1 ASP A 43 8.215 16.804 -13.405 1.00 0.00 O ATOM 591 OD2 ASP A 43 7.569 16.426 -11.339 1.00 0.00 O ATOM 0 H ASP A 43 9.405 14.107 -14.704 1.00 0.00 H new ATOM 0 HA ASP A 43 9.921 14.556 -11.909 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.553 14.340 -13.737 1.00 0.00 H new ATOM 0 HB3 ASP A 43 7.277 14.033 -12.034 1.00 0.00 H new ATOM 596 N GLU A 44 10.063 12.244 -11.049 1.00 0.00 N ATOM 597 CA GLU A 44 10.088 10.915 -10.450 1.00 0.00 C ATOM 598 C GLU A 44 9.293 10.889 -9.148 1.00 0.00 C ATOM 599 O GLU A 44 9.751 11.382 -8.118 1.00 0.00 O ATOM 600 CB GLU A 44 11.531 10.478 -10.187 1.00 0.00 C ATOM 601 CG GLU A 44 12.524 11.009 -11.207 1.00 0.00 C ATOM 602 CD GLU A 44 12.231 10.524 -12.614 1.00 0.00 C ATOM 603 OE1 GLU A 44 11.590 9.462 -12.754 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.643 11.208 -13.574 1.00 0.00 O ATOM 0 H GLU A 44 10.691 12.917 -10.610 1.00 0.00 H new ATOM 0 HA GLU A 44 9.626 10.220 -11.151 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.828 10.815 -9.194 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.576 9.389 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.507 12.099 -11.192 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.530 10.702 -10.923 1.00 0.00 H new ATOM 611 N GLY A 45 8.096 10.312 -9.204 1.00 0.00 N ATOM 612 CA GLY A 45 7.255 10.233 -8.024 1.00 0.00 C ATOM 613 C GLY A 45 6.942 8.803 -7.629 1.00 0.00 C ATOM 614 O GLY A 45 7.148 7.877 -8.413 1.00 0.00 O ATOM 0 H GLY A 45 7.694 9.898 -10.045 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.751 10.736 -7.194 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.323 10.768 -8.209 1.00 0.00 H new ATOM 618 N ILE A 46 6.444 8.623 -6.411 1.00 0.00 N ATOM 619 CA ILE A 46 6.103 7.296 -5.914 1.00 0.00 C ATOM 620 C ILE A 46 4.716 7.286 -5.280 1.00 0.00 C ATOM 621 O ILE A 46 4.470 7.973 -4.288 1.00 0.00 O ATOM 622 CB ILE A 46 7.131 6.800 -4.880 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.551 6.953 -5.428 1.00 0.00 C ATOM 624 CG2 ILE A 46 6.853 5.351 -4.510 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.617 6.946 -4.355 1.00 0.00 C ATOM 0 H ILE A 46 6.268 9.379 -5.750 1.00 0.00 H new ATOM 0 HA ILE A 46 6.112 6.626 -6.773 1.00 0.00 H new ATOM 0 HB ILE A 46 7.042 7.408 -3.979 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.749 6.144 -6.131 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.617 7.886 -5.988 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.588 5.015 -3.778 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.853 5.270 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.919 4.729 -5.402 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.598 7.058 -4.816 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.444 7.772 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.578 6.003 -3.810 1.00 0.00 H new ATOM 637 N PHE A 47 3.813 6.501 -5.857 1.00 0.00 N ATOM 638 CA PHE A 47 2.450 6.400 -5.348 1.00 0.00 C ATOM 639 C PHE A 47 2.032 4.940 -5.199 1.00 0.00 C ATOM 640 O PHE A 47 2.489 4.073 -5.945 1.00 0.00 O ATOM 641 CB PHE A 47 1.479 7.127 -6.281 1.00 0.00 C ATOM 642 CG PHE A 47 1.906 8.528 -6.616 1.00 0.00 C ATOM 643 CD1 PHE A 47 3.095 8.762 -7.289 1.00 0.00 C ATOM 644 CD2 PHE A 47 1.119 9.611 -6.258 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.490 10.049 -7.600 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.509 10.900 -6.566 1.00 0.00 C ATOM 647 CZ PHE A 47 2.697 11.120 -7.237 1.00 0.00 C ATOM 0 H PHE A 47 4.000 5.925 -6.678 1.00 0.00 H new ATOM 0 HA PHE A 47 2.420 6.871 -4.365 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.378 6.556 -7.204 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.494 7.157 -5.815 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.720 7.928 -7.574 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.190 9.445 -5.732 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.418 10.217 -8.126 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.886 11.735 -6.283 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.005 12.127 -7.477 1.00 0.00 H new ATOM 657 N ILE A 48 1.161 4.677 -4.230 1.00 0.00 N ATOM 658 CA ILE A 48 0.681 3.323 -3.983 1.00 0.00 C ATOM 659 C ILE A 48 0.013 2.741 -5.224 1.00 0.00 C ATOM 660 O ILE A 48 -0.930 3.320 -5.763 1.00 0.00 O ATOM 661 CB ILE A 48 -0.317 3.285 -2.811 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.358 3.758 -1.522 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.877 1.881 -2.637 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.620 4.167 -0.443 1.00 0.00 C ATOM 0 H ILE A 48 0.774 5.383 -3.604 1.00 0.00 H new ATOM 0 HA ILE A 48 1.553 2.721 -3.727 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.143 3.960 -3.035 1.00 0.00 H new ATOM 0 HG12 ILE A 48 0.994 2.960 -1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.008 4.602 -1.751 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.581 1.871 -1.805 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.390 1.578 -3.550 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -0.062 1.187 -2.432 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.071 4.491 0.442 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.240 4.987 -0.806 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -1.254 3.319 -0.186 1.00 0.00 H new ATOM 676 N SER A 49 0.508 1.591 -5.672 1.00 0.00 N ATOM 677 CA SER A 49 -0.040 0.932 -6.851 1.00 0.00 C ATOM 678 C SER A 49 -0.994 -0.190 -6.452 1.00 0.00 C ATOM 679 O SER A 49 -1.710 -0.740 -7.289 1.00 0.00 O ATOM 680 CB SER A 49 1.089 0.372 -7.719 1.00 0.00 C ATOM 681 OG SER A 49 0.613 -0.648 -8.580 1.00 0.00 O ATOM 0 H SER A 49 1.287 1.097 -5.236 1.00 0.00 H new ATOM 0 HA SER A 49 -0.597 1.672 -7.425 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.530 1.175 -8.310 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.879 -0.025 -7.082 1.00 0.00 H new ATOM 0 HG SER A 49 -0.358 -0.734 -8.479 1.00 0.00 H new ATOM 687 N LYS A 50 -0.997 -0.526 -5.167 1.00 0.00 N ATOM 688 CA LYS A 50 -1.862 -1.582 -4.653 1.00 0.00 C ATOM 689 C LYS A 50 -1.757 -1.681 -3.135 1.00 0.00 C ATOM 690 O LYS A 50 -0.790 -1.209 -2.537 1.00 0.00 O ATOM 691 CB LYS A 50 -1.496 -2.924 -5.289 1.00 0.00 C ATOM 692 CG LYS A 50 -1.905 -4.125 -4.454 1.00 0.00 C ATOM 693 CD LYS A 50 -1.664 -5.429 -5.196 1.00 0.00 C ATOM 694 CE LYS A 50 -2.288 -5.405 -6.582 1.00 0.00 C ATOM 695 NZ LYS A 50 -2.614 -6.774 -7.068 1.00 0.00 N ATOM 0 H LYS A 50 -0.410 -0.082 -4.461 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.891 -1.333 -4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.971 -2.994 -6.268 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.419 -2.957 -5.454 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.343 -4.128 -3.520 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.960 -4.044 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.592 -5.607 -5.281 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -2.080 -6.257 -4.623 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -3.195 -4.802 -6.561 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -1.602 -4.925 -7.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -3.037 -6.714 -8.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.744 -7.343 -7.