USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 864 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 94 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 110 LYS NZ :NH3+ -174:sc= 0.471 (180deg=-0.0409) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -55:sc= 0.0309 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 13:sc= 0.449 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 73:sc= 0.131 USER MOD Single : A 30 ASN : amide:sc=-0.000564 X(o=-0.00056,f=0) USER MOD Single : A 31 TYR OH : rot 165:sc= -0.969 USER MOD Single : A 34 SER OG : rot -58:sc= 0.371 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 9:sc= 0.543 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -5.65! C(o=-5.6!,f=-7.6!) USER MOD Single : A 66 TYR OH : rot -80:sc=-0.00629 USER MOD Single : A 67 ASN : amide:sc= -0.554 X(o=-0.55,f=-0.35) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -0.0844 K(o=-0.084,f=-2!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 87 GLN : amide:sc= 0.00489 X(o=0.0049,f=0) USER MOD Single : A 89 THR OG1 : rot -113:sc= 0.249 USER MOD Single : A 90 CYS SG : rot -169:sc= -0.0697 USER MOD Single : A 97 TYR OH : rot 180:sc= -0.0149 USER MOD Single : A 100 LYS NZ :NH3+ 155:sc= 0.0725 (180deg=0) USER MOD Single : A 101 HIS :FLIP no HD1:sc= -3.09! C(o=-4.3!,f=-3.1!) USER MOD Single : A 102 LYS NZ :NH3+ -161:sc= -0.0629 (180deg=-0.352) USER MOD Single : A 103 MET CE :methyl -166:sc= -0.0486 (180deg=-0.408) USER MOD Single : A 105 GLN : amide:sc= 0.0898 K(o=0.09,f=-0.69) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0072) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.0766 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.080 -5.603 -31.751 1.00 0.00 N ATOM 2 CA GLY A 1 14.174 -6.348 -30.896 1.00 0.00 C ATOM 3 C GLY A 1 14.497 -6.182 -29.425 1.00 0.00 C ATOM 4 O GLY A 1 15.652 -6.309 -29.017 1.00 0.00 O ATOM 0 H1 GLY A 1 14.817 -5.749 -32.747 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.019 -4.590 -31.522 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.054 -5.935 -31.598 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.152 -6.018 -31.080 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.219 -7.405 -31.158 1.00 0.00 H new ATOM 8 N SER A 2 13.475 -5.894 -28.625 1.00 0.00 N ATOM 9 CA SER A 2 13.657 -5.705 -27.190 1.00 0.00 C ATOM 10 C SER A 2 13.389 -7.001 -26.433 1.00 0.00 C ATOM 11 O SER A 2 12.754 -6.997 -25.378 1.00 0.00 O ATOM 12 CB SER A 2 12.730 -4.600 -26.679 1.00 0.00 C ATOM 13 OG SER A 2 13.181 -4.091 -25.436 1.00 0.00 O ATOM 0 H SER A 2 12.513 -5.786 -28.946 1.00 0.00 H new ATOM 0 HA SER A 2 14.692 -5.411 -27.015 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.683 -3.793 -27.410 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.718 -4.991 -26.570 1.00 0.00 H new ATOM 0 HG SER A 2 13.276 -4.827 -24.796 1.00 0.00 H new ATOM 19 N SER A 3 13.878 -8.110 -26.978 1.00 0.00 N ATOM 20 CA SER A 3 13.689 -9.416 -26.357 1.00 0.00 C ATOM 21 C SER A 3 15.014 -9.971 -25.845 1.00 0.00 C ATOM 22 O SER A 3 15.932 -10.234 -26.621 1.00 0.00 O ATOM 23 CB SER A 3 13.065 -10.393 -27.355 1.00 0.00 C ATOM 24 OG SER A 3 11.682 -10.136 -27.524 1.00 0.00 O ATOM 0 H SER A 3 14.408 -8.130 -27.849 1.00 0.00 H new ATOM 0 HA SER A 3 13.015 -9.294 -25.509 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.573 -10.311 -28.316 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.208 -11.415 -27.005 1.00 0.00 H new ATOM 0 HG SER A 3 11.307 -10.773 -28.168 1.00 0.00 H new ATOM 30 N GLY A 4 15.107 -10.147 -24.530 1.00 0.00 N ATOM 31 CA GLY A 4 16.323 -10.669 -23.935 1.00 0.00 C ATOM 32 C GLY A 4 16.477 -10.266 -22.482 1.00 0.00 C ATOM 33 O GLY A 4 16.757 -11.104 -21.625 1.00 0.00 O ATOM 0 H GLY A 4 14.361 -9.937 -23.866 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.322 -11.756 -24.009 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.183 -10.312 -24.501 1.00 0.00 H new ATOM 37 N SER A 5 16.296 -8.979 -22.204 1.00 0.00 N ATOM 38 CA SER A 5 16.422 -8.466 -20.845 1.00 0.00 C ATOM 39 C SER A 5 15.893 -9.476 -19.831 1.00 0.00 C ATOM 40 O SER A 5 14.816 -10.045 -20.009 1.00 0.00 O ATOM 41 CB SER A 5 15.667 -7.142 -20.705 1.00 0.00 C ATOM 42 OG SER A 5 16.234 -6.142 -21.533 1.00 0.00 O ATOM 0 H SER A 5 16.062 -8.273 -22.902 1.00 0.00 H new ATOM 0 HA SER A 5 17.480 -8.296 -20.644 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.620 -7.287 -20.970 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.690 -6.814 -19.666 1.00 0.00 H new ATOM 0 HG SER A 5 15.733 -5.307 -21.427 1.00 0.00 H new ATOM 48 N SER A 6 16.659 -9.693 -18.767 1.00 0.00 N ATOM 49 CA SER A 6 16.270 -10.637 -17.725 1.00 0.00 C ATOM 50 C SER A 6 16.873 -10.242 -16.381 1.00 0.00 C ATOM 51 O SER A 6 17.699 -9.333 -16.301 1.00 0.00 O ATOM 52 CB SER A 6 16.714 -12.053 -18.099 1.00 0.00 C ATOM 53 OG SER A 6 15.874 -12.603 -19.099 1.00 0.00 O ATOM 0 H SER A 6 17.552 -9.228 -18.603 1.00 0.00 H new ATOM 0 HA SER A 6 15.184 -10.615 -17.637 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.744 -12.032 -18.456 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.696 -12.689 -17.214 1.00 0.00 H new ATOM 0 HG SER A 6 15.313 -11.896 -19.480 1.00 0.00 H new ATOM 59 N GLY A 7 16.454 -10.932 -15.325 1.00 0.00 N ATOM 60 CA GLY A 7 16.962 -10.639 -13.997 1.00 0.00 C ATOM 61 C GLY A 7 18.449 -10.905 -13.874 1.00 0.00 C ATOM 62 O GLY A 7 19.220 -10.591 -14.782 1.00 0.00 O ATOM 0 H GLY A 7 15.772 -11.689 -15.365 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.762 -9.595 -13.757 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.426 -11.243 -13.265 1.00 0.00 H new ATOM 66 N ARG A 8 18.854 -11.483 -12.748 1.00 0.00 N ATOM 67 CA ARG A 8 20.259 -11.788 -12.508 1.00 0.00 C ATOM 68 C ARG A 8 21.156 -10.679 -13.050 1.00 0.00 C ATOM 69 O ARG A 8 22.172 -10.946 -13.693 1.00 0.00 O ATOM 70 CB ARG A 8 20.631 -13.123 -13.157 1.00 0.00 C ATOM 71 CG ARG A 8 20.360 -13.170 -14.652 1.00 0.00 C ATOM 72 CD ARG A 8 20.730 -14.522 -15.242 1.00 0.00 C ATOM 73 NE ARG A 8 21.872 -15.123 -14.560 1.00 0.00 N ATOM 74 CZ ARG A 8 21.764 -15.880 -13.473 1.00 0.00 C ATOM 75 NH1 ARG A 8 20.571 -16.127 -12.949 1.00 0.00 N ATOM 76 NH2 ARG A 8 22.850 -16.392 -12.909 1.00 0.00 N ATOM 0 H ARG A 8 18.229 -11.749 -11.987 1.00 0.00 H new ATOM 0 HA ARG A 8 20.411 -11.861 -11.431 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.689 -13.320 -12.982 1.00 0.00 H new ATOM 0 HB3 ARG A 8 20.073 -13.922 -12.670 1.00 0.00 H new ATOM 0 HG2 ARG A 8 19.306 -12.966 -14.838 1.00 0.00 H new ATOM 0 HG3 ARG A 8 20.929 -12.386 -15.151 1.00 0.00 H new ATOM 0 HD2 ARG A 8 19.874 -15.193 -15.175 1.00 0.00 H new ATOM 0 HD3 ARG A 8 20.961 -14.404 -16.301 1.00 0.00 H new ATOM 0 HE ARG A 8 22.804 -14.953 -14.938 1.00 0.00 H new ATOM 0 HH11 ARG A 8 19.734 -15.736 -13.380 1.00 0.00 H new ATOM 0 HH12 ARG A 8 20.491 -16.708 -12.115 1.00 0.00 H new ATOM 0 HH21 ARG A 8 23.769 -16.205 -13.310 1.00 0.00 H new ATOM 0 HH22 ARG A 8 22.766 -16.973 -12.075 1.00 0.00 H new ATOM 90 N LEU A 9 20.774 -9.434 -12.788 1.00 0.00 N ATOM 91 CA LEU A 9 21.543 -8.284 -13.250 1.00 0.00 C ATOM 92 C LEU A 9 21.344 -7.089 -12.323 1.00 0.00 C ATOM 93 O LEU A 9 20.220 -6.632 -12.113 1.00 0.00 O ATOM 94 CB LEU A 9 21.134 -7.911 -14.676 1.00 0.00 C ATOM 95 CG LEU A 9 22.188 -7.181 -15.507 1.00 0.00 C ATOM 96 CD1 LEU A 9 22.958 -6.192 -14.644 1.00 0.00 C ATOM 97 CD2 LEU A 9 23.138 -8.176 -16.157 1.00 0.00 C ATOM 0 H LEU A 9 19.936 -9.195 -12.258 1.00 0.00 H new ATOM 0 HA LEU A 9 22.598 -8.556 -13.241 1.00 0.00 H new ATOM 0 HB2 LEU A 9 20.853 -8.823 -15.202 1.00 0.00 H new ATOM 0 HB3 LEU A 9 20.243 -7.285 -14.625 1.00 0.00 H new ATOM 0 HG LEU A 9 21.680 -6.625 -16.295 1.00 0.00 H new ATOM 0 HD11 LEU A 9 23.704 -5.682 -15.253 1.00 0.00 H new ATOM 0 HD12 LEU A 9 22.268 -5.459 -14.226 1.00 0.00 H new ATOM 0 HD13 LEU A 9 23.455 -6.726 -13.834 1.00 0.00 H new ATOM 0 HD21 LEU A 9 23.882 -7.638 -16.745 1.00 0.00 H new ATOM 0 HD22 LEU A 9 23.639 -8.759 -15.384 1.00 0.00 H new ATOM 0 HD23 LEU A 9 22.575 -8.844 -16.808 1.00 0.00 H new ATOM 109 N LEU A 10 22.443 -6.586 -11.772 1.00 0.00 N ATOM 110 CA LEU A 10 22.391 -5.441 -10.868 1.00 0.00 C ATOM 111 C LEU A 10 21.551 -4.316 -11.463 1.00 0.00 C ATOM 112 O LEU A 10 21.680 -3.988 -12.643 1.00 0.00 O ATOM 113 CB LEU A 10 23.804 -4.936 -10.572 1.00 0.00 C ATOM 114 CG LEU A 10 23.995 -4.224 -9.232 1.00 0.00 C ATOM 115 CD1 LEU A 10 23.266 -2.889 -9.229 1.00 0.00 C ATOM 116 CD2 LEU A 10 23.509 -5.101 -8.088 1.00 0.00 C ATOM 0 H LEU A 10 23.381 -6.952 -11.935 1.00 0.00 H new ATOM 0 HA LEU A 10 21.925 -5.764 -9.937 1.00 0.00 H new ATOM 0 HB2 LEU A 10 24.487 -5.785 -10.611 1.00 0.00 H new ATOM 0 HB3 LEU A 10 24.099 -4.253 -11.369 1.00 0.00 H new ATOM 0 HG LEU A 10 25.059 -4.035 -9.091 1.00 0.00 H new ATOM 0 HD11 LEU A 10 23.413 -2.396 -8.268 1.00 0.00 H new ATOM 0 HD12 LEU A 10 23.661 -2.257 -10.025 1.00 0.00 H new ATOM 0 HD13 LEU A 10 22.201 -3.055 -9.392 1.00 0.00 H new ATOM 0 HD21 LEU A 10 23.653 -4.578 -7.142 1.00 0.00 H new ATOM 0 HD22 LEU A 10 22.450 -5.322 -8.223 1.00 0.00 H new ATOM 0 HD23 LEU A 10 24.075 -6.032 -8.077 1.00 0.00 H new ATOM 128 N ASP A 11 20.692 -3.727 -10.639 1.00 0.00 N ATOM 129 CA ASP A 11 19.832 -2.635 -11.082 1.00 0.00 C ATOM 130 C ASP A 11 19.033 -2.065 -9.915 1.00 0.00 C ATOM 131 O ASP A 11 18.159 -2.734 -9.361 1.00 0.00 O ATOM 132 CB ASP A 11 18.883 -3.119 -12.179 1.00 0.00 C ATOM 133 CG ASP A 11 18.569 -4.598 -12.063 1.00 0.00 C ATOM 134 OD1 ASP A 11 18.552 -5.113 -10.925 1.00 0.00 O ATOM 135 OD2 ASP A 11 18.340 -5.239 -13.109 1.00 0.00 O ATOM 0 H ASP A 11 20.572 -3.987 -9.660 1.00 0.00 H new ATOM 0 HA ASP A 11 20.466 -1.845 -11.484 1.00 0.00 H new ATOM 0 HB2 ASP A 11 17.955 -2.549 -12.130 1.00 0.00 H new ATOM 0 HB3 ASP A 11 19.328 -2.921 -13.154 1.00 0.00 H new ATOM 140 N LEU A 12 19.338 -0.826 -9.545 1.00 0.00 N ATOM 141 CA LEU A 12 18.648 -0.165 -8.442 1.00 0.00 C ATOM 142 C LEU A 12 18.065 1.172 -8.888 1.00 0.00 C ATOM 143 O LEU A 12 18.564 2.233 -8.513 1.00 0.00 O ATOM 144 CB LEU A 12 19.607 0.049 -7.270 1.00 0.00 C ATOM 145 CG LEU A 12 19.819 -1.152 -6.348 1.00 0.00 C ATOM 146 CD1 LEU A 12 20.919 -0.863 -5.338 1.00 0.00 C ATOM 147 CD2 LEU A 12 18.523 -1.515 -5.638 1.00 0.00 C ATOM 0 H LEU A 12 20.058 -0.259 -9.992 1.00 0.00 H new ATOM 0 HA LEU A 12 17.829 -0.808 -8.120 1.00 0.00 H new ATOM 0 HB2 LEU A 12 20.575 0.350 -7.669 1.00 0.00 H new ATOM 0 HB3 LEU A 12 19.237 0.881 -6.671 1.00 0.00 H new ATOM 0 HG LEU A 12 20.127 -2.002 -6.957 1.00 0.00 H new ATOM 0 HD11 LEU A 12 21.055 -1.729 -4.691 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.850 -0.653 -5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 12 20.641 0.001 -4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 12 18.693 -2.372 -4.986 1.00 0.00 H new ATOM 0 HD22 LEU A 12 18.185 -0.667 -5.042 1.00 0.00 H new ATOM 0 HD23 LEU A 12 17.762 -1.766 -6.376 1.00 0.00 H new ATOM 159 N GLU A 13 17.005 1.113 -9.688 1.00 0.00 N ATOM 160 CA GLU A 13 16.354 2.320 -10.183 1.00 0.00 C ATOM 161 C GLU A 13 16.093 3.303 -9.045 1.00 0.00 C ATOM 162 O GLU A 13 16.122 2.933 -7.872 1.00 0.00 O ATOM 163 CB GLU A 13 15.038 1.967 -10.879 1.00 0.00 C ATOM 164 CG GLU A 13 15.223 1.352 -12.256 1.00 0.00 C ATOM 165 CD GLU A 13 15.849 -0.028 -12.199 1.00 0.00 C ATOM 166 OE1 GLU A 13 15.340 -0.880 -11.440 1.00 0.00 O ATOM 167 OE2 GLU A 13 16.847 -0.256 -12.913 1.00 0.00 O ATOM 0 H GLU A 13 16.579 0.243 -10.007 1.00 0.00 H new ATOM 0 HA GLU A 13 17.022 2.793 -10.903 1.00 0.00 H new ATOM 0 HB2 GLU A 13 14.480 1.272 -10.252 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.433 2.869 -10.972 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.256 1.288 -12.754 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.850 2.007 -12.861 1.00 0.00 H new ATOM 174 N ASN A 14 15.837 4.558 -9.402 1.00 0.00 N ATOM 175 CA ASN A 14 15.572 5.595 -8.411 1.00 0.00 C ATOM 176 C ASN A 14 14.102 6.004 -8.432 1.00 0.00 C ATOM 177 O ASN A 14 13.721 6.949 -9.123 1.00 0.00 O ATOM 178 CB ASN A 14 16.456 6.816 -8.671 1.00 0.00 C ATOM 179 CG ASN A 14 17.873 6.432 -9.053 1.00 0.00 C ATOM 180 OD1 ASN A 14 18.675 6.048 -8.201 1.00 0.00 O ATOM 181 ND2 ASN A 14 18.188 6.536 -10.339 1.00 0.00 N ATOM 0 H ASN A 14 15.808 4.881 -10.369 1.00 0.00 H new ATOM 0 HA ASN A 14 15.804 5.190 -7.426 1.00 0.00 H new ATOM 0 HB2 ASN A 14 16.017 7.416 -9.468 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.480 7.441 -7.778 1.00 0.00 H new ATOM 0 HD21 ASN A 14 19.127 6.293 -10.655 1.00 0.00 H new ATOM 0 HD22 ASN A 14 17.491 6.859 -11.010 1.00 0.00 H new ATOM 188 N ILE A 15 13.283 5.286 -7.672 1.00 0.00 N ATOM 189 CA ILE A 15 11.856 5.575 -7.602 1.00 0.00 C ATOM 190 C ILE A 15 11.586 6.808 -6.746 1.00 0.00 C ATOM 191 O ILE A 15 12.173 6.974 -5.677 1.00 0.00 O ATOM 192 CB ILE A 15 11.067 4.383 -7.028 1.00 0.00 C ATOM 193 CG1 ILE A 15 11.254 3.147 -7.910 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.592 4.735 -6.903 1.00 0.00 C ATOM 195 CD1 ILE A 15 12.574 2.443 -7.692 1.00 0.00 C ATOM 0 H ILE A 15 13.583 4.500 -7.096 1.00 0.00 H new ATOM 0 HA ILE A 15 11.522 5.763 -8.622 1.00 0.00 H new ATOM 0 HB ILE A 15 11.451 4.157 -6.033 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.442 2.446 -7.717 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.178 3.443 -8.956 