USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 953 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 22 LYS NZ :NH3+ -156:sc= 0.238 (180deg=-0.0235) USER MOD Set 1.2: A 99 GLN : amide:sc= -5.98! C(o=-5.7!,f=-6.6!) USER MOD Set 2.1: A 79 CYS SG : rot -150:sc= -0.697 USER MOD Set 2.2: A 83 ASN : amide:sc= 0 X(o=-0.7,f=-0.92) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.0484 X(o=-0.029,f=-0.37) USER MOD Set 3.2: A 62 TYR OH : rot 15:sc= -0.0774 USER MOD Set 4.1: A 20 GLN : amide:sc= -0.118 K(o=-0.12,f=0.56) USER MOD Set 4.2: A 29 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 18 GLN : amide:sc= -0.624 X(o=-1.3,f=-0.86) USER MOD Set 5.2: A 106 GLN : amide:sc= -0.649 K(o=-1.3,f=-1.8!) USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.00458 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00341 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 78:sc= 0.563 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -0.0995 X(o=-0.099,f=-0.17) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.585 X(o=-0.58,f=-0.12) USER MOD Single : A 45 LYS NZ :NH3+ -159:sc= -0.0313 (180deg=-0.233) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 160:sc= -0.237 (180deg=-1.14) USER MOD Single : A 52 THR OG1 : rot 50:sc= -0.261 USER MOD Single : A 53 MET CE :methyl -151:sc= -2.06! (180deg=-3.9!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.724 K(o=-0.72,f=-0.2) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.273 K(o=-0.27,f=-3.2!) USER MOD Single : A 73 ASN : amide:sc= -0.254 K(o=-0.25,f=-0.98) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.637 K(o=-0.64,f=-2.8) USER MOD Single : A 81 LYS NZ :NH3+ -174:sc= 0.928 (180deg=0.808) USER MOD Single : A 82 TYR OH : rot 30:sc= -1.71 USER MOD Single : A 85 LYS NZ :NH3+ -151:sc= -0.284 (180deg=-1.14!) USER MOD Single : A 87 THR OG1 : rot -48:sc= 0.0847 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.61) USER MOD Single : A 113 LYS NZ :NH3+ -128:sc= -1.73 (180deg=-3.75!) USER MOD Single : A 114 MET CE :methyl 141:sc= -1.71 (180deg=-4.23!) USER MOD Single : A 116 SER OG : rot 31:sc= 0.7 USER MOD Single : A 119 SER OG : rot 22:sc= 0.166 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.913 27.256 1.551 1.00 0.00 N ATOM 2 CA GLY A 1 4.091 27.063 0.123 1.00 0.00 C ATOM 3 C GLY A 1 2.879 27.498 -0.676 1.00 0.00 C ATOM 4 O GLY A 1 1.742 27.319 -0.239 1.00 0.00 O ATOM 0 H1 GLY A 1 4.554 28.005 1.883 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.929 27.531 1.744 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.129 26.370 2.051 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.963 27.625 -0.211 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.295 26.011 -0.076 1.00 0.00 H new ATOM 8 N SER A 2 3.121 28.075 -1.849 1.00 0.00 N ATOM 9 CA SER A 2 2.040 28.543 -2.708 1.00 0.00 C ATOM 10 C SER A 2 1.043 27.422 -2.985 1.00 0.00 C ATOM 11 O SER A 2 1.397 26.385 -3.545 1.00 0.00 O ATOM 12 CB SER A 2 2.603 29.077 -4.026 1.00 0.00 C ATOM 13 OG SER A 2 3.523 30.131 -3.799 1.00 0.00 O ATOM 0 H SER A 2 4.056 28.229 -2.226 1.00 0.00 H new ATOM 0 HA SER A 2 1.520 29.349 -2.190 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.096 28.270 -4.568 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.787 29.432 -4.656 1.00 0.00 H new ATOM 0 HG SER A 2 3.869 30.453 -4.657 1.00 0.00 H new ATOM 19 N SER A 3 -0.208 27.640 -2.588 1.00 0.00 N ATOM 20 CA SER A 3 -1.257 26.648 -2.790 1.00 0.00 C ATOM 21 C SER A 3 -0.871 25.314 -2.159 1.00 0.00 C ATOM 22 O SER A 3 -1.060 24.254 -2.755 1.00 0.00 O ATOM 23 CB SER A 3 -1.530 26.459 -4.283 1.00 0.00 C ATOM 24 OG SER A 3 -2.458 27.418 -4.758 1.00 0.00 O ATOM 0 H SER A 3 -0.519 28.494 -2.125 1.00 0.00 H new ATOM 0 HA SER A 3 -2.164 27.011 -2.306 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.597 26.545 -4.840 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.916 25.455 -4.461 1.00 0.00 H new ATOM 0 HG SER A 3 -2.614 27.276 -5.715 1.00 0.00 H new ATOM 30 N GLY A 4 -0.328 25.374 -0.947 1.00 0.00 N ATOM 31 CA GLY A 4 0.076 24.165 -0.253 1.00 0.00 C ATOM 32 C GLY A 4 -1.062 23.176 -0.100 1.00 0.00 C ATOM 33 O GLY A 4 -2.199 23.564 0.174 1.00 0.00 O ATOM 0 H GLY A 4 -0.161 26.239 -0.433 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.893 23.692 -0.799 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.460 24.427 0.733 1.00 0.00 H new ATOM 37 N SER A 5 -0.760 21.894 -0.280 1.00 0.00 N ATOM 38 CA SER A 5 -1.767 20.847 -0.166 1.00 0.00 C ATOM 39 C SER A 5 -1.380 19.835 0.908 1.00 0.00 C ATOM 40 O SER A 5 -1.529 18.627 0.720 1.00 0.00 O ATOM 41 CB SER A 5 -1.951 20.138 -1.509 1.00 0.00 C ATOM 42 OG SER A 5 -3.274 19.653 -1.653 1.00 0.00 O ATOM 0 H SER A 5 0.175 21.556 -0.506 1.00 0.00 H new ATOM 0 HA SER A 5 -2.709 21.314 0.122 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.723 20.827 -2.322 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.246 19.310 -1.586 1.00 0.00 H new ATOM 0 HG SER A 5 -3.366 19.206 -2.520 1.00 0.00 H new ATOM 48 N SER A 6 -0.882 20.336 2.033 1.00 0.00 N ATOM 49 CA SER A 6 -0.468 19.477 3.137 1.00 0.00 C ATOM 50 C SER A 6 -1.585 18.510 3.519 1.00 0.00 C ATOM 51 O SER A 6 -1.349 17.319 3.718 1.00 0.00 O ATOM 52 CB SER A 6 -0.073 20.322 4.348 1.00 0.00 C ATOM 53 OG SER A 6 0.784 21.385 3.971 1.00 0.00 O ATOM 0 H SER A 6 -0.755 21.333 2.205 1.00 0.00 H new ATOM 0 HA SER A 6 0.396 18.898 2.811 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.968 20.724 4.823 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.425 19.694 5.087 1.00 0.00 H new ATOM 0 HG SER A 6 1.021 21.911 4.763 1.00 0.00 H new ATOM 59 N GLY A 7 -2.804 19.032 3.620 1.00 0.00 N ATOM 60 CA GLY A 7 -3.940 18.202 3.978 1.00 0.00 C ATOM 61 C GLY A 7 -3.882 16.832 3.331 1.00 0.00 C ATOM 62 O GLY A 7 -3.949 15.811 4.016 1.00 0.00 O ATOM 0 H GLY A 7 -3.025 20.015 3.460 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.976 18.088 5.061 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.861 18.703 3.680 1.00 0.00 H new ATOM 66 N PHE A 8 -3.761 16.808 2.008 1.00 0.00 N ATOM 67 CA PHE A 8 -3.699 15.553 1.269 1.00 0.00 C ATOM 68 C PHE A 8 -2.674 14.607 1.888 1.00 0.00 C ATOM 69 O PHE A 8 -2.892 13.398 1.961 1.00 0.00 O ATOM 70 CB PHE A 8 -3.347 15.817 -0.197 1.00 0.00 C ATOM 71 CG PHE A 8 -2.915 14.585 -0.940 1.00 0.00 C ATOM 72 CD1 PHE A 8 -3.834 13.604 -1.276 1.00 0.00 C ATOM 73 CD2 PHE A 8 -1.590 14.409 -1.304 1.00 0.00 C ATOM 74 CE1 PHE A 8 -3.439 12.471 -1.959 1.00 0.00 C ATOM 75 CE2 PHE A 8 -1.188 13.277 -1.988 1.00 0.00 C ATOM 76 CZ PHE A 8 -2.114 12.307 -2.317 1.00 0.00 C ATOM 0 H PHE A 8 -3.704 17.644 1.426 1.00 0.00 H new ATOM 0 HA PHE A 8 -4.680 15.081 1.321 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -4.213 16.249 -0.698 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -2.549 16.558 -0.243 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.871 13.727 -1.001 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -0.862 15.165 -1.050 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -4.165 11.713 -2.213 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -0.152 13.152 -2.265 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.804 11.422 -2.853 1.00 0.00 H new ATOM 86 N LEU A 9 -1.554 15.167 2.331 1.00 0.00 N ATOM 87 CA LEU A 9 -0.493 14.376 2.944 1.00 0.00 C ATOM 88 C LEU A 9 -1.000 13.656 4.189 1.00 0.00 C ATOM 89 O LEU A 9 -0.769 12.459 4.364 1.00 0.00 O ATOM 90 CB LEU A 9 0.694 15.270 3.306 1.00 0.00 C ATOM 91 CG LEU A 9 1.151 16.250 2.225 1.00 0.00 C ATOM 92 CD1 LEU A 9 2.368 17.032 2.693 1.00 0.00 C ATOM 93 CD2 LEU A 9 1.454 15.511 0.930 1.00 0.00 C ATOM 0 H LEU A 9 -1.357 16.166 2.277 1.00 0.00 H new ATOM 0 HA LEU A 9 -0.169 13.628 2.221 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.435 15.840 4.199 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.537 14.631 3.569 1.00 0.00 H new ATOM 0 HG LEU A 9 0.343 16.956 2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.679 17.724 1.910 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.116 17.592 3.594 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.183 16.341 2.911 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.778 16.224 0.172 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.245 14.782 1.104 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.556 14.997 0.586 1.00 0.00 H new ATOM 105 N ILE A 10 -1.695 14.392 5.050 1.00 0.00 N ATOM 106 CA ILE A 10 -2.239 13.823 6.277 1.00 0.00 C ATOM 107 C ILE A 10 -3.234 12.709 5.973 1.00 0.00 C ATOM 108 O ILE A 10 -3.221 11.657 6.614 1.00 0.00 O ATOM 109 CB ILE A 10 -2.932 14.896 7.137 1.00 0.00 C ATOM 110 CG1 ILE A 10 -1.904 15.893 7.675 1.00 0.00 C ATOM 111 CG2 ILE A 10 -3.696 14.245 8.281 1.00 0.00 C ATOM 112 CD1 ILE A 10 -1.617 17.036 6.726 1.00 0.00 C ATOM 0 H ILE A 10 -1.895 15.384 4.920 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.397 13.412 6.834 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.642 15.438 6.513 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.263 16.298 8.621 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -0.974 15.365 7.887 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.181 15.016 8.880 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.451 13.571 7.877 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.004 13.681 8.906 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -0.880 17.703 7.173 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -1.228 16.641 5.788 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.537 17.588 6.533 1.00 0.00 H new ATOM 124 N LEU A 11 -4.095 12.946 4.989 1.00 0.00 N ATOM 125 CA LEU A 11 -5.098 11.961 4.596 1.00 0.00 C ATOM 126 C LEU A 11 -4.447 10.623 4.262 1.00 0.00 C ATOM 127 O LEU A 11 -4.946 9.564 4.646 1.00 0.00 O ATOM 128 CB LEU A 11 -5.896 12.468 3.394 1.00 0.00 C ATOM 129 CG LEU A 11 -6.743 11.426 2.663 1.00 0.00 C ATOM 130 CD1 LEU A 11 -8.111 11.300 3.316 1.00 0.00 C ATOM 131 CD2 LEU A 11 -6.884 11.789 1.192 1.00 0.00 C ATOM 0 H LEU A 11 -4.119 13.811 4.449 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.775 11.814 5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.553 13.269 3.732 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.199 12.907 2.680 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.239 10.462 2.731 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.701 10.554 2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.991 10.993 4.355 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.622 12.262 3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.490 11.036 0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.366 12.762 1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.897 11.829 0.731 1.00 0.00 H new ATOM 143 N LEU A 12 -3.328 10.678 3.548 1.00 0.00 N ATOM 144 CA LEU A 12 -2.606 9.470 3.164 1.00 0.00 C ATOM 145 C LEU A 12 -2.056 8.750 4.392 1.00 0.00 C ATOM 146 O LEU A 12 -2.349 7.577 4.618 1.00 0.00 O ATOM 147 CB LEU A 12 -1.462 9.817 2.209 1.00 0.00 C ATOM 148 CG LEU A 12 -1.867 10.485 0.893 1.00 0.00 C ATOM 149 CD1 LEU A 12 -0.637 10.973 0.142 1.00 0.00 C ATOM 150 CD2 LEU A 12 -2.672 9.522 0.034 1.00 0.00 C ATOM 0 H LEU A 12 -2.901 11.546 3.223 1.00 0.00 H new ATOM 0 HA LEU A 12 -3.305 8.805 2.658 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.768 10.476 2.730 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.918 8.901 1.977 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.493 11.347 1.122 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.944 11.445 -0.791 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.100 11.696 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.015 10.127 -0.077 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.952 10.013 -0.898 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -2.070 8.641 -0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.572 9.221 0.570 1.00 0.00 H new ATOM 162 N ARG A 13 -1.260 9.463 5.182 1.00 0.00 N ATOM 163 CA ARG A 13 -0.670 8.893 6.388 1.00 0.00 C ATOM 164 C ARG A 13 -1.724 8.162 7.215 1.00 0.00 C ATOM 165 O ARG A 13 -1.472 7.081 7.746 1.00 0.00 O ATOM 166 CB ARG A 13 -0.017 9.991 7.230 1.00 0.00 C ATOM 167 CG ARG A 13 1.145 10.681 6.536 1.00 0.00 C ATOM 168 CD ARG A 13 1.421 12.050 7.137 1.00 0.00 C ATOM 169 NE ARG A 13 2.243 12.878 6.260 1.00 0.00 N ATOM 170 CZ ARG A 13 2.997 13.884 6.693 1.00 0.00 C ATOM 171 NH1 ARG A 13 3.032 14.183 7.984 1.00 0.00 N ATOM 172 NH2 ARG A 13 3.718 14.591 5.833 1.00 0.00 N ATOM 0 H ARG A 13 -1.009 10.436 5.009 1.00 0.00 H new ATOM 0 HA ARG A 13 0.092 8.175 6.085 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -0.770 10.736 7.487 1.00 0.00 H new ATOM 0 HB3 ARG A 13 0.335 9.558 8.166 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.038 10.061 6.616 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.925 10.787 5.474 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.476 12.557 7.333 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.923 11.930 8.097 1.00 0.00 H new ATOM 0 HE ARG A 13 2.239 12.674 5.261 1.00 0.00 H new ATOM 0 HH11 ARG A 13 2.480 13.641 8.648 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.611 14.955 8.313 1.00 0.00 H new ATOM 0 HH21 ARG A 13 3.694 14.363 4.839 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.296 15.363 6.166 1.00 0.00 H new ATOM 186 N LYS A 14 -2.907 8.759 7.319 1.00 0.00 N ATOM 187 CA LYS A 14 -3.999 8.165 8.079 1.00 0.00 C ATOM 188 C LYS A 14 -4.585 6.964 7.344 1.00 0.00 C ATOM 189 O LYS A 14 -4.754 5.891 7.923 1.00 0.00 O ATOM 190 CB LYS A 14 -5.094 9.205 8.334 1.00 0.00 C ATOM 191 CG LYS A 14 -6.350 8.625 8.961 1.00 0.00 C ATOM 192 CD LYS A 14 -7.346 8.178 7.904 1.00 0.00 C ATOM 193 CE LYS A 14 -8.079 9.363 7.292 1.00 0.00 C ATOM 194 NZ LYS A 14 -9.277 9.745 8.088 1.00 0.00 N ATOM 0 H LYS A 14 -3.133 9.654 6.886 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.600 7.824 9.034 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.699 9.984 8.986 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.357 9.683 7.390 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.084 7.778 9.593 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.813 9.371 9.606 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -6.825 7.627 7.121 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.068 7.493 8.349 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.401 10.214 7.225 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.383 9.116 6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.748 10.556 7.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.936 8.941 8.