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -3.288 -7.223 -6.415 1.00 0.00 H new ATOM 709 N VAL A 51 -2.759 -2.298 -2.516 1.00 0.00 N ATOM 710 CA VAL A 51 -2.777 -2.461 -1.067 1.00 0.00 C ATOM 711 C VAL A 51 -3.401 -3.795 -0.672 1.00 0.00 C ATOM 712 O VAL A 51 -4.591 -4.024 -0.889 1.00 0.00 O ATOM 713 CB VAL A 51 -3.555 -1.321 -0.384 1.00 0.00 C ATOM 714 CG1 VAL A 51 -3.545 -1.498 1.127 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.972 0.029 -0.774 1.00 0.00 C ATOM 0 H VAL A 51 -3.568 -2.693 -2.995 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.740 -2.435 -0.732 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.590 -1.357 -0.723 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.100 -0.683 1.592 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.012 -2.449 1.385 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.516 -1.489 1.488 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.534 0.824 -0.283 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.928 0.078 -0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.036 0.154 -1.855 1.00 0.00 H new ATOM 725 N SER A 52 -2.590 -4.673 -0.091 1.00 0.00 N ATOM 726 CA SER A 52 -3.062 -5.987 0.331 1.00 0.00 C ATOM 727 C SER A 52 -4.158 -5.857 1.384 1.00 0.00 C ATOM 728 O SER A 52 -4.083 -5.035 2.297 1.00 0.00 O ATOM 729 CB SER A 52 -1.901 -6.814 0.886 1.00 0.00 C ATOM 730 OG SER A 52 -2.191 -8.200 0.830 1.00 0.00 O ATOM 0 H SER A 52 -1.603 -4.499 0.098 1.00 0.00 H new ATOM 0 HA SER A 52 -3.477 -6.495 -0.540 1.00 0.00 H new ATOM 0 HB2 SER A 52 -0.996 -6.605 0.316 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.702 -6.522 1.917 1.00 0.00 H new ATOM 0 HG SER A 52 -1.433 -8.708 1.189 1.00 0.00 H new ATOM 736 N PRO A 53 -5.202 -6.689 1.255 1.00 0.00 N ATOM 737 CA PRO A 53 -6.335 -6.688 2.186 1.00 0.00 C ATOM 738 C PRO A 53 -5.954 -7.222 3.563 1.00 0.00 C ATOM 739 O PRO A 53 -6.586 -6.890 4.566 1.00 0.00 O ATOM 740 CB PRO A 53 -7.348 -7.618 1.513 1.00 0.00 C ATOM 741 CG PRO A 53 -6.525 -8.519 0.659 1.00 0.00 C ATOM 742 CD PRO A 53 -5.358 -7.695 0.191 1.00 0.00 C ATOM 0 HA PRO A 53 -6.714 -5.682 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.918 -8.183 2.251 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.067 -7.056 0.917 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.187 -9.389 1.222 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.104 -8.891 -0.186 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.459 -8.301 0.076 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.556 -7.231 -0.775 1.00 0.00 H new ATOM 750 N THR A 54 -4.916 -8.052 3.604 1.00 0.00 N ATOM 751 CA THR A 54 -4.452 -8.633 4.858 1.00 0.00 C ATOM 752 C THR A 54 -3.316 -7.812 5.456 1.00 0.00 C ATOM 753 O THR A 54 -2.775 -8.155 6.507 1.00 0.00 O ATOM 754 CB THR A 54 -3.973 -10.084 4.661 1.00 0.00 C ATOM 755 OG1 THR A 54 -2.715 -10.096 3.977 1.00 0.00 O ATOM 756 CG2 THR A 54 -4.994 -10.888 3.871 1.00 0.00 C ATOM 0 H THR A 54 -4.381 -8.337 2.784 1.00 0.00 H new ATOM 0 HA THR A 54 -5.300 -8.628 5.542 1.00 0.00 H new ATOM 0 HB THR A 54 -3.856 -10.541 5.643 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.417 -11.022 3.857 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.634 -11.909 3.744 1.00 0.00 H new ATOM 0 HG22 THR A 54 -5.942 -10.901 4.409 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.139 -10.431 2.892 1.00 0.00 H new ATOM 764 N GLY A 55 -2.958 -6.724 4.781 1.00 0.00 N ATOM 765 CA GLY A 55 -1.888 -5.870 5.262 1.00 0.00 C ATOM 766 C GLY A 55 -2.370 -4.853 6.277 1.00 0.00 C ATOM 767 O GLY A 55 -3.559 -4.542 6.338 1.00 0.00 O ATOM 0 H GLY A 55 -3.390 -6.419 3.909 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.109 -6.486 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.435 -5.350 4.418 1.00 0.00 H new ATOM 771 N ALA A 56 -1.445 -4.335 7.079 1.00 0.00 N ATOM 772 CA ALA A 56 -1.782 -3.347 8.096 1.00 0.00 C ATOM 773 C ALA A 56 -2.606 -2.208 7.504 1.00 0.00 C ATOM 774 O ALA A 56 -3.594 -1.772 8.094 1.00 0.00 O ATOM 775 CB ALA A 56 -0.517 -2.804 8.745 1.00 0.00 C ATOM 0 H ALA A 56 -0.456 -4.584 7.044 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.386 -3.839 8.859 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.784 -2.067 9.502 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.032 -3.622 9.212 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.108 -2.334 7.986 1.00 0.00 H new ATOM 781 N ALA A 57 -2.192 -1.730 6.335 1.00 0.00 N ATOM 782 CA ALA A 57 -2.892 -0.643 5.663 1.00 0.00 C ATOM 783 C ALA A 57 -4.307 -1.059 5.274 1.00 0.00 C ATOM 784 O ALA A 57 -5.284 -0.439 5.693 1.00 0.00 O ATOM 785 CB ALA A 57 -2.115 -0.194 4.435 1.00 0.00 C ATOM 0 H ALA A 57 -1.375 -2.079 5.834 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.966 0.193 6.358 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.650 0.618 3.943 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.126 0.152 4.736 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.011 -1.031 3.744 1.00 0.00 H new ATOM 791 N GLY A 58 -4.409 -2.112 4.470 1.00 0.00 N ATOM 792 CA GLY A 58 -5.708 -2.592 4.037 1.00 0.00 C ATOM 793 C GLY A 58 -6.721 -2.620 5.165 1.00 0.00 C ATOM 794 O GLY A 58 -7.878 -2.243 4.979 1.00 0.00 O ATOM 0 H GLY A 58 -3.615 -2.642 4.110 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.079 -1.954 3.235 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.602 -3.595 3.623 1.00 0.00 H new ATOM 798 N ARG A 59 -6.286 -3.070 6.338 1.00 0.00 N ATOM 799 CA ARG A 59 -7.164 -3.148 7.499 1.00 0.00 C ATOM 800 C ARG A 59 -7.215 -1.812 8.234 1.00 0.00 C ATOM 801 O ARG A 59 -8.181 -1.515 8.937 1.00 0.00 O ATOM 802 CB ARG A 59 -6.688 -4.248 8.450 1.00 0.00 C ATOM 803 CG ARG A 59 -5.434 -3.881 9.227 1.00 0.00 C ATOM 804 CD ARG A 59 -5.070 -4.958 10.238 1.00 0.00 C ATOM 805 NE ARG A 59 -3.740 -4.750 10.803 1.00 0.00 N ATOM 806 CZ ARG A 59 -3.073 -5.682 11.474 1.00 0.00 C ATOM 807 NH1 ARG A 59 -3.610 -6.880 11.663 1.00 0.00 N ATOM 808 NH2 ARG A 59 -1.866 -5.418 11.958 1.00 0.00 N ATOM 0 H ARG A 59 -5.331 -3.386 6.509 1.00 0.00 H new ATOM 0 HA ARG A 59 -8.168 -3.388 7.149 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.487 -4.478 9.154 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.497 -5.155 7.876 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.605 -3.735 8.534 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.589 -2.933 9.743 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.808 -4.966 11.040 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.111 -5.935 9.757 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.299 -3.839 10.675 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.537 -7.087 11.293 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.095 -7.594 12.179 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -1.449 -4.498 11.815 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -1.355 -6.135 12.473 1.00 0.00 H new ATOM 822 N ASP A 60 -6.168 -1.011 8.066 1.00 0.00 N ATOM 823 CA ASP A 60 -6.093 0.294 8.713 1.00 0.00 C ATOM 824 C ASP A 60 -7.324 1.134 8.386 1.00 0.00 C ATOM 825 O ASP A 60 -8.157 1.398 9.252 1.00 0.00 O ATOM 826 CB ASP A 60 -4.826 1.032 8.276 1.00 0.00 C ATOM 827 CG ASP A 60 -4.642 2.348 9.005 1.00 0.00 C ATOM 828 OD1 ASP A 60 -5.081 2.448 10.171 1.00 0.00 O ATOM 829 OD2 ASP A 60 -4.059 3.278 8.411 1.00 0.00 O ATOM 0 H ASP A 60 -5.360 -1.242 7.488 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.059 0.136 9.791 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -3.959 0.396 8.455 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.869 1.217 7.203 1.00 0.00 H new ATOM 834 N GLY A 61 -7.431 1.553 7.128 1.00 0.00 N ATOM 835 CA GLY A 61 -8.562 2.360 6.709 1.00 0.00 C ATOM 836 C GLY A 61 -8.149 3.747 6.257 1.00 0.00 C ATOM 837 O GLY A 61 -8.937 4.468 5.645 1.00 0.00 O ATOM 0 H GLY A 61 -6.755 1.348 6.392 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.082 1.856 5.895 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.269 2.446 7.534 1.00 0.00 H new ATOM 841 N ARG A 62 -6.911 4.122 6.561 1.00 0.00 N ATOM 842 CA ARG A 62 -6.397 5.434 6.185 1.00 0.00 C ATOM 843 C ARG A 62 -5.502 5.333 4.953 1.00 0.00 C ATOM 844 O ARG A 62 -5.080 6.347 4.395 1.00 0.00 O ATOM 845 CB ARG A 62 -5.615 6.051 7.347 1.00 0.00 C ATOM 846 CG ARG A 62 -6.286 5.866 8.698 1.00 0.00 C ATOM 847 CD ARG A 62 -7.287 6.976 8.979 1.00 0.00 C ATOM 848 NE ARG A 62 -8.492 6.846 8.165 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.484 7.730 8.174 1.00 0.00 C ATOM 850 NH1 ARG A 62 -9.414 8.802 8.950 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.548 7.542 7.404 1.00 0.00 N ATOM 0 H ARG A 62 -6.246 3.537 7.066 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.246 6.075 5.946 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.620 5.607 7.381 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.482 7.117 7.159 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.793 4.902 8.725 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.529 5.850 9.482 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.559 6.960 10.034 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -6.821 7.942 8.785 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.577 6.032 7.556 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.597 8.950 9.542 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.177 9.479 8.955 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.605 6.719 6.805 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.309 8.221 7.411 1.00 0.00 H new ATOM 865 N LEU A 63 -5.217 4.105 4.534 1.00 0.00 N ATOM 866 CA LEU A 63 -4.372 3.872 3.368 1.00 0.00 C ATOM 867 C LEU A 63 -5.195 3.350 2.195 1.00 0.00 C ATOM 868 O LEU A 63 -6.034 2.463 2.358 1.00 0.00 O ATOM 869 CB LEU A 63 -3.261 2.877 3.709 1.00 0.00 C ATOM 870 CG LEU A 63 -2.084 2.824 2.734 1.00 0.00 C ATOM 871 CD1 LEU A 63 -2.506 2.179 1.423 1.00 0.00 C ATOM 872 CD2 LEU A 63 -1.532 4.221 2.490 1.00 0.00 C ATOM 0 H LEU A 63 -5.558 3.256 4.984 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.924 4.823 3.079 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.876 3.119 4.699 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.700 1.881 3.772 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.296 2.215 3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.656 2.150 0.742 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.854 1.164 1.613 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.311 2.761 0.974 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.695 4.165 1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.314 4.852 2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.191 4.648 3.433 1.00 0.00 H new ATOM 884 N ARG A 64 -4.949 3.904 1.012 1.00 0.00 N ATOM 885 CA ARG A 64 -5.667 3.494 -0.188 1.00 0.00 C ATOM 886 C ARG A 64 -4.729 3.441 -1.391 1.00 0.00 C ATOM 887 O ARG A 64 -3.676 4.078 -1.399 1.00 0.00 O ATOM 888 CB ARG A 64 -6.822 4.455 -0.471 1.00 0.00 C ATOM 889 CG ARG A 64 -7.757 4.649 0.712 1.00 0.00 C ATOM 890 CD ARG A 64 -8.913 3.662 0.676 1.00 0.00 C ATOM 891 NE ARG A 64 -8.603 2.430 1.397 1.00 0.00 N ATOM 892 CZ ARG A 64 -9.392 1.361 1.398 1.00 0.00 C ATOM 893 NH1 ARG A 64 -10.531 1.373 0.721 1.00 0.00 N ATOM 894 NH2 ARG A 64 -9.041 0.277 2.079 1.00 0.00 N ATOM 0 H ARG A 64 -4.258 4.638 0.859 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.069 2.495 -0.017 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.415 5.423 -0.764 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.396 4.081 -1.319 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.201 4.525 1.641 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.146 5.667 0.706 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.798 4.124 1.112 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.155 3.425 -0.360 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.734 2.388 1.929 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.804 2.204 0.197 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -11.135 0.551 0.724 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -8.165 0.265 2.602 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.647 -0.543 2.079 1.00 0.00 H new ATOM 908 N VAL A 65 -5.119 2.676 -2.406 1.00 0.00 N ATOM 909 CA VAL A 65 -4.315 2.540 -3.614 1.00 0.00 C ATOM 910 C VAL A 65 -4.391 3.799 -4.470 1.00 0.00 C ATOM 911 O VAL A 65 -5.245 3.915 -5.348 1.00 0.00 O ATOM 912 CB VAL A 65 -4.766 1.332 -4.456 1.00 0.00 C ATOM 913 CG1 VAL A 65 -3.719 0.991 -5.506 1.00 0.00 C ATOM 914 CG2 VAL A 65 -5.045 0.134 -3.561 1.00 0.00 C ATOM 0 H VAL A 65 -5.987 2.141 -2.415 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.285 2.385 -3.292 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.690 1.595 -4.971 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -4.056 0.135 -6.091 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.573 1.846 -6.166 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.777 0.747 -5.015 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.363 -0.711 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -4.139 -0.132 -3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.834 0.385 -2.852 1.00 0.00 H new ATOM 924 N GLY A 66 -3.491 4.742 -4.208 1.00 0.00 N ATOM 925 CA GLY A 66 -3.473 5.981 -4.964 1.00 0.00 C ATOM 926 C GLY A 66 -2.828 7.119 -4.197 1.00 0.00 C ATOM 927 O GLY A 66 -2.438 8.130 -4.782 1.00 0.00 O ATOM 0 H GLY A 66 -2.774 4.670 -3.486 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.934 5.825 -5.898 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.494 6.257 -5.227 1.00 0.00 H new ATOM 931 N LEU A 67 -2.716 6.956 -2.883 1.00 0.00 N ATOM 932 CA LEU A 67 -2.115 7.978 -2.034 1.00 0.00 C ATOM 933 C LEU A 67 -0.633 8.150 -2.355 1.00 0.00 C ATOM 934 O LEU A 67 0.115 7.175 -2.420 1.00 0.00 O ATOM 935 CB LEU A 67 -2.290 7.611 -0.559 1.00 0.00 C ATOM 936 CG LEU A 67 -3.713 7.272 -0.116 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.822 7.304 1.400 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.711 8.232 -0.746 1.00 0.00 C ATOM 0 H LEU A 67 -3.034 6.126 -2.383 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.622 8.923 -2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.649 6.757 -0.339 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.931 8.443 0.047 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.948 6.263 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.842 7.060 1.697 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.135 6.575 1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.567 8.300 1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.719 7.975 -0.419 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.479 9.252 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.652 8.158 -1.832 1.00 0.00 H new ATOM 950 N ARG A 68 -0.217 9.397 -2.552 1.00 0.00 N ATOM 951 CA ARG A 68 1.175 9.697 -2.865 1.00 0.00 C ATOM 952 C ARG A 68 2.036 9.656 -1.606 1.00 0.00 C ATOM 953 O ARG A 68 1.782 10.381 -0.643 1.00 0.00 O ATOM 954 CB ARG A 68 1.286 11.072 -3.527 1.00 0.00 C ATOM 955 CG ARG A 68 2.696 11.420 -3.974 1.00 0.00 C ATOM 956 CD ARG A 68 2.776 12.842 -4.507 1.00 0.00 C ATOM 957 NE ARG A 68 4.156 13.308 -4.619 1.00 0.00 N ATOM 958 CZ ARG A 68 4.496 14.590 -4.685 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.561 15.530 -4.651 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.773 14.935 -4.786 1.00 0.00 N ATOM 0 H ARG A 68 -0.824 10.215 -2.500 1.00 0.00 H new ATOM 0 HA ARG A 68 1.538 8.937 -3.558 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.622 11.105 -4.390 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.938 11.832 -2.828 