USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 831 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 139 TYR OH : rot 72:sc= 0.924 USER MOD Set 1.2: B 166 THR OG1 : rot 180:sc= -0.186 USER MOD Set 2.1: A 57 THR OG1 : rot -120:sc= -0.159 USER MOD Set 2.2: A 59 SER OG : rot 180:sc= -0.0479 USER MOD Set 3.1: A 32 SER OG : rot 127:sc= -2.63! USER MOD Set 3.2: A 54 SER OG : rot 96:sc= -2.52! USER MOD Set 3.3: A 61 THR OG1 : rot 80:sc= -0.028 USER MOD Set 4.1: A 44 SER OG : rot -112:sc= 0.4! USER MOD Set 4.2: A 49 HIS : no HD1:sc= -0.56 K(o=-0.16,f=-1.2) USER MOD Set 5.1: A 1 GLU N :NH3+ -150:sc= -2.06! (180deg=-3.3!) USER MOD Set 5.2: A 68 CYS SG : rot 26:sc= 0.986 USER MOD Single : A 2 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -1.01 K(o=-1,f=-5!) USER MOD Single : A 7 ASN : amide:sc= -0.0427 K(o=-0.043,f=-2.1!) USER MOD Single : A 11 LYS NZ :NH3+ -149:sc= -0.314 (180deg=-0.691) USER MOD Single : A 13 GLN : amide:sc= -4.7! K(o=-4.7!,f=-3.3) USER MOD Single : A 15 SER OG : rot 176:sc= -3.43! USER MOD Single : A 18 TYR OH : rot -130:sc= -0.404 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -180:sc= -0.897! USER MOD Single : A 28 ASN : amide:sc= -5.31! C(o=-5.3!,f=-3.5!) USER MOD Single : A 38 THR OG1 : rot 82:sc= 1.02 USER MOD Single : A 52 THR OG1 : rot 34:sc= -2.29! USER MOD Single : A 56 LYS NZ :NH3+ -156:sc= -0.101 (180deg=-1.18) USER MOD Single : A 58 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 62 LYS NZ :NH3+ -169:sc= 0.0681 (180deg=0.0486) USER MOD Single : A 63 ASN : amide:sc= -0.952 K(o=-0.95,f=-0.42) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= -1.08 K(o=-1.1,f=-2.2!) USER MOD Single : A 97 HIS : no HE2:sc= -16.5! C(o=-17!,f=-33!) USER MOD Single : A 98 TYR OH : rot -27:sc= -0.971! USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 136 TYR OH : rot 100:sc= -0.864 USER MOD Single : A 137 TYR OH : rot -60:sc= -0.421 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 65:sc= 1.21 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : B 165 SER OG : rot 36:sc= 0.0248 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -5.251 -21.898 8.338 1.00 0.00 N ATOM 2 CA GLU A 1 -4.489 -20.621 8.225 1.00 0.00 C ATOM 3 C GLU A 1 -4.827 -19.919 6.906 1.00 0.00 C ATOM 4 O GLU A 1 -5.451 -18.877 6.889 1.00 0.00 O ATOM 5 CB GLU A 1 -3.017 -21.036 8.250 1.00 0.00 C ATOM 6 CG GLU A 1 -2.158 -19.844 8.674 1.00 0.00 C ATOM 7 CD GLU A 1 -0.954 -19.723 7.738 1.00 0.00 C ATOM 8 OE1 GLU A 1 -1.138 -19.888 6.544 1.00 0.00 O ATOM 9 OE2 GLU A 1 0.132 -19.466 8.231 1.00 0.00 O ATOM 0 H1 GLU A 1 -5.436 -22.104 9.340 1.00 0.00 H new ATOM 0 H2 GLU A 1 -6.154 -21.809 7.830 1.00 0.00 H new ATOM 0 H3 GLU A 1 -4.695 -22.672 7.923 1.00 0.00 H new ATOM 0 HA GLU A 1 -4.730 -19.923 9.027 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -2.874 -21.866 8.942 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -2.710 -21.387 7.265 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -2.748 -18.928 8.644 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -1.821 -19.973 9.702 1.00 0.00 H new ATOM 15 N TYR A 2 -4.420 -20.483 5.802 1.00 0.00 N ATOM 16 CA TYR A 2 -4.718 -19.849 4.485 1.00 0.00 C ATOM 17 C TYR A 2 -6.229 -19.654 4.323 1.00 0.00 C ATOM 18 O TYR A 2 -6.682 -18.683 3.751 1.00 0.00 O ATOM 19 CB TYR A 2 -4.182 -20.830 3.441 1.00 0.00 C ATOM 20 CG TYR A 2 -5.172 -21.954 3.242 1.00 0.00 C ATOM 21 CD1 TYR A 2 -6.230 -21.801 2.337 1.00 0.00 C ATOM 22 CD2 TYR A 2 -5.033 -23.146 3.961 1.00 0.00 C ATOM 23 CE1 TYR A 2 -7.149 -22.843 2.152 1.00 0.00 C ATOM 24 CE2 TYR A 2 -5.950 -24.187 3.776 1.00 0.00 C ATOM 25 CZ TYR A 2 -7.009 -24.035 2.872 1.00 0.00 C ATOM 26 OH TYR A 2 -7.914 -25.062 2.690 1.00 0.00 O ATOM 0 H TYR A 2 -3.894 -21.356 5.754 1.00 0.00 H new ATOM 0 HA TYR A 2 -4.261 -18.864 4.386 1.00 0.00 H new ATOM 0 HB2 TYR A 2 -4.010 -20.313 2.497 1.00 0.00 H new ATOM 0 HB3 TYR A 2 -3.222 -21.231 3.765 1.00 0.00 H new ATOM 0 HD1 TYR A 2 -6.338 -20.881 1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 2 -4.217 -23.263 4.659 1.00 0.00 H new ATOM 0 HE1 TYR A 2 -7.965 -22.726 1.454 1.00 0.00 H new ATOM 0 HE2 TYR A 2 -5.841 -25.107 4.330 1.00 0.00 H new ATOM 0 HH TYR A 2 -7.671 -25.818 3.265 1.00 0.00 H new ATOM 36 N GLN A 3 -7.010 -20.574 4.820 1.00 0.00 N ATOM 37 CA GLN A 3 -8.489 -20.444 4.693 1.00 0.00 C ATOM 38 C GLN A 3 -8.994 -19.272 5.540 1.00 0.00 C ATOM 39 O GLN A 3 -9.830 -18.500 5.113 1.00 0.00 O ATOM 40 CB GLN A 3 -9.048 -21.766 5.219 1.00 0.00 C ATOM 41 CG GLN A 3 -10.570 -21.776 5.060 1.00 0.00 C ATOM 42 CD GLN A 3 -11.228 -21.733 6.440 1.00 0.00 C ATOM 43 OE1 GLN A 3 -10.566 -21.514 7.435 1.00 0.00 O ATOM 44 NE2 GLN A 3 -12.513 -21.933 6.543 1.00 0.00 N ATOM 0 H GLN A 3 -6.688 -21.410 5.308 1.00 0.00 H new ATOM 0 HA GLN A 3 -8.800 -20.249 3.667 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -8.609 -22.601 4.673 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -8.780 -21.895 6.268 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -10.890 -20.920 4.466 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -10.884 -22.671 4.523 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -13.069 -22.117 5.708 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -12.962 -21.905 7.459 1.00 0.00 H new ATOM 53 N LEU A 4 -8.494 -19.133 6.737 1.00 0.00 N ATOM 54 CA LEU A 4 -8.951 -18.009 7.608 1.00 0.00 C ATOM 55 C LEU A 4 -8.499 -16.669 7.022 1.00 0.00 C ATOM 56 O LEU A 4 -9.269 -15.736 6.916 1.00 0.00 O ATOM 57 CB LEU A 4 -8.280 -18.258 8.959 1.00 0.00 C ATOM 58 CG LEU A 4 -8.662 -19.647 9.472 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.405 -20.386 9.934 1.00 0.00 C ATOM 60 CD2 LEU A 4 -9.630 -19.507 10.649 1.00 0.00 C ATOM 0 H LEU A 4 -7.791 -19.746 7.150 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.037 -17.967 7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.197 -18.181 8.859 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.588 -17.497 9.676 1.00 0.00 H new ATOM 0 HG LEU A 4 -9.140 -20.210 8.670 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.678 -21.376 10.299 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -6.714 -20.486 9.097 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.926 -19.823 10.735 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -9.903 -20.497 11.015 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -9.151 -18.943 11.449 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -10.527 -18.981 10.322 1.00 0.00 H new ATOM 72 N VAL A 5 -7.256 -16.565 6.640 1.00 0.00 N ATOM 73 CA VAL A 5 -6.759 -15.284 6.063 1.00 0.00 C ATOM 74 C VAL A 5 -7.531 -14.950 4.783 1.00 0.00 C ATOM 75 O VAL A 5 -7.851 -13.808 4.520 1.00 0.00 O ATOM 76 CB VAL A 5 -5.284 -15.534 5.753 1.00 0.00 C ATOM 77 CG1 VAL A 5 -4.557 -15.943 7.035 1.00 0.00 C ATOM 78 CG2 VAL A 5 -5.163 -16.658 4.721 1.00 0.00 C ATOM 0 H VAL A 5 -6.563 -17.311 6.702 1.00 0.00 H new ATOM 0 HA VAL A 5 -6.893 -14.443 6.743 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.837 -14.623 5.354 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.504 -16.122 6.815 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.643 -15.145 7.773 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.004 -16.854 7.432 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.111 -16.837 4.499 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -5.609 -17.569 5.121 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.682 -16.370 3.807 1.00 0.00 H new ATOM 88 N VAL A 6 -7.834 -15.937 3.988 1.00 0.00 N ATOM 89 CA VAL A 6 -8.587 -15.676 2.728 1.00 0.00 C ATOM 90 C VAL A 6 -9.929 -15.014 3.049 1.00 0.00 C ATOM 91 O VAL A 6 -10.276 -13.992 2.492 1.00 0.00 O ATOM 92 CB VAL A 6 -8.803 -17.054 2.102 1.00 0.00 C ATOM 93 CG1 VAL A 6 -9.883 -16.960 1.022 1.00 0.00 C ATOM 94 CG2 VAL A 6 -7.495 -17.538 1.472 1.00 0.00 C ATOM 0 H VAL A 6 -7.593 -16.914 4.155 1.00 0.00 H new ATOM 0 HA VAL A 6 -8.052 -15.005 2.055 1.00 0.00 H new ATOM 0 HB VAL A 6 -9.119 -17.757 2.872 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -10.037 -17.942 0.575 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -10.815 -16.614 1.469 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -9.567 -16.257 0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -7.648 -18.520 1.025 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -7.180 -16.834 0.702 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -6.724 -17.605 2.240 1.00 0.00 H new ATOM 104 N ASN A 7 -10.684 -15.586 3.946 1.00 0.00 N ATOM 105 CA ASN A 7 -11.999 -14.983 4.305 1.00 0.00 C ATOM 106 C ASN A 7 -11.788 -13.565 4.839 1.00 0.00 C ATOM 107 O ASN A 7 -12.478 -12.638 4.463 1.00 0.00 O ATOM 108 CB ASN A 7 -12.568 -15.889 5.396 1.00 0.00 C ATOM 109 CG ASN A 7 -14.068 -15.626 5.548 1.00 0.00 C ATOM 110 OD1 ASN A 7 -14.608 -14.743 4.911 1.00 0.00 O ATOM 111 ND2 ASN A 7 -14.766 -16.357 6.372 1.00 0.00 N ATOM 0 H ASN A 7 -10.448 -16.444 4.445 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.672 -14.910 3.451 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.395 -16.935 5.142 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.058 -15.702 6.341 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -15.766 -16.188 6.482 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.312 -17.098 6.906 1.00 0.00 H new ATOM 118 N ALA A 8 -10.832 -13.389 5.709 1.00 0.00 N ATOM 119 CA ALA A 8 -10.564 -12.031 6.264 1.00 0.00 C ATOM 120 C ALA A 8 -10.157 -11.083 5.138 1.00 0.00 C ATOM 121 O ALA A 8 -10.614 -9.960 5.056 1.00 0.00 O ATOM 122 CB ALA A 8 -9.404 -12.227 7.232 1.00 0.00 C ATOM 0 H ALA A 8 -10.223 -14.128 6.061 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.438 -11.600 6.752 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.143 -11.271 7.686 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.695 -12.931 8.011 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.542 -12.620 6.692 1.00 0.00 H new ATOM 128 N VAL A 9 -9.304 -11.534 4.261 1.00 0.00 N ATOM 129 CA VAL A 9 -8.868 -10.671 3.132 1.00 0.00 C ATOM 130 C VAL A 9 -10.091 -10.227 2.334 1.00 0.00 C ATOM 131 O VAL A 9 -10.187 -9.097 1.898 1.00 0.00 O ATOM 132 CB VAL A 9 -7.961 -11.560 2.278 1.00 0.00 C ATOM 133 CG1 VAL A 9 -7.825 -10.961 0.877 1.00 0.00 C ATOM 134 CG2 VAL A 9 -6.580 -11.649 2.927 1.00 0.00 C ATOM 0 H VAL A 9 -8.890 -12.466 4.279 1.00 0.00 H new ATOM 0 HA VAL A 9 -8.349 -9.772 3.464 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.397 -12.556 2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -7.179 -11.596 0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -8.809 -10.896 