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.985 10.005 9.052 1.00 0.00 H new ATOM 208 N THR A 15 -4.891 7.152 6.064 1.00 0.00 N ATOM 209 CA THR A 15 -5.458 6.083 5.250 1.00 0.00 C ATOM 210 C THR A 15 -4.595 4.828 5.313 1.00 0.00 C ATOM 211 O THR A 15 -5.094 3.732 5.571 1.00 0.00 O ATOM 212 CB THR A 15 -5.606 6.517 3.780 1.00 0.00 C ATOM 213 OG1 THR A 15 -6.669 7.468 3.654 1.00 0.00 O ATOM 214 CG2 THR A 15 -5.884 5.317 2.887 1.00 0.00 C ATOM 0 H THR A 15 -4.756 8.033 5.569 1.00 0.00 H new ATOM 0 HA THR A 15 -6.445 5.863 5.658 1.00 0.00 H new ATOM 0 HB THR A 15 -4.669 6.976 3.464 1.00 0.00 H new ATOM 0 HG1 THR A 15 -6.360 8.346 3.960 1.00 0.00 H new ATOM 0 HG21 THR A 15 -5.985 5.648 1.853 1.00 0.00 H new ATOM 0 HG22 THR A 15 -5.059 4.609 2.962 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.808 4.833 3.205 1.00 0.00 H new ATOM 222 N LEU A 16 -3.298 4.995 5.076 1.00 0.00 N ATOM 223 CA LEU A 16 -2.365 3.874 5.106 1.00 0.00 C ATOM 224 C LEU A 16 -2.572 3.027 6.358 1.00 0.00 C ATOM 225 O LEU A 16 -2.570 1.798 6.294 1.00 0.00 O ATOM 226 CB LEU A 16 -0.924 4.383 5.054 1.00 0.00 C ATOM 227 CG LEU A 16 0.154 3.394 5.501 1.00 0.00 C ATOM 228 CD1 LEU A 16 0.452 2.395 4.393 1.00 0.00 C ATOM 229 CD2 LEU A 16 1.419 4.134 5.910 1.00 0.00 C ATOM 0 H LEU A 16 -2.869 5.895 4.861 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.556 3.251 4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.705 4.690 4.031 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.852 5.274 5.677 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.217 2.846 6.367 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.221 1.699 4.728 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.455 1.843 4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.804 2.927 3.509 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.175 3.415 6.225 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.795 4.708 5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.195 4.810 6.735 1.00 0.00 H new ATOM 241 N GLU A 17 -2.754 3.693 7.494 1.00 0.00 N ATOM 242 CA GLU A 17 -2.965 3.001 8.760 1.00 0.00 C ATOM 243 C GLU A 17 -4.192 2.097 8.688 1.00 0.00 C ATOM 244 O GLU A 17 -4.152 0.945 9.117 1.00 0.00 O ATOM 245 CB GLU A 17 -3.125 4.009 9.898 1.00 0.00 C ATOM 246 CG GLU A 17 -1.873 4.825 10.170 1.00 0.00 C ATOM 247 CD GLU A 17 -2.059 5.822 11.298 1.00 0.00 C ATOM 248 OE1 GLU A 17 -2.785 6.817 11.097 1.00 0.00 O ATOM 249 OE2 GLU A 17 -1.478 5.605 12.382 1.00 0.00 O ATOM 0 H GLU A 17 -2.760 4.711 7.563 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.090 2.381 8.956 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.945 4.686 9.659 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.406 3.477 10.807 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.052 4.152 10.417 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.587 5.358 9.263 1.00 0.00 H new ATOM 256 N GLN A 18 -5.281 2.631 8.145 1.00 0.00 N ATOM 257 CA GLN A 18 -6.521 1.874 8.019 1.00 0.00 C ATOM 258 C GLN A 18 -6.281 0.552 7.299 1.00 0.00 C ATOM 259 O GLN A 18 -6.934 -0.452 7.585 1.00 0.00 O ATOM 260 CB GLN A 18 -7.571 2.695 7.266 1.00 0.00 C ATOM 261 CG GLN A 18 -7.968 3.977 7.981 1.00 0.00 C ATOM 262 CD GLN A 18 -9.331 4.485 7.554 1.00 0.00 C ATOM 263 OE1 GLN A 18 -10.361 4.005 8.029 1.00 0.00 O ATOM 264 NE2 GLN A 18 -9.344 5.461 6.654 1.00 0.00 N ATOM 0 H GLN A 18 -5.330 3.584 7.785 1.00 0.00 H new ATOM 0 HA GLN A 18 -6.889 1.659 9.022 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.185 2.945 6.278 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -8.460 2.082 7.116 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -7.970 3.803 9.057 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -7.220 4.745 7.784 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -8.466 5.829 6.288 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -10.232 5.843 6.329 1.00 0.00 H new ATOM 273 N LEU A 19 -5.340 0.557 6.361 1.00 0.00 N ATOM 274 CA LEU A 19 -5.012 -0.642 5.598 1.00 0.00 C ATOM 275 C LEU A 19 -4.385 -1.705 6.496 1.00 0.00 C ATOM 276 O LEU A 19 -4.759 -2.875 6.443 1.00 0.00 O ATOM 277 CB LEU A 19 -4.059 -0.299 4.452 1.00 0.00 C ATOM 278 CG LEU A 19 -4.589 0.688 3.412 1.00 0.00 C ATOM 279 CD1 LEU A 19 -3.448 1.249 2.577 1.00 0.00 C ATOM 280 CD2 LEU A 19 -5.625 0.018 2.520 1.00 0.00 C ATOM 0 H LEU A 19 -4.790 1.379 6.111 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.937 -1.042 5.184 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.143 0.110 4.878 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.789 -1.223 3.942 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.069 1.515 3.936 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.845 1.950 1.842 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.742 1.766 3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.939 0.434 2.063 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.991 0.735 1.786 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.169 -0.828 2.005 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.457 -0.334 3.130 1.00 0.00 H new ATOM 292 N GLN A 20 -3.429 -1.285 7.320 1.00 0.00 N ATOM 293 CA GLN A 20 -2.752 -2.200 8.231 1.00 0.00 C ATOM 294 C GLN A 20 -3.760 -3.000 9.050 1.00 0.00 C ATOM 295 O GLN A 20 -3.689 -4.226 9.112 1.00 0.00 O ATOM 296 CB GLN A 20 -1.817 -1.427 9.163 1.00 0.00 C ATOM 297 CG GLN A 20 -0.753 -0.626 8.430 1.00 0.00 C ATOM 298 CD GLN A 20 0.515 -0.458 9.244 1.00 0.00 C ATOM 299 OE1 GLN A 20 0.930 0.662 9.543 1.00 0.00 O ATOM 300 NE2 GLN A 20 1.137 -1.573 9.609 1.00 0.00 N ATOM 0 H GLN A 20 -3.107 -0.319 7.375 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.163 -2.897 7.634 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.409 -0.750 9.779 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.330 -2.129 9.839 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.513 -1.122 7.490 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -1.152 0.357 8.179 1.00 0.00 H new ATOM 0 HE21 GLN A 20 0.757 -2.480 9.339 1.00 0.00 H new ATOM 0 HE22 GLN A 20 1.994 -1.522 10.159 1.00 0.00 H new ATOM 309 N GLU A 21 -4.695 -2.295 9.678 1.00 0.00 N ATOM 310 CA GLU A 21 -5.717 -2.940 10.496 1.00 0.00 C ATOM 311 C GLU A 21 -6.166 -4.255 9.866 1.00 0.00 C ATOM 312 O GLU A 21 -6.251 -5.283 10.539 1.00 0.00 O ATOM 313 CB GLU A 21 -6.919 -2.011 10.676 1.00 0.00 C ATOM 314 CG GLU A 21 -6.645 -0.833 11.595 1.00 0.00 C ATOM 315 CD GLU A 21 -6.935 -1.149 13.050 1.00 0.00 C ATOM 316 OE1 GLU A 21 -7.950 -1.824 13.319 1.00 0.00 O ATOM 317 OE2 GLU A 21 -6.146 -0.721 13.918 1.00 0.00 O ATOM 0 H GLU A 21 -4.767 -1.278 9.637 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.284 -3.154 11.473 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.227 -1.636 9.700 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.755 -2.585 11.075 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.602 -0.532 11.493 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.254 0.016 11.283 1.00 0.00 H new ATOM 324 N LYS A 22 -6.454 -4.215 8.569 1.00 0.00 N ATOM 325 CA LYS A 22 -6.894 -5.403 7.846 1.00 0.00 C ATOM 326 C LYS A 22 -5.899 -6.546 8.020 1.00 0.00 C ATOM 327 O LYS A 22 -6.289 -7.698 8.211 1.00 0.00 O ATOM 328 CB LYS A 22 -7.068 -5.085 6.360 1.00 0.00 C ATOM 329 CG LYS A 22 -8.149 -4.056 6.080 1.00 0.00 C ATOM 330 CD LYS A 22 -9.491 -4.488 6.646 1.00 0.00 C ATOM 331 CE LYS A 22 -10.589 -3.496 6.297 1.00 0.00 C ATOM 332 NZ LYS A 22 -11.946 -4.074 6.507 1.00 0.00 N ATOM 0 H LYS A 22 -6.391 -3.373 7.997 1.00 0.00 H new ATOM 0 HA LYS A 22 -7.853 -5.715 8.259 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.121 -4.722 5.962 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.307 -6.005 5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.862 -3.098 6.514 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -8.239 -3.905 5.004 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.751 -5.472 6.257 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.416 -4.583 7.729 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.477 -2.600 6.908 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.483 -3.187 5.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.633 -3.573 5.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.937 -5.083 6.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.217 -3.970 7.506 1.00 0.00 H new ATOM 346 N ASP A 23 -4.613 -6.220 7.953 1.00 0.00 N ATOM 347 CA ASP A 23 -3.561 -7.218 8.106 1.00 0.00 C ATOM 348 C ASP A 23 -3.346 -7.562 9.576 1.00 0.00 C ATOM 349 O ASP A 23 -2.455 -7.019 10.228 1.00 0.00 O ATOM 350 CB ASP A 23 -2.255 -6.713 7.490 1.00 0.00 C ATOM 351 CG ASP A 23 -1.273 -7.835 7.214 1.00 0.00 C ATOM 352 OD1 ASP A 23 -1.722 -8.930 6.813 1.00 0.00 O ATOM 353 OD2 ASP A 23 -0.057 -7.620 7.399 1.00 0.00 O ATOM 0 H ASP A 23 -4.274 -5.271 7.794 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.874 -8.122 7.583 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.474 -6.189 6.560 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.795 -5.989 8.163 1.00 0.00 H new ATOM 358 N THR A 24 -4.172 -8.466 10.094 1.00 0.00 N ATOM 359 CA THR A 24 -4.074 -8.881 11.488 1.00 0.00 C ATOM 360 C THR A 24 -2.770 -9.626 11.751 1.00 0.00 C ATOM 361 O THR A 24 -2.195 -9.528 12.833 1.00 0.00 O ATOM 362 CB THR A 24 -5.256 -9.781 11.891 1.00 0.00 C ATOM 363 OG1 THR A 24 -5.233 -10.993 11.129 1.00 0.00 O ATOM 364 CG2 THR A 24 -6.581 -9.065 11.672 1.00 0.00 C ATOM 0 H THR A 24 -4.916 -8.925 9.569 1.00 0.00 H new ATOM 0 HA THR A 24 -4.097 -7.972 12.089 1.00 0.00 H new ATOM 0 HB THR A 24 -5.158 -10.017 12.951 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.987 -11.560 11.393 1.00 0.00 H new ATOM 0 HG21 THR A 24 -7.401 -9.721 11.964 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.609 -8.158 12.276 1.00 0.00 H new ATOM 0 HG23 THR A 24 -6.683 -8.803 10.619 1.00 0.00 H new ATOM 372 N GLY A 25 -2.308 -10.372 10.751 1.00 0.00 N ATOM 373 CA GLY A 25 -1.075 -11.122 10.894 1.00 0.00 C ATOM 374 C GLY A 25 0.156 -10.245 10.769 1.00 0.00 C ATOM 375 O GLY A 25 1.253 -10.648 11.150 1.00 0.00 O ATOM 0 H GLY A 25 -2.766 -10.470 9.845 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.066 -11.619 11.864 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -1.039 -11.904 10.135 1.00 0.00 H new ATOM 379 N ASN A 26 -0.028 -9.045 10.230 1.00 0.00 N ATOM 380 CA ASN A 26 1.077 -8.110 10.053 1.00 0.00 C ATOM 381 C ASN A 26 2.185 -8.731 9.209 1.00 0.00 C ATOM 382 O ASN A 26 3.370 -8.519 9.469 1.00 0.00 O ATOM 383 CB ASN A 26 1.635 -7.684 11.413 1.00 0.00 C ATOM 384 CG ASN A 26 0.549 -7.531 12.461 1.00 0.00 C ATOM 385 OD1 ASN A 26 0.401 -8.376 13.344 1.00 0.00 O ATOM 386 ND2 ASN A 26 -0.217 -6.451 12.367 1.00 0.00 N ATOM 0 H ASN A 26 -0.931 -8.697 9.908 1.00 0.00 H new ATOM 0 HA ASN A 26 0.697 -7.231 9.532 1.00 0.00 H new ATOM 0 HB2 ASN A 26 2.362 -8.422 11.752 1.00 0.00 H new ATOM 0 HB3 ASN A 26 2.167 -6.739 11.305 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -0.964 -6.295 13.043 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.058 -5.777 11.618 1.00 0.00 H new ATOM 393 N ILE A 27 1.792 -9.495 8.196 1.00 0.00 N ATOM 394 CA ILE A 27 2.752 -10.146 7.312 1.00 0.00 C ATOM 395 C ILE A 27 3.442 -9.130 6.408 1.00 0.00 C ATOM 396 O ILE A 27 4.638 -9.237 6.135 1.00 0.00 O ATOM 397 CB ILE A 27 2.076 -11.219 6.438 1.00 0.00 C ATOM 398 CG1 ILE A 27 1.412 -12.280 7.318 1.00 0.00 C ATOM 399 CG2 ILE A 27 3.091 -11.857 5.503 1.00 0.00 C ATOM 400 CD1 ILE A 27 0.633 -13.314 6.534 1.00 0.00 C ATOM 0 H ILE A 27 0.815 -9.679 7.966 1.00 0.00 H new ATOM 0 HA ILE A 27 3.495 -10.625 7.950 1.00 0.00 H new ATOM 0 HB ILE A 27 1.305 -10.742 5.833 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.179 -12.784 7.907 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.741 -11.788 8.022 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.598 -12.613 4.892 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.521 -11.092 4.857 1.00 0.00 H new ATOM 0 HG23 ILE A 27 3.883 -12.324 6.089 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.190 -14.034 7.222 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.156 -12.821 5.966 1.00 0.00 H new ATOM 0 HD13 ILE A 27 1.304 -13.832 5.849 1.00 0.00 H new ATOM 412 N PHE A 28 2.680 -8.144 5.946 1.00 0.00 N ATOM 413 CA PHE A 28 3.218 -7.108 5.073 1.00 0.00 C ATOM 414 C PHE A 28 3.684 -5.901 5.883 1.00 0.00 C ATOM 415 O PHE A 28 4.378 -5.024 5.368 1.00 0.00 O ATOM 416 CB PHE A 28 2.164 -6.674 4.052 1.00 0.00 C ATOM 417 CG PHE A 28 1.355 -7.814 3.505 1.00 0.00 C ATOM 418 CD1 PHE A 28 0.214 -8.250 4.161 1.00 0.00 C ATOM 419 CD2 PHE A 28 1.733 -8.451 2.334 1.00 0.00 C ATOM 420 CE1 PHE A 28 -0.531 -9.299 3.660 1.00 0.00 C ATOM 421 CE2 PHE A 28 0.990 -9.501 1.827 1.00 0.00 C ATOM 422 CZ PHE A 28 -0.145 -9.925 2.491 1.00 0.00 C ATOM 0 H PHE A 28 1.688 -8.041 6.162 1.00 0.00 H new ATOM 0 HA PHE A 28 4.077 -7.523 4.545 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.492 -5.953 4.519 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.658 -6.161 3.227 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -0.096 -7.764 5.074 1.00 0.00 H new ATOM 0 HD2 PHE A 28 2.619 -8.123 1.811 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.416 -9.630 4.183 1.00 0.00 H new ATOM 0 HE2 PHE A 28 1.296 -9.989 0.913 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.729 -10.744 2.097 1.00 0.00 H new ATOM 432 N SER A 29 3.298 -5.865 7.155 1.00 0.00 N ATOM 433 CA SER A 29 3.671 -4.764 8.036 1.00 0.00 C ATOM 434 C SER A 29 5.178 -4.528 8.000 1.00 0.00 C ATOM 435 O SER A 29 5.661 -3.474 8.413 1.00 0.00 O ATOM 436 CB SER A 29 3.223 -5.056 9.469 1.00 0.00 C ATOM 437 OG SER A 29 2.977 -3.856 10.181 1.00 0.00 O ATOM 0 H SER A 29 2.728 -6.585 7.598 1.00 0.00 H new ATOM 0 HA SER A 29 3.170 -3.862 7.683 1.00 0.00 H new ATOM 0 HB2 SER A 29 2.319 -5.665 9.454 1.00 0.00 H new ATOM 0 HB3 SER A 29 3.990 -5.636 9.982 1.00 0.00 H new ATOM 0 HG SER A 29 2.691 -4.070 11.093 1.00 0.00 H new ATOM 443 N GLU A 30 5.914 -5.518 7.503 1.00 0.00 N ATOM 444 CA GLU A 30 7.366 -5.418 7.415 1.00 0.00 C ATOM 445 C GLU A 30 7.870 -5.973 6.085 1.00 0.00 C ATOM 446 O GLU A 30 7.256 -6.850 5.478 1.00 0.00 O ATOM 447 CB GLU A 30 8.023 -6.167 8.575 1.00 0.00 C ATOM 448 CG GLU A 30 7.468 -5.789 9.937 1.00 0.00 C ATOM 449 CD GLU A 30 8.445 -6.064 11.064 1.00 0.00 C ATOM 450 OE1 GLU A 30 8.812 -7.242 11.257 1.00 0.00 O ATOM 451 OE2 GLU A 30 8.843 -5.101 11.753 1.00 0.00 O ATOM 0 H GLU A 30 5.529 -6.397 7.156 1.00 0.00 H new ATOM 0 HA GLU A 30 7.636 -4.364 7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 30 7.893 -7.239 8.424 1.00 0.00 H new ATOM 0 HB3 GLU A 30 9.095 -5.971 8.562 1.00 0.00 H new ATOM 0 HG2 GLU A 30 7.208 -4.731 9.938 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.547 -6.344 10.116 