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.383 11.305 -3.136 1.00 0.00 H new ATOM 0 HG3 ARG A 68 3.017 10.722 -4.747 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.297 12.890 -5.485 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.221 13.508 -3.847 1.00 0.00 H new ATOM 0 HE ARG A 68 4.899 12.610 -4.648 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.578 15.269 -4.574 1.00 0.00 H new ATOM 0 HH12 ARG A 68 3.825 16.514 -4.702 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.495 14.215 -4.813 1.00 0.00 H new ATOM 0 HH22 ARG A 68 6.033 15.920 -4.837 1.00 0.00 H new ATOM 974 N LEU A 69 3.055 8.804 -1.620 1.00 0.00 N ATOM 975 CA LEU A 69 3.954 8.668 -0.479 1.00 0.00 C ATOM 976 C LEU A 69 4.891 9.867 -0.377 1.00 0.00 C ATOM 977 O LEU A 69 5.764 10.060 -1.224 1.00 0.00 O ATOM 978 CB LEU A 69 4.769 7.379 -0.598 1.00 0.00 C ATOM 979 CG LEU A 69 4.236 6.174 0.179 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.547 6.314 1.661 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.739 6.017 -0.041 1.00 0.00 C ATOM 0 H LEU A 69 3.279 8.197 -2.408 1.00 0.00 H new ATOM 0 HA LEU A 69 3.348 8.626 0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.831 7.108 -1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.785 7.583 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 69 4.733 5.278 -0.192 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.160 5.448 2.197 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.626 6.376 1.802 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.078 7.219 2.047 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.377 5.155 0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.225 6.915 0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.541 5.869 -1.103 1.00 0.00 H new ATOM 993 N LEU A 70 4.704 10.670 0.664 1.00 0.00 N ATOM 994 CA LEU A 70 5.534 11.851 0.879 1.00 0.00 C ATOM 995 C LEU A 70 6.788 11.498 1.673 1.00 0.00 C ATOM 996 O LEU A 70 7.904 11.801 1.255 1.00 0.00 O ATOM 997 CB LEU A 70 4.738 12.931 1.613 1.00 0.00 C ATOM 998 CG LEU A 70 3.989 13.930 0.730 1.00 0.00 C ATOM 999 CD1 LEU A 70 3.054 13.203 -0.223 1.00 0.00 C ATOM 1000 CD2 LEU A 70 3.216 14.923 1.585 1.00 0.00 C ATOM 0 H LEU A 70 3.985 10.525 1.373 1.00 0.00 H new ATOM 0 HA LEU A 70 5.839 12.233 -0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.016 12.441 2.266 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.423 13.486 2.255 1.00 0.00 H new ATOM 0 HG LEU A 70 4.720 14.482 0.139 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.530 13.930 -0.843 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.632 12.533 -0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.329 12.624 0.349 1.00 0.00 H new ATOM 0 HD21 LEU A 70 2.689 15.626 0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.495 14.387 2.203 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.909 15.468 2.226 1.00 0.00 H new ATOM 1012 N GLU A 71 6.594 10.854 2.820 1.00 0.00 N ATOM 1013 CA GLU A 71 7.710 10.459 3.671 1.00 0.00 C ATOM 1014 C GLU A 71 7.319 9.292 4.574 1.00 0.00 C ATOM 1015 O GLU A 71 6.237 9.283 5.162 1.00 0.00 O ATOM 1016 CB GLU A 71 8.176 11.642 4.521 1.00 0.00 C ATOM 1017 CG GLU A 71 8.160 12.968 3.779 1.00 0.00 C ATOM 1018 CD GLU A 71 8.615 14.127 4.645 1.00 0.00 C ATOM 1019 OE1 GLU A 71 7.785 14.652 5.416 1.00 0.00 O ATOM 1020 OE2 GLU A 71 9.801 14.508 4.552 1.00 0.00 O ATOM 0 H GLU A 71 5.676 10.595 3.181 1.00 0.00 H new ATOM 0 HA GLU A 71 8.529 10.139 3.027 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.538 11.720 5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 71 9.187 11.447 4.877 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.806 12.898 2.904 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.151 13.165 3.416 1.00 0.00 H new ATOM 1027 N VAL A 72 8.207 8.309 4.679 1.00 0.00 N ATOM 1028 CA VAL A 72 7.956 7.137 5.510 1.00 0.00 C ATOM 1029 C VAL A 72 8.833 7.150 6.756 1.00 0.00 C ATOM 1030 O VAL A 72 10.051 7.000 6.672 1.00 0.00 O ATOM 1031 CB VAL A 72 8.208 5.832 4.731 1.00 0.00 C ATOM 1032 CG1 VAL A 72 8.171 4.635 5.669 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.190 5.675 3.612 1.00 0.00 C ATOM 0 H VAL A 72 9.107 8.301 4.199 1.00 0.00 H new ATOM 0 HA VAL A 72 6.908 7.177 5.806 1.00 0.00 H new ATOM 0 HB VAL A 72 9.201 5.882 4.283 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.351 3.722 5.101 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.942 4.746 6.431 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.193 4.578 6.148 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.383 4.748 3.072 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.186 5.646 4.035 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.271 6.518 2.926 1.00 0.00 H new ATOM 1043 N ASN A 73 8.205 7.330 7.914 1.00 0.00 N ATOM 1044 CA ASN A 73 8.929 7.362 9.179 1.00 0.00 C ATOM 1045 C ASN A 73 9.858 8.570 9.244 1.00 0.00 C ATOM 1046 O ASN A 73 10.988 8.471 9.723 1.00 0.00 O ATOM 1047 CB ASN A 73 9.734 6.075 9.364 1.00 0.00 C ATOM 1048 CG ASN A 73 8.974 5.025 10.152 1.00 0.00 C ATOM 1049 OD1 ASN A 73 8.054 5.344 10.906 1.00 0.00 O ATOM 1050 ND2 ASN A 73 9.356 3.765 9.981 1.00 0.00 N ATOM 0 H ASN A 73 7.197 7.456 8.002 1.00 0.00 H new ATOM 0 HA ASN A 73 8.199 7.444 9.984 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.998 5.671 8.387 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.668 6.305 9.877 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.882 3.015 10.485 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.124 3.547 9.346 1.00 0.00 H new ATOM 1057 N GLN A 74 9.375 9.709 8.758 1.00 0.00 N ATOM 1058 CA GLN A 74 10.163 10.936 8.760 1.00 0.00 C ATOM 1059 C GLN A 74 11.396 10.793 7.874 1.00 0.00 C ATOM 1060 O GLN A 74 12.462 11.319 8.190 1.00 0.00 O ATOM 1061 CB GLN A 74 10.584 11.294 10.187 1.00 0.00 C ATOM 1062 CG GLN A 74 9.427 11.728 11.072 1.00 0.00 C ATOM 1063 CD GLN A 74 9.707 11.512 12.546 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.437 12.282 13.171 1.00 0.00 O ATOM 1065 NE2 GLN A 74 9.126 10.460 13.110 1.00 0.00 N ATOM 0 H GLN A 74 8.442 9.808 8.358 1.00 0.00 H new ATOM 0 HA GLN A 74 9.542 11.737 8.360 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.073 10.432 10.640 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.322 12.095 10.149 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.216 12.783 10.897 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.532 11.173 10.791 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.529 9.848 12.554 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.277 10.263 14.099 1.00 0.00 H new ATOM 1074 N GLN A 75 11.241 10.077 6.765 1.00 0.00 N ATOM 1075 CA GLN A 75 12.343 9.864 5.834 1.00 0.00 C ATOM 1076 C GLN A 75 11.888 10.077 4.394 1.00 0.00 C ATOM 1077 O GLN A 75 11.427 9.145 3.734 1.00 0.00 O ATOM 1078 CB GLN A 75 12.912 8.454 5.998 1.00 0.00 C ATOM 1079 CG GLN A 75 13.352 8.137 7.418 1.00 0.00 C ATOM 1080 CD GLN A 75 14.476 7.121 7.468 1.00 0.00 C ATOM 1081 OE1 GLN A 75 15.651 7.470 7.346 1.00 0.00 O ATOM 1082 NE2 GLN A 75 14.121 5.854 7.648 1.00 0.00 N ATOM 0 H GLN A 75 10.364 9.635 6.489 1.00 0.00 H new ATOM 0 HA GLN A 75 13.123 10.591 6.061 1.00 0.00 H new ATOM 0 HB2 GLN A 75 12.159 7.729 5.690 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.763 8.334 5.328 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.676 9.056 7.908 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.500 7.758 7.982 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.136 5.609 7.744 1.00 0.00 H new ATOM 0 HE22 GLN A 75 14.834 5.126 7.690 1.00 0.00 H new ATOM 1091 N SER A 76 12.020 11.309 