0.412 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -7.391 -9.964 0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.933 -12.282 2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.147 -10.651 3.000 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.674 -12.077 3.925 1.00 0.00 H new ATOM 144 N ARG A 10 -11.028 -11.113 2.145 1.00 0.00 N ATOM 145 CA ARG A 10 -12.253 -10.750 1.378 1.00 0.00 C ATOM 146 C ARG A 10 -12.920 -9.527 2.009 1.00 0.00 C ATOM 147 O ARG A 10 -13.384 -8.637 1.324 1.00 0.00 O ATOM 148 CB ARG A 10 -13.163 -11.973 1.483 1.00 0.00 C ATOM 149 CG ARG A 10 -14.120 -12.002 0.289 1.00 0.00 C ATOM 150 CD ARG A 10 -15.533 -11.647 0.759 1.00 0.00 C ATOM 151 NE ARG A 10 -16.408 -11.921 -0.415 1.00 0.00 N ATOM 152 CZ ARG A 10 -16.664 -13.152 -0.765 1.00 0.00 C ATOM 153 NH1 ARG A 10 -16.154 -14.145 -0.088 1.00 0.00 N ATOM 154 NH2 ARG A 10 -17.432 -13.391 -1.793 1.00 0.00 N ATOM 0 H ARG A 10 -10.999 -12.073 2.488 1.00 0.00 H new ATOM 0 HA ARG A 10 -12.035 -10.496 0.341 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.565 -12.884 1.505 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -13.728 -11.940 2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -13.790 -11.295 -0.472 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -14.116 -12.990 -0.170 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -15.826 -12.249 1.619 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -15.597 -10.603 1.064 1.00 0.00 H new ATOM 0 HE ARG A 10 -16.807 -11.147 -0.945 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -15.554 -13.959 0.716 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -16.355 -15.106 -0.363 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -17.832 -12.616 -2.322 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -17.633 -14.353 -2.067 1.00 0.00 H new ATOM 168 N LYS A 11 -12.968 -9.474 3.313 1.00 0.00 N ATOM 169 CA LYS A 11 -13.601 -8.306 3.989 1.00 0.00 C ATOM 170 C LYS A 11 -12.655 -7.102 3.952 1.00 0.00 C ATOM 171 O LYS A 11 -13.068 -5.982 3.730 1.00 0.00 O ATOM 172 CB LYS A 11 -13.834 -8.762 5.430 1.00 0.00 C ATOM 173 CG LYS A 11 -14.689 -10.030 5.432 1.00 0.00 C ATOM 174 CD LYS A 11 -16.122 -9.680 5.834 1.00 0.00 C ATOM 175 CE LYS A 11 -16.130 -9.114 7.257 1.00 0.00 C ATOM 176 NZ LYS A 11 -16.594 -7.706 7.108 1.00 0.00 N ATOM 0 H LYS A 11 -12.596 -10.189 3.939 1.00 0.00 H new ATOM 0 HA LYS A 11 -14.528 -7.998 3.505 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -12.880 -8.953 5.921 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -14.331 -7.974 5.996 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -14.679 -10.489 4.443 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -14.273 -10.760 6.127 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -16.538 -8.951 5.139 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -16.753 -10.567 5.781 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -16.797 -9.683 7.905 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -15.137 -9.157 7.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -16.159 -7.117 7.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -16.319 -7.347 6.