1.00 0.00 H new ATOM 458 N PRO A 31 9.015 -5.451 5.622 1.00 0.00 N ATOM 459 CA PRO A 31 9.627 -5.879 4.360 1.00 0.00 C ATOM 460 C PRO A 31 10.191 -7.293 4.441 1.00 0.00 C ATOM 461 O PRO A 31 10.862 -7.652 5.408 1.00 0.00 O ATOM 462 CB PRO A 31 10.754 -4.865 4.151 1.00 0.00 C ATOM 463 CG PRO A 31 11.090 -4.384 5.520 1.00 0.00 C ATOM 464 CD PRO A 31 9.801 -4.402 6.294 1.00 0.00 C ATOM 0 HA PRO A 31 8.904 -5.907 3.545 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.617 -5.326 3.671 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.433 -4.043 3.510 1.00 0.00 H new ATOM 0 HG2 PRO A 31 11.835 -5.028 5.988 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.512 -3.379 5.488 1.00 0.00 H new ATOM 0 HD2 PRO A 31 9.967 -4.636 7.346 1.00 0.00 H new ATOM 0 HD3 PRO A 31 9.297 -3.436 6.258 1.00 0.00 H new ATOM 472 N VAL A 32 9.913 -8.095 3.417 1.00 0.00 N ATOM 473 CA VAL A 32 10.393 -9.470 3.371 1.00 0.00 C ATOM 474 C VAL A 32 11.915 -9.525 3.460 1.00 0.00 C ATOM 475 O VAL A 32 12.629 -8.883 2.689 1.00 0.00 O ATOM 476 CB VAL A 32 9.940 -10.180 2.081 1.00 0.00 C ATOM 477 CG1 VAL A 32 10.451 -11.613 2.052 1.00 0.00 C ATOM 478 CG2 VAL A 32 8.425 -10.144 1.958 1.00 0.00 C ATOM 0 H VAL A 32 9.358 -7.815 2.609 1.00 0.00 H new ATOM 0 HA VAL A 32 9.963 -9.984 4.231 1.00 0.00 H new ATOM 0 HB VAL A 32 10.364 -9.651 1.228 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.121 -12.098 1.134 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.540 -11.612 2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.058 -12.157 2.911 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.122 -10.650 1.041 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.978 -10.648 2.815 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.087 -9.108 1.929 1.00 0.00 H new ATOM 488 N PRO A 33 12.423 -10.308 4.423 1.00 0.00 N ATOM 489 CA PRO A 33 13.865 -10.465 4.635 1.00 0.00 C ATOM 490 C PRO A 33 14.535 -11.246 3.510 1.00 0.00 C ATOM 491 O PRO A 33 13.970 -12.206 2.984 1.00 0.00 O ATOM 492 CB PRO A 33 13.946 -11.246 5.949 1.00 0.00 C ATOM 493 CG PRO A 33 12.655 -11.985 6.031 1.00 0.00 C ATOM 494 CD PRO A 33 11.631 -11.101 5.377 1.00 0.00 C ATOM 0 HA PRO A 33 14.380 -9.505 4.660 1.00 0.00 H new ATOM 0 HB2 PRO A 33 14.795 -11.930 5.951 1.00 0.00 H new ATOM 0 HB3 PRO A 33 14.074 -10.577 6.800 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.723 -12.947 5.522 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.388 -12.191 7.068 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.861 -11.684 4.872 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.125 -10.466 6.104 1.00 0.00 H new ATOM 502 N LEU A 34 15.743 -10.829 3.144 1.00 0.00 N ATOM 503 CA LEU A 34 16.491 -11.490 2.080 1.00 0.00 C ATOM 504 C LEU A 34 17.182 -12.746 2.600 1.00 0.00 C ATOM 505 O LEU A 34 17.437 -13.683 1.845 1.00 0.00 O ATOM 506 CB LEU A 34 17.525 -10.532 1.487 1.00 0.00 C ATOM 507 CG LEU A 34 16.967 -9.332 0.721 1.00 0.00 C ATOM 508 CD1 LEU A 34 18.099 -8.484 0.161 1.00 0.00 C ATOM 509 CD2 LEU A 34 16.044 -9.795 -0.396 1.00 0.00 C ATOM 0 H LEU A 34 16.225 -10.036 3.568 1.00 0.00 H new ATOM 0 HA LEU A 34 15.787 -11.782 1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.153 -10.161 2.297 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.172 -11.097 0.816 1.00 0.00 H new ATOM 0 HG LEU A 34 16.389 -8.720 1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.683 -7.635 -0.381 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.722 -8.123 0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.704 -9.086 -0.517 1.00 0.00 H new ATOM 0 HD21 LEU A 34 15.656 -8.928 -0.930 1.00 0.00 H new ATOM 0 HD22 LEU A 34 16.599 -10.429 -1.087 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.214 -10.361 0.028 1.00 0.00 H new ATOM 521 N SER A 35 17.482 -12.756 3.895 1.00 0.00 N ATOM 522 CA SER A 35 18.146 -13.897 4.516 1.00 0.00 C ATOM 523 C SER A 35 17.477 -15.204 4.105 1.00 0.00 C ATOM 524 O SER A 35 18.149 -16.174 3.756 1.00 0.00 O ATOM 525 CB SER A 35 18.128 -13.757 6.039 1.00 0.00 C ATOM 526 OG SER A 35 19.040 -14.656 6.645 1.00 0.00 O ATOM 0 H SER A 35 17.276 -11.988 4.534 1.00 0.00 H new ATOM 0 HA SER A 35 19.180 -13.916 4.173 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.383 -12.734 6.316 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.122 -13.948 6.413 1.00 0.00 H new ATOM 0 HG SER A 35 19.010 -14.545 7.618 1.00 0.00 H new ATOM 532 N GLU A 36 16.148 -15.222 4.151 1.00 0.00 N ATOM 533 CA GLU A 36 15.388 -16.411 3.785 1.00 0.00 C ATOM 534 C GLU A 36 15.039 -16.398 2.299 1.00 0.00 C ATOM 535 O GLU A 36 14.854 -17.448 1.684 1.00 0.00 O ATOM 536 CB GLU A 36 14.108 -16.502 4.619 1.00 0.00 C ATOM 537 CG GLU A 36 13.438 -17.865 4.559 1.00 0.00 C ATOM 538 CD GLU A 36 12.481 -17.993 3.390 1.00 0.00 C ATOM 539 OE1 GLU A 36 11.982 -16.951 2.915 1.00 0.00 O ATOM 540 OE2 GLU A 36 12.231 -19.135 2.950 1.00 0.00 O ATOM 0 H GLU A 36 15.576 -14.427 4.438 1.00 0.00 H new ATOM 0 HA GLU A 36 16.009 -17.284 3.988 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.343 -16.268 5.657 1.00 0.00 H new ATOM 0 HB3 GLU A 36 13.404 -15.745 4.273 1.00 0.00 H new ATOM 0 HG2 GLU A 36 14.202 -18.639 4.484 1.00 0.00 H new ATOM 0 HG3 GLU A 36 12.896 -18.041 5.488 1.00 0.00 H new ATOM 547 N VAL A 37 14.952 -15.200 1.729 1.00 0.00 N ATOM 548 CA VAL A 37 14.626 -15.049 0.315 1.00 0.00 C ATOM 549 C VAL A 37 15.763 -14.371 -0.441 1.00 0.00 C ATOM 550 O VAL A 37 15.762 -13.158 -0.655 1.00 0.00 O ATOM 551 CB VAL A 37 13.335 -14.232 0.122 1.00 0.00 C ATOM 552 CG1 VAL A 37 12.671 -14.586 -1.200 1.00 0.00 C ATOM 553 CG2 VAL A 37 12.381 -14.459 1.284 1.00 0.00 C ATOM 0 H VAL A 37 15.102 -14.321 2.224 1.00 0.00 H new ATOM 0 HA VAL A 37 14.475 -16.052 -0.085 1.00 0.00 H new ATOM 0 HB VAL A 37 13.597 -13.174 0.098 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.760 -13.999 -1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.354 -14.366 -2.021 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.422 -15.647 -1.209 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.474 -13.874 1.130 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.124 -15.517 1.343 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.859 -14.150 2.213 1.00 0.00 H new ATOM 563 N PRO A 38 16.756 -15.170 -0.857 1.00 0.00 N ATOM 564 CA PRO A 38 17.917 -14.669 -1.597 1.00 0.00 C ATOM 565 C PRO A 38 17.556 -14.220 -3.008 1.00 0.00 C ATOM 566 O PRO A 38 18.294 -13.460 -3.636 1.00 0.00 O ATOM 567 CB PRO A 38 18.857 -15.878 -1.644 1.00 0.00 C ATOM 568 CG PRO A 38 17.959 -17.060 -1.520 1.00 0.00 C ATOM 569 CD PRO A 38 16.822 -16.625 -0.637 1.00 0.00 C ATOM 0 HA PRO A 38 18.354 -13.790 -1.123 1.00 0.00 H new ATOM 0 HB2 PRO A 38 19.421 -15.905 -2.576 1.00 0.00 H new ATOM 0 HB3 PRO A 38 19.584 -15.846 -0.833 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.595 -17.378 -2.497 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.488 -17.908 -1.086 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.889 -17.116 -0.913 1.00 0.00 H new ATOM 0 HD3 PRO A 38 17.011 -16.865 0.409 1.00 0.00 H new ATOM 577 N ASP A 39 16.417 -14.695 -3.502 1.00 0.00 N ATOM 578 CA ASP A 39 15.957 -14.340 -4.840 1.00 0.00 C ATOM 579 C ASP A 39 14.705 -13.472 -4.771 1.00 0.00 C ATOM 580 O ASP A 39 13.888 -13.468 -5.692 1.00 0.00 O ATOM 581 CB ASP A 39 15.674 -15.602 -5.655 1.00 0.00 C ATOM 582 CG ASP A 39 16.935 -16.379 -5.977 1.00 0.00 C ATOM 583 OD1 ASP A 39 17.921 -15.753 -6.418 1.00 0.00 O ATOM 584 OD2 ASP A 39 16.936 -17.614 -5.787 1.00 0.00 O ATOM 0 H ASP A 39 15.796 -15.326 -2.996 1.00 0.00 H new ATOM 0 HA ASP A 39 16.746 -13.769 -5.330 1.00 0.00 H new ATOM 0 HB2 ASP A 39 14.988 -16.242 -5.101 1.00 0.00 H new ATOM 0 HB3 ASP A 39 15.174 -15.327 -6.583 1.00 0.00 H new ATOM 589 N TYR A 40 14.559 -12.738 -3.673 1.00 0.00 N ATOM 590 CA TYR A 40 13.405 -11.868 -3.482 1.00 0.00 C ATOM 591 C TYR A 40 13.250 -10.904 -4.654 1.00 0.00 C ATOM 592 O TYR A 40 12.217 -10.884 -5.326 1.00 0.00 O ATOM 593 CB TYR A 40 13.540 -11.085 -2.176 1.00 0.00 C ATOM 594 CG TYR A 40 12.346 -10.208 -1.869 1.00 0.00 C ATOM 595 CD1 TYR A 40 11.052 -10.687 -2.017 1.00 0.00 C ATOM 596 CD2 TYR A 40 12.515 -8.901 -1.431 1.00 0.00 C ATOM 597 CE1 TYR A 40 9.959 -9.890 -1.739 1.00 0.00 C ATOM 598 CE2 TYR A 40 11.429 -8.096 -1.148 1.00 0.00 C ATOM 599 CZ TYR A 40 10.152 -8.595 -1.304 1.00 0.00 C ATOM 600 OH TYR A 40 9.066 -7.797 -1.024 1.00 0.00 O ATOM 0 H TYR A 40 15.226 -12.729 -2.901 1.00 0.00 H new ATOM 0 HA TYR A 40 12.514 -12.494 -3.430 1.00 0.00 H new ATOM 0 HB2 TYR A 40 13.685 -11.787 -1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 40 14.434 -10.463 -2.226 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.897 -11.701 -2.356 1.00 0.00 H new ATOM 0 HD2 TYR A 40 13.513 -8.507 -1.310 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.959 -10.278 -1.861 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.578 -7.082 -0.807 1.00 0.00 H new ATOM 0 HH TYR A 40 9.375 -6.915 -0.728 1.00 0.00 H new ATOM 610 N LEU A 41 14.284 -10.104 -4.894 1.00 0.00 N ATOM 611 CA LEU A 41 14.265 -9.137 -5.985 1.00 0.00 C ATOM 612 C LEU A 41 14.233 -9.841 -7.338 1.00 0.00 C ATOM 613 O LEU A 41 13.511 -9.430 -8.246 1.00 0.00 O ATOM 614 CB LEU A 41 15.489 -8.222 -5.903 1.00 0.00 C ATOM 615 CG LEU A 41 15.775 -7.606 -4.533 1.00 0.00 C ATOM 616 CD1 LEU A 41 17.109 -6.876 -4.544 1.00 0.00 C ATOM 617 CD2 LEU A 41 14.652 -6.662 -4.129 1.00 0.00 C ATOM 0 H LEU A 41 15.145 -10.106 -4.348 1.00 0.00 H new ATOM 0 HA LEU A 41 13.361 -8.536 -5.888 1.00 0.00 H new ATOM 0 HB2 LEU A 41 16.365 -8.792 -6.213 1.00 0.00 H new ATOM 0 HB3 LEU A 41 15.363 -7.414 -6.623 1.00 0.00 H new ATOM 0 HG LEU A 41 15.830 -8.409 -3.798 1.00 0.00 H new ATOM 0 HD11 LEU A 41 17.296 -6.444 -3.561 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.906 -7.578 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU A 41 17.083 -6.082 -5.290 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.872 -6.232 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.566 -5.863 -4.865 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.713 -7.213 -4.080 1.00 0.00 H new ATOM 629 N ASP A 42 15.018 -10.905 -7.464 1.00 0.00 N ATOM 630 CA ASP A 42 15.078 -11.669 -8.705 1.00 0.00 C ATOM 631 C ASP A 42 13.694 -11.787 -9.337 1.00 0.00 C ATOM 632 O ASP A 42 13.550 -11.712 -10.558 1.00 0.00 O ATOM 633 CB ASP A 42 15.653 -13.062 -8.443 1.00 0.00 C ATOM 634 CG ASP A 42 15.964 -13.809 -9.725 1.00 0.00 C ATOM 635 OD1 ASP A 42 15.108 -13.810 -10.634 1.00 0.00 O ATOM 636 OD2 ASP A 42 17.063 -14.394 -9.820 1.00 0.00 O ATOM 0 H ASP A 42 15.622 -11.258 -6.722 1.00 0.00 H new ATOM 0 HA ASP A 42 15.731 -11.139 -9.399 1.00 0.00 H new ATOM 0 HB2 ASP A 42 16.562 -12.971 -7.849 1.00 0.00 H new ATOM 0 HB3 ASP A 42 14.943 -13.640 -7.852 1.00 0.00 H new ATOM 641 N HIS A 43 12.680 -11.970 -8.499 1.00 0.00 N ATOM 642 CA HIS A 43 11.307 -12.099 -8.975 1.00 0.00 C ATOM 643 C HIS A 43 10.535 -10.800 -8.763 1.00 0.00 C ATOM 644 O HIS A 43 9.632 -10.471 -9.534 1.00 0.00 O ATOM 645 CB HIS A 43 10.600 -13.249 -8.258 1.00 0.00 C ATOM 646 CG HIS A 43 11.215 -14.589 -8.525 1.00 0.00 C ATOM 647 ND1 HIS A 43 10.643 -15.524 -9.362 1.00 0.00 N ATOM 648 CD2 HIS A 43 12.358 -15.148 -8.063 1.00 0.00 C ATOM 649 CE1 HIS A 43 11.407 -16.602 -9.401 1.00 0.00 C ATOM 650 NE2 HIS A 43 12.454 -16.398 -8.622 1.00 0.00 N ATOM 0 H HIS A 43 12.782 -12.032 -7.486 1.00 0.00 H new ATOM 0 HA HIS A 43 11.338 -12.313 -10.043 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.613 -13.060 -7.185 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.555 -13.270 -8.566 1.00 0.00 H new ATOM 0 HD2 HIS A 43 13.063 -14.695 -7.382 1.00 0.00 H new ATOM 0 HE1 HIS A 43 11.209 -17.497 -9.972 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.211 -17.062 -8.462 1.00 0.00 H new ATOM 659 N ILE A 44 10.894 -10.069 -7.714 1.00 0.00 N ATOM 660 CA ILE A 44 10.234 -8.807 -7.402 1.00 0.00 C ATOM 661 C ILE A 44 11.087 -7.618 -7.836 1.00 0.00 C ATOM 662 O ILE A 44 12.080 -7.283 -7.190 1.00 0.00 O ATOM 663 CB ILE A 44 9.936 -8.686 -5.896 1.00 0.00 C ATOM 664 CG1 ILE A 44 8.922 -9.749 -5.468 1.00 0.00 C ATOM 665 CG2 ILE A 44 9.419 -7.292 -5.569 1.00 0.00 C ATOM 666 CD1 ILE A 44 7.805 -9.955 -6.466 1.00 0.00 C ATOM 0 H ILE A 44 11.638 -10.328 -7.066 1.00 0.00 H new ATOM 0 HA ILE A 44 9.294 -8.798 -7.953 1.00 0.00 H new ATOM 0 HB ILE A 44 10.861 -8.849 -5.343 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.442 -10.695 -5.316 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.492 -9.464 -4.508 1.00 0.00 H new ATOM 0 HG21 ILE A 44 9.213 -7.222 -4.501 1.00 0.00 H new ATOM 0 HG22 ILE A 44 10.171 -6.552 -5.843 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.503 -7.103 -6.129 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.124 -10.722 -6.097 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.260 -9.021 -6.600 1.00 0.00 H new ATOM 0 HD13 ILE A 44 8.224 -10.271 -7.421 1.00 0.00 H new ATOM 678 N LYS A 45 10.692 -6.984 -8.935 1.00 0.00 N ATOM 679 CA LYS A 45 11.416 -5.831 -9.456 1.00 0.00 C ATOM 680 C LYS A 45 11.317 -4.649 -8.498 1.00 0.00 C ATOM 681 O LYS A 45 12.307 -3.965 -8.236 1.00 0.00 O ATOM 682 CB LYS A 45 10.868 -5.437 -10.829 1.00 0.00 C ATOM 683 CG LYS A 45 11.200 -6.432 -11.927 1.00 0.00 C ATOM 684 CD LYS A 45 12.673 -6.380 -12.298 1.00 0.00 C ATOM 685 CE LYS A 45 12.931 -5.376 -13.413 1.00 0.00 C ATOM 686 NZ LYS A 45 12.383 -5.843 -14.717 1.00 0.00 N ATOM 0 H LYS A 45 9.873 -7.250 -9.482 1.00 0.00 H new ATOM 0 HA LYS A 45 12.466 -6.107 -9.557 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.785 -5.332 -10.762 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.267 -4.460 -11.103 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.942 -7.439 -11.598 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.594 -6.219 -12.808 1.00 0.00 H new ATOM 0 HD2 LYS A 45 13.261 -6.111 -11.421 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.005 -7.369 -12.613 1.00 0.00 H new ATOM 0 HE2 LYS A 45 12.480 -4.419 -13.151 1.00 0.00 H new ATOM 0 HE3 LYS A 45 14.004 -5.207 -13.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 12.863 -5.345 -15.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.540 -6.867 -14.