3.912 1.00 0.00 N ATOM 1092 CA SER A 76 11.618 11.645 2.551 1.00 0.00 C ATOM 1093 C SER A 76 12.021 10.541 1.578 1.00 0.00 C ATOM 1094 O SER A 76 13.113 9.979 1.676 1.00 0.00 O ATOM 1095 CB SER A 76 12.248 12.972 2.124 1.00 0.00 C ATOM 1096 OG SER A 76 11.676 13.443 0.916 1.00 0.00 O ATOM 0 H SER A 76 12.402 12.091 4.444 1.00 0.00 H new ATOM 0 HA SER A 76 10.533 11.744 2.532 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.108 13.714 2.910 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.323 12.843 1.995 1.00 0.00 H new ATOM 0 HG SER A 76 12.094 14.293 0.666 1.00 0.00 H new ATOM 1102 N LEU A 77 11.132 10.236 0.639 1.00 0.00 N ATOM 1103 CA LEU A 77 11.394 9.200 -0.354 1.00 0.00 C ATOM 1104 C LEU A 77 12.155 9.768 -1.547 1.00 0.00 C ATOM 1105 O LEU A 77 12.318 9.100 -2.569 1.00 0.00 O ATOM 1106 CB LEU A 77 10.079 8.574 -0.824 1.00 0.00 C ATOM 1107 CG LEU A 77 9.189 7.982 0.268 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.182 7.012 -0.331 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.034 7.290 1.328 1.00 0.00 C ATOM 0 H LEU A 77 10.224 10.691 0.544 1.00 0.00 H new ATOM 0 HA LEU A 77 12.010 8.431 0.113 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.508 9.334 -1.357 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.311 7.787 -1.542 1.00 0.00 H new ATOM 0 HG LEU A 77 8.640 8.795 0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.557 6.601 0.462 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.555 7.537 -1.052 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.711 6.202 -0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.384 6.874 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.610 6.487 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 77 10.715 8.012 1.779 1.00 0.00 H new ATOM 1121 N LEU A 78 12.622 11.005 -1.410 1.00 0.00 N ATOM 1122 CA LEU A 78 13.369 11.663 -2.476 1.00 0.00 C ATOM 1123 C LEU A 78 14.841 11.266 -2.434 1.00 0.00 C ATOM 1124 O LEU A 78 15.356 10.860 -1.393 1.00 0.00 O ATOM 1125 CB LEU A 78 13.235 13.182 -2.356 1.00 0.00 C ATOM 1126 CG LEU A 78 14.073 14.009 -3.332 1.00 0.00 C ATOM 1127 CD1 LEU A 78 13.327 15.270 -3.740 1.00 0.00 C ATOM 1128 CD2 LEU A 78 15.419 14.359 -2.715 1.00 0.00 C ATOM 0 H LEU A 78 12.496 11.572 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 78 12.952 11.342 -3.431 1.00 0.00 H new ATOM 0 HB2 LEU A 78 12.187 13.446 -2.494 1.00 0.00 H new ATOM 0 HB3 LEU A 78 13.505 13.471 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 78 14.250 13.411 -4.226 1.00 0.00 H new ATOM 0 HD11 LEU A 78 13.939 15.846 -4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 78 12.389 14.997 -4.223 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.118 15.872 -2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 78 16.002 14.947 -3.423 1.00 0.00 H new ATOM 0 HD22 LEU A 78 15.263 14.938 -1.805 1.00 0.00 H new ATOM 0 HD23 LEU A 78 15.958 13.443 -2.474 1.00 0.00 H new ATOM 1140 N GLY A 79 15.514 11.387 -3.575 1.00 0.00 N ATOM 1141 CA GLY A 79 16.921 11.039 -3.646 1.00 0.00 C ATOM 1142 C GLY A 79 17.143 9.544 -3.768 1.00 0.00 C ATOM 1143 O GLY A 79 18.212 9.100 -4.189 1.00 0.00 O ATOM 0 H GLY A 79 15.110 11.720 -4.450 1.00 0.00 H new ATOM 0 HA2 GLY A 79 17.374 11.541 -4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.429 11.407 -2.754 1.00 0.00 H new ATOM 1147 N LEU A 80 16.132 8.766 -3.397 1.00 0.00 N ATOM 1148 CA LEU A 80 16.222 7.312 -3.465 1.00 0.00 C ATOM 1149 C LEU A 80 15.314 6.761 -4.560 1.00 0.00 C ATOM 1150 O LEU A 80 14.322 7.387 -4.933 1.00 0.00 O ATOM 1151 CB LEU A 80 15.846 6.695 -2.116 1.00 0.00 C ATOM 1152 CG LEU A 80 14.597 7.263 -1.443 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.863 6.175 -0.673 1.00 0.00 C ATOM 1154 CD2 LEU A 80 14.966 8.415 -0.520 1.00 0.00 C ATOM 0 H LEU A 80 15.241 9.118 -3.046 1.00 0.00 H new ATOM 0 HA LEU A 80 17.252 7.047 -3.705 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.703 5.624 -2.256 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.689 6.818 -1.436 1.00 0.00 H new ATOM 0 HG LEU A 80 13.931 7.643 -2.218 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.977 6.598 -0.201 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.565 5.382 -1.359 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.521 5.764 0.093 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.064 8.807 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.652 8.060 0.249 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.447 9.205 -1.098 1.00 0.00 H new ATOM 1166 N THR A 81 15.659 5.582 -5.070 1.00 0.00 N ATOM 1167 CA THR A 81 14.876 4.946 -6.121 1.00 0.00 C ATOM 1168 C THR A 81 13.820 4.016 -5.533 1.00 0.00 C ATOM 1169 O THR A 81 13.721 3.864 -4.315 1.00 0.00 O ATOM 1170 CB THR A 81 15.772 4.143 -7.082 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.416 3.076 -6.376 1.00 0.00 O ATOM 1172 CG2 THR A 81 16.822 5.041 -7.720 1.00 0.00 C ATOM 0 H THR A 81 16.476 5.049 -4.771 1.00 0.00 H new ATOM 0 HA THR A 81 14.385 5.745 -6.676 1.00 0.00 H new ATOM 0 HB THR A 81 15.142 3.729 -7.870 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.982 2.569 -6.995 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.443 4.452 -8.395 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.329 5.835 -8.281 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.447 5.480 -6.942 1.00 0.00 H new ATOM 1180 N HIS A 82 13.032 3.396 -6.406 1.00 0.00 N ATOM 1181 CA HIS A 82 11.984 2.479 -5.973 1.00 0.00 C ATOM 1182 C HIS A 82 12.525 1.475 -4.960 1.00 0.00 C ATOM 1183 O HIS A 82 12.030 1.383 -3.837 1.00 0.00 O ATOM 1184 CB HIS A 82 11.393 1.741 -7.175 1.00 0.00 C ATOM 1185 CG HIS A 82 9.981 1.289 -6.965 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.568 -0.010 -7.177 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.884 1.969 -6.559 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.278 -0.108 -6.911 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.839 1.080 -6.534 1.00 0.00 N ATOM 0 H HIS A 82 13.100 3.512 -7.417 1.00 0.00 H new ATOM 0 HA HIS A 82 11.199 3.064 -5.494 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.431 2.394 -8.047 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.014 0.874 -7.400 1.00 0.00 H new ATOM 0 HD1 HIS A 82 10.165 -0.775 -7.490 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.839 3.017 -6.302 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.683 -1.006 -6.988 1.00 0.00 H new ATOM 1198 N GLY A 83 13.544 0.723 -5.365 1.00 0.00 N ATOM 1199 CA GLY A 83 14.134 -0.265 -4.481 1.00 0.00 C ATOM 1200 C GLY A 83 14.448 0.298 -3.109 1.00 0.00 C ATOM 1201 O GLY A 83 14.082 -0.290 -2.092 1.00 0.00 O ATOM 0 H GLY A 83 13.971 0.780 -6.289 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.451 -1.108 -4.377 1.00 0.00 H new ATOM 0 HA3 GLY A 83 15.049 -0.650 -4.931 1.00 0.00 H new ATOM 1205 N GLU A 84 15.129 1.440 -3.081 1.00 0.00 N ATOM 1206 CA GLU A 84 15.493 2.080 -1.823 1.00 0.00 C ATOM 1207 C GLU A 84 14.249 2.464 -1.027 1.00 0.00 C ATOM 1208 O GLU A 84 14.163 2.205 0.173 1.00 0.00 O ATOM 1209 CB GLU A 84 16.347 3.323 -2.086 1.00 0.00 C ATOM 1210 CG GLU A 84 17.826 3.021 -2.253 1.00 0.00 C ATOM 1211 CD GLU A 84 18.686 4.269 -2.197 1.00 0.00 C ATOM 1212 OE1 GLU A 84 18.820 4.848 -1.099 1.00 0.00 O ATOM 1213 OE2 GLU A 84 19.225 4.666 -3.251 1.00 0.00 O ATOM 0 H GLU A 84 15.439 1.940 -3.914 1.00 0.00 H new ATOM 0 HA GLU A 84 16.072 1.367 -1.237 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.983 3.820 -2.985 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.219 4.023 -1.260 1.00 0.00 H new ATOM 0 HG2 GLU A 84 18.143 2.331 -1.471 