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -17.629 -7.670 7.202 1.00 0.00 H new ATOM 190 N LEU A 12 -11.387 -7.326 4.170 1.00 0.00 N ATOM 191 CA LEU A 12 -10.416 -6.194 4.147 1.00 0.00 C ATOM 192 C LEU A 12 -10.204 -5.706 2.711 1.00 0.00 C ATOM 193 O LEU A 12 -10.181 -4.522 2.446 1.00 0.00 O ATOM 194 CB LEU A 12 -9.119 -6.775 4.714 1.00 0.00 C ATOM 195 CG LEU A 12 -8.102 -5.650 4.916 1.00 0.00 C ATOM 196 CD1 LEU A 12 -8.505 -4.808 6.128 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.716 -6.254 5.156 1.00 0.00 C ATOM 0 H LEU A 12 -10.982 -8.242 4.363 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.766 -5.338 4.723 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.316 -7.276 5.662 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.716 -7.526 4.034 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.077 -5.020 4.027 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.780 -4.007 6.272 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.493 -4.378 5.960 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.530 -5.438 7.017 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -5.990 -5.454 5.300 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -6.743 -6.884 6.045 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.427 -6.855 4.294 1.00 0.00 H new ATOM 209 N GLN A 13 -10.050 -6.610 1.782 1.00 0.00 N ATOM 210 CA GLN A 13 -9.840 -6.195 0.364 1.00 0.00 C ATOM 211 C GLN A 13 -11.037 -5.378 -0.129 1.00 0.00 C ATOM 212 O GLN A 13 -10.895 -4.474 -0.930 1.00 0.00 O ATOM 213 CB GLN A 13 -9.722 -7.502 -0.421 1.00 0.00 C ATOM 214 CG GLN A 13 -8.270 -7.982 -0.399 1.00 0.00 C ATOM 215 CD GLN A 13 -8.081 -9.082 -1.444 1.00 0.00 C ATOM 216 OE1 GLN A 13 -7.090 -9.105 -2.147 1.00 0.00 O ATOM 217 NE2 GLN A 13 -8.996 -10.003 -1.577 1.00 0.00 N ATOM 0 H GLN A 13 -10.060 -7.617 1.943 1.00 0.00 H new ATOM 0 HA GLN A 13 -8.956 -5.569 0.244 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -10.373 -8.260 0.014 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -10.051 -7.352 -1.449 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -7.597 -7.150 -0.606 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -8.015 -8.359 0.592 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.828 -9.984 -0.987 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -8.879 -10.742 -2.271 1.00 0.00 H new ATOM 226 N GLU A 14 -12.214 -5.689 0.340 1.00 0.00 N ATOM 227 CA GLU A 14 -13.418 -4.930 -0.107 1.00 0.00 C ATOM 228 C GLU A 14 -13.245 -3.440 0.193 1.00 0.00 C ATOM 229 O GLU A 14 -13.799 -2.593 -0.479 1.00 0.00 O ATOM 230 CB GLU A 14 -14.575 -5.510 0.706 1.00 0.00 C ATOM 231 CG GLU A 14 -15.721 -5.888 -0.234 1.00 0.00 C ATOM 232 CD GLU A 14 -15.194 -6.808 -1.338 1.00 0.00 C ATOM 233 OE1 GLU A 14 -14.971 -7.973 -1.055 1.00 0.00 O ATOM 234 OE2 GLU A 14 -15.023 -6.329 -2.447 1.00 0.00 O ATOM 0 H GLU A 14 -12.395 -6.434 1.012 1.00 0.00 H new ATOM 0 HA GLU A 14 -13.588 -5.020 -1.180 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -14.240 -6.387 1.260 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.918 -4.781 1.440 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -16.513 -6.388 0.324 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -16.158 -4.990 -0.672 1.00 0.00 H new ATOM 241 N SER A 15 -12.477 -3.111 1.195 1.00 0.00 N ATOM 242 CA SER A 15 -12.269 -1.673 1.532 1.00 0.00 C ATOM 243 C SER A 15 -11.627 -0.949 0.346 1.00 0.00 C ATOM 244 O SER A 15 -12.010 0.149 -0.006 1.00 0.00 O ATOM 245 CB SER A 15 -11.322 -1.681 2.730 1.00 0.00 C ATOM 246 OG SER A 15 -10.075 -2.238 2.336 1.00 0.00 O ATOM 0 H SER A 15 -11.985 -3.774 1.794 1.00 0.00 H new ATOM 0 HA SER A 15 -13.203 -1.158 1.756 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.179 -0.667 3.103 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.752 -2.263 3.545 1.00 0.00 H new ATOM 0 HG SER A 15 -9.445 -2.192 3.085 1.00 0.00 H new