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.048 3.883 -6.496 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.477 5.590 -6.237 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.193 4.984 -7.886 1.00 0.00 H new ATOM 0 HD11 ILE A 15 12.637 1.577 -8.350 1.00 0.00 H new ATOM 0 HD12 ILE A 15 13.393 3.128 -7.914 1.00 0.00 H new ATOM 0 HD13 ILE A 15 12.645 2.116 -6.655 1.00 0.00 H new ATOM 207 N GLN A 16 10.694 7.669 -7.224 1.00 0.00 N ATOM 208 CA GLN A 16 10.346 8.887 -6.502 1.00 0.00 C ATOM 209 C GLN A 16 9.311 8.601 -5.419 1.00 0.00 C ATOM 210 O GLN A 16 8.110 8.562 -5.689 1.00 0.00 O ATOM 211 CB GLN A 16 9.810 9.944 -7.470 1.00 0.00 C ATOM 212 CG GLN A 16 10.827 10.392 -8.507 1.00 0.00 C ATOM 213 CD GLN A 16 10.254 11.389 -9.494 1.00 0.00 C ATOM 214 OE1 GLN A 16 9.871 12.498 -9.121 1.00 0.00 O ATOM 215 NE2 GLN A 16 10.193 11.000 -10.762 1.00 0.00 N ATOM 0 H GLN A 16 10.199 7.546 -8.108 1.00 0.00 H new ATOM 0 HA GLN A 16 11.249 9.267 -6.025 1.00 0.00 H new ATOM 0 HB2 GLN A 16 8.934 9.545 -7.981 1.00 0.00 H new ATOM 0 HB3 GLN A 16 9.479 10.812 -6.900 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.683 10.838 -8.001 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.195 9.521 -9.049 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.522 10.072 -11.027 1.00 0.00 H new ATOM 0 HE22 GLN A 16 9.817 11.630 -11.471 1.00 0.00 H new ATOM 224 N ILE A 17 9.784 8.401 -4.194 1.00 0.00 N ATOM 225 CA ILE A 17 8.899 8.119 -3.070 1.00 0.00 C ATOM 226 C ILE A 17 8.857 9.292 -2.096 1.00 0.00 C ATOM 227 O ILE A 17 9.881 9.884 -1.754 1.00 0.00 O ATOM 228 CB ILE A 17 9.338 6.852 -2.312 1.00 0.00 C ATOM 229 CG1 ILE A 17 9.328 5.642 -3.249 1.00 0.00 C ATOM 230 CG2 ILE A 17 8.431 6.610 -1.115 1.00 0.00 C ATOM 231 CD1 ILE A 17 9.681 4.342 -2.560 1.00 0.00 C ATOM 0 H ILE A 17 10.775 8.429 -3.954 1.00 0.00 H new ATOM 0 HA ILE A 17 7.904 7.958 -3.484 1.00 0.00 H new ATOM 0 HB ILE A 17 10.355 6.998 -1.948 1.00 0.00 H new ATOM 0 HG12 ILE A 17 8.339 5.549 -3.699 1.00 0.00 H new ATOM 0 HG13 ILE A 17 10.033 5.816 -4.062 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.754 5.711 -0.590 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.484 7.464 -0.440 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.404 6.481 -1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 17 9.654 3.528 -3.284 1.00 0.00 H new ATOM 0 HD12 ILE A 17 10.682 4.416 -2.134 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.962 4.145 -1.765 1.00 0.00 H new ATOM 243 N PRO A 18 7.645 9.635 -1.636 1.00 0.00 N ATOM 244 CA PRO A 18 7.439 10.738 -0.693 1.00 0.00 C ATOM 245 C PRO A 18 7.985 10.422 0.696 1.00 0.00 C ATOM 246 O PRO A 18 7.934 9.278 1.147 1.00 0.00 O ATOM 247 CB PRO A 18 5.917 10.888 -0.648 1.00 0.00 C ATOM 248 CG PRO A 18 5.393 9.544 -1.023 1.00 0.00 C ATOM 249 CD PRO A 18 6.381 8.973 -2.002 1.00 0.00 C ATOM 0 HA PRO A 18 7.960 11.643 -1.004 1.00 0.00 H new ATOM 0 HB2 PRO A 18 5.577 11.182 0.345 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.574 11.655 -1.343 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.298 8.904 -0.146 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.402 9.622 -1.470 1.00 0.00 H new ATOM 0 HD2 PRO A 18 6.454 7.889 -1.913 1.00 0.00 H new ATOM 0 HD3 PRO A 18 6.097 9.190 -3.032 1.00 0.00 H new ATOM 257 N ASP A 19 8.505 11.443 1.368 1.00 0.00 N ATOM 258 CA ASP A 19 9.058 11.274 2.707 1.00 0.00 C ATOM 259 C ASP A 19 8.014 10.698 3.658 1.00 0.00 C ATOM 260 O ASP A 19 8.335 9.904 4.541 1.00 0.00 O ATOM 261 CB ASP A 19 9.572 12.611 3.242 1.00 0.00 C ATOM 262 CG ASP A 19 10.663 13.203 2.372 1.00 0.00 C ATOM 263 OD1 ASP A 19 11.597 12.460 2.004 1.00 0.00 O ATOM 264 OD2 ASP A 19 10.583 14.409 2.059 1.00 0.00 O ATOM 0 H ASP A 19 8.555 12.396 1.008 1.00 0.00 H new ATOM 0 HA ASP A 19 9.890 10.573 2.644 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.743 13.315 3.309 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.954 12.471 4.253 1.00 0.00 H new ATOM 269 N ALA A 20 6.763 11.105 3.472 1.00 0.00 N ATOM 270 CA ALA A 20 5.671 10.629 4.312 1.00 0.00 C ATOM 271 C ALA A 20 4.614 9.907 3.483 1.00 0.00 C ATOM 272 O ALA A 20 4.414 10.195 2.303 1.00 0.00 O ATOM 273 CB ALA A 20 5.046 11.790 5.073 1.00 0.00 C ATOM 0 H ALA A 20 6.480 11.764 2.746 1.00 0.00 H new ATOM 0 HA ALA A 20 6.081 9.917 5.029 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.232 11.420 5.696 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.801 12.260 5.703 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.657 12.522 4.365 1.00 0.00 H new ATOM 279 N PRO A 21 3.922 8.947 4.112 1.00 0.00 N ATOM 280 CA PRO A 21 2.874 8.163 3.451 1.00 0.00 C ATOM 281 C PRO A 21 1.633 8.995 3.148 1.00 0.00 C ATOM 282 O PRO A 21 0.914 9.432 4.047 1.00 0.00 O ATOM 283 CB PRO A 21 2.549 7.071 4.473 1.00 0.00 C ATOM 284 CG PRO A 21 2.929 7.658 5.789 1.00 0.00 C ATOM 285 CD PRO A 21 4.108 8.551 5.519 1.00 0.00 C ATOM 0 HA PRO A 21 3.201 7.778 2.485 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.492 6.807 4.448 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.110 6.159 4.270 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.101 8.223 6.218 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.187 6.877 6.505 1.00 0.00 H new ATOM 0 HD2 PRO A 21 4.117 9.416 6.182 1.00 0.00 H new ATOM 0 HD3 PRO A 21 5.052 8.026 5.667 1.00 0.00 H new ATOM 293 N PRO A 22 1.373 9.221 1.851 1.00 0.00 N ATOM 294 CA PRO A 22 0.217 10.002 1.400 1.00 0.00 C ATOM 295 C PRO A 22 -1.102 9.275 1.639 1.00 0.00 C ATOM 296 O PRO A 22 -1.137 8.075 1.913 1.00 0.00 O ATOM 297 CB PRO A 22 0.469 10.173 -0.100 1.00 0.00 C ATOM 298 CG PRO A 22 1.328 9.015 -0.475 1.00 0.00 C ATOM 299 CD PRO A 22 2.187 8.731 0.726 1.00 0.00 C ATOM 0 HA PRO A 22 0.125 10.944 1.941 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -0.465 10.171 -0.661 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.966 11.120 -0.312 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.722 8.147 -0.735 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.940 9.249 -1.346 1.00 0.00 H new ATOM 0 HD2 PRO A 22 2.405 7.667 0.821 1.00 0.00 H new ATOM 0 HD3 PRO A 22 3.144 9.249 0.667 1.00 0.00 H new ATOM 307 N PRO A 23 -2.215 10.017 1.533 1.00 0.00 N ATOM 308 CA PRO A 23 -3.557 9.463 1.733 1.00 0.00 C ATOM 309 C PRO A 23 -3.966 8.514 0.612 1.00 0.00 C ATOM 310 O PRO A 23 -3.194 8.265 -0.315 1.00 0.00 O ATOM 311 CB PRO A 23 -4.455 10.703 1.738 1.00 0.00 C ATOM 312 CG PRO A 23 -3.705 11.717 0.946 1.00 0.00 C ATOM 313 CD PRO A 23 -2.248 11.453 1.209 1.00 0.00 C ATOM 0 HA PRO A 23 -3.621 8.869 2.645 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.426 10.490 1.291 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.642 11.053 2.753 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.932 11.628 -0.116 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -3.979 12.728 1.247 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.634 11.683 0.338 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.872 12.060 2.033 1.00 0.00 H new ATOM 321 N ILE A 24 -5.182 7.987 0.702 1.00 0.00 N ATOM 322 CA ILE A 24 -5.693 7.067 -0.306 1.00 0.00 C ATOM 323 C ILE A 24 -6.792 7.718 -1.139 1.00 0.00 C ATOM 324 O ILE A 24 -7.664 8.417 -0.623 1.00 0.00 O ATOM 325 CB ILE A 24 -6.244 5.780 0.334 1.00 0.00 C ATOM 326 CG1 ILE A 24 -5.180 5.128 1.220 1.00 0.00 C ATOM 327 CG2 ILE A 24 -6.712 4.811 -0.741 1.00 0.00 C ATOM 328 CD1 ILE A 24 -5.145 5.680 2.628 1.00 0.00 C ATOM 0 H ILE A 24 -5.832 8.182 1.463 1.00 0.00 H new ATOM 0 HA ILE A 24 -4.854 6.811 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.099 6.040 0.958 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -5.363 4.054 1.264 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.201 5.266 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.099 3.906 -0.272 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.499 5.277 -1.334 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.874 4.554 -1.389 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.368 5.172 3.199 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.931 6.748 2.595 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -6.111 5.518 3.106 1.00 0.00 H new ATOM 340 N PRO A 25 -6.751 7.484 -2.459 1.00 0.00 N ATOM 341 CA PRO A 25 -7.738 8.036 -3.392 1.00 0.00 C ATOM 342 C PRO A 25 -9.114 7.403 -3.223 1.00 0.00 C ATOM 343 O PRO A 25 -9.301 6.511 -2.395 1.00 0.00 O ATOM 344 CB PRO A 25 -7.157 7.694 -4.766 1.00 0.00 C ATOM 345 CG PRO A 25 -6.300 6.499 -4.528 1.00 0.00 C ATOM 346 CD PRO A 25 -5.740 6.660 -3.143 1.00 0.00 C ATOM 0 HA PRO A 25 -7.896 9.103 -3.234 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -7.946 7.478 -5.487 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -6.576 8.524 -5.168 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -6.881 5.580 -4.610 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.501 6.438 -5.267 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.606 5.697 -2.650 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.766 7.149 -3.158 1.00 0.00 H new ATOM 354 N LYS A 26 -10.076 7.869 -4.012 1.00 0.00 N ATOM 355 CA LYS A 26 -11.436 7.348 -3.951 1.00 0.00 C ATOM 356 C LYS A 26 -11.486 5.901 -4.432 1.00 0.00 C ATOM 357 O LYS A 26 -11.231 5.618 -5.602 1.00 0.00 O ATOM 358 CB LYS A 26 -12.374 8.211 -4.799 1.00 0.00 C ATOM 359 CG LYS A 26 -13.830 7.785 -4.720 1.00 0.00 C ATOM 360 CD LYS A 26 -14.494 8.299 -3.454 1.00 0.00 C ATOM 361 CE LYS A 26 -14.970 9.734 -3.618 1.00 0.00 C ATOM 362 NZ LYS A 26 -15.773 10.189 -2.449 1.00 0.00 N ATOM 0 H LYS A 26 -9.938 8.607 -4.702 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.764 7.379 -2.912 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.290 9.249 -4.477 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.049 8.173 -5.839 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -14.367 8.159 -5.591 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.894 6.697 -4.749 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -15.340 7.660 -3.201 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -13.791 8.240 -2.623 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.109 10.390 -3.745 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -15.569 9.816 -4.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -16.079 11.172 -2.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -16.608 9.579 -2.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -15.193 10.135 -1.587 1.00 0.00 H new ATOM 376 N GLU A 27 -11.818 4.990 -3.522 1.00 0.00 N ATOM 377 CA GLU A 27 -11.902 3.573 -3.855 1.00 0.00 C ATOM 378 C GLU A 27 -13.018 3.317 -4.864 1.00 0.00 C ATOM 379 O GLU A 27 -14.083 3.932 -4.820 1.00 0.00 O ATOM 380 CB GLU A 27 -12.141 2.743 -2.593 1.00 0.00 C ATOM 381 CG GLU A 27 -13.347 3.194 -1.786 1.00 0.00 C ATOM 382 CD GLU A 27 -14.637 2.552 -2.259 1.00 0.00 C ATOM 383 OE1 GLU A 27 -14.575 1.440 -2.823 1.00 0.00 O ATOM 384 OE2 GLU A 27 -15.709 3.162 -2.062 1.00 0.00 O ATOM 0 H GLU A 27 -12.033 5.208 -2.549 1.00 0.00 H new ATOM 0 HA GLU A 27 -10.954 3.275 -4.303 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.273 1.699 -2.875 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -11.253 2.793 -1.962 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.188 2.951 -0.735 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.439 4.278 -1.852 1.00 0.00 H new ATOM 391 N PRO A 28 -12.768 2.387 -5.798 1.00 0.00 N ATOM 392 CA PRO A 28 -13.738 2.027 -6.836 1.00 0.00 C ATOM 393 C PRO A 28 -14.941 1.278 -6.271 1.00 0.00 C ATOM 394 O PRO A 28 -14.789 0.261 -5.596 1.00 0.00 O ATOM 395 CB PRO A 28 -12.936 1.120 -7.773 1.00 0.00 C ATOM 396 CG PRO A 28 -11.860 0.548 -6.916 1.00 0.00 C ATOM 397 CD PRO A 28 -11.520 1.614 -5.912 1.00 0.00 C ATOM 0 HA PRO A 28 -14.155 2.907 -7.326 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.563 0.336 -8.198 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.520 1.683 -8.609 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.198 -0.362 -6.420 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.987 0.280 -7.512 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.225 1.185 -4.955 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.692 2.236 -6.251 1.00 0.00 H new ATOM 405 N SER A 29 -16.135 1.788 -6.553 1.00 0.00 N ATOM 406 CA SER A 29 -17.364 1.169 -6.070 1.00 0.00 C ATOM 407 C SER A 29 -18.203 0.646 -7.233 1.00 0.00 C ATOM 408 O SER A 29 -19.405 0.894 -7.306 1.00 0.00 O ATOM 409 CB SER A 29 -18.178 2.172 -5.251 1.00 0.00 C ATOM 410 OG SER A 29 -17.715 2.231 -3.912 1.00 0.00 O ATOM 0 H SER A 29 -16.278 2.628 -7.113 1.00 0.00 H new ATOM 0 HA SER A 29 -17.091 0.327 -5.434 1.00 0.00 H new ATOM 0 HB2 SER A 29 -18.109 3.160 -5.707 1.00 0.00 H new ATOM 0 HB3 SER A 29 -19.230 1.888 -5.263 1.00 0.00 H new ATOM 0 HG SER A 29 -16.855 2.701 -3.883 1.00 0.00 H new ATOM 416 N ASN A 30 -17.557 -0.079 -8.141 1.00 0.00 N ATOM 417 CA ASN A 30 -18.242 -0.636 -9.301 1.00 0.00 C ATOM 418 C ASN A 30 -17.938 -2.124 -9.449 1.00 0.00 C ATOM 419 O ASN A 30 -18.500 -2.800 -10.312 1.00 0.00 O ATOM 420 CB ASN A 30 -17.828 0.109 -10.571 1.00 0.00 C ATOM 421 CG ASN A 30 -18.922 0.115 -11.622 1.00 0.00 C ATOM 422 OD1 ASN A 30 -19.779 0.999 -11.636 1.00 0.00 O ATOM 423 ND2 ASN A 30 -18.897 -0.874 -12.507 1.00 0.00 N ATOM 0 H ASN A 30 -16.561 -0.294 -8.095 1.00 0.00 H new ATOM 0 HA ASN A 30 -19.315 -0.515 -9.151 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -17.566 1.136 -10.317 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -16.933 -0.355 -10.985 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -19.607 -0.923 -13.237 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -18.167 -1.585 -12.457 1.00 0.00 H new ATOM 430 N TYR A 31 -17.047 -2.627 -8.603 1.00 0.00 N ATOM 431 CA TYR A 31 -16.667 -4.034 -8.640 1.00 0.00 C ATOM 432 C TYR A 31 -17.500 -4.850 -7.656 1.00 0.00 C ATOM 433 O TYR A 31 -17.907 -4.351 -6.607 1.00 0.00 O ATOM 434 CB TYR A 31 -15.179 -4.191 -8.319 1.00 0.00 C ATOM 435 CG TYR A 31 -14.317 -3.086 -8.887 1.00 0.00 C ATOM 436 CD1 TYR A 31 -14.707 -2.389 -10.024 1.00 0.00 C ATOM 437 CD2 TYR A 31 -13.113 -2.739 -8.287 1.00 0.00 C ATOM 438 CE1 TYR A 31 -13.923 -1.380 -10.547 1.00 0.00 C ATOM 439 CE2 TYR A 31 -12.323 -1.729 -8.802 1.00 0.00 C ATOM 440 CZ TYR A 31 -12.732 -1.053 -9.932 1.00 0.00 C ATOM 441 OH TYR A 31 -11.947 -0.048 -10.449 1.00 0.00 O ATOM 0 H TYR A 31 -16.574 -2.081 -7.883 1.00 0.00 H new ATOM 0 HA TYR A 31 -16.856 -4.409 -9.646 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -15.051 -4.221 -7.237 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -14.831 -5.148 -8.708 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -15.640 -2.641 -10.507 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -12.789 -3.268 -7.403 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -14.240 -0.850 -11.433 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -11.391 -1.471 -8.322 1.00 0.00 H new ATOM 0 HH TYR A 31 -11.279 0.220 -9.784 1.00 0.00 H new ATOM 451 N ASP A 32 -17.748 -6.108 -8.002 1.00 0.00 N ATOM 452 CA ASP A 32 -18.531 -6.995 -7.150 1.00 0.00 C ATOM 453 C ASP A 32 -17.663 -8.120 -6.594 1.00 0.00 C ATOM 454 O ASP A 32 -17.647 -8.368 -5.389 1.00 0.00 O ATOM 455 CB ASP A 32 -19.708 -7.581 -7.932 1.00 0.00 C ATOM 456 CG ASP A 32 -20.348 -8.756 -7.220 1.00 0.00 C ATOM 457 OD1 ASP A 32 -20.276 -8.807 -5.974 1.00 0.00 O ATOM 458 OD2 ASP A 32 -20.922 -9.626 -7.909 1.00 0.00 O ATOM 0 H ASP A 32 -17.418 -6.537 -8.867 1.00 0.00 H new ATOM 0 HA ASP A 32 -18.916 -6.410 -6.315 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -20.457 -6.805 -8.092 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -19.364 -7.900 -8.916 1.00 0.00 H new ATOM 463 N PHE A 33 -16.943 -8.799 -7.482 1.00 0.00 N ATOM 464 CA PHE A 33 -16.074 -9.899 -7.081 1.00 0.00 C ATOM 465 C PHE A 33 -15.373 -9.585 -5.762 1.00 0.00 C ATOM 466 O PHE A 33 -15.184 -8.421 -5.409 1.00 0.00 O ATOM 467 CB PHE A 33 -15.036 -10.180 -8.169 1.00 0.00 C ATOM 468 CG PHE A 33 -14.092 -9.036 -8.407 1.00 0.00 C ATOM 469 CD1 PHE A 33 -13.120 -8.718 -7.472 1.00 0.00 C ATOM 470 CD2 PHE A 33 -14.177 -8.280 -9.564 1.00 0.00 C ATOM 471 CE1 PHE A 33 -12.250 -7.665 -7.688 1.00 0.00 C ATOM 472 CE2 PHE A 33 -13.310 -7.227 -9.786 1.00 0.00 C ATOM 473 CZ PHE A 33 -12.345 -6.920 -8.847 1.00 0.00 C ATOM 0 H PHE A 33 -16.945 -8.606 -8.484 1.00 0.00 H new ATOM 0 HA PHE A 33 -16.693 -10.786 -6.942 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -14.461 -11.063 -7.892 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -15.552 -10.415 -9.100 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -13.041 -9.299 -6.565 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -14.930 -8.516 -10.302 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -11.497 -7.426 -6.951 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -13.387 -6.645 -10.693 1.00 0.00 H new ATOM 0 HZ PHE A 33 -11.665 -6.098 -9.019 1.00 0.00 H new ATOM 483 N SER A 34 -14.990 -10.632 -5.039 1.00 0.00 N ATOM 484 CA SER A 34 -14.314 -10.470 -3.757 1.00 0.00 C ATOM 485 C SER A 34 -15.242 -9.827 -2.731 1.00 0.00 C ATOM 486 O SER A 34 -14.907 -8.811 -2.125 1.00 0.00 O ATOM 487 CB SER A 34 -13.054 -9.618 -3.926 1.00 0.00 C ATOM 488 OG SER A 34 -12.330 -9.532 -2.710 1.00 0.00 O ATOM 0 H SER A 34 -15.136 -11.602 -5.319 1.00 0.00 H new ATOM 0 HA SER A 34 -14.031 -11.459 -3.396 1.00 0.00 H new ATOM 0 HB2 SER A 34 -12.420 -10.050 -4.701 1.00 0.00 H new ATOM 0 HB3 SER A 34 -13.330 -8.618 -4.261 1.00 0.00 H new ATOM 0 HG SER A 34 -12.904 -9.150 -2.014 1.00 0.00 H new ATOM 494 N GLY A 35 -16.412 -10.430 -2.541 1.00 0.00 N ATOM 495 CA GLY A 35 -17.372 -9.903 -1.588 1.00 0.00 C ATOM 496 C GLY A 35 -17.040 -10.287 -0.160 1.00 0.00 C ATOM 497 O GLY A 35 -16.268 -11.212 0.094 1.00 0.00 O ATOM 0 H GLY A 35 -16.712 -11.274 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.403 -8.817 -1.671 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.367 -10.271 -1.838 1.00 0.00 H new ATOM 501 N PRO A 36 -17.630 -9.564 0.803 1.00 0.00 N ATOM 502 CA PRO A 36 -17.408 -9.814 2.230 1.00 0.00 C ATOM 503 C PRO A 36 -18.034 -11.125 2.694 1.00 0.00 C ATOM 504 O PRO A 36 -19.218 -11.173 3.029 1.00 0.00 O ATOM 505 CB PRO A 36 -18.091 -8.625 2.910 1.00 0.00 C ATOM 506 CG PRO A 36 -19.130 -8.180 1.940 1.00 0.00 C ATOM 507 CD PRO A 36 -18.562 -8.447 0.573 1.00 0.00 C ATOM 0 HA PRO A 36 -16.348 -9.906 2.467 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -18.536 -8.915 3.862 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -17.379 -7.827 3.121 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -20.062 -8.726 2.089 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -19.356 -7.122 2.069 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -19.341 -8.714 -0.141 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -18.050 -7.572 0.173 1.00 0.00 H new ATOM 515 N SER A 37 -17.233 -12.185 2.711 1.00 0.00 N ATOM 516 CA SER A 37 -17.711 -13.498 3.131 1.00 0.00 C ATOM 517 C SER A 37 -17.015 -13.945 4.412 1.00 0.00 C ATOM 518 O SER A 37 -15.895 -13.524 4.703 1.00 0.00 O ATOM 519 CB SER A 37 -17.476 -14.527 2.023 1.00 0.00 C ATOM 520 OG SER A 37 -16.108 -14.583 1.661 1.00 0.00 O ATOM 0 H SER A 37 -16.250 -12.161 2.439 1.00 0.00 H new ATOM 0 HA SER A 37 -18.781 -13.423 3.327 1.00 0.00 H new ATOM 0 HB2 SER A 37 -17.807 -15.510 2.359 1.00 0.00 H new ATOM 0 HB3 SER A 37 -18.076 -14.270 1.150 1.00 0.00 H new ATOM 0 HG SER A 37 -15.984 -15.249 0.953 1.00 0.00 H new ATOM 526 N SER A 38 -17.687 -14.801 5.175 1.00 0.00 N ATOM 527 CA SER A 38 -17.136 -15.304 6.428 1.00 0.00 C ATOM 528 C SER A 38 -15.793 -15.990 6.195 1.00 0.00 C ATOM 529 O SER A 38 -15.492 -16.429 5.086 1.00 0.00 O ATOM 530 CB SER A 38 -18.113 -16.281 7.084 1.00 0.00 C ATOM 531 OG SER A 38 -17.890 -16.364 8.481 1.00 0.00 O ATOM 0 H SER A 38 -18.614 -15.161 4.947 1.00 0.00 H new ATOM 0 HA SER A 38 -16.980 -14.455 7.094 1.00 0.00 H new ATOM 0 HB2 SER A 38 -19.137 -15.959 6.894 1.00 0.00 H new ATOM 0 HB3 SER A 38 -18.001 -17.268 6.635 1.00 0.00 H new ATOM 0 HG SER A 38 -18.528 -16.993 8.877 1.00 0.00 H new ATOM 537 N GLY A 39 -14.989 -16.078 7.250 1.00 0.00 N ATOM 538 CA GLY A 39 -13.688 -16.712 7.141 1.00 0.00 C ATOM 539 C GLY A 39 -13.774 -18.225 7.181 1.00 0.00 C ATOM 540 O GLY A 39 -14.845 -18.786 7.415 1.00 0.00 O ATOM 0 H GLY A 39 -15.215 -15.722 8.178 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.214 -16.403 6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.050 -16.366 7.954 1.00 0.00 H new ATOM 544 N ILE A 40 -12.645 -18.886 6.950 1.00 0.00 N ATOM 545 CA ILE A 40 -12.599 -20.343 6.960 1.00 0.00 C ATOM 546 C ILE A 40 -11.849 -20.860 8.184 1.00 0.00 C ATOM 547 O ILE A 40 -11.407 -22.008 8.213 1.00 0.00 O ATOM 548 CB ILE A 40 -11.926 -20.894 5.689 1.00 0.00 C ATOM 549 CG1 ILE A 40 -10.449 -20.494 5.654 1.00 0.00 C ATOM 550 CG2 ILE A 40 -12.646 -20.390 4.448 1.00 0.00 C ATOM 551 CD1 ILE A 40 -9.536 -21.495 6.327 1.00 0.00 C ATOM 0 H ILE A 40 -11.751 -18.436 6.754 1.00 0.00 H new ATOM 0 HA ILE A 40 -13.631 -20.692 6.994 1.00 0.00 H new ATOM 0 HB ILE A 40 -11.988 -21.982 5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -10.139 -20.372 4.616 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -10.332 -19.525 6.138 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.159 -20.788 3.558 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.685 -20.719 4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -12.611 -19.301 4.424 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.505 -21.147 6.264 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -9.820 -21.600 7.374 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -9.624 -22.460 5.828 1.00 0.00 H new ATOM 563 N GLU A 41 -11.712 -20.005 9.192 1.00 0.00 N ATOM 564 CA GLU A 41 -11.017 -20.377 10.419 1.00 0.00 C ATOM 565 C GLU A 41 -11.931 -21.178 11.341 1.00 0.00 C ATOM 566 O GLU A 41 -11.955 -20.959 12.552 1.00 0.00 O ATOM 567 CB GLU A 41 -10.510 -19.128 11.143 1.00 0.00 C ATOM 568 CG GLU A 41 -9.493 -19.426 12.232 1.00 0.00 C ATOM 569 CD GLU A 41 -8.265 -20.141 11.702 1.00 0.00 C ATOM 570 OE1 GLU A 41 -7.635 -19.621 10.758 1.00 0.00 O ATOM 571 OE2 GLU A 41 -7.934 -21.222 12.233 1.00 0.00 O ATOM 0 H GLU A 41 -12.073 -19.051 9.184 1.00 0.00 H new ATOM 0 HA GLU A 41 -10.166 -21.002 10.149 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.062 -18.453 10.414 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.358 -18.604 11.583 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.189 -18.493 12.706 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -9.961 -20.038 13.003 1.00 0.00 H new ATOM 578 N GLY A 42 -12.684 -22.106 10.759 1.00 0.00 N ATOM 579 CA GLY A 42 -13.591 -22.925 11.542 1.00 0.00 C ATOM 580 C GLY A 42 -14.830 -22.167 11.974 1.00 0.00 C ATOM 581 O GLY A 42 -15.231 -21.199 11.327 1.00 0.00 O ATOM 0 H GLY A 42 -12.682 -22.305 9.759 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -13.887 -23.795 10.956 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -13.070 -23.297 12.424 1.00 0.00 H new ATOM 585 N ARG A 43 -15.439 -22.608 13.070 1.00 0.00 N ATOM 586 CA ARG A 43 -16.642 -21.965 13.586 1.00 0.00 C ATOM 587 C ARG A 43 -17.722 -21.889 12.510 1.00 0.00 C ATOM 588 O ARG A 43 -18.413 -20.879 12.380 1.00 0.00 O ATOM 589 CB ARG A 43 -16.317 -20.561 14.098 1.00 0.00 C ATOM 590 CG ARG A 43 -15.847 -20.534 15.543 1.00 0.00 C ATOM 591 CD ARG A 43 -14.491 -21.203 15.701 1.00 0.00 C ATOM 592 NE ARG A 43 -14.017 -21.160 17.082 1.00 0.00 N ATOM 593 CZ ARG A 43 -13.450 -20.092 17.632 1.00 0.00 C ATOM 594 NH1 ARG A 43 -13.288 -18.984 16.922 1.00 0.00 N ATOM 595 NH2 ARG A 43 -13.045 -20.131 18.895 1.00 0.00 N ATOM 0 H ARG A 43 -15.120 -23.407 13.617 1.00 0.00 H new ATOM 0 HA ARG A 43 -17.019 -22.567 14.413 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.545 -20.122 13.465 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -17.203 -19.934 14.001 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -15.787 -19.502 15.888 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -16.579 -21.039 16.174 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -14.558 -22.240 15.373 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -13.766 -20.710 15.053 1.00 0.00 H new ATOM 0 HE ARG A 43 -14.127 -21.996 17.656 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -13.599 -18.950 15.951 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -12.852 -18.165 17.347 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -13.169 -20.981 19.444 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.610 -19.311 19.317 1.00 0.00 H new ATOM 609 N GLY A 44 -17.860 -22.964 11.740 1.00 0.00 N ATOM 610 CA GLY A 44 -18.856 -22.997 10.685 1.00 0.00 C ATOM 611 C GLY A 44 -18.686 -24.190 9.765 1.00 0.00 C ATOM 612 O GLY A 44 -19.385 -25.194 9.904 1.00 0.00 O ATOM 0 H GLY A 44 -17.300 -23.812 11.828 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -19.851 -23.024 11.129 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -18.792 -22.079 10.100 1.00 0.00 H new ATOM 616 N SER A 45 -17.757 -24.080 8.821 1.00 0.00 N ATOM 617 CA SER A 45 -17.502 -25.156 7.870 1.00 0.00 C ATOM 618 C SER A 45 -16.307 -24.824 6.982 1.00 0.00 C ATOM 619 O SER A 45 -16.177 -23.703 6.491 1.00 0.00 O ATOM 620 CB SER A 45 -18.740 -25.406 7.007 1.00 0.00 C ATOM 621 OG SER A 45 -19.047 -24.272 6.214 1.00 0.00 O ATOM 0 H SER A 45 -17.168 -23.257 8.694 1.00 0.00 H new ATOM 0 HA SER A 45 -17.273 -26.060 8.434 1.00 0.00 H new ATOM 0 HB2 SER A 45 -18.570 -26.269 6.363 1.00 0.00 H new ATOM 0 HB3 SER A 45 -19.590 -25.648 7.646 1.00 0.00 H new ATOM 0 HG SER A 45 -19.841 -24.458 5.671 1.00 0.00 H new ATOM 627 N SER A 46 -15.436 -25.808 6.781 1.00 0.00 N ATOM 628 CA SER A 46 -14.249 -25.621 5.955 1.00 0.00 C ATOM 629 C SER A 46 -14.500 -26.095 4.527 1.00 0.00 C ATOM 630 O SER A 46 -15.299 -27.001 4.293 1.00 0.00 O ATOM 631 CB SER A 46 -13.061 -26.377 6.554 1.00 0.00 C ATOM 632 OG SER A 46 -12.731 -25.874 7.837 1.00 0.00 O ATOM 0 H SER A 46 -15.530 -26.743 7.179 1.00 0.00 H new ATOM 0 HA SER A 46 -14.018 -24.556 5.930 1.00 0.00 H new ATOM 0 HB2 SER A 46 -13.300 -27.438 6.626 1.00 0.00 H new ATOM 0 HB3 SER A 46 -12.199 -26.289 5.893 1.00 0.00 H new ATOM 0 HG SER A 46 -11.970 -26.375 8.199 1.00 0.00 H new ATOM 638 N GLY A 47 -13.811 -25.474 3.574 1.00 0.00 N ATOM 639 CA GLY A 47 -13.973 -25.844 2.180 1.00 0.00 C ATOM 640 C GLY A 47 -13.099 -27.019 1.787 1.00 0.00 C ATOM 641 O GLY A 47 -13.183 -28.091 2.385 1.00 0.00 O ATOM 0 H GLY A 47 -13.144 -24.721 3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -15.017 -26.093 1.992 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -13.731 -24.988 