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.363 -5.644 -14.756 1.00 0.00 H new ATOM 700 N LYS A 46 10.118 -4.415 -7.976 1.00 0.00 N ATOM 701 CA LYS A 46 9.889 -3.316 -7.044 1.00 0.00 C ATOM 702 C LYS A 46 9.227 -3.817 -5.765 1.00 0.00 C ATOM 703 O LYS A 46 8.003 -3.812 -5.629 1.00 0.00 O ATOM 704 CB LYS A 46 9.017 -2.240 -7.696 1.00 0.00 C ATOM 705 CG LYS A 46 8.804 -1.018 -6.820 1.00 0.00 C ATOM 706 CD LYS A 46 7.849 -0.029 -7.467 1.00 0.00 C ATOM 707 CE LYS A 46 7.184 0.863 -6.429 1.00 0.00 C ATOM 708 NZ LYS A 46 7.988 2.086 -6.152 1.00 0.00 N ATOM 0 H LYS A 46 9.289 -4.972 -8.182 1.00 0.00 H new ATOM 0 HA LYS A 46 10.856 -2.883 -6.786 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.478 -1.929 -8.633 1.00 0.00 H new ATOM 0 HB3 LYS A 46 8.048 -2.671 -7.945 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.409 -1.327 -5.852 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.761 -0.532 -6.633 1.00 0.00 H new ATOM 0 HD2 LYS A 46 8.392 0.587 -8.184 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.086 -0.571 -8.026 1.00 0.00 H new ATOM 0 HE2 LYS A 46 6.193 1.151 -6.779 1.00 0.00 H new ATOM 0 HE3 LYS A 46 7.045 0.303 -5.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 7.502 2.667 -5.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 8.925 1.812 -5.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.100 2.634 -7.029 1.00 0.00 H new ATOM 722 N PRO A 47 10.052 -4.259 -4.804 1.00 0.00 N ATOM 723 CA PRO A 47 9.568 -4.770 -3.518 1.00 0.00 C ATOM 724 C PRO A 47 8.978 -3.669 -2.642 1.00 0.00 C ATOM 725 O PRO A 47 9.710 -2.876 -2.050 1.00 0.00 O ATOM 726 CB PRO A 47 10.827 -5.352 -2.871 1.00 0.00 C ATOM 727 CG PRO A 47 11.953 -4.601 -3.492 1.00 0.00 C ATOM 728 CD PRO A 47 11.522 -4.294 -4.900 1.00 0.00 C ATOM 0 HA PRO A 47 8.763 -5.495 -3.644 1.00 0.00 H new ATOM 0 HB2 PRO A 47 10.813 -5.221 -1.789 1.00 0.00 H new ATOM 0 HB3 PRO A 47 10.912 -6.422 -3.062 1.00 0.00 H new ATOM 0 HG2 PRO A 47 12.162 -3.685 -2.940 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.868 -5.194 -3.485 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.925 -3.342 -5.246 1.00 0.00 H new ATOM 0 HD3 PRO A 47 11.861 -5.057 -5.600 1.00 0.00 H new ATOM 736 N MET A 48 7.653 -3.626 -2.566 1.00 0.00 N ATOM 737 CA MET A 48 6.966 -2.623 -1.761 1.00 0.00 C ATOM 738 C MET A 48 6.356 -3.252 -0.512 1.00 0.00 C ATOM 739 O MET A 48 5.983 -4.426 -0.516 1.00 0.00 O ATOM 740 CB MET A 48 5.876 -1.935 -2.584 1.00 0.00 C ATOM 741 CG MET A 48 5.079 -0.905 -1.800 1.00 0.00 C ATOM 742 SD MET A 48 6.087 0.492 -1.266 1.00 0.00 S ATOM 743 CE MET A 48 6.690 1.095 -2.841 1.00 0.00 C ATOM 0 H MET A 48 7.033 -4.274 -3.052 1.00 0.00 H new ATOM 0 HA MET A 48 7.700 -1.879 -1.450 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.335 -1.448 -3.445 1.00 0.00 H new ATOM 0 HB3 MET A 48 5.194 -2.691 -2.972 1.00 0.00 H new ATOM 0 HG2 MET A 48 4.257 -0.541 -2.417 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.635 -1.383 -0.927 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.020 2.128 -2.733 1.00 0.00 H new ATOM 0 HE2 MET A 48 7.527 0.479 -3.170 1.00 0.00 H new ATOM 0 HE3 MET A 48 5.890 1.045 -3.580 1.00 0.00 H new ATOM 753 N ASP A 49 6.256 -2.466 0.553 1.00 0.00 N ATOM 754 CA ASP A 49 5.689 -2.946 1.808 1.00 0.00 C ATOM 755 C ASP A 49 4.926 -1.834 2.521 1.00 0.00 C ATOM 756 O ASP A 49 4.787 -0.728 1.998 1.00 0.00 O ATOM 757 CB ASP A 49 6.794 -3.487 2.717 1.00 0.00 C ATOM 758 CG ASP A 49 8.114 -2.772 2.512 1.00 0.00 C ATOM 759 OD1 ASP A 49 8.592 -2.728 1.360 1.00 0.00 O ATOM 760 OD2 ASP A 49 8.671 -2.255 3.504 1.00 0.00 O ATOM 0 H ASP A 49 6.560 -1.493 0.573 1.00 0.00 H new ATOM 0 HA ASP A 49 4.991 -3.751 1.578 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.487 -3.385 3.758 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.928 -4.552 2.527 1.00 0.00 H new ATOM 765 N PHE A 50 4.432 -2.135 3.718 1.00 0.00 N ATOM 766 CA PHE A 50 3.681 -1.162 4.502 1.00 0.00 C ATOM 767 C PHE A 50 4.613 -0.111 5.101 1.00 0.00 C ATOM 768 O PHE A 50 4.232 1.048 5.270 1.00 0.00 O ATOM 769 CB PHE A 50 2.903 -1.864 5.616 1.00 0.00 C ATOM 770 CG PHE A 50 1.545 -2.343 5.189 1.00 0.00 C ATOM 771 CD1 PHE A 50 0.673 -1.494 4.526 1.00 0.00 C ATOM 772 CD2 PHE A 50 1.140 -3.642 5.450 1.00 0.00 C ATOM 773 CE1 PHE A 50 -0.577 -1.932 4.131 1.00 0.00 C ATOM 774 CE2 PHE A 50 -0.109 -4.086 5.057 1.00 0.00 C ATOM 775 CZ PHE A 50 -0.968 -3.229 4.399 1.00 0.00 C ATOM 0 H PHE A 50 4.539 -3.045 4.166 1.00 0.00 H new ATOM 0 HA PHE A 50 2.977 -0.662 3.837 1.00 0.00 H new ATOM 0 HB2 PHE A 50 3.484 -2.714 5.973 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.790 -1.179 6.457 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.974 -0.478 4.316 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.808 -4.316 5.966 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.247 -1.261 3.614 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.412 -5.102 5.264 1.00 0.00 H new ATOM 0 HZ PHE A 50 -1.945 -3.573 4.094 1.00 0.00 H new ATOM 785 N PHE A 51 5.834 -0.524 5.420 1.00 0.00 N ATOM 786 CA PHE A 51 6.820 0.379 6.001 1.00 0.00 C ATOM 787 C PHE A 51 7.571 1.139 4.911 1.00 0.00 C ATOM 788 O PHE A 51 7.855 2.329 5.050 1.00 0.00 O ATOM 789 CB PHE A 51 7.809 -0.401 6.869 1.00 0.00 C ATOM 790 CG PHE A 51 9.160 0.248 6.970 1.00 0.00 C ATOM 791 CD1 PHE A 51 9.347 1.368 7.764 1.00 0.00 C ATOM 792 CD2 PHE A 51 10.242 -0.260 6.270 1.00 0.00 C ATOM 793 CE1 PHE A 51 10.588 1.968 7.860 1.00 0.00 C ATOM 794 CE2 PHE A 51 11.486 0.335 6.363 1.00 0.00 C ATOM 795 CZ PHE A 51 11.659 1.452 7.158 1.00 0.00 C ATOM 0 H PHE A 51 6.165 -1.479 5.286 1.00 0.00 H new ATOM 0 HA PHE A 51 6.292 1.101 6.624 1.00 0.00 H new ATOM 0 HB2 PHE A 51 7.392 -0.512 7.870 1.00 0.00 H new ATOM 0 HB3 PHE A 51 7.927 -1.404 6.460 1.00 0.00 H new ATOM 0 HD1 PHE A 51 8.513 1.777 8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 51 10.112 -1.131 5.645 1.00 0.00 H new ATOM 0 HE1 PHE A 51 10.720 2.840 8.484 1.00 0.00 H new ATOM 0 HE2 PHE A 51 12.322 -0.073 5.815 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.630 1.920 7.230 1.00 0.00 H new ATOM 805 N THR A 52 7.889 0.442 3.825 1.00 0.00 N ATOM 806 CA THR A 52 8.609 1.048 2.712 1.00 0.00 C ATOM 807 C THR A 52 7.816 2.203 2.109 1.00 0.00 C ATOM 808 O THR A 52 8.356 3.287 1.884 1.00 0.00 O ATOM 809 CB THR A 52 8.909 0.017 1.608 1.00 0.00 C ATOM 810 OG1 THR A 52 9.997 -0.824 2.007 1.00 0.00 O ATOM 811 CG2 THR A 52 9.250 0.710 0.298 1.00 0.00 C ATOM 0 H THR A 52 7.659 -0.543 3.692 1.00 0.00 H new ATOM 0 HA THR A 52 9.550 1.425 3.113 1.00 0.00 H new ATOM 0 HB THR A 52 8.017 -0.591 1.456 1.00 0.00 H new ATOM 0 HG1 THR A 52 9.826 -1.176 2.906 1.00 0.00 H new ATOM 0 HG21 THR A 52 9.458 -0.039 -0.466 1.00 0.00 H new ATOM 0 HG22 THR A 52 8.408 1.326 -0.017 1.00 0.00 H new ATOM 0 HG23 THR A 52 10.129 1.340 0.438 1.00 0.00 H new ATOM 819 N MET A 53 6.535 1.966 1.852 1.00 0.00 N ATOM 820 CA MET A 53 5.669 2.988 1.278 1.00 0.00 C ATOM 821 C MET A 53 5.622 4.225 2.169 1.00 0.00 C ATOM 822 O MET A 53 5.690 5.355 1.684 1.00 0.00 O ATOM 823 CB MET A 53 4.256 2.437 1.078 1.00 0.00 C ATOM 824 CG MET A 53 3.606 1.950 2.363 1.00 0.00 C ATOM 825 SD MET A 53 2.043 1.100 2.073 1.00 0.00 S ATOM 826 CE MET A 53 1.122 2.371 1.210 1.00 0.00 C ATOM 0 H MET A 53 6.073 1.075 2.032 1.00 0.00 H new ATOM 0 HA MET A 53 6.081 3.274 0.310 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.631 3.213 0.636 1.00 0.00 H new ATOM 0 HB3 MET A 53 4.294 1.614 0.365 1.00 0.00 H new ATOM 0 HG2 MET A 53 4.291 1.277 2.879 1.00 0.00 H new ATOM 0 HG3 MET A 53 3.436 2.800 3.024 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.057 2.245 1.406 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.442 3.353 1.559 1.00 0.00 H new ATOM 0 HE3 MET A 53 1.306 2.290 0.139 1.00 0.00 H new ATOM 836 N LYS A 54 5.509 4.005 3.474 1.00 0.00 N ATOM 837 CA LYS A 54 5.456 5.101 4.434 1.00 0.00 C ATOM 838 C LYS A 54 6.661 6.023 4.275 1.00 0.00 C ATOM 839 O LYS A 54 6.510 7.235 4.124 1.00 0.00 O ATOM 840 CB LYS A 54 5.405 4.553 5.863 1.00 0.00 C ATOM 841 CG LYS A 54 5.255 5.632 6.922 1.00 0.00 C ATOM 842 CD LYS A 54 3.794 5.921 7.221 1.00 0.00 C ATOM 843 CE LYS A 54 3.627 6.625 8.559 1.00 0.00 C ATOM 844 NZ LYS A 54 2.266 7.207 8.712 1.00 0.00 N ATOM 0 H LYS A 54 5.452 3.076 3.892 1.00 0.00 H new ATOM 0 HA LYS A 54 4.552 5.677 4.240 1.00 0.00 H new ATOM 0 HB2 LYS A 54 4.572 3.855 5.946 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.316 3.987 6.059 1.00 0.00 H new ATOM 0 HG2 LYS A 54 5.759 5.318 7.836 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.746 6.545 6.584 1.00 0.00 H new ATOM 0 HD2 LYS A 54 3.375 6.540 6.428 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.231 4.987 7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.813 5.918 9.367 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.372 7.415 8.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 2.192 7.678 9.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 2.098 7.901 7.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 1.556 6.450 8.651 1.00 0.00 H new ATOM 858 N GLN A 55 7.855 5.440 4.308 1.00 0.00 N ATOM 859 CA GLN A 55 9.085 6.210 4.166 1.00 0.00 C ATOM 860 C GLN A 55 8.986 7.183 2.995 1.00 0.00 C ATOM 861 O GLN A 55 9.312 8.362 3.126 1.00 0.00 O ATOM 862 CB GLN A 55 10.278 5.274 3.967 1.00 0.00 C ATOM 863 CG GLN A 55 10.458 4.271 5.095 1.00 0.00 C ATOM 864 CD GLN A 55 11.202 4.854 6.281 1.00 0.00 C ATOM 865 OE1 GLN A 55 12.393 5.155 6.194 1.00 0.00 O ATOM 866 NE2 GLN A 55 10.502 5.015 7.399 1.00 0.00 N ATOM 0 H GLN A 55 7.997 4.437 4.432 1.00 0.00 H new ATOM 0 HA GLN A 55 9.232 6.784 5.081 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.153 4.734 3.028 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.186 5.870 3.874 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.480 3.918 5.422 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.001 3.403 4.721 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.517 4.752 7.426 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.950 5.402 8.230 1.00 0.00 H new ATOM 875 N ASN A 56 8.535 6.680 1.850 1.00 0.00 N ATOM 876 CA ASN A 56 8.394 7.504 0.657 1.00 0.00 C ATOM 877 C ASN A 56 7.298 8.549 0.842 1.00 0.00 C ATOM 878 O ASN A 56 7.430 9.690 0.397 1.00 0.00 O ATOM 879 CB ASN A 56 8.079 6.629 -0.559 1.00 0.00 C ATOM 880 CG ASN A 56 9.133 5.564 -0.791 1.00 0.00 C ATOM 881 OD1 ASN A 56 10.330 5.816 -0.648 1.00 0.00 O ATOM 882 ND2 ASN A 56 8.692 4.365 -1.154 1.00 0.00 N ATOM 0 H ASN A 56 8.261 5.706 1.724 1.00 0.00 H new ATOM 0 HA ASN A 56 9.339 8.021 0.490 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.109 6.152 -0.419 1.00 0.00 H new ATOM 0 HB3 ASN A 56 8.000 7.258 -1.446 1.00 0.00 H new ATOM 0 HD21 ASN A 56 9.354 3.609 -1.326 1.00 0.00 H new ATOM 0 HD22 ASN A 56 7.691 4.201 -1.261 1.00 0.00 H new ATOM 889 N LEU A 57 6.215 8.151 1.502 1.00 0.00 N ATOM 890 CA LEU A 57 5.095 9.052 1.748 1.00 0.00 C ATOM 891 C LEU A 57 5.530 10.243 2.596 1.00 0.00 C ATOM 892 O LEU A 57 5.195 11.389 2.294 1.00 0.00 O ATOM 893 CB LEU A 57 3.956 8.306 2.444 1.00 0.00 C ATOM 894 CG LEU A 57 2.897 9.176 3.120 1.00 0.00 C ATOM 895 CD1 LEU A 57 1.543 8.484 3.095 1.00 0.00 C ATOM 896 CD2 LEU A 57 3.305 9.500 4.549 1.00 0.00 C ATOM 0 H LEU A 57 6.089 7.210 1.876 1.00 0.00 H new ATOM 0 HA LEU A 57 4.743 9.423 0.786 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.461 7.672 1.708 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.388 7.645 3.195 1.00 0.00 H new ATOM 0 HG LEU A 57 2.815 10.111 2.566 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.801 9.118 3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.246 8.304 2.062 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.610 7.534 3.624 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.539 10.120 5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.416 8.575 5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.253 10.038 4.544 1.00 0.00 H new ATOM 908 N GLU A 58 6.280 9.964 3.657 1.00 0.00 N ATOM 909 CA GLU A 58 6.762 11.013 4.549 1.00 0.00 C ATOM 910 C GLU A 58 7.767 11.914 3.835 1.00 0.00 C ATOM 911 O GLU A 58 7.961 13.068 4.215 1.00 0.00 O ATOM 912 CB GLU A 58 7.404 10.400 5.794 1.00 0.00 C ATOM 913 CG GLU A 58 6.417 9.675 6.694 1.00 0.00 C ATOM 914 CD GLU A 58 7.068 9.122 7.947 1.00 0.00 C ATOM 915 OE1 GLU A 58 7.616 8.001 7.887 1.00 0.00 O ATOM 916 OE2 GLU A 58 7.028 9.809 8.988 1.00 0.00 O ATOM 0 H GLU A 58 6.567 9.021 3.920 1.00 0.00 H new ATOM 0 HA GLU A 58 5.908 11.619 4.852 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.182 9.702 5.485 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.893 11.189 6.366 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.618 10.360 6.976 1.00 0.00 H new ATOM 0 HG3 GLU A 58 5.956 8.859 6.138 1.00 0.00 H new ATOM 923 N ALA A 59 8.403 11.376 2.800 1.00 0.00 N ATOM 924 CA ALA A 59 9.387 12.130 2.033 1.00 0.00 C ATOM 925 C ALA A 59 8.713 12.982 0.963 1.00 0.00 C ATOM 926 O ALA A 59 9.373 13.503 0.063 1.00 0.00 O ATOM 927 CB ALA A 59 10.398 11.185 1.399 1.00 0.00 C ATOM 0 H ALA A 59 8.255 10.421 2.473 1.00 0.00 H new ATOM 0 HA ALA A 59 9.910 12.799 2.717 1.00 0.00 H new ATOM 0 HB1 ALA A 59 11.127 11.761 0.829 1.00 0.00 H new ATOM 0 HB2 ALA A 59 10.910 10.623 2.180 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.882 10.493 0.733 1.00 0.00 H new ATOM 933 N TYR A 60 7.395 13.119 1.065 1.00 0.00 N ATOM 934 CA TYR A 60 6.632 13.906 0.105 1.00 0.00 C ATOM 935 C TYR A 60 6.840 13.384 -1.314 1.00 0.00 C ATOM 936 O TYR A 60 6.996 14.161 -2.256 1.00 0.00 O ATOM 937 CB TYR A 60 7.037 15.379 0.183 1.00 0.00 C ATOM 938 CG TYR A 60 6.492 16.092 1.399 1.00 0.00 C ATOM 939 CD1 TYR A 60 6.831 15.679 2.682 1.00 0.00 C ATOM 940 CD2 TYR A 60 5.636 17.179 1.267 1.00 0.00 C ATOM 941 CE1 TYR A 60 6.335 16.327 3.796 1.00 0.00 C ATOM 942 CE2 TYR A 60 5.137 17.835 2.375 1.00 0.00 C ATOM 943 CZ TYR A 60 5.489 17.405 3.638 1.00 0.00 C ATOM 944 OH TYR A 60 4.992 18.055 4.744 1.00 0.00 O ATOM 0 H TYR A 60 6.834 12.695 1.803 1.00 0.00 H new ATOM 0 HA TYR A 60 5.575 13.814 0.356 1.00 0.00 H new ATOM 0 HB2 TYR A 60 8.125 15.448 0.188 1.00 0.00 H new ATOM 0 HB3 TYR A 60 6.689 15.891 -0.714 1.00 0.00 H new ATOM 0 HD1 TYR A 60 7.494 14.836 2.810 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.356 17.517 0.280 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.608 15.992 4.786 1.00 0.00 H new ATOM 0 HE2 TYR A 60 4.475 18.680 2.254 1.00 0.00 H new ATOM 0 HH TYR A 60 4.413 18.792 4.458 1.00 0.00 H new ATOM 954 N ARG A 61 6.841 12.062 -1.457 1.00 0.00 N ATOM 955 CA ARG A 61 7.030 11.435 -2.760 1.00 0.00 C ATOM 956 C ARG A 61 5.688 11.185 -3.443 1.00 0.00 C ATOM 957 O ARG A 61 5.607 11.124 -4.670 1.00 0.00 O ATOM 958 CB ARG A 61 7.792 10.118 -2.609 1.00 0.00 C ATOM 959 CG ARG A 61 9.230 10.294 -2.150 1.00 0.00 C ATOM 960 CD ARG A 61 10.112 9.150 -2.626 1.00 0.00 C ATOM 961 NE ARG A 61 11.531 9.485 -2.551 1.00 0.00 N ATOM 962 CZ ARG A 61 12.484 8.787 -3.158 1.00 0.00 C ATOM 963 NH1 ARG A 61 12.170 7.722 -3.883 1.00 0.00 N ATOM 964 NH2 ARG A 61 13.753 9.154 -3.041 1.00 0.00 N ATOM 0 H ARG A 61 6.713 11.405 -0.687 1.00 0.00 