ATOM 252 N GLY A 16 -10.653 -1.559 -0.275 1.00 0.00 N ATOM 253 CA GLY A 16 -9.990 -0.909 -1.440 1.00 0.00 C ATOM 254 C GLY A 16 -8.666 -0.279 -1.001 1.00 0.00 C ATOM 255 O GLY A 16 -8.200 0.675 -1.591 1.00 0.00 O ATOM 0 H GLY A 16 -10.289 -2.478 -0.025 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.810 -1.644 -2.224 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.644 -0.146 -1.862 1.00 0.00 H new ATOM 259 N PHE A 17 -8.054 -0.800 0.028 1.00 0.00 N ATOM 260 CA PHE A 17 -6.761 -0.218 0.489 1.00 0.00 C ATOM 261 C PHE A 17 -5.722 -1.324 0.718 1.00 0.00 C ATOM 262 O PHE A 17 -4.573 -1.054 1.005 1.00 0.00 O ATOM 263 CB PHE A 17 -7.089 0.509 1.798 1.00 0.00 C ATOM 264 CG PHE A 17 -7.086 -0.466 2.953 1.00 0.00 C ATOM 265 CD1 PHE A 17 -5.873 -0.951 3.458 1.00 0.00 C ATOM 266 CD2 PHE A 17 -8.296 -0.879 3.522 1.00 0.00 C ATOM 267 CE1 PHE A 17 -5.871 -1.851 4.530 1.00 0.00 C ATOM 268 CE2 PHE A 17 -8.294 -1.778 4.595 1.00 0.00 C ATOM 269 CZ PHE A 17 -7.082 -2.265 5.099 1.00 0.00 C ATOM 0 H PHE A 17 -8.391 -1.598 0.566 1.00 0.00 H new ATOM 0 HA PHE A 17 -6.331 0.459 -0.249 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -6.358 1.298 1.977 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.064 0.989 1.721 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -4.939 -0.631 3.020 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -9.231 -0.504 3.133 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -4.936 -2.226 4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -9.228 -2.096 5.034 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.081 -2.960 5.926 1.00 0.00 H new ATOM 279 N TYR A 18 -6.110 -2.564 0.591 1.00 0.00 N ATOM 280 CA TYR A 18 -5.130 -3.671 0.799 1.00 0.00 C ATOM 281 C TYR A 18 -4.753 -4.296 -0.546 1.00 0.00 C ATOM 282 O TYR A 18 -5.569 -4.900 -1.214 1.00 0.00 O ATOM 283 CB TYR A 18 -5.865 -4.686 1.680 1.00 0.00 C ATOM 284 CG TYR A 18 -5.148 -6.019 1.646 1.00 0.00 C ATOM 285 CD1 TYR A 18 -3.801 -6.088 1.265 1.00 0.00 C ATOM 286 CD2 TYR A 18 -5.835 -7.187 2.001 1.00 0.00 C ATOM 287 CE1 TYR A 18 -3.143 -7.324 1.238 1.00 0.00 C ATOM 288 CE2 TYR A 18 -5.175 -8.423 1.975 1.00 0.00 C ATOM 289 CZ TYR A 18 -3.830 -8.491 1.594 1.00 0.00 C ATOM 290 OH TYR A 18 -3.181 -9.708 1.567 1.00 0.00 O ATOM 0 H TYR A 18 -7.057 -2.858 0.354 1.00 0.00 H new ATOM 0 HA TYR A 18 -4.204 -3.328 1.260 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -5.918 -4.319 2.705 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -6.891 -4.807 1.331 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -3.270 -5.188 0.992 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -6.873 -7.135 2.295 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -2.106 -7.377 0.943 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -5.705 -9.323 2.249 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.722 -10.356 1.069 1.00 0.00 H new ATOM 300 N TRP A 19 -3.514 -4.170 -0.941 1.00 0.00 N ATOM 301 CA TRP A 19 -3.081 -4.773 -2.231 1.00 0.00 C ATOM 302 C TRP A 19 -1.862 -5.670 -2.007 1.00 0.00 C ATOM 303 O TRP A 19 -1.046 -5.420 -1.143 1.00 0.00 O ATOM 304 CB TRP A 19 -2.749 -3.599 -3.162 1.00 0.00 C ATOM 305 CG TRP A 19 -1.913 -2.575 -2.456 1.00 0.00 C ATOM 306 CD1 TRP A 19 -2.298 -1.858 -1.375 1.00 0.00 C ATOM 307 CD2 TRP A 19 -0.565 -2.127 -2.783 1.00 0.00 C ATOM 308 NE1 TRP A 19 -1.270 -1.007 -1.014 1.00 0.00 N ATOM 309 CE2 TRP A 19 -0.181 -1.135 -1.851 1.00 0.00 C ATOM 310 CE3 TRP A 19 0.353 -2.485 -3.786 1.00 0.00 C ATOM 311 CZ2 TRP A 19 1.069 -0.519 -1.912 