1.550 1.00 0.00 H new ATOM 645 N SER A 48 -12.258 -26.817 0.778 1.00 0.00 N ATOM 646 CA SER A 48 -11.369 -27.870 0.302 1.00 0.00 C ATOM 647 C SER A 48 -10.400 -27.331 -0.745 1.00 0.00 C ATOM 648 O SER A 48 -10.813 -26.842 -1.797 1.00 0.00 O ATOM 649 CB SER A 48 -12.181 -29.026 -0.286 1.00 0.00 C ATOM 650 OG SER A 48 -11.442 -30.235 -0.257 1.00 0.00 O ATOM 0 H SER A 48 -12.174 -25.934 0.274 1.00 0.00 H new ATOM 0 HA SER A 48 -10.792 -28.236 1.152 1.00 0.00 H new ATOM 0 HB2 SER A 48 -13.106 -29.148 0.277 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.461 -28.792 -1.313 1.00 0.00 H new ATOM 0 HG SER A 48 -11.983 -30.958 -0.636 1.00 0.00 H new ATOM 656 N SER A 49 -9.107 -27.423 -0.450 1.00 0.00 N ATOM 657 CA SER A 49 -8.078 -26.942 -1.364 1.00 0.00 C ATOM 658 C SER A 49 -8.090 -27.738 -2.665 1.00 0.00 C ATOM 659 O SER A 49 -8.338 -28.943 -2.666 1.00 0.00 O ATOM 660 CB SER A 49 -6.699 -27.037 -0.708 1.00 0.00 C ATOM 661 OG SER A 49 -6.697 -26.419 0.568 1.00 0.00 O ATOM 0 H SER A 49 -8.747 -27.826 0.415 1.00 0.00 H new ATOM 0 HA SER A 49 -8.292 -25.899 -1.595 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.411 -28.084 -0.609 1.00 0.00 H new ATOM 0 HB3 SER A 49 -5.955 -26.561 -1.347 1.00 0.00 H new ATOM 0 HG SER A 49 -5.805 -26.495 0.967 1.00 0.00 H new ATOM 667 N GLY A 50 -7.821 -27.053 -3.773 1.00 0.00 N ATOM 668 CA GLY A 50 -7.807 -27.711 -5.066 1.00 0.00 C ATOM 669 C GLY A 50 -6.401 -27.998 -5.555 1.00 0.00 C ATOM 670 O GLY A 50 -5.431 -27.447 -5.034 1.00 0.00 O ATOM 0 H GLY A 50 -7.613 -26.055 -3.798 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -8.364 -28.646 -5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -8.321 -27.084 -5.795 1.00 0.00 H new ATOM 674 N SER A 51 -6.290 -28.863 -6.558 1.00 0.00 N ATOM 675 CA SER A 51 -4.991 -29.226 -7.114 1.00 0.00 C ATOM 676 C SER A 51 -4.808 -28.624 -8.504 1.00 0.00 C ATOM 677 O SER A 51 -5.031 -29.289 -9.515 1.00 0.00 O ATOM 678 CB SER A 51 -4.850 -30.748 -7.182 1.00 0.00 C ATOM 679 OG SER A 51 -3.488 -31.131 -7.262 1.00 0.00 O ATOM 0 H SER A 51 -7.083 -29.325 -7.002 1.00 0.00 H new ATOM 0 HA SER A 51 -4.217 -28.825 -6.459 1.00 0.00 H new ATOM 0 HB2 SER A 51 -5.306 -31.198 -6.301 1.00 0.00 H new ATOM 0 HB3 SER A 51 -5.389 -31.128 -8.050 1.00 0.00 H new ATOM 0 HG SER A 51 -3.425 -32.108 -7.303 1.00 0.00 H new ATOM 685 N SER A 52 -4.399 -27.360 -8.545 1.00 0.00 N ATOM 686 CA SER A 52 -4.189 -26.665 -9.809 1.00 0.00 C ATOM 687 C SER A 52 -3.290 -27.481 -10.734 1.00 0.00 C ATOM 688 O SER A 52 -2.535 -28.341 -10.284 1.00 0.00 O ATOM 689 CB SER A 52 -3.570 -25.288 -9.562 1.00 0.00 C ATOM 690 OG SER A 52 -3.931 -24.376 -10.585 1.00 0.00 O ATOM 0 H SER A 52 -4.206 -26.796 -7.717 1.00 0.00 H new ATOM 0 HA SER A 52 -5.158 -26.538 -10.291 1.00 0.00 H new ATOM 0 HB2 SER A 52 -3.900 -24.905 -8.596 1.00 0.00 H new ATOM 0 HB3 SER A 52 -2.485 -25.377 -9.516 1.00 0.00 H new ATOM 0 HG SER A 52 -3.524 -23.503 -10.403 1.00 0.00 H new ATOM 696 N GLY A 53 -3.378 -27.202 -12.031 1.00 0.00 N ATOM 697 CA GLY A 53 -2.568 -27.918 -13.000 1.00 0.00 C ATOM 698 C GLY A 53 -1.494 -27.044 -13.616 1.00 0.00 C ATOM 699 O GLY A 53 -1.130 -26.009 -13.057 1.00 0.00 O ATOM 0 H GLY A 53 -3.995 -26.494 -12.428 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -2.101 -28.775 -12.516 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -3.211 -28.309 -13.789 1.00 0.00 H new ATOM 703 N SER A 54 -0.985 -27.460 -14.771 1.00 0.00 N ATOM 704 CA SER A 54 0.058 -26.711 -15.462 1.00 0.00 C ATOM 705 C SER A 54 -0.466 -25.357 -15.931 1.00 0.00 C ATOM 706 O SER A 54 -1.088 -25.253 -16.989 1.00 0.00 O ATOM 707 CB SER A 54 0.584 -27.509 -16.656 1.00 0.00 C ATOM 708 OG SER A 54 1.825 -26.995 -17.106 1.00 0.00 O ATOM 0 H SER A 54 -1.278 -28.312 -15.248 1.00 0.00 H new ATOM 0 HA SER A 54 0.875 -26.542 -14.760 1.00 0.00 H new ATOM 0 HB2 SER A 54 0.701 -28.556 -16.375 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.143 -27.476 -17.468 1.00 0.00 H new ATOM 0 HG SER A 54 2.141 -27.523 -17.869 1.00 0.00 H new ATOM 714 N SER A 55 -0.211 -24.322 -15.137 1.00 0.00 N ATOM 715 CA SER A 55 -0.660 -22.975 -15.468 1.00 0.00 C ATOM 716 C SER A 55 0.211 -21.928 -14.781 1.00 0.00 C ATOM 717 O SER A 55 0.593 -22.085 -13.622 1.00 0.00 O ATOM 718 CB SER A 55 -2.122 -22.787 -15.059 1.00 0.00 C ATOM 719 OG SER A 55 -2.988 -23.524 -15.904 1.00 0.00 O ATOM 0 H SER A 55 0.304 -24.391 -14.260 1.00 0.00 H new ATOM 0 HA SER A 55 -0.572 -22.844 -16.547 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.258 -23.107 -14.026 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.381 -21.729 -15.101 1.00 0.00 H new ATOM 0 HG SER A 55 -2.459 -24.116 -16.479 1.00 0.00 H new ATOM 725 N GLY A 56 0.521 -20.857 -15.506 1.00 0.00 N ATOM 726 CA GLY A 56 1.345 -19.799 -14.951 1.00 0.00 C ATOM 727 C GLY A 56 1.103 -18.463 -15.624 1.00 0.00 C ATOM 728 O GLY A 56 0.506 -18.400 -16.699 1.00 0.00 O ATOM 0 H GLY A 56 0.216 -20.703 -16.467 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.143 -19.707 -13.884 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.396 -20.069 -15.054 1.00 0.00 H new ATOM 732 N ASP A 57 1.565 -17.391 -14.991 1.00 0.00 N ATOM 733 CA ASP A 57 1.395 -16.048 -15.534 1.00 0.00 C ATOM 734 C ASP A 57 2.580 -15.160 -15.169 1.00 0.00 C ATOM 735 O ASP A 57 3.403 -15.519 -14.327 1.00 0.00 O ATOM 736 CB ASP A 57 0.097 -15.426 -15.018 1.00 0.00 C ATOM 737 CG ASP A 57 -0.427 -14.336 -15.932 1.00 0.00 C ATOM 738 OD1 ASP A 57 -0.505 -14.575 -17.155 1.00 0.00 O ATOM 739 OD2 ASP A 57 -0.757 -13.244 -15.425 1.00 0.00 O ATOM 0 H ASP A 57 2.061 -17.425 -14.100 1.00 0.00 H new ATOM 0 HA ASP A 57 1.344 -16.126 -16.620 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.659 -16.204 -14.915 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.266 -15.012 -14.024 1.00 0.00 H new ATOM 744 N LYS A 58 2.662 -13.998 -15.809 1.00 0.00 N ATOM 745 CA LYS A 58 3.745 -13.057 -15.552 1.00 0.00 C ATOM 746 C LYS A 58 3.326 -12.011 -14.524 1.00 0.00 C ATOM 747 O LYS A 58 3.630 -10.828 -14.670 1.00 0.00 O ATOM 748 CB LYS A 58 4.169 -12.368 -16.852 1.00 0.00 C ATOM 749 CG LYS A 58 5.225 -13.134 -17.630 1.00 0.00 C ATOM 750 CD LYS A 58 6.068 -12.205 -18.487 1.00 0.00 C ATOM 751 CE LYS A 58 6.933 -12.984 -19.467 1.00 0.00 C ATOM 752 NZ LYS A 58 8.184 -13.480 -18.830 1.00 0.00 N ATOM 0 H LYS A 58 1.990 -13.686 -16.510 1.00 0.00 H new ATOM 0 HA LYS A 58 4.590 -13.616 -15.151 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.292 -12.232 -17.484 1.00 0.00 H new ATOM 0 HB3 LYS A 58 4.551 -11.374 -16.619 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.869 -13.675 -16.936 1.00 0.00 H new ATOM 0 HG3 LYS A 58 4.743 -13.878 -18.264 1.00 0.00 H new ATOM 0 HD2 LYS A 58 5.418 -11.524 -19.036 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.703 -11.593 -17.846 1.00 0.00 H new ATOM 0 HE2 LYS A 58 6.366 -13.828 -19.860 1.00 0.00 H new ATOM 0 HE3 LYS A 58 7.185 -12.347 -20.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.745 -14.005 -19.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.737 -12.673 -18.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.944 -14.108 -18.037 1.00 0.00 H new ATOM 766 N GLU A 59 2.628 -12.457 -13.484 1.00 0.00 N ATOM 767 CA GLU A 59 2.168 -11.559 -12.432 1.00 0.00 C ATOM 768 C GLU A 59 3.271 -10.584 -12.029 1.00 0.00 C ATOM 769 O GLU A 59 4.457 -10.887 -12.153 1.00 0.00 O ATOM 770 CB GLU A 59 1.709 -12.360 -11.211 1.00 0.00 C ATOM 771 CG GLU A 59 0.540 -13.287 -11.496 1.00 0.00 C ATOM 772 CD GLU A 59 0.513 -14.493 -10.577 1.00 0.00 C ATOM 773 OE1 GLU A 59 1.536 -15.205 -10.502 1.00 0.00 O ATOM 774 OE2 GLU A 59 -0.531 -14.723 -9.932 1.00 0.00 O ATOM 0 H GLU A 59 2.369 -13.434 -13.348 1.00 0.00 H new ATOM 0 HA GLU A 59 1.325 -10.987 -12.820 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.547 -12.949 -10.838 1.00 0.00 H new ATOM 0 HB3 GLU A 59 1.428 -11.668 -10.418 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -0.392 -12.733 -11.389 1.00 0.00 H new ATOM 0 HG3 GLU A 59 0.593 -13.625 -12.531 1.00 0.00 H new ATOM 781 N ARG A 60 2.869 -9.413 -11.546 1.00 0.00 N ATOM 782 CA ARG A 60 3.822 -8.392 -11.126 1.00 0.00 C ATOM 783 C ARG A 60 4.185 -8.560 -9.654 1.00 0.00 C ATOM 784 O ARG A 60 3.321 -8.817 -8.816 1.00 0.00 O ATOM 785 CB ARG A 60 3.244 -6.996 -11.364 1.00 0.00 C ATOM 786 CG ARG A 60 4.302 -5.934 -11.616 1.00 0.00 C ATOM 787 CD ARG A 60 3.699 -4.683 -12.237 1.00 0.00 C ATOM 788 NE ARG A 60 3.672 -4.755 -13.696 1.00 0.00 N ATOM 789 CZ ARG A 60 2.993 -3.908 -14.461 1.00 0.00 C ATOM 790 NH1 ARG A 60 2.289 -2.929 -13.909 1.00 0.00 N ATOM 791 NH2 ARG A 60 3.018 -4.038 -15.781 1.00 0.00 N ATOM 0 H ARG A 60 1.890 -9.148 -11.436 1.00 0.00 H new ATOM 0 HA ARG A 60 4.728 -8.509 -11.721 1.00 0.00 H new ATOM 0 HB2 ARG A 60 2.568 -7.033 -12.218 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.649 -6.706 -10.498 1.00 0.00 H new ATOM 0 HG2 ARG A 60 4.791 -5.676 -10.677 1.00 0.00 H new ATOM 0 HG3 ARG A 60 5.071 -6.335 -12.276 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.685 -4.545 -11.862 1.00 0.00 H new ATOM 0 HD3 ARG A 60 4.275 -3.811 -11.928 1.00 0.00 H new ATOM 0 HE ARG A 60 4.204 -5.496 -14.152 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.268 -2.825 -12.895 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.768 -2.280 -14.499 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.559 -4.789 -16.209 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.496 -3.387 -16.368 1.00 0.00 H new ATOM 805 N HIS A 61 5.470 -8.413 -9.346 1.00 0.00 N ATOM 806 CA HIS A 61 5.948 -8.549 -7.975 1.00 0.00 C ATOM 807 C HIS A 61 6.029 -7.187 -7.291 1.00 0.00 C ATOM 808 O HIS A 61 6.773 -6.308 -7.722 1.00 0.00 O ATOM 809 CB HIS A 61 7.319 -9.225 -7.954 1.00 0.00 C ATOM 810 CG HIS A 61 7.568 -10.037 -6.721 1.00 0.00 C ATOM 811 ND1 HIS A 61 8.663 -9.849 -5.904 1.00 0.00 N ATOM 812 CD2 HIS A 61 6.855 -11.045 -6.166 1.00 0.00 C ATOM 813 CE1 HIS A 61 8.613 -10.707 -4.901 1.00 0.00 C ATOM 814 NE2 HIS A 61 7.526 -11.444 -5.036 1.00 0.00 N ATOM 0 H HIS A 61 6.198 -8.200 -10.027 1.00 0.00 H new ATOM 0 HA HIS A 61 5.238 -9.170 -7.429 1.00 0.00 H new ATOM 0 HB2 HIS A 61 7.410 -9.870 -8.828 1.00 0.00 H new ATOM 0 HB3 HIS A 61 8.093 -8.462 -8.039 1.00 0.00 H new ATOM 0 HD2 HIS A 61 5.931 -11.458 -6.542 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.338 -10.791 -4.105 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.232 -12.189 -4.404 1.00 0.00 H new ATOM 823 N GLY A 62 5.256 -7.021 -6.221 1.00 0.00 N ATOM 824 CA GLY A 62 5.255 -5.764 -5.495 1.00 0.00 C ATOM 825 C GLY A 62 5.558 -5.945 -4.021 1.00 0.00 C ATOM 826 O GLY A 62 5.544 -7.065 -3.510 1.00 0.00 O ATOM 0 H GLY A 62 4.631 -7.734 -5.845 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.993 -5.094 -5.935 1.00 0.00 H new ATOM 0 HA3 GLY A 62 4.283 -5.284 -5.607 1.00 0.00 H new ATOM 830 N VAL A 63 5.835 -4.841 -3.336 1.00 0.00 N ATOM 831 CA VAL A 63 6.144 -4.882 -1.911 1.00 0.00 C ATOM 832 C VAL A 63 5.555 -3.678 -1.186 1.00 0.00 C ATOM 833 O VAL A 63 5.681 -2.542 -1.643 1.00 0.00 O ATOM 834 CB VAL A 63 7.665 -4.922 -1.668 1.00 0.00 C ATOM 835 CG1 VAL A 63 7.988 -4.500 -0.242 1.00 0.00 C ATOM 836 CG2 VAL A 63 8.215 -6.309 -1.960 1.00 0.00 C ATOM 0 H VAL A 63 5.852 -3.906 -3.744 1.00 0.00 H new ATOM 0 HA VAL A 63 5.696 -5.794 -1.516 1.00 0.00 H new ATOM 0 HB VAL A 63 8.143 -4.217 -2.348 1.00 0.00 H new ATOM 0 HG11 VAL A 63 9.067 -4.534 -0.088 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.629 -3.485 -0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.500 -5.179 0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.290 -6.319 -1.783 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.733 -7.036 -1.307 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.016 -6.568 -3.000 1.00 0.00 H new ATOM 846 N ALA A 64 4.913 -3.933 -0.051 1.00 0.00 N ATOM 847 CA ALA A 64 4.306 -2.870 0.740 1.00 0.00 C ATOM 848 C ALA A 64 5.371 -1.959 1.343 1.00 0.00 C ATOM 849 O ALA A 64 6.329 -2.430 1.956 1.00 0.00 O ATOM 850 CB ALA A 64 3.432 -3.460 1.836 1.00 0.00 C ATOM 0 H ALA A 64 4.800 -4.868 0.342 1.00 0.00 H new ATOM 0 HA ALA A 64 3.682 -2.269 0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.985 -2.654 2.419 1.00 0.00 H new ATOM 0 HB2 ALA A 64 2.643 -4.063 1.387 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.040 -4.086 2.489 1.00 0.00 H new ATOM 856 N ILE A 65 5.196 -0.654 1.163 1.00 0.00 N ATOM 857 CA ILE A 65 6.142 0.322 1.690 1.00 0.00 C ATOM 858 C ILE A 65 5.534 1.108 2.847 1.00 0.00 C ATOM 859 O ILE A 65 6.245 1.771 3.603 1.00 0.00 O ATOM 860 CB ILE A 65 6.601 1.307 0.599 1.00 0.00 C ATOM 861 CG1 ILE A 65 5.396 1.827 -0.189 1.00 0.00 C ATOM 862 CG2 ILE A 65 7.601 0.639 -0.332 1.00 0.00 C ATOM 863 CD1 ILE A 65 5.745 2.918 -1.176 1.00 0.00 C ATOM 0 H ILE A 65 4.409 -0.248 0.657 1.00 0.00 H new ATOM 0 HA ILE A 65 7.006 -0.238 2.049 1.00 0.00 H new ATOM 0 HB ILE A 65 7.091 2.154 1.079 1.00 0.00 H new ATOM 0 HG12 ILE A 65 4.937 0.996 -0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.651 2.206 0.510 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.916 1.348 -1.097 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.470 0.314 0.240 1.00 0.00 H new ATOM 0 HG23 ILE A 65 7.135 -0.224 -0.807 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.843 3.238 -1.698 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.177 