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.985 2.517 -3.206 1.00 0.00 H new ATOM 1220 N ALA A 85 13.288 3.083 -1.704 1.00 0.00 N ATOM 1221 CA ALA A 85 12.048 3.501 -1.061 1.00 0.00 C ATOM 1222 C ALA A 85 11.371 2.328 -0.360 1.00 0.00 C ATOM 1223 O ALA A 85 11.024 2.413 0.818 1.00 0.00 O ATOM 1224 CB ALA A 85 11.107 4.122 -2.083 1.00 0.00 C ATOM 0 H ALA A 85 13.344 3.306 -2.698 1.00 0.00 H new ATOM 0 HA ALA A 85 12.293 4.249 -0.307 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.185 4.430 -1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.584 4.992 -2.535 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.877 3.390 -2.858 1.00 0.00 H new ATOM 1230 N VAL A 86 11.186 1.234 -1.091 1.00 0.00 N ATOM 1231 CA VAL A 86 10.550 0.044 -0.539 1.00 0.00 C ATOM 1232 C VAL A 86 11.159 -0.329 0.809 1.00 0.00 C ATOM 1233 O VAL A 86 10.458 -0.404 1.817 1.00 0.00 O ATOM 1234 CB VAL A 86 10.677 -1.156 -1.496 1.00 0.00 C ATOM 1235 CG1 VAL A 86 10.200 -2.432 -0.820 1.00 0.00 C ATOM 1236 CG2 VAL A 86 9.898 -0.899 -2.777 1.00 0.00 C ATOM 0 H VAL A 86 11.468 1.147 -2.067 1.00 0.00 H new ATOM 0 HA VAL A 86 9.495 0.282 -0.405 1.00 0.00 H new ATOM 0 HB VAL A 86 11.728 -1.282 -1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.297 -3.269 -1.512 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.805 -2.622 0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 86 9.155 -2.321 -0.530 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.998 -1.757 -3.442 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.846 -0.746 -2.538 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.291 -0.010 -3.270 1.00 0.00 H new ATOM 1246 N GLN A 87 12.468 -0.561 0.817 1.00 0.00 N ATOM 1247 CA GLN A 87 13.171 -0.926 2.041 1.00 0.00 C ATOM 1248 C GLN A 87 12.861 0.060 3.161 1.00 0.00 C ATOM 1249 O GLN A 87 12.956 -0.276 4.343 1.00 0.00 O ATOM 1250 CB GLN A 87 14.679 -0.976 1.792 1.00 0.00 C ATOM 1251 CG GLN A 87 15.073 -1.854 0.614 1.00 0.00 C ATOM 1252 CD GLN A 87 14.335 -3.178 0.601 1.00 0.00 C ATOM 1253 OE1 GLN A 87 13.034 -3.128 0.339 1.00 0.00 O flip ATOM 1254 NE2 GLN A 87 14.927 -4.234 0.824 1.00 0.00 N flip ATOM 0 H GLN A 87 13.062 -0.503 -0.010 1.00 0.00 H new ATOM 0 HA GLN A 87 12.828 -1.914 2.347 1.00 0.00 H new ATOM 0 HB2 GLN A 87 15.044 0.036 1.618 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.175 -1.344 2.690 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.871 -1.321 -0.315 1.00 0.00 H new ATOM 0 HG3 GLN A 87 16.146 -2.041 0.648 1.00 0.00 H new ATOM 0 HE21 GLN A 87 15.928 -4.226 1.021 1.00 0.00 H new ATOM 0 HE22 GLN A 87 14.417 -5.117 0.812 1.00 0.00 H new ATOM 1263 N LEU A 88 12.490 1.279 2.784 1.00 0.00 N ATOM 1264 CA LEU A 88 12.166 2.316 3.758 1.00 0.00 C ATOM 1265 C LEU A 88 10.802 2.062 4.390 1.00 0.00 C ATOM 1266 O LEU A 88 10.575 2.388 5.556 1.00 0.00 O ATOM 1267 CB LEU A 88 12.184 3.693 3.092 1.00 0.00 C ATOM 1268 CG LEU A 88 12.677 4.852 3.958 1.00 0.00 C ATOM 1269 CD1 LEU A 88 12.572 6.167 3.201 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.889 4.918 5.258 1.00 0.00 C ATOM 0 H LEU A 88 12.406 1.573 1.811 1.00 0.00 H new ATOM 0 HA LEU A 88 12.921 2.290 4.544 1.00 0.00 H new ATOM 0 HB2 LEU A 88 12.813 3.636 2.204 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.174 3.923 2.753 1.00 0.00 H new ATOM 0 HG LEU A 88 13.726 4.679 4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 88 12.927 6.980 3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.181 6.117 2.298 1.00 0.00 H new ATOM 0 HD13 LEU A 88 11.532 6.348 2.928 1.00 0.00 H new ATOM 0 HD21 LEU A 88 12.253 5.749 5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.832 5.067 5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 88 12.016 3.986 5.808 1.00 0.00 H new ATOM 1282 N LEU A 89 9.896 1.476 3.615 1.00 0.00 N ATOM 1283 CA LEU A 89 8.553 1.175 4.100 1.00 0.00 C ATOM 1284 C LEU A 89 8.567 -0.040 5.022 1.00 0.00 C ATOM 1285 O LEU A 89 7.690 -0.196 5.872 1.00 0.00 O ATOM 1286 CB LEU A 89 7.609 0.926 2.922 1.00 0.00 C ATOM 1287 CG LEU A 89 7.509 -0.521 2.437 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.500 -1.295 3.271 1.00 0.00 C ATOM 1289 CD2 LEU A 89 7.131 -0.564 0.963 1.00 0.00 C ATOM 0 H LEU A 89 10.067 1.200 2.648 1.00 0.00 H new ATOM 0 HA LEU A 89 8.196 2.034 4.668 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.612 1.264 3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.931 1.547 2.086 1.00 0.00 H new ATOM 0 HG LEU A 89 8.485 -0.992 2.555 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.442 -2.322 2.911 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.813 -1.293 4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.520 -0.825 3.185 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.064 -1.601 0.635 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.167 -0.075 0.820 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.891 -0.046 0.377 1.00 0.00 H new ATOM 1301 N ARG A 90 9.568 -0.897 4.849 1.00 0.00 N ATOM 1302 CA ARG A 90 9.696 -2.097 5.666 1.00 0.00 C ATOM 1303 C ARG A 90 10.658 -1.865 6.827 1.00 0.00 C ATOM 1304 O ARG A 90 10.901 -2.761 7.634 1.00 0.00 O ATOM 1305 CB ARG A 90 10.182 -3.271 4.814 1.00 0.00 C ATOM 1306 CG ARG A 90 11.398 -2.943 3.963 1.00 0.00 C ATOM 1307 CD ARG A 90 12.180 -4.197 3.603 1.00 0.00 C ATOM 1308 NE ARG A 90 13.608 -3.929 3.463 1.00 0.00 N ATOM 1309 CZ ARG A 90 14.525 -4.882 3.331 1.00 0.00 C ATOM 1310 NH1 ARG A 90 14.164 -6.157 3.321 1.00 0.00 N ATOM 1311 NH2 ARG A 90 15.806 -4.559 3.208 1.00 0.00 N ATOM 0 H ARG A 90 10.302 -0.782 4.150 1.00 0.00 H new ATOM 0 HA ARG A 90 8.713 -2.335 6.073 1.00 0.00 H new ATOM 0 HB2 ARG A 90 10.422 -4.109 5.468 1.00 0.00 H new ATOM 0 HB3 ARG A 90 9.371 -3.597 4.163 1.00 0.00 H new ATOM 0 HG2 ARG A 90 11.080 -2.437 3.052 1.00 0.00 H new ATOM 0 HG3 ARG A 90 12.045 -2.251 4.502 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.027 -4.953 4.373 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.795 -4.609 2.670 1.00 0.00 H new ATOM 0 HE ARG A 90 13.919 -2.958 3.467 1.00 0.00 H new ATOM 0 HH11 ARG A 90 13.180 -6.409 3.415 1.00 0.00 H new ATOM 0 HH12 ARG A 90 14.870 -6.886 3.220 1.00 0.00 H new ATOM 0 HH21 ARG A 90 16.088 -3.579 3.215 1.00 0.00 H new ATOM 0 HH22 ARG A 90 16.509 -5.291 3.107 1.00 0.00 H new ATOM 1325 N SER A 91 11.205 -0.655 6.903 1.00 0.00 N ATOM 1326 CA SER A 91 12.144 -0.306 7.961 1.00 0.00 C ATOM 1327 C SER A 91 11.404 0.108 9.230 1.00 0.00 C ATOM 1328 O SER A 91 11.963 0.778 10.098 1.00 0.00 O ATOM 1329 CB SER A 91 13.065 0.827 7.502 1.00 0.00 C ATOM 1330 OG SER A 91 12.518 2.093 7.829 1.00 0.00 O ATOM 0 H SER A 91 11.013 0.099 6.244 1.00 0.00 H new ATOM 0 HA SER A 91 12.746 -1.187 8.183 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.043 0.718 7.971 1.00 0.00 H new ATOM 0 HB3 SER A 91 13.219 0.761 6.425 1.00 0.00 H new ATOM 0 HG SER A 91 11.813 2.320 7.188 1.00 0.00 H new ATOM 1336 N VAL A 92 10.142 -0.298 9.330 1.00 0.00 N ATOM 1337 CA VAL A 92 9.325 0.028 10.492 1.00 0.00 C ATOM 1338 C VAL A 92 9.124 -1.192 11.383 1.00 0.00 C ATOM 1339 O VAL A 92 9.031 -2.319 10.898 1.00 0.00 O ATOM 1340 CB VAL A 92 7.947 0.577 10.073 1.00 0.00 C ATOM 1341 CG1 VAL A 92 7.323 -0.308 9.005 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.032 0.696 11.282 1.00 0.00 C ATOM 0 H VAL A 92 9.664 -0.853 8.620 1.00 0.00 H new ATOM 0 HA VAL A 92 9.860 0.797 11.049 1.00 0.00 H new ATOM 0 HB VAL A 92 8.084 1.573 9.651 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.351 0.095 8.721 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.973 -0.336 8.131 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.197 -1.317 9.397 