H new ATOM 0 HA ARG A 61 7.613 12.114 -3.382 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.267 9.484 -1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 61 7.786 9.593 -3.564 1.00 0.00 H new ATOM 0 HG2 ARG A 61 9.621 11.238 -2.529 1.00 0.00 H new ATOM 0 HG3 ARG A 61 9.261 10.350 -1.062 1.00 0.00 H new ATOM 0 HD2 ARG A 61 9.916 8.265 -2.020 1.00 0.00 H new ATOM 0 HD3 ARG A 61 9.853 8.896 -3.654 1.00 0.00 H new ATOM 0 HE ARG A 61 11.806 10.300 -2.002 1.00 0.00 H new ATOM 0 HH11 ARG A 61 11.195 7.437 -3.975 1.00 0.00 H new ATOM 0 HH12 ARG A 61 12.904 7.187 -4.348 1.00 0.00 H new ATOM 0 HH21 ARG A 61 13.998 9.973 -2.484 1.00 0.00 H new ATOM 0 HH22 ARG A 61 14.484 8.617 -3.508 1.00 0.00 H new ATOM 978 N TYR A 62 4.640 11.040 -2.640 1.00 0.00 N ATOM 979 CA TYR A 62 3.303 10.794 -3.166 1.00 0.00 C ATOM 980 C TYR A 62 2.464 12.067 -3.142 1.00 0.00 C ATOM 981 O TYR A 62 1.993 12.495 -2.086 1.00 0.00 O ATOM 982 CB TYR A 62 2.609 9.697 -2.357 1.00 0.00 C ATOM 983 CG TYR A 62 3.416 8.423 -2.245 1.00 0.00 C ATOM 984 CD1 TYR A 62 4.112 7.920 -3.338 1.00 0.00 C ATOM 985 CD2 TYR A 62 3.484 7.724 -1.047 1.00 0.00 C ATOM 986 CE1 TYR A 62 4.851 6.757 -3.240 1.00 0.00 C ATOM 987 CE2 TYR A 62 4.222 6.560 -0.940 1.00 0.00 C ATOM 988 CZ TYR A 62 4.902 6.081 -2.039 1.00 0.00 C ATOM 989 OH TYR A 62 5.638 4.922 -1.937 1.00 0.00 O ATOM 0 H TYR A 62 4.691 11.089 -1.622 1.00 0.00 H new ATOM 0 HA TYR A 62 3.402 10.467 -4.201 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.399 10.073 -1.356 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.649 9.469 -2.819 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.074 8.447 -4.280 1.00 0.00 H new ATOM 0 HD2 TYR A 62 2.951 8.096 -0.184 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.386 6.379 -4.099 1.00 0.00 H new ATOM 0 HE2 TYR A 62 4.265 6.029 -0.001 1.00 0.00 H new ATOM 0 HH TYR A 62 6.239 4.848 -2.707 1.00 0.00 H new ATOM 999 N LEU A 63 2.280 12.669 -4.311 1.00 0.00 N ATOM 1000 CA LEU A 63 1.498 13.894 -4.427 1.00 0.00 C ATOM 1001 C LEU A 63 0.105 13.601 -4.975 1.00 0.00 C ATOM 1002 O LEU A 63 -0.846 14.335 -4.705 1.00 0.00 O ATOM 1003 CB LEU A 63 2.214 14.897 -5.333 1.00 0.00 C ATOM 1004 CG LEU A 63 3.642 15.267 -4.930 1.00 0.00 C ATOM 1005 CD1 LEU A 63 4.452 15.677 -6.149 1.00 0.00 C ATOM 1006 CD2 LEU A 63 3.632 16.381 -3.894 1.00 0.00 C ATOM 0 H LEU A 63 2.662 12.328 -5.193 1.00 0.00 H new ATOM 0 HA LEU A 63 1.394 14.324 -3.431 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.237 14.490 -6.344 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.620 15.810 -5.370 1.00 0.00 H new ATOM 0 HG LEU A 63 4.112 14.390 -4.486 1.00 0.00 H new ATOM 0 HD11 LEU A 63 5.465 15.937 -5.842 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.488 14.849 -6.857 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.984 16.540 -6.623 1.00 0.00 H new ATOM 0 HD21 LEU A 63 4.657 16.631 -3.619 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.143 17.261 -4.311 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.089 16.050 -3.009 1.00 0.00 H new ATOM 1018 N ASN A 64 -0.009 12.523 -5.744 1.00 0.00 N ATOM 1019 CA ASN A 64 -1.287 12.132 -6.328 1.00 0.00 C ATOM 1020 C ASN A 64 -1.731 10.771 -5.801 1.00 0.00 C ATOM 1021 O ASN A 64 -0.928 9.845 -5.685 1.00 0.00 O ATOM 1022 CB ASN A 64 -1.181 12.090 -7.854 1.00 0.00 C ATOM 1023 CG ASN A 64 0.091 11.414 -8.328 1.00 0.00 C ATOM 1024 OD1 ASN A 64 0.111 10.210 -8.583 1.00 0.00 O ATOM 1025 ND2 ASN A 64 1.164 12.189 -8.446 1.00 0.00 N ATOM 0 H ASN A 64 0.768 11.905 -5.977 1.00 0.00 H new ATOM 0 HA ASN A 64 -2.032 12.874 -6.042 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.043 11.561 -8.261 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.216 13.107 -8.246 1.00 0.00 H new ATOM 0 HD21 ASN A 64 2.049 11.790 -8.759 1.00 0.00 H new ATOM 0 HD22 ASN A 64 1.102 13.183 -8.224 1.00 0.00 H new ATOM 1032 N PHE A 65 -3.016 10.658 -5.482 1.00 0.00 N ATOM 1033 CA PHE A 65 -3.570 9.411 -4.966 1.00 0.00 C ATOM 1034 C PHE A 65 -3.089 8.221 -5.792 1.00 0.00 C ATOM 1035 O PHE A 65 -2.780 7.160 -5.248 1.00 0.00 O ATOM 1036 CB PHE A 65 -5.099 9.466 -4.971 1.00 0.00 C ATOM 1037 CG PHE A 65 -5.734 8.572 -3.945 1.00 0.00 C ATOM 1038 CD1 PHE A 65 -5.667 8.884 -2.597 1.00 0.00 C ATOM 1039 CD2 PHE A 65 -6.398 7.417 -4.329 1.00 0.00 C ATOM 1040 CE1 PHE A 65 -6.250 8.062 -1.651 1.00 0.00 C ATOM 1041 CE2 PHE A 65 -6.983 6.591 -3.387 1.00 0.00 C ATOM 1042 CZ PHE A 65 -6.910 6.915 -2.047 1.00 0.00 C ATOM 0 H PHE A 65 -3.694 11.415 -5.572 1.00 0.00 H new ATOM 0 HA PHE A 65 -3.222 9.284 -3.941 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.418 10.493 -4.794 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.462 9.186 -5.960 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.153 9.780 -2.282 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -6.459 7.159 -5.376 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.190 8.316 -0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -7.496 5.694 -3.699 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.368 6.273 -1.310 1.00 0.00 H new ATOM 1052 N ASP A 66 -3.031 8.405 -7.106 1.00 0.00 N ATOM 1053 CA ASP A 66 -2.589 7.347 -8.007 1.00 0.00 C ATOM 1054 C ASP A 66 -1.254 6.768 -7.551 1.00 0.00 C ATOM 1055 O ASP A 66 -1.014 5.567 -7.671 1.00 0.00 O ATOM 1056 CB ASP A 66 -2.466 7.883 -9.434 1.00 0.00 C ATOM 1057 CG ASP A 66 -2.265 6.778 -10.452 1.00 0.00 C ATOM 1058 OD1 ASP A 66 -1.108 6.344 -10.634 1.00 0.00 O ATOM 1059 OD2 ASP A 66 -3.263 6.348 -11.068 1.00 0.00 O ATOM 0 H ASP A 66 -3.284 9.277 -7.571 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.334 6.552 -7.988 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.364 8.446 -9.686 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -1.628 8.579 -9.487 1.00 0.00 H new ATOM 1064 N ASP A 67 -0.388 7.630 -7.030 1.00 0.00 N ATOM 1065 CA ASP A 67 0.924 7.204 -6.556 1.00 0.00 C ATOM 1066 C ASP A 67 0.799 6.388 -5.273 1.00 0.00 C ATOM 1067 O ASP A 67 1.328 5.280 -5.177 1.00 0.00 O ATOM 1068 CB ASP A 67 1.823 8.418 -6.318 1.00 0.00 C ATOM 1069 CG ASP A 67 2.600 8.815 -7.558 1.00 0.00 C ATOM 1070 OD1 ASP A 67 3.020 7.910 -8.309 1.00 0.00 O ATOM 1071 OD2 ASP A 67 2.791 10.030 -7.775 1.00 0.00 O ATOM 0 H ASP A 67 -0.571 8.628 -6.925 1.00 0.00 H new ATOM 0 HA ASP A 67 1.374 6.574 -7.324 1.00 0.00 H new ATOM 0 HB2 ASP A 67 1.213 9.260 -5.990 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.521 8.197 -5.511 1.00 0.00 H new ATOM 1076 N PHE A 68 0.098 6.943 -4.291 1.00 0.00 N ATOM 1077 CA PHE A 68 -0.095 6.268 -3.013 1.00 0.00 C ATOM 1078 C PHE A 68 -0.792 4.924 -3.207 1.00 0.00 C ATOM 1079 O PHE A 68 -0.560 3.978 -2.454 1.00 0.00 O ATOM 1080 CB PHE A 68 -0.913 7.146 -2.065 1.00 0.00 C ATOM 1081 CG PHE A 68 -1.248 6.476 -0.764 1.00 0.00 C ATOM 1082 CD1 PHE A 68 -2.390 5.700 -0.642 1.00 0.00 C ATOM 1083 CD2 PHE A 68 -0.420 6.621 0.339 1.00 0.00 C ATOM 1084 CE1 PHE A 68 -2.700 5.082 0.554 1.00 0.00 C ATOM 1085 CE2 PHE A 68 -0.726 6.004 1.537 1.00 0.00 C ATOM 1086 CZ PHE A 68 -1.868 5.235 1.646 1.00 0.00 C ATOM 0 H PHE A 68 -0.346 7.859 -4.355 1.00 0.00 H new ATOM 0 HA PHE A 68 0.887 6.089 -2.575 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.357 8.061 -1.860 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.838 7.439 -2.562 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.045 5.577 -1.492 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.474 7.223 0.261 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -3.593 4.479 0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.072 6.123 2.388 1.00 0.00 H new ATOM 0 HZ PHE A 68 -2.110 4.755 2.583 1.00 0.00 H new ATOM 1096 N GLU A 69 -1.647 4.848 -4.222 1.00 0.00 N ATOM 1097 CA GLU A 69 -2.379 3.622 -4.515 1.00 0.00 C ATOM 1098 C GLU A 69 -1.455 2.568 -5.118 1.00 0.00 C ATOM 1099 O GLU A 69 -1.408 1.429 -4.654 1.00 0.00 O ATOM 1100 CB GLU A 69 -3.537 3.908 -5.471 1.00 0.00 C ATOM 1101 CG GLU A 69 -4.596 2.817 -5.491 1.00 0.00 C ATOM 1102 CD GLU A 69 -5.682 3.040 -4.457 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -5.607 4.049 -3.724 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -6.608 2.205 -4.383 1.00 0.00 O ATOM 0 H GLU A 69 -1.850 5.622 -4.855 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.780 3.236 -3.578 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.005 4.851 -5.189 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.142 4.037 -6.479 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.047 2.772 -6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.122 1.852 -5.312 1.00 0.00 H new ATOM 1111 N GLU A 70 -0.722 2.957 -6.157 1.00 0.00 N ATOM 1112 CA GLU A 70 0.199 2.045 -6.825 1.00 0.00 C ATOM 1113 C GLU A 70 0.988 1.227 -5.808 1.00 0.00 C ATOM 1114 O GLU A 70 0.961 -0.004 -5.829 1.00 0.00 O ATOM 1115 CB GLU A 70 1.161 2.825 -7.724 1.00 0.00 C ATOM 1116 CG GLU A 70 1.721 2.003 -8.874 1.00 0.00 C ATOM 1117 CD GLU A 70 0.643 1.255 -9.635 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -0.379 1.883 -9.986 1.00 0.00 O ATOM 1119 OE2 GLU A 70 0.820 0.044 -9.880 1.00 0.00 O ATOM 0 H GLU A 70 -0.748 3.896 -6.554 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.388 1.362 -7.439 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.643 3.694 -8.128 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.987 3.199 -7.120 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.255 2.661 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU A 70 2.448 1.290 -8.486 1.00 0.00 H new ATOM 1126 N ASP A 71 1.692 1.918 -4.918 1.00 0.00 N ATOM 1127 CA ASP A 71 2.489 1.258 -3.891 1.00 0.00 C ATOM 1128 C ASP A 71 1.697 0.133 -3.230 1.00 0.00 C ATOM 1129 O ASP A 71 2.081 -1.035 -3.301 1.00 0.00 O ATOM 1130 CB ASP A 71 2.941 2.268 -2.836 1.00 0.00 C ATOM 1131 CG ASP A 71 3.148 3.654 -3.414 1.00 0.00 C ATOM 1132 OD1 ASP A 71 3.909 3.780 -4.396 1.00 0.00 O ATOM 1133 OD2 ASP A 71 2.549 4.614 -2.885 1.00 0.00 O ATOM 0 H ASP A 71 1.727 2.937 -4.887 1.00 0.00 H new ATOM 0 HA ASP A 71 3.369 0.828 -4.369 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.197 2.316 -2.041 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.870 1.924 -2.382 1.00 0.00 H new ATOM 1138 N PHE A 72 0.593 0.493 -2.585 1.00 0.00 N ATOM 1139 CA PHE A 72 -0.251 -0.485 -1.909 1.00 0.00 C ATOM 1140 C PHE A 72 -0.486 -1.705 -2.794 1.00 0.00 C ATOM 1141 O PHE A 72 -0.311 -2.843 -2.360 1.00 0.00 O ATOM 1142 CB PHE A 72 -1.592 0.145 -1.524 1.00 0.00 C ATOM 1143 CG PHE A 72 -2.678 -0.861 -1.276 1.00 0.00 C ATOM 1144 CD1 PHE A 72 -3.459 -1.328 -2.322 1.00 0.00 C ATOM 1145 CD2 PHE A 72 -2.918 -1.342 0.000 1.00 0.00 C ATOM 1146 CE1 PHE A 72 -4.462 -2.253 -2.096 1.00 0.00 C ATOM 1147 CE2 PHE A 72 -3.918 -2.268 0.231 1.00 0.00 C ATOM 1148 CZ PHE A 72 -4.689 -2.725 -0.818 1.00 0.00 C ATOM 0 H PHE A 72 0.262 1.455 -2.516 1.00 0.00 H new ATOM 0 HA PHE A 72 0.264 -0.808 -1.004 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.456 0.749 -0.627 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.908 0.821 -2.319 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.282 -0.966 -3.324 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.317 -0.989 0.825 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.067 -2.606 -2.918 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -4.096 -2.633 1.232 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.469 -3.451 -0.640 1.00 0.00 H new ATOM 1158 N ASN A 73 -0.883 -1.459 -4.038 1.00 0.00 N ATOM 1159 CA ASN A 73 -1.143 -2.538 -4.985 1.00 0.00 C ATOM 1160 C ASN A 73 0.028 -3.514 -5.033 1.00 0.00 C ATOM 1161 O ASN A 73 -0.149 -4.721 -4.868 1.00 0.00 O ATOM 1162 CB ASN A 73 -1.403 -1.967 -6.381 1.00 0.00 C ATOM 1163 CG ASN A 73 -2.646 -1.099 -6.429 1.00 0.00 C ATOM 1164 OD1 ASN A 73 -3.602 -1.323 -5.686 1.00 0.00 O ATOM 1165 ND2 ASN A 73 -2.638 -0.101 -7.306 1.00 0.00 N ATOM 0 H ASN A 73 -1.032 -0.523 -4.414 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.029 -3.077 -4.649 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.541 -1.380 -6.697 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -1.508 -2.787 -7.092 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.446 0.517 -7.383 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.824 0.048 -7.902 1.00 0.00 H new ATOM 1172 N LEU A 74 1.225 -2.983 -5.258 1.00 0.00 N ATOM 1173 CA LEU A 74 2.426 -3.807 -5.327 1.00 0.00 C ATOM 1174 C LEU A 74 2.489 -4.778 -4.152 1.00 0.00 C ATOM 1175 O LEU A 74 2.701 -5.977 -4.336 1.00 0.00 O ATOM 1176 CB LEU A 74 3.675 -2.923 -5.340 1.00 0.00 C ATOM 1177 CG LEU A 74 4.071 -2.341 -6.697 1.00 0.00 C ATOM 1178 CD1 LEU A 74 5.207 -1.342 -6.538 1.00 0.00 C ATOM 1179 CD2 LEU A 74 4.466 -3.452 -7.660 1.00 0.00 C ATOM 0 H LEU A 74 1.389 -1.986 -5.396 1.00 0.00 H new ATOM 0 HA LEU A 74 2.387 -4.385 -6.250 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.519 -2.098 -4.645 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.513 -3.507 -4.959 1.00 0.00 H new ATOM 0 HG LEU A 74 3.209 -1.818 -7.112 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.476 -0.938 -7.514 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.889 -0.530 -5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 74 6.072 -1.841 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.745 -3.019 -8.621 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.313 -4.004 -7.251 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.624 -4.130 -7.798 1.00 0.00 H new ATOM 1191 N ILE A 75 2.302 -4.252 -2.947 1.00 0.00 N ATOM 1192 CA ILE A 75 2.334 -5.073 -1.742 1.00 0.00 C ATOM 1193 C ILE A 75 1.576 -6.381 -1.949 1.00 0.00 C ATOM 1194 O ILE A 75 2.006 -7.439 -1.489 1.00 0.00 O ATOM 1195 CB ILE A 75 1.731 -4.328 -0.537 1.00 0.00 C ATOM 1196 CG1 ILE A 75 2.587 -3.112 -0.181 1.00 0.00 C ATOM 1197 CG2 ILE A 75 1.607 -5.264 0.656 1.00 0.00 C ATOM 1198 CD1 ILE A 75 1.915 -2.159 0.782 1.00 0.00 C ATOM 0 H ILE A 75 2.127 -3.261 -2.778 1.00 0.00 H new ATOM 0 HA ILE A 75 3.382 -5.291 -1.536 1.00 0.00 H new ATOM 0 HB ILE A 75 0.734 -3.980 -0.806 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.526 -3.454 0.255 1.00 0.00 H new ATOM 0 HG13 ILE A 75 2.838 -2.574 -1.095 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.179 -4.723 1.500 1.00 0.00 H new ATOM 0 HG22 ILE A 75 0.959 -6.101 0.396 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.594 -5.639 0.928 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.581 -1.321 0.989 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.990 -1.787 0.340 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.689 -2.681 1.712 1.00 0.00 H new ATOM 1210 N VAL A 76 0.446 -6.300 -2.643 1.00 0.00 N ATOM 1211 CA VAL A 76 -0.371 -7.478 -2.913 1.00 0.00 C ATOM 1212 