3.766 -0.644 1.00 0.00 H new ATOM 0 HD13 ILE A 65 6.467 2.538 -1.899 1.00 0.00 H new ATOM 875 N TYR A 66 4.215 1.029 2.979 1.00 0.00 N ATOM 876 CA TYR A 66 3.510 1.733 4.044 1.00 0.00 C ATOM 877 C TYR A 66 2.421 0.854 4.652 1.00 0.00 C ATOM 878 O TYR A 66 1.745 0.107 3.946 1.00 0.00 O ATOM 879 CB TYR A 66 2.895 3.027 3.507 1.00 0.00 C ATOM 880 CG TYR A 66 3.912 3.994 2.945 1.00 0.00 C ATOM 881 CD1 TYR A 66 5.004 4.402 3.701 1.00 0.00 C ATOM 882 CD2 TYR A 66 3.783 4.498 1.657 1.00 0.00 C ATOM 883 CE1 TYR A 66 5.936 5.285 3.192 1.00 0.00 C ATOM 884 CE2 TYR A 66 4.710 5.381 1.138 1.00 0.00 C ATOM 885 CZ TYR A 66 5.785 5.772 1.910 1.00 0.00 C ATOM 886 OH TYR A 66 6.711 6.651 1.398 1.00 0.00 O ATOM 0 H TYR A 66 3.612 0.485 2.362 1.00 0.00 H new ATOM 0 HA TYR A 66 4.232 1.976 4.824 1.00 0.00 H new ATOM 0 HB2 TYR A 66 2.172 2.780 2.729 1.00 0.00 H new ATOM 0 HB3 TYR A 66 2.344 3.518 4.309 1.00 0.00 H new ATOM 0 HD1 TYR A 66 5.126 4.022 4.704 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.943 4.194 1.050 1.00 0.00 H new ATOM 0 HE1 TYR A 66 6.778 5.593 3.794 1.00 0.00 H new ATOM 0 HE2 TYR A 66 4.594 5.763 0.134 1.00 0.00 H new ATOM 0 HH TYR A 66 6.532 7.551 1.742 1.00 0.00 H new ATOM 896 N ASN A 67 2.259 0.950 5.967 1.00 0.00 N ATOM 897 CA ASN A 67 1.253 0.163 6.672 1.00 0.00 C ATOM 898 C ASN A 67 -0.155 0.603 6.279 1.00 0.00 C ATOM 899 O ASN A 67 -0.627 1.659 6.700 1.00 0.00 O ATOM 900 CB ASN A 67 1.438 0.299 8.185 1.00 0.00 C ATOM 901 CG ASN A 67 2.524 -0.615 8.719 1.00 0.00 C ATOM 902 OD1 ASN A 67 3.503 -0.156 9.308 1.00 0.00 O ATOM 903 ND2 ASN A 67 2.356 -1.916 8.514 1.00 0.00 N ATOM 0 H ASN A 67 2.811 1.564 6.566 1.00 0.00 H new ATOM 0 HA ASN A 67 1.381 -0.882 6.389 1.00 0.00 H new ATOM 0 HB2 ASN A 67 1.686 1.333 8.427 1.00 0.00 H new ATOM 0 HB3 ASN A 67 0.497 0.071 8.685 1.00 0.00 H new ATOM 0 HD21 ASN A 67 3.054 -2.580 8.850 1.00 0.00 H new ATOM 0 HD22 ASN A 67 1.529 -2.252 8.021 1.00 0.00 H new ATOM 910 N PHE A 68 -0.820 -0.216 5.471 1.00 0.00 N ATOM 911 CA PHE A 68 -2.173 0.088 5.020 1.00 0.00 C ATOM 912 C PHE A 68 -3.206 -0.648 5.868 1.00 0.00 C ATOM 913 O PHE A 68 -3.199 -1.876 5.945 1.00 0.00 O ATOM 914 CB PHE A 68 -2.341 -0.293 3.548 1.00 0.00 C ATOM 915 CG PHE A 68 -3.731 -0.068 3.025 1.00 0.00 C ATOM 916 CD1 PHE A 68 -4.756 -0.944 3.345 1.00 0.00 C ATOM 917 CD2 PHE A 68 -4.013 1.019 2.213 1.00 0.00 C ATOM 918 CE1 PHE A 68 -6.036 -0.740 2.866 1.00 0.00 C ATOM 919 CE2 PHE A 68 -5.291 1.228 1.732 1.00 0.00 C ATOM 920 CZ PHE A 68 -6.304 0.347 2.057 1.00 0.00 C ATOM 0 H PHE A 68 -0.444 -1.095 5.115 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.334 1.160 5.131 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.638 0.286 2.949 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.079 -1.343 3.421 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.552 -1.796 3.976 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.225 1.710 1.953 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.826 -1.430 3.124 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.498 2.080 1.102 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.303 0.508 1.680 1.00 0.00 H new ATOM 930 N GLN A 69 -4.092 0.113 6.503 1.00 0.00 N ATOM 931 CA GLN A 69 -5.131 -0.467 7.347 1.00 0.00 C ATOM 932 C GLN A 69 -6.515 -0.016 6.893 1.00 0.00 C ATOM 933 O GLN A 69 -6.884 1.146 7.054 1.00 0.00 O ATOM 934 CB GLN A 69 -4.908 -0.075 8.808 1.00 0.00 C ATOM 935 CG GLN A 69 -5.867 -0.753 9.773 1.00 0.00 C ATOM 936 CD GLN A 69 -5.350 -2.090 10.267 1.00 0.00 C ATOM 937 OE1 GLN A 69 -4.315 -2.161 10.930 1.00 0.00 O ATOM 938 NE2 GLN A 69 -6.069 -3.158 9.946 1.00 0.00 N ATOM 0 H GLN A 69 -4.111 1.131 6.449 1.00 0.00 H new ATOM 0 HA GLN A 69 -5.074 -1.552 7.257 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -3.885 -0.324 9.090 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -5.011 1.006 8.905 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -6.042 -0.098 10.626 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -6.829 -0.899 9.281 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -6.921 -3.053 9.395 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.770 -4.084 10.251 1.00 0.00 H new ATOM 947 N GLY A 70 -7.278 -0.945 6.324 1.00 0.00 N ATOM 948 CA GLY A 70 -8.613 -0.623 5.855 1.00 0.00 C ATOM 949 C GLY A 70 -9.690 -1.068 6.823 1.00 0.00 C ATOM 950 O GLY A 70 -9.449 -1.172 8.026 1.00 0.00 O ATOM 0 H GLY A 70 -6.995 -1.914 6.180 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.690 0.453 5.700 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.779 -1.098 4.888 1.00 0.00 H new ATOM 954 N SER A 71 -10.883 -1.330 6.299 1.00 0.00 N ATOM 955 CA SER A 71 -12.004 -1.761 7.127 1.00 0.00 C ATOM 956 C SER A 71 -12.477 -3.153 6.719 1.00 0.00 C ATOM 957 O SER A 71 -12.801 -3.984 7.566 1.00 0.00 O ATOM 958 CB SER A 71 -13.159 -0.765 7.017 1.00 0.00 C ATOM 959 OG SER A 71 -12.804 0.491 7.568 1.00 0.00 O ATOM 0 H SER A 71 -11.099 -1.251 5.305 1.00 0.00 H new ATOM 0 HA SER A 71 -11.665 -1.800 8.162 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.438 -0.641 5.971 1.00 0.00 H new ATOM 0 HB3 SER A 71 -14.033 -1.159 7.535 1.00 0.00 H new ATOM 0 HG SER A 71 -13.559 1.110 7.484 1.00 0.00 H new ATOM 965 N GLY A 72 -12.515 -3.399 5.412 1.00 0.00 N ATOM 966 CA GLY A 72 -12.950 -4.690 4.913 1.00 0.00 C ATOM 967 C GLY A 72 -13.084 -4.713 3.403 1.00 0.00 C ATOM 968 O GLY A 72 -13.210 -3.666 2.769 1.00 0.00 O ATOM 0 H GLY A 72 -12.252 -2.727 4.691 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -12.238 -5.455 5.223 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.909 -4.946 5.364 1.00 0.00 H new ATOM 972 N ALA A 73 -13.055 -5.910 2.826 1.00 0.00 N ATOM 973 CA ALA A 73 -13.175 -6.065 1.382 1.00 0.00 C ATOM 974 C ALA A 73 -14.128 -5.029 0.796 1.00 0.00 C ATOM 975 O ALA A 73 -15.059 -4.564 1.454 1.00 0.00 O ATOM 976 CB ALA A 73 -13.644 -7.471 1.039 1.00 0.00 C ATOM 0 H ALA A 73 -12.949 -6.786 3.337 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.191 -5.905 0.941 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.729 -7.572 -0.043 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.924 -8.197 1.416 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.616 -7.652 1.498 1.00 0.00 H new ATOM 982 N PRO A 74 -13.893 -4.656 -0.471 1.00 0.00 N ATOM 983 CA PRO A 74 -12.787 -5.202 -1.264 1.00 0.00 C ATOM 984 C PRO A 74 -11.427 -4.725 -0.768 1.00 0.00 C ATOM 985 O PRO A 74 -10.388 -5.143 -1.280 1.00 0.00 O ATOM 986 CB PRO A 74 -13.061 -4.666 -2.671 1.00 0.00 C ATOM 987 CG PRO A 74 -13.856 -3.424 -2.455 1.00 0.00 C ATOM 988 CD PRO A 74 -14.687 -3.673 -1.227 1.00 0.00 C ATOM 0 HA PRO A 74 -12.744 -6.290 -1.208 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.133 -4.455 -3.202 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.613 -5.390 -3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.203 -2.562 -2.316 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.488 -3.210 -3.317 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -14.844 -2.758 -0.656 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.673 -4.063 -1.481 1.00 0.00 H new ATOM 996 N GLN A 75 -11.440 -3.850 0.232 1.00 0.00 N ATOM 997 CA GLN A 75 -10.206 -3.316 0.797 1.00 0.00 C ATOM 998 C GLN A 75 -9.446 -4.396 1.559 1.00 0.00 C ATOM 999 O GLN A 75 -9.978 -5.007 2.487 1.00 0.00 O ATOM 1000 CB GLN A 75 -10.512 -2.139 1.724 1.00 0.00 C ATOM 1001 CG GLN A 75 -11.279 -1.014 1.047 1.00 0.00 C ATOM 1002 CD GLN A 75 -12.163 -0.248 2.012 1.00 0.00 C ATOM 1003 OE1 GLN A 75 -12.113 -0.463 3.223 1.00 0.00 O ATOM 1004 NE2 GLN A 75 -12.979 0.654 1.478 1.00 0.00 N ATOM 0 H GLN A 75 -12.291 -3.496 0.668 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.580 -2.968 -0.024 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.088 -2.499 2.576 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -9.575 -1.744 2.117 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.573 -0.326 0.583 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.893 -1.428 0.247 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -12.988 0.800 0.468 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -13.597 1.201 2.077 1.00 0.00 H new ATOM 1013 N LEU A 76 -8.199 -4.626 1.163 1.00 0.00 N ATOM 1014 CA LEU A 76 -7.364 -5.633 1.809 1.00 0.00 C ATOM 1015 C LEU A 76 -6.248 -4.978 2.617 1.00 0.00 C ATOM 1016 O LEU A 76 -5.653 -3.991 2.186 1.00 0.00 O ATOM 1017 CB LEU A 76 -6.766 -6.576 0.764 1.00 0.00 C ATOM 1018 CG LEU A 76 -5.574 -7.416 1.222 1.00 0.00 C ATOM 1019 CD1 LEU A 76 -6.043 -8.603 2.048 1.00 0.00 C ATOM 1020 CD2 LEU A 76 -4.761 -7.886 0.024 1.00 0.00 C ATOM 0 H LEU A 76 -7.744 -4.129 0.398 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.992 -6.207 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.550 -7.251 0.422 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.458 -5.983 -0.097 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.935 -6.794 1.848 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -5.180 -9.189 2.365 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.581 -8.245 2.926 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.704 -9.227 1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.916 -8.483 0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.391 -8.491 -0.628 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.393 -7.021 -0.528 1.00 0.00 H new ATOM 1032 N SER A 77 -5.969 -5.535 3.792 1.00 0.00 N ATOM 1033 CA SER A 77 -4.926 -5.004 4.661 1.00 0.00 C ATOM 1034 C SER A 77 -3.542 -5.380 4.140 1.00 0.00 C ATOM 1035 O SER A 77 -3.381 -6.376 3.433 1.00 0.00 O ATOM 1036 CB SER A 77 -5.106 -5.528 6.087 1.00 0.00 C ATOM 1037 OG SER A 77 -5.107 -6.944 6.114 1.00 0.00 O ATOM 0 H SER A 77 -6.451 -6.354 4.163 1.00 0.00 H new ATOM 0 HA SER A 77 -5.010 -3.917 4.667 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.304 -5.150 6.721 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.042 -5.153 6.500 1.00 0.00 H new ATOM 0 HG SER A 77 -5.222 -7.254 7.037 1.00 0.00 H new ATOM 1043 N LEU A 78 -2.545 -4.576 4.495 1.00 0.00 N ATOM 1044 CA LEU A 78 -1.174 -4.822 4.064 1.00 0.00 C ATOM 1045 C LEU A 78 -0.180 -4.388 5.137 1.00 0.00 C ATOM 1046 O LEU A 78 -0.477 -3.518 5.955 1.00 0.00 O ATOM 1047 CB LEU A 78 -0.887 -4.080 2.758 1.00 0.00 C ATOM 1048 CG LEU A 78 -1.365 -4.767 1.477 1.00 0.00 C ATOM 1049 CD1 LEU A 78 -1.053 -3.907 0.262 1.00 0.00 C ATOM 1050 CD2 LEU A 78 -0.727 -6.141 1.339 1.00 0.00 C ATOM 0 H LEU A 78 -2.661 -3.749 5.080 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.059 -5.893 3.899 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.351 -3.095 2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.189 -3.922 2.682 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.446 -4.895 1.537 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.400 -4.412 -0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.558 -2.946 0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.023 -3.746 0.197 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.078 -6.615 0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.357 -6.036 1.301 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.002 -6.758 2.195 1.00 0.00 H new ATOM 1062 N GLN A 79 1.000 -4.999 5.125 1.00 0.00 N ATOM 1063 CA GLN A 79 2.038 -4.674 6.096 1.00 0.00 C ATOM 1064 C GLN A 79 3.369 -4.406 5.402 1.00 0.00 C ATOM 1065 O GLN A 79 3.778 -5.153 4.512 1.00 0.00 O ATOM 1066 CB GLN A 79 2.197 -5.813 7.105 1.00 0.00 C ATOM 1067 CG GLN A 79 1.218 -5.738 8.266 1.00 0.00 C ATOM 1068 CD GLN A 79 0.949 -7.092 8.891 1.00 0.00 C ATOM 1069 OE1 GLN A 79 1.825 -7.956 8.931 1.00 0.00 O ATOM 1070 NE2 GLN A 79 -0.269 -7.285 9.384 1.00 0.00 N ATOM 0 H GLN A 79 1.261 -5.721 4.454 1.00 0.00 H new ATOM 0 HA GLN A 79 1.735 -3.769 6.623 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.065 -6.765 6.590 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.214 -5.801 7.497 1.00 0.00 H new ATOM 0 HG2 GLN A 79 1.612 -5.063 9.026 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.278 -5.310 7.917 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -0.965 -6.541 9.330 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -0.508 -8.177 9.817 1.00 0.00 H new ATOM 1079 N ILE A 80 4.040 -3.335 5.813 1.00 0.00 N ATOM 1080 CA ILE A 80 5.325 -2.970 5.231 1.00 0.00 C ATOM 1081 C ILE A 80 6.253 -4.177 5.142 1.00 0.00 C ATOM 1082 O ILE A 80 6.463 -4.885 6.126 1.00 0.00 O ATOM 1083 CB ILE A 80 6.019 -1.863 6.047 1.00 0.00 C ATOM 1084 CG1 ILE A 80 5.103 -0.644 6.176 1.00 0.00 C ATOM 1085 CG2 ILE A 80 7.339 -1.474 5.398 1.00 0.00 C ATOM 1086 CD1 ILE A 80 5.694 0.470 7.012 1.00 0.00 C ATOM 0 H ILE A 80 3.715 -2.705 6.547 1.00 0.00 H new ATOM 0 HA ILE A 80 5.121 -2.597 4.227 1.00 0.00 H new ATOM 0 HB ILE A 80 6.227 -2.245 7.046 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.879 -0.261 5.180 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.157 -0.956 6.618 1.00 0.00 H new ATOM 0 HG21 ILE A 80 7.817 -0.691 5.987 1.00 0.00 H new ATOM 0 HG22 ILE A 80 7.993 -2.345 5.353 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.154 -1.107 4.388 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.991 1.301 7.060 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.892 0.103 8.019 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.626 0.809 6.560 1.00 0.00 