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.063 1.085 10.968 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.899 -0.286 11.736 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.477 1.374 12.010 1.00 0.00 H new ATOM 1352 N GLY A 93 9.056 -0.960 12.690 1.00 0.00 N ATOM 1353 CA GLY A 93 8.866 -2.050 13.629 1.00 0.00 C ATOM 1354 C GLY A 93 7.425 -2.515 13.694 1.00 0.00 C ATOM 1355 O GLY A 93 7.060 -3.516 13.076 1.00 0.00 O ATOM 0 H GLY A 93 9.129 -0.036 13.116 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.502 -2.887 13.342 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.187 -1.731 14.621 1.00 0.00 H new ATOM 1359 N ASP A 94 6.604 -1.789 14.444 1.00 0.00 N ATOM 1360 CA ASP A 94 5.194 -2.133 14.588 1.00 0.00 C ATOM 1361 C ASP A 94 4.304 -0.985 14.119 1.00 0.00 C ATOM 1362 O ASP A 94 3.101 -1.158 13.923 1.00 0.00 O ATOM 1363 CB ASP A 94 4.877 -2.479 16.043 1.00 0.00 C ATOM 1364 CG ASP A 94 6.028 -3.183 16.735 1.00 0.00 C ATOM 1365 OD1 ASP A 94 6.818 -3.854 16.038 1.00 0.00 O ATOM 1366 OD2 ASP A 94 6.139 -3.063 17.972 1.00 0.00 O ATOM 0 H ASP A 94 6.890 -0.958 14.962 1.00 0.00 H new ATOM 0 HA ASP A 94 4.992 -3.004 13.964 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.634 -1.566 16.586 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.992 -3.115 16.078 1.00 0.00 H new ATOM 1371 N THR A 95 4.904 0.188 13.943 1.00 0.00 N ATOM 1372 CA THR A 95 4.166 1.364 13.500 1.00 0.00 C ATOM 1373 C THR A 95 5.095 2.382 12.847 1.00 0.00 C ATOM 1374 O THR A 95 6.172 2.677 13.366 1.00 0.00 O ATOM 1375 CB THR A 95 3.427 2.038 14.672 1.00 0.00 C ATOM 1376 OG1 THR A 95 2.711 1.056 15.429 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.462 3.098 14.164 1.00 0.00 C ATOM 0 H THR A 95 5.899 0.349 14.100 1.00 0.00 H new ATOM 0 HA THR A 95 3.435 1.021 12.768 1.00 0.00 H new ATOM 0 HB THR A 95 4.167 2.520 15.311 1.00 0.00 H new ATOM 0 HG1 THR A 95 2.245 1.492 16.173 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.952 3.560 15.009 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.015 3.859 13.613 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.727 2.635 13.505 1.00 0.00 H new ATOM 1385 N LEU A 96 4.671 2.916 11.707 1.00 0.00 N ATOM 1386 CA LEU A 96 5.465 3.903 10.982 1.00 0.00 C ATOM 1387 C LEU A 96 4.715 5.226 10.865 1.00 0.00 C ATOM 1388 O LEU A 96 3.595 5.363 11.359 1.00 0.00 O ATOM 1389 CB LEU A 96 5.818 3.379 9.589 1.00 0.00 C ATOM 1390 CG LEU A 96 4.821 3.704 8.477 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.409 3.364 7.116 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.514 2.955 8.697 1.00 0.00 C ATOM 0 H LEU A 96 3.782 2.683 11.264 1.00 0.00 H new ATOM 0 HA LEU A 96 6.384 4.076 11.542 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.791 3.782 9.307 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.927 2.296 9.647 1.00 0.00 H new ATOM 0 HG LEU A 96 4.613 4.774 8.503 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.685 3.602 6.337 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.317 3.945 6.957 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.647 2.301 7.078 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.816 3.198 7.896 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.705 1.882 8.698 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.084 3.248 9.655 1.00 0.00 H new ATOM 1404 N THR A 97 5.339 6.198 10.207 1.00 0.00 N ATOM 1405 CA THR A 97 4.730 7.509 10.024 1.00 0.00 C ATOM 1406 C THR A 97 4.712 7.906 8.552 1.00 0.00 C ATOM 1407 O THR A 97 5.695 8.430 8.028 1.00 0.00 O ATOM 1408 CB THR A 97 5.477 8.592 10.826 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.941 8.049 12.067 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.573 9.785 11.096 1.00 0.00 C ATOM 0 H THR A 97 6.266 6.102 9.792 1.00 0.00 H new ATOM 0 HA THR A 97 3.706 7.436 10.391 1.00 0.00 H new ATOM 0 HB THR A 97 6.329 8.928 10.235 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.416 8.743 12.570 1.00 0.00 H new ATOM 0 HG21 THR A 97 5.122 10.536 11.663 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.244 10.214 10.149 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.704 9.461 11.669 1.00 0.00 H new ATOM 1418 N VAL A 98 3.588 7.654 7.890 1.00 0.00 N ATOM 1419 CA VAL A 98 3.441 7.987 6.478 1.00 0.00 C ATOM 1420 C VAL A 98 2.733 9.325 6.300 1.00 0.00 C ATOM 1421 O VAL A 98 1.669 9.559 6.875 1.00 0.00 O ATOM 1422 CB VAL A 98 2.655 6.898 5.723 1.00 0.00 C ATOM 1423 CG1 VAL A 98 3.167 5.515 6.095 1.00 0.00 C ATOM 1424 CG2 VAL A 98 1.166 7.020 6.012 1.00 0.00 C ATOM 0 H VAL A 98 2.765 7.220 8.309 1.00 0.00 H new ATOM 0 HA VAL A 98 4.446 8.053 6.062 1.00 0.00 H new ATOM 0 HB VAL A 98 2.807 7.040 4.653 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.600 4.759 5.552 1.00 0.00 H new ATOM 0 HG12 VAL A 98 4.222 5.435 5.833 1.00 0.00 H new ATOM 0 HG13 VAL A 98 3.046 5.359 7.167 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.626 6.243 5.471 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.992 6.905 7.082 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.812 8.000 5.690 1.00 0.00 H new ATOM 1434 N LEU A 99 3.329 10.201 5.499 1.00 0.00 N ATOM 1435 CA LEU A 99 2.756 11.518 5.243 1.00 0.00 C ATOM 1436 C LEU A 99 1.922 11.510 3.966 1.00 0.00 C ATOM 1437 O LEU A 99 1.684 12.556 3.361 1.00 0.00 O ATOM 1438 CB LEU A 99 3.864 12.567 5.136 1.00 0.00 C ATOM 1439 CG LEU A 99 3.413 14.027 5.177 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.701 14.330 6.486 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.601 14.958 4.987 1.00 0.00 C ATOM 0 H LEU A 99 4.209 10.023 5.015 1.00 0.00 H new ATOM 0 HA LEU A 99 2.104 11.772 6.079 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.571 12.403 5.949 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.405 12.401 4.204 1.00 0.00 H new ATOM 0 HG LEU A 99 2.712 14.193 4.359 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.388 15.374 6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.826 13.687 6.581 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.379 14.146 7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.261 15.993 5.019 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.326 14.790 5.783 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.068 14.759 4.023 1.00 0.00 H new ATOM 1453 N VAL A 100 1.480 10.324 3.561 1.00 0.00 N ATOM 1454 CA VAL A 100 0.670 10.180 2.357 1.00 0.00 C ATOM 1455 C VAL A 100 -0.490 11.169 2.354 1.00 0.00 C ATOM 1456 O VAL A 100 -0.770 11.816 3.364 1.00 0.00 O ATOM 1457 CB VAL A 100 0.112 8.751 2.223 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.243 7.733 2.231 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -0.884 8.462 3.336 1.00 0.00 C ATOM 0 H VAL A 100 1.669 9.449 4.049 1.00 0.00 H new ATOM 0 HA VAL A 100 1.323 10.388 1.510 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.410 8.671 1.269 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.830 6.729 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.915 7.930 1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.795 7.810 3.167 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.268 7.448 3.226 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.389 8.559 4.302 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.710 9.171 3.279 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.162 11.281 1.214 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.293 12.192 1.078 1.00 0.00 C ATOM 1471 C CYS A 101 -3.151 11.818 -0.126 1.00 0.00 C ATOM 1472 O CYS A 101 -2.666 11.215 -1.084 1.00 0.00 O ATOM 1473 CB CYS A 101 -1.800 13.633 0.942 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.232 