C VAL A 76 0.132 -8.224 -4.144 1.00 0.00 C ATOM 1213 O VAL A 76 0.359 -9.433 -4.099 1.00 0.00 O ATOM 1214 CB VAL A 76 -1.849 -7.098 -3.124 1.00 0.00 C ATOM 1215 CG1 VAL A 76 -2.665 -8.325 -3.505 1.00 0.00 C ATOM 1216 CG2 VAL A 76 -2.413 -6.440 -1.875 1.00 0.00 C ATOM 0 H VAL A 76 0.075 -5.432 -3.029 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.291 -8.127 -2.041 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.909 -6.381 -3.943 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.707 -8.039 -3.650 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.273 -8.750 -4.429 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.600 -9.067 -2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.458 -6.178 -2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.342 -7.132 -1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.844 -5.538 -1.651 1.00 0.00 H new ATOM 1226 N SER A 77 0.303 -7.497 -5.242 1.00 0.00 N ATOM 1227 CA SER A 77 0.775 -8.089 -6.488 1.00 0.00 C ATOM 1228 C SER A 77 2.054 -8.888 -6.257 1.00 0.00 C ATOM 1229 O SER A 77 2.054 -10.116 -6.325 1.00 0.00 O ATOM 1230 CB SER A 77 1.021 -7.002 -7.536 1.00 0.00 C ATOM 1231 OG SER A 77 -0.131 -6.194 -7.711 1.00 0.00 O ATOM 0 H SER A 77 0.121 -6.495 -5.295 1.00 0.00 H new ATOM 0 HA SER A 77 0.004 -8.766 -6.855 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.862 -6.380 -7.230 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.294 -7.463 -8.485 1.00 0.00 H new ATOM 0 HG SER A 77 0.051 -5.506 -8.384 1.00 0.00 H new ATOM 1237 N ASN A 78 3.146 -8.180 -5.985 1.00 0.00 N ATOM 1238 CA ASN A 78 4.434 -8.821 -5.745 1.00 0.00 C ATOM 1239 C ASN A 78 4.251 -10.155 -5.026 1.00 0.00 C ATOM 1240 O ASN A 78 4.918 -11.140 -5.347 1.00 0.00 O ATOM 1241 CB ASN A 78 5.337 -7.904 -4.918 1.00 0.00 C ATOM 1242 CG ASN A 78 5.851 -6.723 -5.721 1.00 0.00 C ATOM 1243 OD1 ASN A 78 6.196 -6.860 -6.895 1.00 0.00 O ATOM 1244 ND2 ASN A 78 5.907 -5.558 -5.089 1.00 0.00 N ATOM 0 H ASN A 78 3.164 -7.162 -5.925 1.00 0.00 H new ATOM 0 HA ASN A 78 4.904 -9.009 -6.710 1.00 0.00 H new ATOM 0 HB2 ASN A 78 4.785 -7.539 -4.052 1.00 0.00 H new ATOM 0 HB3 ASN A 78 6.183 -8.477 -4.538 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.247 -4.729 -5.577 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.610 -5.491 -4.115 1.00 0.00 H new ATOM 1251 N CYS A 79 3.346 -10.179 -4.055 1.00 0.00 N ATOM 1252 CA CYS A 79 3.075 -11.392 -3.292 1.00 0.00 C ATOM 1253 C CYS A 79 2.336 -12.418 -4.144 1.00 0.00 C ATOM 1254 O CYS A 79 2.715 -13.589 -4.193 1.00 0.00 O ATOM 1255 CB CYS A 79 2.255 -11.060 -2.044 1.00 0.00 C ATOM 1256 SG CYS A 79 2.469 -12.236 -0.687 1.00 0.00 S ATOM 0 H CYS A 79 2.787 -9.372 -3.777 1.00 0.00 H new ATOM 0 HA CYS A 79 4.029 -11.822 -2.988 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.531 -10.065 -1.695 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.200 -11.022 -2.315 1.00 0.00 H new ATOM 0 HG CYS A 79 1.374 -12.297 0.011 1.00 0.00 H new ATOM 1262 N LEU A 80 1.279 -11.972 -4.813 1.00 0.00 N ATOM 1263 CA LEU A 80 0.484 -12.852 -5.663 1.00 0.00 C ATOM 1264 C LEU A 80 1.293 -13.320 -6.870 1.00 0.00 C ATOM 1265 O LEU A 80 0.876 -14.219 -7.599 1.00 0.00 O ATOM 1266 CB LEU A 80 -0.783 -12.134 -6.132 1.00 0.00 C ATOM 1267 CG LEU A 80 -1.732 -11.661 -5.031 1.00 0.00 C ATOM 1268 CD1 LEU A 80 -2.758 -10.689 -5.592 1.00 0.00 C ATOM 1269 CD2 LEU A 80 -2.422 -12.848 -4.375 1.00 0.00 C ATOM 0 H LEU A 80 0.952 -11.006 -4.784 1.00 0.00 H new ATOM 0 HA LEU A 80 0.202 -13.726 -5.076 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.488 -11.269 -6.726 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.332 -12.803 -6.794 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.147 -11.142 -4.272 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.425 -10.363 -4.794 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.247 -9.824 -6.014 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.339 -11.183 -6.371 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.094 -12.492 -3.594 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.994 -13.396 -5.124 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.673 -13.508 -3.937 1.00 0.00 H new ATOM 1281 N LYS A 81 2.453 -12.704 -7.071 1.00 0.00 N ATOM 1282 CA LYS A 81 3.324 -13.060 -8.186 1.00 0.00 C ATOM 1283 C LYS A 81 4.447 -13.985 -7.727 1.00 0.00 C ATOM 1284 O LYS A 81 4.901 -14.846 -8.481 1.00 0.00 O ATOM 1285 CB LYS A 81 3.915 -11.799 -8.820 1.00 0.00 C ATOM 1286 CG LYS A 81 5.281 -12.016 -9.448 1.00 0.00 C ATOM 1287 CD LYS A 81 5.840 -10.728 -10.026 1.00 0.00 C ATOM 1288 CE LYS A 81 6.785 -11.001 -11.187 1.00 0.00 C ATOM 1289 NZ LYS A 81 7.926 -11.867 -10.780 1.00 0.00 N ATOM 0 H LYS A 81 2.812 -11.956 -6.477 1.00 0.00 H new ATOM 0 HA LYS A 81 2.725 -13.587 -8.928 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.229 -11.430 -9.582 1.00 0.00 H new ATOM 0 HB3 LYS A 81 3.994 -11.023 -8.059 1.00 0.00 H new ATOM 0 HG2 LYS A 81 5.969 -12.408 -8.699 1.00 0.00 H new ATOM 0 HG3 LYS A 81 5.206 -12.766 -10.235 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.020 -10.094 -10.364 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.368 -10.178 -9.247 1.00 0.00 H new ATOM 0 HE2 LYS A 81 6.236 -11.480 -11.997 1.00 0.00 H new ATOM 0 HE3 LYS A 81 7.166 -10.056 -11.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 8.600 -11.947 -11.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 8.404 -11.447 -9.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 7.572 -12.812 -10.530 1.00 0.00 H new ATOM 1303 N TYR A 82 4.887 -13.803 -6.488 1.00 0.00 N ATOM 1304 CA TYR A 82 5.957 -14.620 -5.929 1.00 0.00 C ATOM 1305 C TYR A 82 5.442 -16.006 -5.551 1.00 0.00 C ATOM 1306 O TYR A 82 5.858 -17.012 -6.123 1.00 0.00 O ATOM 1307 CB TYR A 82 6.563 -13.936 -4.703 1.00 0.00 C ATOM 1308 CG TYR A 82 7.986 -14.358 -4.415 1.00 0.00 C ATOM 1309 CD1 TYR A 82 8.934 -14.409 -5.429 1.00 0.00 C ATOM 1310 CD2 TYR A 82 8.383 -14.703 -3.129 1.00 0.00 C ATOM 1311 CE1 TYR A 82 10.236 -14.795 -5.172 1.00 0.00 C ATOM 1312 CE2 TYR A 82 9.683 -15.088 -2.862 1.00 0.00 C ATOM 1313 CZ TYR A 82 10.605 -15.132 -3.887 1.00 0.00 C ATOM 1314 OH TYR A 82 11.901 -15.515 -3.626 1.00 0.00 O ATOM 0 H TYR A 82 4.519 -13.096 -5.851 1.00 0.00 H new ATOM 0 HA TYR A 82 6.729 -14.734 -6.690 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.536 -12.856 -4.849 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.945 -14.155 -3.832 1.00 0.00 H new ATOM 0 HD1 TYR A 82 8.649 -14.142 -6.436 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.663 -14.670 -2.324 1.00 0.00 H new ATOM 0 HE1 TYR A 82 10.960 -14.832 -5.973 1.00 0.00 H new ATOM 0 HE2 TYR A 82 9.975 -15.353 -1.857 1.00 0.00 H new ATOM 0 HH TYR A 82 12.507 -15.069 -4.254 1.00 0.00 H new ATOM 1324 N ASN A 83 4.534 -16.048 -4.581 1.00 0.00 N ATOM 1325 CA ASN A 83 3.962 -17.309 -4.124 1.00 0.00 C ATOM 1326 C ASN A 83 2.587 -17.540 -4.745 1.00 0.00 C ATOM 1327 O ASN A 83 2.130 -16.752 -5.573 1.00 0.00 O ATOM 1328 CB ASN A 83 3.852 -17.321 -2.598 1.00 0.00 C ATOM 1329 CG ASN A 83 4.999 -16.587 -1.930 1.00 0.00 C ATOM 1330 OD1 ASN A 83 6.137 -17.055 -1.937 1.00 0.00 O ATOM 1331 ND2 ASN A 83 4.703 -15.429 -1.351 1.00 0.00 N ATOM 0 H ASN A 83 4.179 -15.224 -4.097 1.00 0.00 H new ATOM 0 HA ASN A 83 4.625 -18.115 -4.440 1.00 0.00 H new ATOM 0 HB2 ASN A 83 2.909 -16.863 -2.301 1.00 0.00 H new ATOM 0 HB3 ASN A 83 3.830 -18.352 -2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 83 5.434 -14.889 -0.887 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.745 -15.080 -1.370 1.00 0.00 H new ATOM 1338 N ALA A 84 1.934 -18.623 -4.340 1.00 0.00 N ATOM 1339 CA ALA A 84 0.612 -18.955 -4.854 1.00 0.00 C ATOM 1340 C ALA A 84 -0.404 -19.068 -3.723 1.00 0.00 C ATOM 1341 O ALA A 84 -0.072 -18.878 -2.553 1.00 0.00 O ATOM 1342 CB ALA A 84 0.665 -20.252 -5.649 1.00 0.00 C ATOM 0 H ALA A 84 2.299 -19.286 -3.657 1.00 0.00 H new ATOM 0 HA ALA A 84 0.293 -18.149 -5.515 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.330 -20.488 -6.027 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.354 -20.138 -6.486 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.009 -21.060 -5.004 1.00 0.00 H new ATOM 1348 N LYS A 85 -1.646 -19.380 -4.079 1.00 0.00 N ATOM 1349 CA LYS A 85 -2.713 -19.519 -3.094 1.00 0.00 C ATOM 1350 C LYS A 85 -2.275 -20.418 -1.942 1.00 0.00 C ATOM 1351 O LYS A 85 -2.626 -20.177 -0.787 1.00 0.00 O ATOM 1352 CB LYS A 85 -3.972 -20.090 -3.751 1.00 0.00 C ATOM 1353 CG LYS A 85 -4.539 -19.207 -4.849 1.00 0.00 C ATOM 1354 CD LYS A 85 -3.954 -19.559 -6.207 1.00 0.00 C ATOM 1355 CE LYS A 85 -4.944 -19.285 -7.328 1.00 0.00 C ATOM 1356 NZ LYS A 85 -6.222 -20.025 -7.133 1.00 0.00 N ATOM 0 H LYS A 85 -1.939 -19.541 -5.043 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.937 -18.529 -2.695 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.741 -21.070 -4.168 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.735 -20.240 -2.987 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.623 -19.315 -4.880 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.329 -18.162 -4.621 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -3.045 -18.981 -6.374 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -3.670 -20.611 -6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.148 -18.215 -7.379 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -4.501 -19.571 -8.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -6.651 -20.228 -8.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.033 -20.919 -6.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.876 -19.446 -6.568 1.00 0.00 H new ATOM 1370 N ASP A 86 -1.508 -21.453 -2.264 1.00 0.00 N ATOM 1371 CA ASP A 86 -1.020 -22.386 -1.255 1.00 0.00 C ATOM 1372 C ASP A 86 -0.434 -21.639 -0.061 1.00 0.00 C ATOM 1373 O ASP A 86 -0.923 -21.759 1.062 1.00 0.00 O ATOM 1374 CB ASP A 86 0.032 -23.317 -1.857 1.00 0.00 C ATOM 1375 CG ASP A 86 0.547 -24.334 -0.857 1.00 0.00 C ATOM 1376 OD1 ASP A 86 -0.259 -24.817 -0.035 1.00 0.00 O ATOM 1377 OD2 ASP A 86 1.756 -24.646 -0.896 1.00 0.00 O ATOM 0 H ASP A 86 -1.210 -21.667 -3.216 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.864 -22.982 -0.908 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.396 -23.838 -2.713 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.867 -22.724 -2.230 1.00 0.00 H new ATOM 1382 N THR A 87 0.620 -20.867 -0.313 1.00 0.00 N ATOM 1383 CA THR A 87 1.276 -20.102 0.741 1.00 0.00 C ATOM 1384 C THR A 87 0.269 -19.257 1.514 1.00 0.00 C ATOM 1385 O THR A 87 -0.903 -19.179 1.146 1.00 0.00 O ATOM 1386 CB THR A 87 2.369 -19.180 0.169 1.00 0.00 C ATOM 1387 OG1 THR A 87 1.787 -18.230 -0.731 1.00 0.00 O ATOM 1388 CG2 THR A 87 3.432 -19.990 -0.559 1.00 0.00 C ATOM 0 H THR A 87 1.037 -20.755 -1.237 1.00 0.00 H new ATOM 0 HA THR A 87 1.736 -20.824 1.416 1.00 0.00 H new ATOM 0 HB THR A 87 2.840 -18.653 0.998 1.00 0.00 H new ATOM 0 HG1 THR A 87 1.196 -18.694 -1.359 1.00 0.00 H new ATOM 0 HG21 THR A 87 4.194 -19.318 -0.955 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.893 -20.693 0.135 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.972 -20.540 -1.380 1.00 0.00 H new ATOM 1396 N ILE A 88 0.735 -18.626 2.587 1.00 0.00 N ATOM 1397 CA ILE A 88 -0.125 -17.786 3.411 1.00 0.00 C ATOM 1398 C ILE A 88 -0.149 -16.351 2.895 1.00 0.00 C ATOM 1399 O ILE A 88 -1.193 -15.845 2.483 1.00 0.00 O ATOM 1400 CB ILE A 88 0.332 -17.784 4.881 1.00 0.00 C ATOM 1401 CG1 ILE A 88 -0.243 -18.994 5.620 1.00 0.00 C ATOM 1402 CG2 ILE A 88 -0.089 -16.491 5.565 1.00 0.00 C ATOM 1403 CD1 ILE A 88 0.104 -19.027 7.091 1.00 0.00 C ATOM 0 H ILE A 88 1.702 -18.681 2.906 1.00 0.00 H new ATOM 0 HA ILE A 88 -1.129 -18.207 3.352 1.00 0.00 H new ATOM 0 HB ILE A 88 1.420 -17.850 4.907 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.328 -18.994 5.511 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.124 -19.905 5.148 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.241 -16.505 6.604 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.364 -15.643 5.051 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -1.174 -16.398 5.531 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.337 -19.912 7.549 1.00 0.00 H new ATOM 0 HD12 ILE A 88 1.187 -19.059 7.209 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.287 -18.133 7.577 1.00 0.00 H new ATOM 1415 N PHE A 89 1.009 -15.700 2.920 1.00 0.00 N ATOM 1416 CA PHE A 89 1.123 -14.324 2.453 1.00 0.00 C ATOM 1417 C PHE A 89 0.249 -14.091 1.225 1.00 0.00 C ATOM 1418 O PHE A 89 -0.187 -12.969 0.962 1.00 0.00 O ATOM 1419 CB PHE A 89 2.581 -13.991 2.127 1.00 0.00 C ATOM 1420 CG PHE A 89 3.569 -14.708 3.000 1.00 0.00 C ATOM 1421 CD1 PHE A 89 3.379 -14.779 4.371 1.00 0.00 C ATOM 1422 CD2 PHE A 89 4.688 -15.314 2.451 1.00 0.00 C ATOM 1423 CE1 PHE A 89 4.288 -15.438 5.178 1.00 0.00 C ATOM 1424 CE2 PHE A 89 5.601 -15.974 3.252 1.00 0.00 C ATOM 1425 CZ PHE A 89 5.400 -16.037 4.617 1.00 0.00 C ATOM 0 H PHE A 89 1.882 -16.104 3.259 1.00 0.00 H new ATOM 0 HA PHE A 89 0.778 -13.667 3.252 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.779 -14.243 1.085 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.731 -12.916 2.229 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.511 -14.314 4.814 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.849 -15.270 1.384 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.129 -15.485 6.245 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.470 -16.440 2.811 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.111 -16.554 5.245 1.00 0.00 H new ATOM 1435 N TYR A 90 -0.004 -15.158 0.476 1.00 0.00 N ATOM 1436 CA TYR A 90 -0.823 -15.072 -0.727 1.00 0.00 C ATOM 1437 C TYR A 90 -2.281 -14.792 -0.374 1.00 0.00 C ATOM 1438 O TYR A 90 -2.850 -13.784 -0.794 1.00 0.00 O ATOM 1439 CB TYR A 90 -0.722 -16.368 -1.533 1.00 0.00 C ATOM 1440 CG TYR A 90 -1.334 -16.272 -2.913 1.00 0.00 C ATOM 1441 CD1 TYR A 90 -2.699 -16.072 -3.077 1.00 0.00 C ATOM 1442 CD2 TYR A 90 -0.546 -16.382 -4.052 1.00 0.00 C ATOM 1443 CE1 TYR A 90 -3.262 -15.985 -4.335 1.00 0.00 C ATOM 1444 CE2 TYR A 90 -1.101 -16.295 -5.314 1.00 0.00 C ATOM 1445 CZ TYR A 90 -2.459 -16.096 -5.451 1.00 0.00 C ATOM 1446 OH TYR A 90 -3.016 -16.009 -6.706 1.00 0.00 O ATOM 0 H TYR A 90 0.347 -16.094 0.681 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.449 -14.246 -1.332 1.00 0.00 H new ATOM 0 HB2 TYR A 90 0.328 -16.646 -1.629 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.214 -17.169 -0.981 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -3.331 -15.983 -2.206 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.518 -16.538 -3.949 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -4.325 -15.831 -4.444 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.474 -16.382 -6.189 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.314 -16.106 -7.383 1.00 0.00 H new ATOM 1456 N ARG A 91 -2.878 -15.691 0.401 1.00 0.00 N ATOM 1457 CA ARG A 91 -4.270 -15.543 0.811 1.00 0.00 C ATOM 1458 C ARG A 91 -4.472 -14.244 1.587 1.00 0.00 C ATOM 1459 O ARG A 91 -5.497 -13.579 1.446 1.00 0.00 O ATOM 1460 CB ARG A 91 -4.701 -16.734 1.667 1.00 0.00 C ATOM 1461 CG ARG A 91 -4.693 -18.057 0.918 1.00 0.00 C ATOM 1462 CD ARG A 91 -5.037 -19.220 1.837 1.00 0.00 C ATOM 1463 NE ARG A 91 -5.570 -20.361 1.098 1.00 0.00 N ATOM 1464 CZ ARG A 91 -6.723 -20.336 0.439 1.00 0.00 C ATOM 1465 NH1 ARG A 91 -7.459 -19.233 0.426 1.00 0.00 N ATOM 1466 NH2 ARG A 91 -7.143 -21.415 -0.209 1.00 0.00 N ATOM 0 H ARG A 91 -2.420 -16.530 0.758 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.886 -15.509 -0.087 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.038 -16.810 2.529 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.704 -16.550 2.052 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.409 -18.016 0.097 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.710 -18.220 0.475 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.145 -19.526 2.384 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.768 -18.894 2.577 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.027 -21.225 1.087 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.140 -18.401 0.923 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.344 -19.216 -0.081 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.580 -22.266 -0.202 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -8.029 -21.394 -0.714 1.00 0.00 H new ATOM 1480 N ALA A 92 -3.488 -13.893 2.408 1.00 0.00 N ATOM 1481 CA ALA A 92 -3.557 -12.675 3.206 1.00 0.00 C ATOM 1482 C ALA A 92 -3.668 -11.441 2.316 1.00 0.00 C ATOM 1483 O ALA A 92 -4.475 -10.549 2.574 1.00 0.00 O ATOM 1484 CB ALA A 92 -2.339 -12.566 4.111 1.00 0.00 C ATOM 0 H ALA A 92 -2.634 -14.435 2.538 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.453 -12.727 3.825 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.405 -11.652 4.701 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.304 -13.427 4.779 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.435 -12.541 3.503 1.00 0.00 H new ATOM 1490 N ALA A 93 -2.852 -11.398 1.268 1.00 0.00 N ATOM 1491 CA ALA A 93 -2.860 -10.275 0.339 1.00 0.00 C ATOM 1492 C ALA A 93 -4.193 -10.180 -0.398 1.00 0.00 C ATOM 1493 O ALA A 93 -4.721 -9.089 -0.610 1.00 0.00 O ATOM 1494 CB ALA A 93 -1.715 -10.401 -0.654 1.00 0.00 C ATOM 0 H ALA A 93 -2.177 -12.128 1.041 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.727 -9.360 0.916 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -1.734 -9.555 -1.341 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.767 -10.410 -0.117 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -1.822 -11.328 -1.217 1.00 0.00 H new ATOM 1500 N VAL A 94 -4.732 -11.332 -0.785 1.00 0.00 N ATOM 1501 CA VAL A 94 -6.003 -11.379 -1.498 1.00 0.00 C ATOM 1502 C VAL A 94 -7.070 -10.565 -0.774 1.00 0.00 C ATOM 1503 O VAL A 94 -7.754 -9.742 -1.381 1.00 0.00 O ATOM 1504 CB VAL A 94 -6.501 -12.828 -1.661 1.00 0.00 C ATOM 1505 CG1 VAL A 94 -7.989 -12.849 -1.972 1.00 0.00 C ATOM 1506 CG2 VAL A 94 -5.710 -13.544 -2.746 1.00 0.00 C ATOM 0 H VAL A 94 -4.308 -12.245 -0.617 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.829 -10.949 -2.484 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.344 -13.356 -0.721 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.323 -13.881 -2.084 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.538 -12.376 -1.157 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.175 -12.305 -2.898 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.075 -14.566 -2.848 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.833 -13.019 -3.693 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.654 -13.561 -2.475 1.00 0.00 H new ATOM 1516 N ARG A 95 -7.205 -10.801 0.527 1.00 0.00 N ATOM 1517 CA ARG A 95 -8.189 -10.090 1.334 1.00 0.00 C ATOM 1518 C ARG A 95 -7.909 -8.590 1.337 1.00 0.00 C ATOM 1519 O ARG A 95 -8.776 -7.785 0.996 1.00 0.00 O ATOM 1520 CB ARG A 95 -8.185 -10.623 2.768 1.00 0.00 C ATOM 1521 CG ARG A 95 -9.099 -9.853 3.706 1.00 0.00 C ATOM 1522 CD ARG A 95 -9.634 -10.742 4.818 1.00 0.00 C ATOM 1523 NE ARG A 95 -10.859 -11.434 4.422 1.00 0.00 N ATOM 1524 CZ ARG A 95 -11.744 -11.914 5.289 1.00 0.00 C ATOM 1525 NH1 ARG A 95 -11.542 -11.777 6.593 1.00 0.00 N ATOM 1526 NH2 ARG A 95 -12.834 -12.531 4.852 1.00 0.00 N ATOM 0 H ARG A 95 -6.645 -11.479 1.044 1.00 0.00 H new ATOM 0 HA ARG A 95 -9.172 -10.258 0.894 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -8.487 -11.670 2.758 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.167 -10.589 3.157 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.554 -9.015 4.140 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.932 -9.434 3.141 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.876 -11.475 5.093 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.829 -10.137 5.704 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.044 -11.555 3.426 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -10.706 -11.302 6.932 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -12.223 -12.147 7.256 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -12.993 -12.637 3.850 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -13.513 -12.899 5.518 1.00 0.00 H new ATOM 1540 N LEU A 96 -6.692 -8.222 1.723 1.00 0.00 N ATOM 1541 CA LEU A 96 -6.297 -6.819 1.770 1.00 0.00 C ATOM 1542 C LEU A 96 -6.721 -6.090 0.501 1.00 0.00 C ATOM 1543 O LEU A 96 -7.315 -5.013 0.560 1.00 0.00 O ATOM 1544 CB LEU A 96 -4.782 -6.701 1.956 1.00 0.00 C ATOM 1545 CG LEU A 96 -4.265 -6.879 3.384 1.00 0.00 C ATOM 1546 CD1 LEU A 96 -2.752 -7.025 3.391 1.00 0.00 C ATOM 1547 CD2 LEU A 96 -4.693 -5.707 4.256 1.00 0.00 C ATOM 0 H LEU A 96 -5.962 -8.875 2.008 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.800 -6.355 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.299 -7.444 1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.467 -5.721 1.596 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.699 -7.791 3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.403 -7.151 4.416 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.468 -7.897 2.802 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.298 -6.132 2.960 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.316 -5.850 5.269 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.288 -4.782 3.846 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.781 -5.649 4.278 1.00 0.00 H new ATOM 1559 N ARG A 97 -6.418 -6.685 -0.648 1.00 0.00 N ATOM 1560 CA ARG A 97 -6.769 -6.093 -1.933 1.00 0.00 C ATOM 1561 C ARG A 97 -8.279 -5.897 -2.045 1.00 0.00 C ATOM 1562 O ARG A 97 -8.746 -4.888 -2.573 1.00 0.00 O ATOM 1563 CB ARG A 97 -6.272 -6.975 -3.079 1.00 0.00 C ATOM 1564 CG ARG A 97 -6.665 -6.465 -4.455 1.00 0.00 C ATOM 1565 CD ARG A 97 -6.469 -7.531 -5.522 1.00 0.00 C ATOM 1566 NE ARG A 97 -6.786 -7.034 -6.858 1.00 0.00 N ATOM 1567 CZ ARG A 97 -6.055 -6.129 -7.498 1.00 0.00 C ATOM 1568 NH1 ARG A 97 -4.969 -5.626 -6.928 1.00 0.00 N ATOM 1569 NH2 ARG A 97 -6.408 -5.727 -8.712 1.00 0.00 N ATOM 0 H ARG A 97 -5.929 -7.578 -0.715 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.286 -5.118 -2.000 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -5.186 -7.048 -3.025 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.667 -7.983 -2.948 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.708 -6.149 -4.443 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.069 -5.587 -4.703 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -5.436 -7.879 -5.501 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -7.100 -8.390 -5.296 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.615 -7.402 -7.325 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -4.693 -5.934 -5.996 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -4.409 -4.931 -7.422 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.242 -6.113 -9.155 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -5.846 -5.032 -9.203 1.00 0.00 H new ATOM 1583 N GLU A 98 -9.036 -6.871 -1.549 1.00 0.00 N ATOM 1584 CA GLU A 98 -10.491 -6.805 -1.595 1.00 0.00 C ATOM 1585 C GLU A 98 -11.023 -5.793 -0.586 1.00 0.00 C ATOM 1586 O GLU A 98 -11.605 -4.775 -0.962 1.00 0.00 O ATOM 1587 CB GLU A 98 -11.095 -8.184 -1.317 1.00 0.00 C ATOM 1588 CG GLU A 98 -11.033 -9.127 -2.507 1.00 0.00 C ATOM 1589 CD GLU A 98 -11.995 -8.736 -3.613 1.00 0.00 C ATOM 1590 OE1 GLU A 98 -11.683 -7.787 -4.362 1.00 0.00 O ATOM 1591 OE2 GLU A 98 -13.059 -9.378 -3.728 1.00 0.00 O ATOM 0 H GLU A 98 -8.665 -7.714 -1.111 1.00 0.00 H new ATOM 0 HA GLU A 98 -10.782 -6.482 -2.595 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.570 -8.638 -0.476 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -12.135 -8.062 -1.015 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -10.017 -9.141 -2.902 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.260 -10.140 -2.175 1.00 0.00 H new ATOM 1598 N GLN A 99 -10.819 -6.080 0.696 1.00 0.00 N ATOM 1599 CA GLN A 99 -11.280 -5.194 1.758 1.00 0.00 C ATOM 1600 C GLN A 99 -10.586 -3.839 1.677 1.00 0.00 C ATOM 1601 O GLN A 99 -11.239 -2.802 1.561 1.00 0.00 O ATOM 1602 CB GLN A 99 -11.025 -5.829 3.127 1.00 0.00 C ATOM 1603 CG GLN A 99 -11.621 -7.220 3.273 1.00 0.00 C ATOM 1604 CD GLN A 99 -11.558 -7.736 4.697 1.00 0.00 C ATOM 1605 OE1 GLN A 99 -11.232 -6.993 5.624 1.00 0.00 O ATOM 1606 NE2 GLN A 99 -11.869 -9.013 4.879 1.00 0.00 N ATOM 0 H GLN A 99 -10.338 -6.918 1.024 1.00 0.00 H new ATOM 0 HA GLN A 99 -12.351 -5.041 1.629 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -9.950 -5.884 3.298 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.439 -5.182 3.901 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -12.660 -7.202 2.943 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -11.089 -7.909 2.617 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -12.134 -9.592 4.082 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -11.844 -9.416 5.816 1.00 0.00 H new ATOM 1615 N GLY A 100 -9.258 -3.854 1.738 1.00 0.00 N ATOM 1616 CA GLY A 100 -8.499 -2.620 1.670 1.00 0.00 C ATOM 1617 C GLY A 100 -9.042 -1.661 0.628 1.00 0.00 C ATOM 1618 O GLY A 100 -9.054 -0.449 0.837 1.00 0.00 O ATOM 0 H GLY A 100 -8.695 -4.699 1.833 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.511 -2.136 2.646 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.458 -2.849 1.441 1.00 0.00 H new ATOM 1622 N GLY A 101 -9.490 -2.206 -0.499 1.00 0.00 N ATOM 1623 CA GLY A 101 -10.028 -1.376 -1.560 1.00 0.00 C ATOM 1624 C GLY A 101 -11.001 -0.334 -1.045 1.00 0.00 C ATOM 1625 O GLY A 101 -10.977 0.817 -1.481 1.00 0.00 O ATOM 0 H GLY A 101 -9.490 -3.207 -0.696 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.209 -0.878 -2.079 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.531 -2.008 -2.292 1.00 0.00 H new ATOM 1629 N ALA A 102 -11.861 -0.737 -0.115 1.00 0.00 N ATOM 1630 CA ALA A 102 -12.845 0.171 0.460 1.00 0.00 C ATOM 1631 C ALA A 102 -12.170 1.372 1.113 1.00 0.00 C ATOM 1632 O ALA A 102 -12.725 2.470 1.142 1.00 0.00 O ATOM 1633 CB ALA A 102 -13.712 -0.565 1.472 1.00 0.00 C ATOM 0 H ALA A 102 -11.896 -1.687 0.256 1.00 0.00 H new ATOM 0 HA ALA A 102 -13.479 0.539 -0.347 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -14.443 0.124 1.894 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -14.231 -1.386 0.978 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -13.084 -0.961 2.270 1.00 0.00 H new ATOM 1639 N VAL A 103 -10.967 1.156 1.637 1.00 0.00 N ATOM 1640 CA VAL A 103 -10.215 2.221 2.289 1.00 0.00 C ATOM 1641 C VAL A 103 -9.674 3.216 1.269 1.00 0.00 C ATOM 1642 O VAL A 103 -9.713 4.427 1.485 1.00 0.00 O ATOM 1643 CB VAL A 103 -9.042 1.657 3.113 1.00 0.00 C ATOM 1644 CG1 VAL A 103 -8.219 2.787 3.712 1.00 0.00 C ATOM 1645 CG2 VAL A 103 -9.555 0.725 4.200 1.00 0.00 C ATOM 0 H VAL A 103 -10.493 0.253 1.622 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.907 2.732 2.959 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.396 1.082 2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.395 2.370 4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.821 3.411 2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.850 3.391 4.363 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.713 0.336 4.772 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.223 1.274 4.864 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.097 -0.103 3.743 1.00 0.00 H new ATOM 1655 N LEU A 104 -9.169 2.697 0.155 1.00 0.00 N ATOM 1656 CA LEU A 104 -8.618 3.539 -0.901 1.00 0.00 C ATOM 1657 C LEU A 104 -9.733 4.211 -1.697 1.00 0.00 C ATOM 1658 O LEU A 104 -9.500 5.194 -2.400 1.00 0.00 O ATOM 1659 CB LEU A 104 -7.738 2.709 -1.837 1.00 0.00 C ATOM 1660 CG LEU A 104 -6.512 2.055 -1.198 1.00 0.00 C ATOM 1661 CD1 LEU A 104 -5.980 0.939 -2.084 1.00 0.00 C ATOM 1662 CD2 LEU A 104 -5.430 3.091 -0.937 1.00 0.00 C ATOM 0 H LEU A 104 -9.130 1.697 -0.040 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.010 4.314 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.352 1.926 -2.282 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.400 3.351 -2.651 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.811 1.623 -0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.108 0.485 -1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.753 0.183 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.697 1.348 -3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.565 2.607 -0.482 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.134 3.553 -1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.814 3.856 -0.263 1.00 0.00 H new ATOM 1674 N ARG A 105 -10.943 3.676 -1.578 1.00 0.00 N ATOM 1675 CA ARG A 105 -12.094 4.225 -2.286 1.00 0.00 C ATOM 1676 C ARG A 105 -12.749 5.340 -1.476 1.00 0.00 C ATOM 1677 O ARG A 105 -13.174 6.353 -2.030 1.00 0.00 O ATOM 1678 CB ARG A 105 -13.115 3.122 -2.575 1.00 0.00 C ATOM 1679 CG ARG A 105 -12.870 2.392 -3.886 1.00 0.00 C ATOM 1680 CD ARG A 105 -14.165 1.865 -4.482 1.00 0.00 C ATOM 1681 NE ARG A 105 -14.834 2.867 -5.307 1.00 0.00 N ATOM 1682 CZ ARG A 105 -16.135 2.844 -5.580 1.00 0.00 C ATOM 1683 NH1 ARG A 105 -16.901 1.877 -5.093 1.00 0.00 N ATOM 1684 NH2 ARG A 105 -16.671 3.791 -6.339 1.00 0.00 N ATOM 0 H ARG A 105 -11.152 2.863 -0.998 1.00 0.00 H new ATOM 0 HA ARG A 105 -11.744 4.643 -3.230 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.098 2.400 -1.758 