H new ATOM 1098 N GLY A 81 6.807 -4.405 3.955 1.00 0.00 N ATOM 1099 CA GLY A 81 7.707 -5.527 3.760 1.00 0.00 C ATOM 1100 C GLY A 81 6.977 -6.790 3.348 1.00 0.00 C ATOM 1101 O GLY A 81 7.520 -7.890 3.453 1.00 0.00 O ATOM 0 H GLY A 81 6.649 -3.833 3.125 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.442 -5.271 2.997 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.256 -5.713 4.683 1.00 0.00 H new ATOM 1105 N ASP A 82 5.744 -6.634 2.881 1.00 0.00 N ATOM 1106 CA ASP A 82 4.938 -7.772 2.453 1.00 0.00 C ATOM 1107 C ASP A 82 4.746 -7.763 0.940 1.00 0.00 C ATOM 1108 O ASP A 82 4.395 -6.739 0.354 1.00 0.00 O ATOM 1109 CB ASP A 82 3.579 -7.753 3.153 1.00 0.00 C ATOM 1110 CG ASP A 82 3.702 -7.852 4.661 1.00 0.00 C ATOM 1111 OD1 ASP A 82 4.734 -7.403 5.202 1.00 0.00 O ATOM 1112 OD2 ASP A 82 2.767 -8.378 5.300 1.00 0.00 O ATOM 0 H ASP A 82 5.280 -5.730 2.789 1.00 0.00 H new ATOM 0 HA ASP A 82 5.466 -8.685 2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 82 3.053 -6.834 2.894 1.00 0.00 H new ATOM 0 HB3 ASP A 82 2.973 -8.581 2.786 1.00 0.00 H new ATOM 1117 N VAL A 83 4.979 -8.912 0.312 1.00 0.00 N ATOM 1118 CA VAL A 83 4.832 -9.037 -1.133 1.00 0.00 C ATOM 1119 C VAL A 83 3.468 -9.612 -1.498 1.00 0.00 C ATOM 1120 O VAL A 83 2.952 -10.497 -0.815 1.00 0.00 O ATOM 1121 CB VAL A 83 5.932 -9.931 -1.734 1.00 0.00 C ATOM 1122 CG1 VAL A 83 5.798 -9.997 -3.248 1.00 0.00 C ATOM 1123 CG2 VAL A 83 7.309 -9.422 -1.334 1.00 0.00 C ATOM 0 H VAL A 83 5.270 -9.769 0.782 1.00 0.00 H new ATOM 0 HA VAL A 83 4.923 -8.034 -1.549 1.00 0.00 H new ATOM 0 HB VAL A 83 5.813 -10.940 -1.338 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.584 -10.633 -3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.824 -10.411 -3.509 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.890 -8.994 -3.665 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.075 -10.065 -1.767 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.441 -8.404 -1.700 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.399 -9.432 -0.248 1.00 0.00 H new ATOM 1133 N VAL A 84 2.888 -9.105 -2.582 1.00 0.00 N ATOM 1134 CA VAL A 84 1.585 -9.570 -3.040 1.00 0.00 C ATOM 1135 C VAL A 84 1.598 -9.856 -4.537 1.00 0.00 C ATOM 1136 O VAL A 84 2.109 -9.061 -5.327 1.00 0.00 O ATOM 1137 CB VAL A 84 0.482 -8.538 -2.736 1.00 0.00 C ATOM 1138 CG1 VAL A 84 0.291 -8.387 -1.234 1.00 0.00 C ATOM 1139 CG2 VAL A 84 0.815 -7.199 -3.377 1.00 0.00 C ATOM 0 H VAL A 84 3.301 -8.372 -3.159 1.00 0.00 H new ATOM 0 HA VAL A 84 1.370 -10.491 -2.499 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.455 -8.896 -3.163 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.492 -7.654 -1.039 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.004 -9.347 -0.805 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.224 -8.051 -0.781 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.026 -6.482 -3.152 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.762 -6.832 -2.982 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.896 -7.323 -4.457 1.00 0.00 H new ATOM 1149 N ARG A 85 1.034 -10.997 -4.921 1.00 0.00 N ATOM 1150 CA ARG A 85 0.982 -11.389 -6.324 1.00 0.00 C ATOM 1151 C ARG A 85 -0.093 -10.603 -7.069 1.00 0.00 C ATOM 1152 O ARG A 85 -1.279 -10.925 -6.989 1.00 0.00 O ATOM 1153 CB ARG A 85 0.709 -12.889 -6.447 1.00 0.00 C ATOM 1154 CG ARG A 85 1.932 -13.754 -6.187 1.00 0.00 C ATOM 1155 CD ARG A 85 3.106 -13.335 -7.058 1.00 0.00 C ATOM 1156 NE ARG A 85 3.996 -14.455 -7.352 1.00 0.00 N ATOM 1157 CZ ARG A 85 5.125 -14.335 -8.041 1.00 0.00 C ATOM 1158 NH1 ARG A 85 5.501 -13.150 -8.503 1.00 0.00 N ATOM 1159 NH2 ARG A 85 5.883 -15.401 -8.267 1.00 0.00 N ATOM 0 H ARG A 85 0.607 -11.666 -4.280 1.00 0.00 H new ATOM 0 HA ARG A 85 1.949 -11.165 -6.774 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.077 -13.165 -5.744 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.331 -13.100 -7.447 1.00 0.00 H new ATOM 0 HG2 ARG A 85 2.213 -13.682 -5.136 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.688 -14.799 -6.381 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.733 -12.914 -7.991 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.668 -12.548 -6.555 1.00 0.00 H new ATOM 0 HE ARG A 85 3.736 -15.380 -7.009 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.923 -12.328 -8.329 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.369 -13.061 -9.032 1.00 0.00 H new ATOM 0 HH21 ARG A 85 5.599 -16.314 -7.911 1.00 0.00 H new ATOM 0 HH22 ARG A 85 6.750 -15.307 -8.796 1.00 0.00 H new ATOM 1173 N ILE A 86 0.330 -9.571 -7.791 1.00 0.00 N ATOM 1174 CA ILE A 86 -0.597 -8.740 -8.550 1.00 0.00 C ATOM 1175 C ILE A 86 -1.155 -9.495 -9.752 1.00 0.00 C ATOM 1176 O ILE A 86 -0.406 -9.925 -10.628 1.00 0.00 O ATOM 1177 CB ILE A 86 0.079 -7.446 -9.040 1.00 0.00 C ATOM 1178 CG1 ILE A 86 0.541 -6.603 -7.848 1.00 0.00 C ATOM 1179 CG2 ILE A 86 -0.873 -6.650 -9.920 1.00 0.00 C ATOM 1180 CD1 ILE A 86 1.726 -5.715 -8.159 1.00 0.00 C ATOM 0 H ILE A 86 1.308 -9.290 -7.867 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.413 -8.481 -7.876 1.00 0.00 H new ATOM 0 HB ILE A 86 0.953 -7.713 -9.634 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.289 -5.983 -7.509 1.00 0.00 H new ATOM 0 HG13 ILE A 86 0.801 -7.266 -7.023 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.380 -5.739 -10.258 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.158 -7.250 -10.784 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.765 -6.390 -9.349 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.999 -5.147 -7.269 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.570 -6.330 -8.469 1.00 0.00 H new ATOM 0 HD13 ILE A 86 1.464 -5.027 -8.963 1.00 0.00 H new ATOM 1192 N GLN A 87 -2.474 -9.650 -9.785 1.00 0.00 N ATOM 1193 CA GLN A 87 -3.133 -10.352 -10.881 1.00 0.00 C ATOM 1194 C GLN A 87 -3.822 -9.369 -11.821 1.00 0.00 C ATOM 1195 O GLN A 87 -3.761 -9.516 -13.041 1.00 0.00 O ATOM 1196 CB GLN A 87 -4.152 -11.353 -10.334 1.00 0.00 C ATOM 1197 CG GLN A 87 -3.589 -12.268 -9.258 1.00 0.00 C ATOM 1198 CD GLN A 87 -4.438 -13.505 -9.042 1.00 0.00 C ATOM 1199 OE1 GLN A 87 -5.637 -13.411 -8.778 1.00 0.00 O ATOM 1200 NE2 GLN A 87 -3.819 -14.675 -9.151 1.00 0.00 N ATOM 0 H GLN A 87 -3.108 -9.300 -9.067 1.00 0.00 H new ATOM 0 HA GLN A 87 -2.371 -10.891 -11.444 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.003 -10.807 -9.926 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.529 -11.962 -11.156 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.579 -12.569 -9.535 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -3.512 -11.716 -8.321 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -2.824 -14.707 -9.371 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -4.339 -15.542 -9.014 1.00 0.00 H new ATOM 1209 N GLU A 88 -4.478 -8.367 -11.244 1.00 0.00 N ATOM 1210 CA GLU A 88 -5.180 -7.360 -12.032 1.00 0.00 C ATOM 1211 C GLU A 88 -4.949 -5.964 -11.462 1.00 0.00 C ATOM 1212 O GLU A 88 -4.632 -5.807 -10.282 1.00 0.00 O ATOM 1213 CB GLU A 88 -6.679 -7.665 -12.071 1.00 0.00 C ATOM 1214 CG GLU A 88 -7.437 -6.860 -13.113 1.00 0.00 C ATOM 1215 CD GLU A 88 -7.879 -5.505 -12.595 1.00 0.00 C ATOM 1216 OE1 GLU A 88 -7.472 -5.139 -11.472 1.00 0.00 O ATOM 1217 OE2 GLU A 88 -8.630 -4.811 -13.311 1.00 0.00 O ATOM 0 H GLU A 88 -4.538 -8.231 -10.235 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.784 -7.389 -13.047 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.820 -8.727 -12.271 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.107 -7.466 -11.089 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.805 -6.721 -13.990 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -8.312 -7.424 -13.437 1.00 0.00 H new ATOM 1224 N THR A 89 -5.110 -4.951 -12.308 1.00 0.00 N ATOM 1225 CA THR A 89 -4.918 -3.568 -11.890 1.00 0.00 C ATOM 1226 C THR A 89 -6.077 -2.689 -12.347 1.00 0.00 C ATOM 1227 O THR A 89 -6.234 -2.424 -13.539 1.00 0.00 O ATOM 1228 CB THR A 89 -3.602 -2.992 -12.444 1.00 0.00 C ATOM 1229 OG1 THR A 89 -2.505 -3.837 -12.080 1.00 0.00 O ATOM 1230 CG2 THR A 89 -3.362 -1.585 -11.916 1.00 0.00 C ATOM 0 H THR A 89 -5.373 -5.063 -13.287 1.00 0.00 H new ATOM 0 HA THR A 89 -4.875 -3.570 -10.801 1.00 0.00 H new ATOM 0 HB THR A 89 -3.680 -2.947 -13.530 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.918 -3.360 -11.457 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.427 -1.199 -12.321 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.184 -0.937 -12.220 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.303 -1.610 -10.828 1.00 0.00 H new ATOM 1238 N CYS A 90 -6.885 -2.241 -11.393 1.00 0.00 N ATOM 1239 CA CYS A 90 -8.031 -1.391 -11.698 1.00 0.00 C ATOM 1240 C CYS A 90 -7.715 0.072 -11.406 1.00 0.00 C ATOM 1241 O CYS A 90 -7.381 0.433 -10.279 1.00 0.00 O ATOM 1242 CB CYS A 90 -9.251 -1.834 -10.889 1.00 0.00 C ATOM 1243 SG CYS A 90 -8.896 -2.185 -9.151 1.00 0.00 S ATOM 0 H CYS A 90 -6.768 -2.452 -10.402 1.00 0.00 H new ATOM 0 HA CYS A 90 -8.254 -1.491 -12.760 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -10.012 -1.055 -10.943 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -9.675 -2.726 -11.350 1.00 0.00 H new ATOM 0 HG CYS A 90 -9.923 -2.768 -8.607 1.00 0.00 H new ATOM 1249 N GLY A 91 -7.823 0.912 -12.432 1.00 0.00 N ATOM 1250 CA GLY A 91 -7.545 2.326 -12.265 1.00 0.00 C ATOM 1251 C GLY A 91 -6.326 2.579 -11.399 1.00 0.00 C ATOM 1252 O GLY A 91 -5.228 2.119 -11.711 1.00 0.00 O ATOM 0 H GLY A 91 -8.098 0.638 -13.375 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.392 2.781 -13.244 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.412 2.813 -11.818 1.00 0.00 H new ATOM 1256 N ASP A 92 -6.519 3.313 -10.309 1.00 0.00 N ATOM 1257 CA ASP A 92 -5.427 3.627 -9.395 1.00 0.00 C ATOM 1258 C ASP A 92 -5.397 2.648 -8.227 1.00 0.00 C ATOM 1259 O ASP A 92 -5.120 3.030 -7.090 1.00 0.00 O ATOM 1260 CB ASP A 92 -5.565 5.059 -8.874 1.00 0.00 C ATOM 1261 CG ASP A 92 -4.871 6.069 -9.765 1.00 0.00 C ATOM 1262 OD1 ASP A 92 -5.145 6.073 -10.983 1.00 0.00 O ATOM 1263 OD2 ASP A 92 -4.051 6.856 -9.244 1.00 0.00 O ATOM 0 H ASP A 92 -7.422 3.702 -10.037 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.490 3.537 -9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -6.622 5.314 -8.796 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.148 5.118 -7.869 1.00 0.00 H new ATOM 1268 N TRP A 93 -5.686 1.383 -8.514 1.00 0.00 N ATOM 1269 CA TRP A 93 -5.693 0.349 -7.486 1.00 0.00 C ATOM 1270 C TRP A 93 -5.246 -0.991 -8.059 1.00 0.00 C ATOM 1271 O TRP A 93 -5.451 -1.272 -9.240 1.00 0.00 O ATOM 1272 CB TRP A 93 -7.090 0.216 -6.877 1.00 0.00 C ATOM 1273 CG TRP A 93 -7.531 1.438 -6.130 1.00 0.00 C ATOM 1274 CD1 TRP A 93 -7.774 2.676 -6.655 1.00 0.00 C ATOM 1275 CD2 TRP A 93 -7.781 1.540 -4.724 1.00 0.00 C ATOM 1276 NE1 TRP A 93 -8.159 3.541 -5.659 1.00 0.00 N ATOM 1277 CE2 TRP A 93 -8.172 2.868 -4.466 1.00 0.00 C ATOM 1278 CE3 TRP A 93 -7.714 0.638 -3.659 1.00 0.00 C ATOM 1279 CZ2 TRP A 93 -8.492 3.314 -3.186 1.00 0.00 C ATOM 1280 CZ3 TRP A 93 -8.032 1.082 -2.390 1.00 0.00 C ATOM 1281 CH2 TRP A 93 -8.418 2.409 -2.162 1.00 0.00 C ATOM 0 H TRP A 93 -5.918 1.049 -9.450 1.00 0.00 H new ATOM 0 HA TRP A 93 -4.990 0.642 -6.706 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -7.806 0.006 -7.671 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -7.104 -0.639 -6.201 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -7.678 2.936 -7.699 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -8.397 4.525 -5.787 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -7.419 -0.388 -3.825 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -8.788 4.337 -3.