14.064 -0.719 1.00 0.00 S ATOM 0 H CYS A 101 -0.943 10.752 0.370 1.00 0.00 H new ATOM 0 HA CYS A 101 -2.905 12.109 1.976 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -2.606 14.310 1.226 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -0.984 13.795 1.647 1.00 0.00 H new ATOM 0 HG CYS A 101 -0.837 15.302 -0.735 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.428 12.179 -0.071 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.355 11.882 -1.157 1.00 0.00 C ATOM 1482 C ASP A 102 -4.763 12.289 -2.503 1.00 0.00 C ATOM 1483 O ASP A 102 -4.589 13.474 -2.783 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.685 12.601 -0.932 1.00 0.00 C ATOM 1485 CG ASP A 102 -7.221 12.403 0.472 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -7.266 11.243 0.931 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -7.597 13.408 1.111 1.00 0.00 O ATOM 0 H ASP A 102 -4.845 12.678 0.715 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.531 10.806 -1.168 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.555 13.667 -1.121 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.418 12.237 -1.652 1.00 0.00 H new ATOM 1492 N GLY A 103 -4.453 11.296 -3.332 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.883 11.571 -4.638 1.00 0.00 C ATOM 1494 C GLY A 103 -4.899 11.438 -5.754 1.00 0.00 C ATOM 1495 O GLY A 103 -4.987 12.298 -6.630 1.00 0.00 O ATOM 0 H GLY A 103 -4.586 10.307 -3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.470 12.580 -4.645 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -3.055 10.886 -4.821 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.669 10.355 -5.725 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.683 10.110 -6.744 1.00 0.00 C ATOM 1501 C PHE A 104 -7.790 9.209 -6.204 1.00 0.00 C ATOM 1502 O PHE A 104 -7.554 8.047 -5.877 1.00 0.00 O ATOM 1503 CB PHE A 104 -6.049 9.471 -7.982 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.616 9.869 -8.194 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -3.589 9.157 -7.594 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -4.295 10.954 -8.993 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -2.270 9.520 -7.787 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -2.978 11.322 -9.190 1.00 0.00 C ATOM 1509 CZ PHE A 104 -1.964 10.604 -8.586 1.00 0.00 C ATOM 0 H PHE A 104 -5.610 9.633 -5.007 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.121 11.068 -7.022 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.107 8.386 -7.891 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.629 9.749 -8.862 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.823 8.308 -6.968 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -5.084 11.519 -9.468 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -1.479 8.957 -7.314 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.741 12.170 -9.815 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.934 10.890 -8.738 1.00 0.00 H new ATOM 1519 N GLU A 105 -8.998 9.757 -6.114 1.00 0.00 N ATOM 1520 CA GLU A 105 -10.142 9.003 -5.613 1.00 0.00 C ATOM 1521 C GLU A 105 -10.774 8.170 -6.724 1.00 0.00 C ATOM 1522 O GLU A 105 -11.989 7.979 -6.756 1.00 0.00 O ATOM 1523 CB GLU A 105 -11.184 9.952 -5.016 1.00 0.00 C ATOM 1524 CG GLU A 105 -10.802 10.493 -3.649 1.00 0.00 C ATOM 1525 CD GLU A 105 -11.513 11.790 -3.316 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -11.128 12.839 -3.873 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -12.456 11.756 -2.497 1.00 0.00 O ATOM 0 H GLU A 105 -9.210 10.718 -6.381 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.787 8.328 -4.834 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -11.335 10.788 -5.699 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.137 9.429 -4.937 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.038 9.748 -2.889 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.725 10.654 -3.614 1.00 0.00 H new ATOM 1534 N SER A 106 -9.939 7.677 -7.633 1.00 0.00 N ATOM 1535 CA SER A 106 -10.416 6.868 -8.749 1.00 0.00 C ATOM 1536 C SER A 106 -11.606 6.010 -8.329 1.00 0.00 C ATOM 1537 O SER A 106 -12.561 5.840 -9.086 1.00 0.00 O ATOM 1538 CB SER A 106 -9.291 5.975 -9.276 1.00 0.00 C ATOM 1539 OG SER A 106 -9.785 5.030 -10.210 1.00 0.00 O ATOM 0 H SER A 106 -8.930 7.823 -7.619 1.00 0.00 H new ATOM 0 HA SER A 106 -10.738 7.542 -9.543 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.525 6.590 -9.747 1.00 0.00 H new ATOM 0 HB3 SER A 106 -8.816 5.455 -8.444 1.00 0.00 H new ATOM 0 HG SER A 106 -9.047 4.473 -10.533 1.00 0.00 H new ATOM 1545 N GLY A 107 -11.541 5.473 -7.114 1.00 0.00 N ATOM 1546 CA GLY A 107 -12.618 4.640 -6.613 1.00 0.00 C ATOM 1547 C GLY A 107 -12.142 3.261 -6.202 1.00 0.00 C ATOM 1548 O GLY A 107 -11.145 2.748 -6.711 1.00 0.00 O ATOM 0 H GLY A 107 -10.762 5.600 -6.468 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -13.084 5.130 -5.758 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.385 4.542 -7.381 1.00 0.00 H new ATOM 1552 N PRO A 108 -12.863 2.639 -5.257 1.00 0.00 N ATOM 1553 CA PRO A 108 -12.526 1.303 -4.756 1.00 0.00 C ATOM 1554 C PRO A 108 -12.768 0.215 -5.797 1.00 0.00 C ATOM 1555 O PRO A 108 -13.754 0.256 -6.533 1.00 0.00 O ATOM 1556 CB PRO A 108 -13.470 1.123 -3.565 1.00 0.00 C ATOM 1557 CG PRO A 108 -14.627 2.014 -3.860 1.00 0.00 C ATOM 1558 CD PRO A 108 -14.063 3.191 -4.607 1.00 0.00 C ATOM 0 HA PRO A 108 -11.470 1.219 -4.498 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -13.786 0.085 -3.464 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -12.985 1.401 -2.630 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -15.377 1.495 -4.458 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -15.118 2.334 -2.941 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -14.772 3.581 -5.337 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -13.814 4.012 -3.935 1.00 0.00 H new ATOM 1566 N SER A 109 -11.863 -0.757 -5.852 1.00 0.00 N ATOM 1567 CA SER A 109 -11.977 -1.855 -6.805 1.00 0.00 C ATOM 1568 C SER A 109 -13.211 -2.703 -6.511 1.00 0.00 C ATOM 1569 O SER A 109 -13.479 -3.052 -5.362 1.00 0.00 O ATOM 1570 CB SER A 109 -10.722 -2.728 -6.762 1.00 0.00 C ATOM 1571 OG SER A 109 -10.598 -3.382 -5.511 1.00 0.00 O ATOM 0 H SER A 109 -11.043 -0.807 -5.248 1.00 0.00 H new ATOM 0 HA SER A 109 -12.080 -1.429 -7.803 1.00 0.00 H new ATOM 0 HB2 SER A 109 -10.763 -3.469 -7.561 1.00 0.00 H new ATOM 0 HB3 SER A 109 -9.841 -2.113 -6.943 1.00 0.00 H new ATOM 0 HG SER A 109 -9.789 -3.935 -5.510 1.00 0.00 H new ATOM 1577 N SER A 110 -13.959 -3.031 -7.560 1.00 0.00 N ATOM 1578 CA SER A 110 -15.167 -3.835 -7.416 1.00 0.00 C ATOM 1579 C SER A 110 -14.883 -5.103 -6.616 1.00 0.00 C ATOM 1580 O SER A 110 -13.760 -5.604 -6.603 1.00 0.00 O ATOM 1581 CB SER A 110 -15.728 -4.202 -8.791 1.00 0.00 C ATOM 1582 OG SER A 110 -14.919 -5.175 -9.429 1.00 0.00 O ATOM 0 H SER A 110 -13.750 -2.752 -8.519 1.00 0.00 H new ATOM 0 HA SER A 110 -15.906 -3.243 -6.876 1.00 0.00 H new ATOM 0 HB2 SER A 110 -16.743 -4.583 -8.683 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.787 -3.309 -9.413 1.00 0.00 H new ATOM 0 HG SER A 110 -15.300 -5.394 -10.305 1.00 0.00 H new ATOM 1588 N GLY A 111 -15.912 -5.616 -5.948 1.00 0.00 N ATOM 1589 CA GLY A 111 -15.755 -6.820 -5.154 1.00 0.00 C ATOM 1590 C GLY A 111 -16.982 -7.130 -4.320 1.00 0.00 C ATOM 1591 O GLY A 111 -16.919 -7.920 -3.379 1.00 0.00 O ATOM 0 H GLY A 111 -16.852 -5.219 -5.943 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -15.546 -7.662 -5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -14.892 -6.708 -4.497 1.00 0.00 H new TER 1595 GLY A 111