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -14.113 3.559 -2.593 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -12.390 3.067 -4.595 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -12.182 1.563 -3.719 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -13.954 0.981 -5.084 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -14.833 1.552 -3.679 1.00 0.00 H new ATOM 0 HE ARG A 105 -14.273 3.625 -5.695 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -16.492 1.149 -4.507 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -17.899 1.862 -5.304 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -16.085 4.537 -6.713 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -17.669 3.773 -6.548 1.00 0.00 H new ATOM 1698 N GLN A 106 -12.826 5.144 -0.164 1.00 0.00 N ATOM 1699 CA GLN A 106 -13.431 6.133 0.721 1.00 0.00 C ATOM 1700 C GLN A 106 -12.490 7.313 0.942 1.00 0.00 C ATOM 1701 O GLN A 106 -12.924 8.407 1.302 1.00 0.00 O ATOM 1702 CB GLN A 106 -13.791 5.494 2.063 1.00 0.00 C ATOM 1703 CG GLN A 106 -12.587 5.218 2.948 1.00 0.00 C ATOM 1704 CD GLN A 106 -12.954 5.099 4.414 1.00 0.00 C ATOM 1705 OE1 GLN A 106 -14.115 5.270 4.791 1.00 0.00 O ATOM 1706 NE2 GLN A 106 -11.966 4.806 5.251 1.00 0.00 N ATOM 0 H GLN A 106 -12.478 4.311 0.310 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.341 6.501 0.246 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.480 6.150 2.595 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -14.319 4.558 1.880 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -12.105 4.296 2.622 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -11.859 6.019 2.824 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -11.019 4.673 4.896 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -12.154 4.714 6.249 1.00 0.00 H new ATOM 1715 N ALA A 107 -11.199 7.083 0.725 1.00 0.00 N ATOM 1716 CA ALA A 107 -10.197 8.127 0.899 1.00 0.00 C ATOM 1717 C ALA A 107 -9.991 8.910 -0.393 1.00 0.00 C ATOM 1718 O ALA A 107 -9.670 10.099 -0.365 1.00 0.00 O ATOM 1719 CB ALA A 107 -8.882 7.523 1.368 1.00 0.00 C ATOM 0 H ALA A 107 -10.823 6.183 0.428 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.557 8.820 1.659 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -8.143 8.314 1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.034 7.014 2.320 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -8.525 6.808 0.627 1.00 0.00 H new ATOM 1725 N ARG A 108 -10.178 8.239 -1.524 1.00 0.00 N ATOM 1726 CA ARG A 108 -10.010 8.871 -2.826 1.00 0.00 C ATOM 1727 C ARG A 108 -10.921 10.089 -2.960 1.00 0.00 C ATOM 1728 O ARG A 108 -10.500 11.142 -3.436 1.00 0.00 O ATOM 1729 CB ARG A 108 -10.309 7.873 -3.946 1.00 0.00 C ATOM 1730 CG ARG A 108 -9.821 8.326 -5.313 1.00 0.00 C ATOM 1731 CD ARG A 108 -10.275 7.375 -6.408 1.00 0.00 C ATOM 1732 NE ARG A 108 -9.942 5.986 -6.101 1.00 0.00 N ATOM 1733 CZ ARG A 108 -10.445 4.947 -6.758 1.00 0.00 C ATOM 1734 NH1 ARG A 108 -11.298 5.138 -7.755 1.00 0.00 N ATOM 1735 NH2 ARG A 108 -10.093 3.713 -6.420 1.00 0.00 N ATOM 0 H ARG A 108 -10.446 7.256 -1.565 1.00 0.00 H new ATOM 0 HA ARG A 108 -8.974 9.200 -2.910 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -9.845 6.917 -3.703 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -11.385 7.703 -3.992 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -10.196 9.328 -5.521 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.733 8.387 -5.310 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -11.352 7.468 -6.544 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -9.809 7.659 -7.351 1.00 0.00 H new ATOM 0 HE ARG A 108 -9.287 5.804 -5.340 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -11.570 6.085 -8.019 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -11.682 4.338 -8.258 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -9.436 3.562 -5.655 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -10.480 2.916 -6.925 1.00 0.00 H new ATOM 1749 N ARG A 109 -12.172 9.935 -2.537 1.00 0.00 N ATOM 1750 CA ARG A 109 -13.143 11.019 -2.611 1.00 0.00 C ATOM 1751 C ARG A 109 -12.614 12.270 -1.915 1.00 0.00 C ATOM 1752 O ARG A 109 -12.912 13.391 -2.325 1.00 0.00 O ATOM 1753 CB ARG A 109 -14.468 10.591 -1.977 1.00 0.00 C ATOM 1754 CG ARG A 109 -14.466 10.662 -0.458 1.00 0.00 C ATOM 1755 CD ARG A 109 -15.578 9.813 0.140 1.00 0.00 C ATOM 1756 NE ARG A 109 -15.681 9.988 1.586 1.00 0.00 N ATOM 1757 CZ ARG A 109 -16.681 9.503 2.314 1.00 0.00 C ATOM 1758 NH1 ARG A 109 -17.658 8.819 1.735 1.00 0.00 N ATOM 1759 NH2 ARG A 109 -16.705 9.703 3.627 1.00 0.00 N ATOM 0 H ARG A 109 -12.536 9.069 -2.139 1.00 0.00 H new ATOM 0 HA ARG A 109 -13.311 11.252 -3.663 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.267 11.225 -2.361 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -14.696 9.570 -2.285 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -13.503 10.322 -0.078 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -14.587 11.698 -0.141 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -16.527 10.078 -0.326 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -15.394 8.763 -0.086 1.00 0.00 H new ATOM 0 HE ARG A 109 -14.946 10.510 2.063 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -17.644 8.663 0.727 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -18.424 8.448 2.298 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -15.956 10.229 4.077 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -17.473 9.331 4.186 1.00 0.00 H new ATOM 1773 N GLN A 110 -11.829 12.069 -0.862 1.00 0.00 N ATOM 1774 CA GLN A 110 -11.261 13.180 -0.110 1.00 0.00 C ATOM 1775 C GLN A 110 -10.180 13.890 -0.919 1.00 0.00 C ATOM 1776 O GLN A 110 -10.332 15.054 -1.288 1.00 0.00 O ATOM 1777 CB GLN A 110 -10.678 12.683 1.214 1.00 0.00 C ATOM 1778 CG GLN A 110 -11.650 11.844 2.030 1.00 0.00 C ATOM 1779 CD GLN A 110 -11.331 11.858 3.512 1.00 0.00 C ATOM 1780 OE1 GLN A 110 -11.047 10.818 4.108 1.00 0.00 O ATOM 1781 NE2 GLN A 110 -11.376 13.039 4.116 1.00 0.00 N ATOM 0 H GLN A 110 -11.572 11.147 -0.511 1.00 0.00 H new ATOM 0 HA GLN A 110 -12.061 13.891 0.097 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.785 12.093 1.009 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -10.364 13.541 1.808 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -12.663 12.216 1.877 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -11.630 10.816 1.668 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -11.616 13.875 3.584 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -11.171 13.110 5.113 1.00 0.00 H new ATOM 1790 N ALA A 111 -9.090 13.180 -1.192 1.00 0.00 N ATOM 1791 CA ALA A 111 -7.985 13.741 -1.958 1.00 0.00 C ATOM 1792 C ALA A 111 -8.497 14.599 -3.111 1.00 0.00 C ATOM 1793 O ALA A 111 -7.802 15.497 -3.585 1.00 0.00 O ATOM 1794 CB ALA A 111 -7.089 12.630 -2.483 1.00 0.00 C ATOM 0 H ALA A 111 -8.949 12.215 -0.894 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.402 14.380 -1.294 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.268 13.064 -3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.688 12.060 -1.645 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -7.669 11.969 -3.127 1.00 0.00 H new ATOM 1800 N GLU A 112 -9.716 14.315 -3.558 1.00 0.00 N ATOM 1801 CA GLU A 112 -10.319 15.059 -4.657 1.00 0.00 C ATOM 1802 C GLU A 112 -11.019 16.315 -4.145 1.00 0.00 C ATOM 1803 O GLU A 112 -10.926 17.383 -4.750 1.00 0.00 O ATOM 1804 CB GLU A 112 -11.318 14.179 -5.413 1.00 0.00 C ATOM 1805 CG GLU A 112 -10.674 12.997 -6.117 1.00 0.00 C ATOM 1806 CD GLU A 112 -11.422 12.587 -7.371 1.00 0.00 C ATOM 1807 OE1 GLU A 112 -11.402 13.361 -8.352 1.00 0.00 O ATOM 1808 OE2 GLU A 112 -12.026 11.495 -7.372 1.00 0.00 O ATOM 0 H GLU A 112 -10.305 13.575 -3.176 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.522 15.359 -5.338 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.067 13.810 -4.713 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.842 14.788 -6.149 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.646 13.250 -6.378 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.630 12.151 -5.432 1.00 0.00 H new ATOM 1815 N LYS A 113 -11.719 16.179 -3.024 1.00 0.00 N ATOM 1816 CA LYS A 113 -12.434 17.300 -2.427 1.00 0.00 C ATOM 1817 C LYS A 113 -11.461 18.308 -1.823 1.00 0.00 C ATOM 1818 O LYS A 113 -11.726 19.510 -1.811 1.00 0.00 O ATOM 1819 CB LYS A 113 -13.400 16.801 -1.349 1.00 0.00 C ATOM 1820 CG LYS A 113 -12.749 16.608 0.009 1.00 0.00 C ATOM 1821 CD LYS A 113 -13.755 16.143 1.049 1.00 0.00 C ATOM 1822 CE LYS A 113 -14.609 14.999 0.525 1.00 0.00 C ATOM 1823 NZ LYS A 113 -15.743 15.489 -0.306 1.00 0.00 N ATOM 0 H LYS A 113 -11.806 15.302 -2.510 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.002 17.796 -3.215 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -14.221 17.512 -1.251 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -13.834 15.855 -1.672 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -11.945 15.877 -0.073 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -12.296 17.545 0.333 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -13.229 15.823 1.948 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -14.397 16.977 1.334 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -13.990 14.325 -0.067 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -14.997 14.421 1.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -16.632 15.077 0.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -15.795 16.526 -0.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -15.595 15.207 -1.296 1.00 0.00 H new ATOM 1837 N MET A 114 -10.334 17.810 -1.327 1.00 0.00 N ATOM 1838 CA MET A 114 -9.319 18.668 -0.724 1.00 0.00 C ATOM 1839 C MET A 114 -9.169 19.966 -1.511 1.00 0.00 C ATOM 1840 O MET A 114 -9.196 21.056 -0.940 1.00 0.00 O ATOM 1841 CB MET A 114 -7.976 17.939 -0.662 1.00 0.00 C ATOM 1842 CG MET A 114 -8.008 16.677 0.187 1.00 0.00 C ATOM 1843 SD MET A 114 -7.726 17.010 1.937 1.00 0.00 S ATOM 1844 CE MET A 114 -7.152 15.410 2.497 1.00 0.00 C ATOM 0 H MET A 114 -10.100 16.817 -1.330 1.00 0.00 H new ATOM 0 HA MET A 114 -9.639 18.912 0.289 1.00 0.00 H new ATOM 0 HB2 MET A 114 -7.666 17.679 -1.674 1.00 0.00 H new ATOM 0 HB3 MET A 114 -7.222 18.617 -0.262 1.00 0.00 H new ATOM 0 HG2 MET A 114 -8.974 16.186 0.065 1.00 0.00 H new ATOM 0 HG3 MET A 114 -7.250 15.982 -0.173 1.00 0.00 H new ATOM 0 HE1 MET A 114 -6.348 15.545 3.221 1.00 0.00 H new ATOM 0 HE2 MET A 114 -7.976 14.871 2.966 1.00 0.00 H new ATOM 0 HE3 MET A 114 -6.782 14.838 1.646 1.00 0.00 H new ATOM 1854 N GLY A 115 -9.011 19.843 -2.825 1.00 0.00 N ATOM 1855 CA GLY A 115 -8.859 21.014 -3.668 1.00 0.00 C ATOM 1856 C GLY A 115 -8.910 20.677 -5.145 1.00 0.00 C ATOM 1857 O GLY A 115 -8.458 19.610 -5.561 1.00 0.00 O ATOM 0 H GLY A 115 -8.986 18.952 -3.321 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -9.647 21.730 -3.435 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -7.910 21.500 -3.442 1.00 0.00 H new ATOM 1861 N SER A 116 -9.464 21.588 -5.940 1.00 0.00 N ATOM 1862 CA SER A 116 -9.578 21.379 -7.378 1.00 0.00 C ATOM 1863 C SER A 116 -9.389 22.690 -8.134 1.00 0.00 C ATOM 1864 O SER A 116 -10.209 23.602 -8.033 1.00 0.00 O ATOM 1865 CB SER A 116 -10.940 20.770 -7.720 1.00 0.00 C ATOM 1866 OG SER A 116 -11.994 21.649 -7.367 1.00 0.00 O ATOM 0 H SER A 116 -9.841 22.477 -5.612 1.00 0.00 H new ATOM 0 HA SER A 116 -8.792 20.688 -7.683 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.987 20.551 -8.787 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.061 19.823 -7.195 1.00 0.00 H new ATOM 0 HG SER A 116 -11.690 22.576 -7.456 1.00 0.00 H new ATOM 1872 N GLY A 117 -8.301 22.778 -8.892 1.00 0.00 N ATOM 1873 CA GLY A 117 -8.023 23.981 -9.655 1.00 0.00 C ATOM 1874 C GLY A 117 -7.368 23.683 -10.989 1.00 0.00 C ATOM 1875 O GLY A 117 -6.930 22.564 -11.254 1.00 0.00 O ATOM 0 H GLY A 117 -7.607 22.038 -8.992 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -8.953 24.524 -9.824 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.374 24.635 -9.073 1.00 0.00 H new ATOM 1879 N PRO A 118 -7.296 24.703 -11.858 1.00 0.00 N ATOM 1880 CA PRO A 118 -6.693 24.569 -13.187 1.00 0.00 C ATOM 1881 C PRO A 118 -5.179 24.390 -13.121 1.00 0.00 C ATOM 1882 O PRO A 118 -4.435 25.361 -12.989 1.00 0.00 O ATOM 1883 CB PRO A 118 -7.045 25.892 -13.871 1.00 0.00 C ATOM 1884 CG PRO A 118 -7.231 26.859 -12.754 1.00 0.00 C ATOM 1885 CD PRO A 118 -7.798 26.065 -11.609 1.00 0.00 C ATOM 0 HA PRO A 118 -7.061 23.689 -13.715 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -6.250 26.213 -14.544 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -7.951 25.799 -14.469 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -6.284 27.322 -12.477 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -7.907 27.664 -13.043 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -7.459 26.449 -10.647 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -8.888 26.096 -11.599 1.00 0.00 H new ATOM 1893 N SER A 119 -4.731 23.142 -13.216 1.00 0.00 N ATOM 1894 CA SER A 119 -3.306 22.835 -13.163 1.00 0.00 C ATOM 1895 C SER A 119 -2.706 22.805 -14.565 1.00 0.00 C ATOM 1896 O SER A 119 -3.232 22.149 -15.463 1.00 0.00 O ATOM 1897 CB SER A 119 -3.078 21.493 -12.468 1.00 0.00 C ATOM 1898 OG SER A 119 -3.655 20.430 -13.208 1.00 0.00 O ATOM 0 H SER A 119 -5.334 22.327 -13.330 1.00 0.00 H new ATOM 0 HA SER A 119 -2.810 23.620 -12.591 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.009 21.319 -12.349 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.510 21.520 -11.468 1.00 0.00 H new ATOM 0 HG SER A 119 -3.764 20.703 -14.143 1.00 0.00 H new ATOM 1904 N SER A 120 -1.600 23.521 -14.744 1.00 0.00 N ATOM 1905 CA SER A 120 -0.928 23.580 -16.036 1.00 0.00 C ATOM 1906 C SER A 120 -0.004 22.381 -16.223 1.00 0.00 C ATOM 1907 O SER A 120 0.994 22.237 -15.518 1.00 0.00 O ATOM 1908 CB SER A 120 -0.130 24.879 -16.162 1.00 0.00 C ATOM 1909 OG SER A 120 -0.014 25.277 -17.517 1.00 0.00 O ATOM 0 H SER A 120 -1.151 24.068 -14.010 1.00 0.00 H new ATOM 0 HA SER A 120 -1.690 23.554 -16.815 1.00 0.00 H new ATOM 0 HB2 SER A 120 -0.619 25.667 -15.589 1.00 0.00 H new ATOM 0 HB3 SER A 120 0.863 24.743 -15.734 1.00 0.00 H new ATOM 0 HG SER A 120 0.499 26.111 -17.570 1.00 0.00 H new ATOM 1915 N GLY A 121 -0.343 21.522 -17.180 1.00 0.00 N ATOM 1916 CA GLY A 121 0.466 20.346 -17.443 1.00 0.00 C ATOM 1917 C GLY A 121 -0.099 19.491 -18.559 1.00 0.00 C ATOM 1918 O GLY A 121 -0.675 18.433 -18.309 1.00 0.00 O ATOM 0 H GLY A 121 -1.164 21.620 -17.778 1.00 0.00 H new ATOM 0 HA2 GLY A 121 1.478 20.656 -17.704 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.540 19.749 -16.534 1.00 0.00 H new TER 1922 GLY A 121