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -7.982 0.394 -1.559 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -8.662 2.724 -1.158 1.00 0.00 H new ATOM 1292 N TYR A 94 -4.633 -1.815 -7.216 1.00 0.00 N ATOM 1293 CA TYR A 94 -4.154 -3.126 -7.641 1.00 0.00 C ATOM 1294 C TYR A 94 -5.121 -4.224 -7.211 1.00 0.00 C ATOM 1295 O TYR A 94 -6.040 -3.986 -6.427 1.00 0.00 O ATOM 1296 CB TYR A 94 -2.766 -3.397 -7.060 1.00 0.00 C ATOM 1297 CG TYR A 94 -1.657 -2.648 -7.765 1.00 0.00 C ATOM 1298 CD1 TYR A 94 -1.485 -2.756 -9.140 1.00 0.00 C ATOM 1299 CD2 TYR A 94 -0.784 -1.832 -7.057 1.00 0.00 C ATOM 1300 CE1 TYR A 94 -0.473 -2.074 -9.788 1.00 0.00 C ATOM 1301 CE2 TYR A 94 0.230 -1.146 -7.697 1.00 0.00 C ATOM 1302 CZ TYR A 94 0.381 -1.270 -9.063 1.00 0.00 C ATOM 1303 OH TYR A 94 1.389 -0.588 -9.705 1.00 0.00 O ATOM 0 H TYR A 94 -4.456 -1.599 -6.235 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.092 -3.127 -8.729 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.764 -3.124 -6.005 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -2.562 -4.466 -7.113 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.153 -3.383 -9.711 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.900 -1.732 -5.988 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -0.351 -2.170 -10.857 1.00 0.00 H new ATOM 0 HE2 TYR A 94 0.901 -0.516 -7.131 1.00 0.00 H new ATOM 0 HH TYR A 94 1.900 -0.067 -9.051 1.00 0.00 H new ATOM 1313 N ARG A 95 -4.907 -5.429 -7.729 1.00 0.00 N ATOM 1314 CA ARG A 95 -5.758 -6.566 -7.401 1.00 0.00 C ATOM 1315 C ARG A 95 -4.928 -7.832 -7.215 1.00 0.00 C ATOM 1316 O ARG A 95 -4.301 -8.319 -8.155 1.00 0.00 O ATOM 1317 CB ARG A 95 -6.801 -6.783 -8.499 1.00 0.00 C ATOM 1318 CG ARG A 95 -8.108 -7.369 -7.990 1.00 0.00 C ATOM 1319 CD ARG A 95 -8.107 -8.887 -8.069 1.00 0.00 C ATOM 1320 NE ARG A 95 -8.982 -9.488 -7.067 1.00 0.00 N ATOM 1321 CZ ARG A 95 -8.621 -9.696 -5.805 1.00 0.00 C ATOM 1322 NH1 ARG A 95 -7.409 -9.352 -5.394 1.00 0.00 N ATOM 1323 NH2 ARG A 95 -9.474 -10.248 -4.952 1.00 0.00 N ATOM 0 H ARG A 95 -4.150 -5.643 -8.379 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.268 -6.347 -6.463 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.006 -5.830 -8.987 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -6.386 -7.447 -9.257 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.270 -7.058 -6.958 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -8.938 -6.974 -8.576 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.427 -9.198 -9.063 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.091 -9.256 -7.931 1.00 0.00 H new ATOM 0 HE ARG A 95 -9.922 -9.763 -7.351 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -6.751 -8.927 -6.047 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -7.134 -9.513 -4.425 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -10.408 -10.513 -5.265 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -9.196 -10.407 -3.984 1.00 0.00 H new ATOM 1337 N GLY A 96 -4.927 -8.360 -5.994 1.00 0.00 N ATOM 1338 CA GLY A 96 -4.169 -9.564 -5.707 1.00 0.00 C ATOM 1339 C GLY A 96 -4.440 -10.101 -4.316 1.00 0.00 C ATOM 1340 O GLY A 96 -5.518 -9.890 -3.760 1.00 0.00 O ATOM 0 H GLY A 96 -5.437 -7.975 -5.199 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.416 -10.329 -6.443 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.105 -9.353 -5.811 1.00 0.00 H new ATOM 1344 N TYR A 97 -3.460 -10.798 -3.752 1.00 0.00 N ATOM 1345 CA TYR A 97 -3.599 -11.371 -2.418 1.00 0.00 C ATOM 1346 C TYR A 97 -2.238 -11.529 -1.749 1.00 0.00 C ATOM 1347 O TYR A 97 -1.201 -11.527 -2.414 1.00 0.00 O ATOM 1348 CB TYR A 97 -4.304 -12.726 -2.494 1.00 0.00 C ATOM 1349 CG TYR A 97 -3.556 -13.753 -3.314 1.00 0.00 C ATOM 1350 CD1 TYR A 97 -2.321 -14.237 -2.899 1.00 0.00 C ATOM 1351 CD2 TYR A 97 -4.083 -14.238 -4.504 1.00 0.00 C ATOM 1352 CE1 TYR A 97 -1.634 -15.174 -3.646 1.00 0.00 C ATOM 1353 CE2 TYR A 97 -3.404 -15.177 -5.257 1.00 0.00 C ATOM 1354 CZ TYR A 97 -2.180 -15.641 -4.823 1.00 0.00 C ATOM 1355 OH TYR A 97 -1.499 -16.575 -5.570 1.00 0.00 O ATOM 0 H TYR A 97 -2.561 -10.980 -4.198 1.00 0.00 H new ATOM 0 HA TYR A 97 -4.201 -10.689 -1.817 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -4.443 -13.111 -1.484 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -5.297 -12.586 -2.921 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.891 -13.874 -1.977 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -5.041 -13.875 -4.847 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.675 -15.539 -3.310 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -3.829 -15.545 -6.179 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.021 -16.799 -6.368 1.00 0.00 H new ATOM 1365 N LEU A 98 -2.248 -11.668 -0.428 1.00 0.00 N ATOM 1366 CA LEU A 98 -1.015 -11.829 0.335 1.00 0.00 C ATOM 1367 C LEU A 98 -0.388 -13.195 0.075 1.00 0.00 C ATOM 1368 O LEU A 98 -0.994 -14.230 0.354 1.00 0.00 O ATOM 1369 CB LEU A 98 -1.290 -11.657 1.830 1.00 0.00 C ATOM 1370 CG LEU A 98 -0.138 -11.096 2.664 1.00 0.00 C ATOM 1371 CD1 LEU A 98 0.288 -9.734 2.138 1.00 0.00 C ATOM 1372 CD2 LEU A 98 -0.537 -11.004 4.130 1.00 0.00 C ATOM 0 H LEU A 98 -3.097 -11.672 0.138 1.00 0.00 H new ATOM 0 HA LEU A 98 -0.314 -11.060 0.011 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.151 -10.999 1.947 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.571 -12.626 2.241 1.00 0.00 H new ATOM 0 HG LEU A 98 0.710 -11.775 2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.109 -9.350 2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.615 -9.830 1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.554 -9.044 2.190 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.295 -10.603 4.709 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.400 -10.346 4.232 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.792 -11.997 4.501 1.00 0.00 H new ATOM 1384 N ILE A 99 0.828 -13.190 -0.459 1.00 0.00 N ATOM 1385 CA ILE A 99 1.538 -14.429 -0.753 1.00 0.00 C ATOM 1386 C ILE A 99 1.841 -15.205 0.524 1.00 0.00 C ATOM 1387 O ILE A 99 1.580 -16.406 0.611 1.00 0.00 O ATOM 1388 CB ILE A 99 2.857 -14.159 -1.501 1.00 0.00 C ATOM 1389 CG1 ILE A 99 2.639 -13.120 -2.604 1.00 0.00 C ATOM 1390 CG2 ILE A 99 3.409 -15.450 -2.085 1.00 0.00 C ATOM 1391 CD1 ILE A 99 3.835 -12.944 -3.513 1.00 0.00 C ATOM 0 H ILE A 99 1.343 -12.342 -0.697 1.00 0.00 H new ATOM 0 HA ILE A 99 0.884 -15.024 -1.391 1.00 0.00 H new ATOM 0 HB ILE A 99 3.585 -13.763 -0.793 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.777 -13.414 -3.203 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.397 -12.161 -2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 99 4.341 -15.242 -2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 99 3.596 -16.162 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 99 2.686 -15.872 -2.783 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.609 -12.193 -4.270 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.694 -12.620 -2.925 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.065 -13.892 -3.999 1.00 0.00 H new ATOM 1403 N LYS A 100 2.392 -14.512 1.514 1.00 0.00 N ATOM 1404 CA LYS A 100 2.729 -15.134 2.789 1.00 0.00 C ATOM 1405 C LYS A 100 1.492 -15.747 3.439 1.00 0.00 C ATOM 1406 O LYS A 100 1.599 -16.538 4.376 1.00 0.00 O ATOM 1407 CB LYS A 100 3.356 -14.105 3.732 1.00 0.00 C ATOM 1408 CG LYS A 100 2.529 -12.841 3.890 1.00 0.00 C ATOM 1409 CD LYS A 100 2.885 -12.097 5.166 1.00 0.00 C ATOM 1410 CE LYS A 100 4.118 -11.227 4.979 1.00 0.00 C ATOM 1411 NZ LYS A 100 4.593 -10.654 6.269 1.00 0.00 N ATOM 0 H LYS A 100 2.615 -13.518 1.458 1.00 0.00 H new ATOM 0 HA LYS A 100 3.450 -15.929 2.598 1.00 0.00 H new ATOM 0 HB2 LYS A 100 3.497 -14.561 4.712 1.00 0.00 H new ATOM 0 HB3 LYS A 100 4.345 -13.838 3.359 1.00 0.00 H new ATOM 0 HG2 LYS A 100 2.691 -12.190 3.031 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.470 -13.097 3.901 1.00 0.00 H new ATOM 0 HD2 LYS A 100 2.043 -11.476 5.473 1.00 0.00 H new ATOM 0 HD3 LYS A 100 3.062 -12.813 5.968 1.00 0.00 H new ATOM 0 HE2 LYS A 100 4.915 -11.819 4.529 1.00 0.00 H new ATOM 0 HE3 LYS A 100 3.890 -10.418 4.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 5.609 -10.441 6.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 4.069 -9.780 6.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 4.434 -11.341 7.034 1.00 0.00 H new ATOM 1425 N HIS A 101 0.319 -15.378 2.934 1.00 0.00 N ATOM 1426 CA HIS A 101 -0.938 -15.894 3.464 1.00 0.00 C ATOM 1427 C HIS A 101 -2.069 -15.705 2.458 1.00 0.00 C ATOM 1428 O HIS A 101 -2.554 -14.592 2.254 1.00 0.00 O ATOM 1429 CB HIS A 101 -1.286 -15.195 4.778 1.00 0.00 C ATOM 1430 CG HIS A 101 -0.280 -15.424 5.863 1.00 0.00 C ATOM 1431 ND1 HIS A 101 0.782 -14.682 6.257 1.00 0.00 N flip ATOM 1432 CD2 HIS A 101 -0.299 -16.529 6.687 1.00 0.00 C flip ATOM 1433 CE1 HIS A 101 1.377 -15.345 7.301 1.00 0.00 C flip ATOM 1434 NE2 HIS A 101 0.705 -16.457 7.542 1.00 0.00 N flip ATOM 0 H HIS A 101 0.213 -14.724 2.159 1.00 0.00 H new ATOM 0 HA HIS A 101 -0.816 -16.961 3.650 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -1.376 -14.124 4.597 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -2.261 -15.544 5.118 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -1.023 -17.329 6.641 1.00 0.00 H new ATOM 0 HE1 HIS A 101 2.253 -15.012 7.838 1.00 0.00 H new ATOM 0 HE2 HIS A 101 0.924 -17.143 8.265 1.00 0.00 H new ATOM 1443 N LYS A 102 -2.486 -16.800 1.831 1.00 0.00 N ATOM 1444 CA LYS A 102 -3.561 -16.757 0.847 1.00 0.00 C ATOM 1445 C LYS A 102 -4.917 -16.601 1.528 1.00 0.00 C ATOM 1446 O LYS A 102 -5.954 -16.576 0.868 1.00 0.00 O ATOM 1447 CB LYS A 102 -3.550 -18.028 -0.006 1.00 0.00 C ATOM 1448 CG LYS A 102 -2.213 -18.302 -0.672 1.00 0.00 C ATOM 1449 CD LYS A 102 -2.130 -17.654 -2.044 1.00 0.00 C ATOM 1450 CE LYS A 102 -2.923 -18.436 -3.079 1.00 0.00 C ATOM 1451 NZ LYS A 102 -2.323 -19.773 -3.345 1.00 0.00 N ATOM 0 H LYS A 102 -2.095 -17.729 1.987 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.396 -15.893 0.203 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -3.815 -18.879 0.622 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -4.319 -17.947 -0.774 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.408 -17.925 -0.042 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.067 -19.378 -0.767 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.509 -16.633 -1.989 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.087 -17.591 -2.355 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.949 -18.561 -2.732 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -2.968 -17.867 -4.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.676 -20.137 -4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -1.287 -19.687 -3.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.586 -20.430 -2.583 1.00 0.00 H new ATOM 1465 N MET A 103 -4.900 -16.495 2.853 1.00 0.00 N ATOM 1466 CA MET A 103 -6.128 -16.338 3.623 1.00 0.00 C ATOM 1467 C MET A 103 -6.652 -14.909 3.526 1.00 0.00 C ATOM 1468 O MET A 103 -7.663 -14.565 4.139 1.00 0.00 O ATOM 1469 CB MET A 103 -5.888 -16.707 5.088 1.00 0.00 C ATOM 1470 CG MET A 103 -6.047 -18.192 5.375 1.00 0.00 C ATOM 1471 SD MET A 103 -6.066 -18.560 7.140 1.00 0.00 S ATOM 1472 CE MET A 103 -4.490 -17.875 7.646 1.00 0.00 C ATOM 0 H MET A 103 -4.049 -16.515 3.415 1.00 0.00 H new ATOM 0 HA MET A 103 -6.877 -17.010 3.205 1.00 0.00 H new ATOM 0 HB2 MET A 103 -4.883 -16.396 5.372 1.00 0.00 H new ATOM 0 HB3 MET A 103 -6.584 -16.148 5.714 1.00 0.00 H new ATOM 0 HG2 MET A 103 -6.973 -18.548 4.924 1.00 0.00 H new ATOM 0 HG3 MET A 103 -5.231 -18.739 4.903 1.00 0.00 H new ATOM 0 HE1 MET A 103 -4.240 -18.235 8.644 1.00 0.00 H new ATOM 0 HE2 MET A 103 -3.716 -18.185 6.944 1.00 0.00 H new ATOM 0 HE3 MET A 103 -4.553 -16.787 7.659 1.00 0.00 H new ATOM 1482 N LEU A 104 -5.958 -14.081 2.753 1.00 0.00 N ATOM 1483 CA LEU A 104 -6.354 -12.688 2.576 1.00 0.00 C ATOM 1484 C LEU A 104 -6.272 -12.281 1.108 1.00 0.00 C ATOM 1485 O LEU A 104 -5.260 -12.513 0.446 1.00 0.00 O ATOM 1486 CB LEU A 104 -5.465 -11.773 3.421 1.00 0.00 C ATOM 1487 CG LEU A 104 -5.162 -12.256 4.840 1.00 0.00 C ATOM 1488 CD1 LEU A 104 -3.977 -13.209 4.838 1.00 0.00 C ATOM 1489 CD2 LEU A 104 -4.897 -11.073 5.760 1.00 0.00 C ATOM 0 H LEU A 104 -5.119 -14.350 2.239 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.388 -12.585 2.905 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.520 -11.633 2.897 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.942 -10.795 3.486 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.033 -12.794 5.214 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.776 -13.542 5.856 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.205 -14.072 4.212 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.099 -12.697 4.444 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.683 -11.435 6.766 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.042 -10.507 5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.775 -10.428 5.786 1.00 0.00 H new ATOM 1501 N GLN A 105 -7.342 -11.671 0.607 1.00 0.00 N ATOM 1502 CA GLN A 105 -7.389 -11.231 -0.782 1.00 0.00 C ATOM 1503 C GLN A 105 -8.235 -9.970 -0.924 1.00 0.00 C ATOM 1504 O GLN A 105 -9.188 -9.762 -0.175 1.00 0.00 O ATOM 1505 CB GLN A 105 -7.952 -12.340 -1.672 1.00 0.00 C ATOM 1506 CG GLN A 105 -7.383 -13.716 -1.363 1.00 0.00 C ATOM 1507 CD GLN A 105 -8.075 -14.821 -2.137 1.00 0.00 C ATOM 1508 OE1 GLN A 105 -8.774 -14.563 -3.118 1.00 0.00 O ATOM 1509 NE2 GLN A 105 -7.882 -16.060 -1.701 1.00 0.00 N ATOM 0 H GLN A 105 -8.187 -11.471 1.142 1.00 0.00 H new ATOM 0 HA GLN A 105 -6.372 -11.002 -1.099 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -9.036 -12.370 -1.559 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.747 -12.097 -2.715 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -6.318 -13.726 -1.597 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -7.477 -13.912 -0.295 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -7.295 -16.227 -0.884 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -8.321 -16.844 -2.183 1.00 0.00 H new ATOM 1518 N GLY A 106 -7.878 -9.130 -1.892 1.00 0.00 N ATOM 1519 CA GLY A 106 -8.614 -7.899 -2.114 1.00 0.00 C ATOM 1520 C GLY A 106 -7.869 -6.932 -3.011 1.00 0.00 C ATOM 1521 O GLY A 106 -7.163 -7.346 -3.931 1.00 0.00 O ATOM 0 H GLY A 106 -7.093 -9.280 -2.526 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -9.581 -8.133 -2.560 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.813 -7.420 -1.155 1.00 0.00 H new ATOM 1525 N ILE A 107 -8.026 -5.639 -2.745 1.00 0.00 N ATOM 1526 CA ILE A 107 -7.362 -4.611 -3.536 1.00 0.00 C ATOM 1527 C ILE A 107 -6.665 -3.593 -2.640 1.00 0.00 C ATOM 1528 O ILE A 107 -7.007 -3.445 -1.466 1.00 0.00 O ATOM 1529 CB ILE A 107 -8.357 -3.875 -4.452 1.00 0.00 C ATOM 1530 CG1 ILE A 107 -9.474 -3.240 -3.622 1.00 0.00 C ATOM 1531 CG2 ILE A 107 -8.935 -4.833 -5.484 1.00 0.00 C ATOM 1532 CD1 ILE A 107 -10.428 -2.395 -4.438 1.00 0.00 C ATOM 0 H ILE A 107 -8.607 -5.279 -1.988 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.620 -5.118 -4.153 1.00 0.00 H new ATOM 0 HB ILE A 107 -7.826 -3.082 -4.978 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.037 -4.028 -3.122 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.029 -2.621 -2.842 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.637 -4.298 -6.124 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.128 -5.243 -6.092 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.454 -5.645 -4.976 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.194 -1.977 -3.785 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.878 -1.585 -4.917 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -10.901 -3.014 -5.201 1.00 0.00 H new ATOM 1544 N PHE A 108 -5.686 -2.891 -3.201 1.00 0.00 N ATOM 1545 CA PHE A 108 -4.940 -1.885 -2.453 1.00 0.00 C ATOM 1546 C PHE A 108 -4.420 -0.792 -3.381 1.00 0.00 C ATOM 1547 O PHE A 108 -4.314 -0.971 -4.595 1.00 0.00 O ATOM 1548 CB PHE A 108 -3.773 -2.535 -1.707 1.00 0.00 C ATOM 1549 CG PHE A 108 -3.224 -3.751 -2.396 1.00 0.00 C ATOM 1550 CD1 PHE A 108 -3.746 -5.007 -2.133 1.00 0.00 C ATOM 1551 CD2 PHE A 108 -2.186 -3.639 -3.307 1.00 0.00 C ATOM 1552 CE1 PHE A 108 -3.243 -6.128 -2.765 1.00 0.00 C ATOM 1553 CE2 PHE A 108 -1.679 -4.757 -3.943 1.00 0.00 C ATOM 1554 CZ PHE A 108 -2.209 -6.003 -3.672 1.00 0.00 C ATOM 0 H PHE A 108 -5.391 -3.000 -4.171 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.617 -1.431 -1.729 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.974 -1.802 -1.589 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.102 -2.812 -0.705 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -4.556 -5.111 -1.426 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -1.768 -2.667 -3.523 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -3.658 -7.102 -2.550 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -0.870 -4.656 -4.651 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.816 -6.878 -4.168 1.00 0.00 H new ATOM 1564 N PRO A 109 -4.088 0.370 -2.799 1.00 0.00 N ATOM 1565 CA PRO A 109 -3.574 1.516 -3.554 1.00 0.00 C ATOM 1566 C PRO A 109 -2.168 1.272 -4.093 1.00 0.00 C ATOM 1567 O PRO A 109 -1.288 0.804 -3.370 1.00 0.00 O ATOM 1568 CB PRO A 109 -3.562 2.646 -2.521 1.00 0.00 C ATOM 1569 CG PRO A 109 -3.450 1.955 -1.206 1.00 0.00 C ATOM 1570 CD PRO A 109 -4.189 0.654 -1.357 1.00 0.00 C ATOM 0 HA PRO A 109 -4.182 1.730 -4.433 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -2.724 3.324 -2.685 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -4.471 3.244 -2.578 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.406 1.783 -0.944 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -3.883 2.560 -0.409 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -3.737 -0.137 -0.759 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -5.227 0.742 -1.036 1.00 0.00 H new ATOM 1578 N LYS A 110 -1.964 1.591 -5.366 1.00 0.00 N ATOM 1579 CA LYS A 110 -0.664 1.408 -6.002 1.00 0.00 C ATOM 1580 C LYS A 110 0.394 2.285 -5.340 1.00 0.00 C ATOM 1581 O LYS A 110 1.589 2.003 -5.424 1.00 0.00 O ATOM 1582 CB LYS A 110 -0.753 1.736 -7.494 1.00 0.00 C ATOM 1583 CG LYS A 110 -1.904 1.042 -8.202 1.00 0.00 C ATOM 1584 CD LYS A 110 -2.425 1.870 -9.364 1.00 0.00 C ATOM 1585 CE LYS A 110 -1.372 2.032 -10.450 1.00 0.00 C ATOM 1586 NZ LYS A 110 -1.009 0.727 -11.069 1.00 0.00 N ATOM 0 H LYS A 110 -2.682 1.978 -5.978 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.372 0.365 -5.882 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -0.860 2.814 -7.615 1.00 0.00 H new ATOM 0 HB3 LYS A 110 0.183 1.453 -7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.574 0.069 -8.566 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.712 0.860 -7.493 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -3.311 1.393 -9.783 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.732 2.852 -9.004 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.745 2.708 -11.220 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.480 2.493 -10.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.219 0.865 -11.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.726 0.057 -10.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -1.829 0.347 -11.583 1.00 0.00 H new ATOM 1600 N SER A 111 -0.054 3.350 -4.682 1.00 0.00 N ATOM 1601 CA SER A 111 0.855 4.269 -4.008 1.00 0.00 C ATOM 1602 C SER A 111 1.464 3.620 -2.768 1.00 0.00 C ATOM 1603 O SER A 111 2.391 4.159 -2.164 1.00 0.00 O ATOM 1604 CB SER A 111 0.119 5.552 -3.616 1.00 0.00 C ATOM 1605 OG SER A 111 -0.165 6.346 -4.755 1.00 0.00 O ATOM 0 H SER A 111 -1.040 3.597 -4.602 1.00 0.00 H new ATOM 0 HA SER A 111 1.660 4.517 -4.700 1.00 0.00 H new ATOM 0 HB2 SER A 111 -0.810 5.300 -3.104 1.00 0.00 H new ATOM 0 HB3 SER A 111 0.726 6.123 -2.913 1.00 0.00 H new ATOM 0 HG SER A 111 -0.637 7.159 -4.478 1.00 0.00 H new ATOM 1611 N PHE A 112 0.935 2.460 -2.396 1.00 0.00 N ATOM 1612 CA PHE A 112 1.424 1.736 -1.228 1.00 0.00 C ATOM 1613 C PHE A 112 2.240 0.517 -1.646 1.00 0.00 C ATOM 1614 O PHE A 112 2.943 -0.082 -0.832 1.00 0.00 O ATOM 1615 CB PHE A 112 0.254 1.302 -0.343 1.00 0.00 C ATOM 1616 CG PHE A 112 -0.314 2.416 0.489 1.00 0.00 C ATOM 1617 CD1 PHE A 112 -0.936 3.499 -0.112 1.00 0.00 C ATOM 1618 CD2 PHE A 112 -0.228 2.380 1.871 1.00 0.00 C ATOM 1619 CE1 PHE A 112 -1.459 4.526 0.652 1.00 0.00 C ATOM 1620 CE2 PHE A 112 -0.749 3.403 2.640 1.00 0.00 C ATOM 1621 CZ PHE A 112 -1.367 4.477 2.029 1.00 0.00 C ATOM 0 H PHE A 112 0.167 2.001 -2.886 1.00 0.00 H new ATOM 0 HA PHE A 112 2.070 2.406 -0.661 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.535 0.891 -0.973 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.586 0.500 0.316 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -1.013 3.541 -1.188 1.00 0.00 H new ATOM 0 HD2 PHE A 112 0.252 1.542 2.354 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.939 5.366 0.172 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -0.673 3.363 3.717 1.00 0.00 H new ATOM 0 HZ PHE A 112 -1.777 5.277 2.627 1.00 0.00 H new ATOM 1631 N ILE A 113 2.141 0.155 -2.921 1.00 0.00 N ATOM 1632 CA ILE A 113 2.869 -0.992 -3.448 1.00 0.00 C ATOM 1633 C ILE A 113 4.126 -0.552 -4.191 1.00 0.00 C ATOM 1634 O ILE A 113 4.092 0.387 -4.987 1.00 0.00 O ATOM 1635 CB ILE A 113 1.992 -1.829 -4.398 1.00 0.00 C ATOM 1636 CG1 ILE A 113 0.746 -2.333 -3.666 1.00 0.00 C ATOM 1637 CG2 ILE A 113 2.787 -2.995 -4.965 1.00 0.00 C ATOM 1638 CD1 ILE A 113 1.058 -3.100 -2.400 1.00 0.00 C ATOM 0 H ILE A 113 1.564 0.640 -3.608 1.00 0.00 H new ATOM 0 HA ILE A 113 3.151 -1.605 -2.592 1.00 0.00 H new ATOM 0 HB ILE A 113 1.673 -1.196 -5.226 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.111 -1.482 -3.419 1.00 0.00 H new ATOM 0 HG13 ILE A 113 0.174 -2.973 -4.338 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.153 -3.576 -5.634 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.646 -2.615 -5.518 1.00 0.00 H new ATOM 0 HG23 ILE A 113 3.133 -3.630 -4.150 1.00 0.00 H new ATOM 0 HD11 ILE A 113 0.128 -3.427 -1.934 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.668 -3.970 -2.643 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.603 -2.456 -1.710 1.00 0.00 H new ATOM 1650 N HIS A 114 5.234 -1.236 -3.926 1.00 0.00 N ATOM 1651 CA HIS A 114 6.503 -0.917 -4.571 1.00 0.00 C ATOM 1652 C HIS A 114 6.852 -1.960 -5.628 1.00 0.00 C ATOM 1653 O HIS A 114 7.408 -3.013 -5.315 1.00 0.00 O ATOM 1654 CB HIS A 114 7.621 -0.833 -3.532 1.00 0.00 C ATOM 1655 CG HIS A 114 8.915 -0.320 -4.085 1.00 0.00 C ATOM 1656 ND1 HIS A 114 9.105 0.994 -4.459 1.00 0.00 N ATOM 1657 CD2 HIS A 114 10.088 -0.951 -4.324 1.00 0.00 C ATOM 1658 CE1 HIS A 114 10.338 1.148 -4.907 1.00 0.00 C ATOM 1659 NE2 HIS A 114 10.956 -0.018 -4.834 1.00 0.00 N ATOM 0 H HIS A 114 5.279 -2.015 -3.269 1.00 0.00 H new ATOM 0 HA HIS A 114 6.400 0.051 -5.061 1.00 0.00 H new ATOM 0 HB2 HIS A 114 7.301 -0.184 -2.717 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.785 -1.823 -3.105 1.00 0.00 H new ATOM 0 HD2 HIS A 114 10.302 -1.995 -4.146 1.00 0.00 H new ATOM 0 HE1 HIS A 114 10.768 2.070 -5.271 1.00 0.00 H new ATOM 0 HE2 HIS A 114 11.921 -0.196 -5.112 1.00 0.00 H new ATOM 1668 N ILE A 115 6.521 -1.661 -6.880 1.00 0.00 N ATOM 1669 CA ILE A 115 6.801 -2.573 -7.982 1.00 0.00 C ATOM 1670 C ILE A 115 8.302 -2.733 -8.197 1.00 0.00 C ATOM 1671 O ILE A 115 8.987 -1.791 -8.598 1.00 0.00 O ATOM 1672 CB ILE A 115 6.155 -2.086 -9.293 1.00 0.00 C ATOM 1673 CG1 ILE A 115 4.643 -1.930 -9.115 1.00 0.00 C ATOM 1674 CG2 ILE A 115 6.464 -3.053 -10.426 1.00 0.00 C ATOM 1675 CD1 ILE A 115 3.921 -3.243 -8.908 1.00 0.00 C ATOM 0 H ILE A 115 6.059 -0.795 -7.156 1.00 0.00 H new ATOM 0 HA ILE A 115 6.371 -3.537 -7.710 1.00 0.00 H new ATOM 0 HB ILE A 115 6.574 -1.112 -9.548 1.00 0.00 H new ATOM 0 HG12 ILE A 115 4.451 -1.280 -8.261 1.00 0.00 H new ATOM 0 HG13 ILE A 115 4.231 -1.433 -9.993 1.00 0.00 H new ATOM 0 HG21 ILE A 115 6.001 -2.696 -11.346 1.00 0.00 H new ATOM 0 HG22 ILE A 115 7.543 -3.118 -10.565 1.00 0.00 H new ATOM 0 HG23 ILE A 115 6.070 -4.039 -10.181 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.854 -3.057 -8.789 1.00 0.00 H new ATOM 0 HD12 ILE A 115 4.083 -3.887 -9.772 1.00 0.00 H new ATOM 0 HD13 ILE A 115 4.306 -3.733 -8.013 1.00 0.00 H new ATOM 1687 N LYS A 116 8.808 -3.931 -7.928 1.00 0.00 N ATOM 1688 CA LYS A 116 10.228 -4.217 -8.094 1.00 0.00 C ATOM 1689 C LYS A 116 10.562 -4.485 -9.558 1.00 0.00 C ATOM 1690 O LYS A 116 10.656 -5.636 -9.982 1.00 0.00 O ATOM 1691 CB LYS A 116 10.630 -5.422 -7.240 1.00 0.00 C ATOM 1692 CG LYS A 116 10.357 -5.235 -5.758 1.00 0.00 C ATOM 1693 CD LYS A 116 10.411 -6.557 -5.010 1.00 0.00 C ATOM 1694 CE LYS A 116 11.822 -6.873 -4.538 1.00 0.00 C ATOM 1695 NZ LYS A 116 12.068 -8.340 -4.469 1.00 0.00 N ATOM 0 H LYS A 116 8.255 -4.721 -7.594 1.00 0.00 H new ATOM 0 HA LYS A 116 10.790 -3.342 -7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 116 10.092 -6.302 -7.592 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.692 -5.620 -7.383 1.00 0.00 H new ATOM 0 HG2 LYS A 116 11.090 -4.547 -5.336 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.376 -4.779 -5.622 1.00 0.00 H new ATOM 0 HD2 LYS A 116 9.739 -6.519 -4.152 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.055 -7.358 -5.658 1.00 0.00 H new ATOM 0 HE2 LYS A 116 12.543 -6.415 -5.216 1.00 0.00 H new ATOM 0 HE3 LYS A 116 11.984 -6.431 -3.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.040 -8.514 -4.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 11.397 -8.774 -3.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 11.939 -8.758 -5.412 1.00 0.00 H new ATOM 1709 N GLU A 117 10.740 -3.413 -10.325 1.00 0.00 N ATOM 1710 CA GLU A 117 11.064 -3.534 -11.742 1.00 0.00 C ATOM 1711 C GLU A 117 12.574 -3.606 -11.951 1.00 0.00 C ATOM 1712 O GLU A 117 13.224 -2.594 -12.213 1.00 0.00 O ATOM 1713 CB GLU A 117 10.485 -2.353 -12.523 1.00 0.00 C ATOM 1714 CG GLU A 117 8.985 -2.445 -12.744 1.00 0.00 C ATOM 1715 CD GLU A 117 8.522 -1.647 -13.947 1.00 0.00 C ATOM 1716 OE1 GLU A 117 9.015 -1.914 -15.063 1.00 0.00 O ATOM 1717 OE2 GLU A 117 7.666 -0.755 -13.772 1.00 0.00 O ATOM 0 H GLU A 117 10.665 -2.453 -9.989 1.00 0.00 H new ATOM 0 HA GLU A 117 10.619 -4.458 -12.112 1.00 0.00 H new ATOM 0 HB2 GLU A 117 10.709 -1.430 -11.988 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.983 -2.289 -13.491 1.00 0.00 H new ATOM 0 HG2 GLU A 117 8.705 -3.490 -12.876 1.00 0.00 H new ATOM 0 HG3 GLU A 117 8.468 -2.086 -11.854 1.00 0.00 H new ATOM 1724 N VAL A 118 13.126 -4.809 -11.832 1.00 0.00 N ATOM 1725 CA VAL A 118 14.559 -5.014 -12.008 1.00 0.00 C ATOM 1726 C VAL A 118 14.936 -5.014 -13.485 1.00 0.00 C ATOM 1727 O VAL A 118 16.097 -4.806 -13.841 1.00 0.00 O ATOM 1728 CB VAL A 118 15.018 -6.339 -11.372 1.00 0.00 C ATOM 1729 CG1 VAL A 118 14.855 -6.291 -9.860 1.00 0.00 C ATOM 1730 CG2 VAL A 118 14.247 -7.509 -11.962 1.00 0.00 C ATOM 0 H VAL A 118 12.602 -5.657 -11.614 1.00 0.00 H new ATOM 0 HA VAL A 118 15.062 -4.186 -11.508 1.00 0.00 H new ATOM 0 HB VAL A 118 16.075 -6.481 -11.595 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.184 -7.236 -9.428 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.457 -5.478 -9.455 1.00 0.00 H new ATOM 0 HG13 VAL A 118 13.807 -6.125 -9.612 1.00 0.00 H new ATOM 0 HG21 VAL A 118 14.585 -8.437 -11.501 1.00 0.00 H new ATOM 0 HG22 VAL A 118 13.182 -7.376 -11.772 1.00 0.00 H new ATOM 0 HG23 VAL A 118 14.421 -7.554 -13.037 1.00 0.00 H new ATOM 1740 N THR A 119 13.948 -5.248 -14.343 1.00 0.00 N ATOM 1741 CA THR A 119 14.176 -5.276 -15.782 1.00 0.00 C ATOM 1742 C THR A 119 14.025 -3.886 -16.390 1.00 0.00 C ATOM 1743 O THR A 119 13.714 -3.745 -17.573 1.00 0.00 O ATOM 1744 CB THR A 119 13.204 -6.241 -16.486 1.00 0.00 C ATOM 1745 OG1 THR A 119 11.971 -6.309 -15.762 1.00 0.00 O ATOM 1746 CG2 THR A 119 13.809 -7.632 -16.600 1.00 0.00 C ATOM 0 H THR A 119 12.982 -5.421 -14.066 1.00 0.00 H new ATOM 0 HA THR A 119 15.197 -5.626 -15.934 1.00 0.00 H new ATOM 0 HB THR A 119 13.015 -5.862 -17.490 1.00 0.00 H new ATOM 0 HG1 THR A 119 11.358 -6.923 -16.217 1.00 0.00 H new ATOM 0 HG21 THR A 119 13.104 -8.296 -17.101 1.00 0.00 H new ATOM 0 HG22 THR A 119 14.732 -7.581 -17.178 1.00 0.00 H new ATOM 0 HG23 THR A 119 14.025 -8.017 -15.604 1.00 0.00 H new TER 1754 THR A 119