1.00 0.00 C ATOM 312 CZ3 TRP A 19 1.613 -1.866 -3.850 1.00 0.00 C ATOM 313 CH2 TRP A 19 1.970 -0.885 -2.914 1.00 0.00 C ATOM 0 H TRP A 19 -2.785 -3.676 -0.426 1.00 0.00 H new ATOM 0 HA TRP A 19 -3.858 -5.401 -2.668 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -2.217 -3.965 -4.040 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -3.671 -3.139 -3.517 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -3.252 -1.938 -0.876 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -1.312 -0.363 -0.224 1.00 0.00 H new ATOM 0 HE3 TRP A 19 0.088 -3.240 -4.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 1.338 0.236 -1.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 2.311 -2.148 -4.625 1.00 0.00 H new ATOM 0 HH2 TRP A 19 2.940 -0.413 -2.968 1.00 0.00 H new ATOM 324 N SER A 20 -1.731 -6.712 -2.780 1.00 0.00 N ATOM 325 CA SER A 20 -0.564 -7.621 -2.610 1.00 0.00 C ATOM 326 C SER A 20 0.283 -7.629 -3.882 1.00 0.00 C ATOM 327 O SER A 20 -0.099 -8.183 -4.894 1.00 0.00 O ATOM 328 CB SER A 20 -1.157 -9.002 -2.358 1.00 0.00 C ATOM 329 OG SER A 20 -2.570 -8.897 -2.242 1.00 0.00 O ATOM 0 H SER A 20 -2.381 -6.973 -3.521 1.00 0.00 H new ATOM 0 HA SER A 20 0.084 -7.306 -1.792 1.00 0.00 H new ATOM 0 HB2 SER A 20 -0.898 -9.676 -3.175 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.737 -9.429 -1.447 1.00 0.00 H new ATOM 0 HG SER A 20 -2.952 -9.785 -2.082 1.00 0.00 H new ATOM 335 N ALA A 21 1.427 -7.017 -3.833 1.00 0.00 N ATOM 336 CA ALA A 21 2.309 -6.981 -5.033 1.00 0.00 C ATOM 337 C ALA A 21 3.758 -6.717 -4.616 1.00 0.00 C ATOM 338 O ALA A 21 4.616 -6.468 -5.439 1.00 0.00 O ATOM 339 CB ALA A 21 1.775 -5.825 -5.882 1.00 0.00 C ATOM 0 H ALA A 21 1.794 -6.537 -3.011 1.00 0.00 H new ATOM 0 HA ALA A 21 2.303 -7.924 -5.579 1.00 0.00 H new ATOM 0 HB1 ALA A 21 2.374 -5.732 -6.788 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.737 -6.021 -6.151 1.00 0.00 H new ATOM 0 HB3 ALA A 21 1.833 -4.898 -5.312 1.00 0.00 H new ATOM 345 N VAL A 22 4.037 -6.772 -3.342 1.00 0.00 N ATOM 346 CA VAL A 22 5.425 -6.527 -2.869 1.00 0.00 C ATOM 347 C VAL A 22 5.939 -7.761 -2.124 1.00 0.00 C ATOM 348 O VAL A 22 5.435 -8.854 -2.298 1.00 0.00 O ATOM 349 CB VAL A 22 5.319 -5.326 -1.924 1.00 0.00 C ATOM 350 CG1 VAL A 22 5.774 -4.063 -2.655 1.00 0.00 C ATOM 351 CG2 VAL A 22 3.865 -5.148 -1.464 1.00 0.00 C ATOM 0 H VAL A 22 3.359 -6.977 -2.608 1.00 0.00 H new ATOM 0 HA VAL A 22 6.119 -6.332 -3.687 1.00 0.00 H new ATOM 0 HB VAL A 22 5.953 -5.499 -1.054 1.00 0.00 H new ATOM 0 HG11 VAL A 22 5.699 -3.207 -1.984 1.00 0.00 H new ATOM 0 HG12 VAL A 22 6.808 -4.182 -2.977 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.139 -3.898 -3.526 1.00 0.00 H new ATOM 0 HG21 VAL A 22 3.798 -4.292 -0.792 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.227 -4.979 -2.332 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.536 -6.046 -0.941 1.00 0.00 H new ATOM 361 N THR A 23 6.930 -7.601 -1.294 1.00 0.00 N ATOM 362 CA THR A 23 7.459 -8.775 -0.543 1.00 0.00 C ATOM 363 C THR A 23 6.768 -8.876 0.819 1.00 0.00 C ATOM 364 O THR A 23 5.982 -8.027 1.189 1.00 0.00 O ATOM 365 CB THR A 23 8.954 -8.500 -0.369 1.00 0.00 C ATOM 366 OG1 THR A 23 9.383 -7.581 -1.365 1.00 0.00 O ATOM 367 CG2 THR A 23 9.734 -9.808 -0.511 1.00 0.00 C ATOM 0 H THR A 23 7.395 -6.714 -1.103 1.00 0.00 H new ATOM 0 HA THR A 23 7.281 -9.715 -1.064 1.00 0.00 H new ATOM 0 HB THR A 23 9.134 -8.077 0.619 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.341 -7.404 -1.256 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.799 -9.612 -0.387 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.404 -10.513 0.252 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.556 -10.232 -1.499 1.00 0.00 H new ATOM 375 N GLY A 24 7.050 -9.906 1.566 1.00 0.00 N ATOM 376 CA GLY A 24 6.404 -10.052 2.898 1.00 0.00 C ATOM 377 C GLY A 24 6.537 -8.743 3.676 1.00 0.00 C ATOM 378 O GLY A 24 5.629 -7.937 3.717 1.00 0.00 O ATOM 0 H GLY A 24 7.698 -10.651 1.312 1.00 0.00 H new ATOM 0 HA2 GLY A 24 5.352 -10.310 2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 24 6.870 -10.866 3.453 1.00 0.00 H new ATOM 382 N GLY A 25 7.663 -8.528 4.299 1.00 0.00 N ATOM 383 CA GLY A 25 7.857 -7.274 5.082 1.00 0.00 C ATOM 384 C GLY A 25 8.195 -6.112 4.146 1.00 0.00 C ATOM 385 O GLY A 25 7.862 -4.974 4.410 1.00 0.00 O ATOM 0 H GLY A 25 8.458 -9.167 4.300 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.952 -7.045 5.645 1.00 0.00 H new ATOM 0 HA3 GLY A 25 8.659 -7.411 5.808 1.00 0.00 H new ATOM 389 N GLU A 26 8.862 -6.384 3.057 1.00 0.00 N ATOM 390 CA GLU A 26 9.224 -5.285 2.115 1.00 0.00 C ATOM 391 C GLU A 26 7.960 -4.586 1.620 1.00 0.00 C ATOM 392 O GLU A 26 7.983 -3.433 1.237 1.00 0.00 O ATOM 393 CB GLU A 26 9.946 -5.972 0.956 1.00 0.00 C ATOM 394 CG GLU A 26 11.027 -5.043 0.403 1.00 0.00 C ATOM 395 CD GLU A 26 12.140 -5.876 -0.235 1.00 0.00 C ATOM 396 OE1 GLU A 26 11.929 -6.371 -1.329 1.00 0.00 O ATOM 397 OE2 GLU A 26 13.185 -6.005 0.383 1.00 0.00 O ATOM 0 H GLU A 26 9.171 -7.316 2.779 1.00 0.00 H new ATOM 0 HA GLU A 26 9.848 -4.525 2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 26 10.394 -6.906 1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.234 -6.227 0.171 1.00 0.00 H new ATOM 0 HG2 GLU A 26 10.597 -4.366 -0.335 1.00 0.00 H new ATOM 0 HG3 GLU A 26 11.434 -4.425 1.203 1.00 0.00 H new ATOM 404 N ALA A 27 6.854 -5.272 1.636 1.00 0.00 N ATOM 405 CA ALA A 27 5.585 -4.649 1.177 1.00 0.00 C ATOM 406 C ALA A 27 5.145 -3.570 2.171 1.00 0.00 C ATOM 407 O ALA A 27 4.812 -2.464 1.798 1.00 0.00 O ATOM 408 CB ALA A 27 4.573 -5.793 1.152 1.00 0.00 C ATOM 0 H ALA A 27 6.774 -6.240 1.948 1.00 0.00 H new ATOM 0 HA ALA A 27 5.684 -4.169 0.203 1.00 0.00 H new ATOM 0 HB1 ALA A 27 3.605 -5.415 0.822 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.915 -6.566 0.464 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.476 -6.215 2.152 1.00 0.00 H new ATOM 414 N ASN A 28 5.138 -3.892 3.437 1.00 0.00 N ATOM 415 CA ASN A 28 4.715 -2.887 4.463 1.00 0.00 C ATOM 416 C ASN A 28 5.742 -1.756 4.576 1.00 0.00 C ATOM 417 O ASN A 28 5.401 -0.591 4.607 1.00 0.00 O ATOM 418 CB ASN A 28 4.631 -3.649 5.788 1.00 0.00 C ATOM 419 CG ASN A 28 4.365 -5.133 5.531 1.00 0.00 C ATOM 420 OD1 ASN A 28 3.315 -5.503 5.045 1.00 0.00 O ATOM 421 ND2 ASN A 28 5.286 -5.999 5.842 1.00 0.00 N ATOM 0 H ASN A 28 5.406 -4.804 3.807 1.00 0.00 H new ATOM 0 HA ASN A 28 3.763 -2.430 4.194 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.561 -3.530 6.343 1.00 0.00 H new ATOM 0 HB3 ASN A 28 3.836 -3.232 6.406 1.00 0.00 H new ATOM 0 HD21 ASN A 28 5.128 -6.993 5.678 1.00 0.00 H new ATOM 0 HD22 ASN A 28 6.166 -5.683 6.250 1.00 0.00 H new ATOM 428 N LEU A 29 6.994 -2.099 4.665 1.00 0.00 N ATOM 429 CA LEU A 29 8.059 -1.063 4.808 1.00 0.00 C ATOM 430 C LEU A 29 8.056 -0.089 3.626 1.00 0.00 C ATOM 431 O LEU A 29 8.388 1.070 3.773 1.00 0.00 O ATOM 432 CB LEU A 29 9.367 -1.850 4.864 1.00 0.00 C ATOM 433 CG LEU A 29 9.756 -2.090 6.327 1.00 0.00 C ATOM 434 CD1 LEU A 29 8.498 -2.348 7.165 1.00 0.00 C ATOM 435 CD2 LEU A 29 10.680 -3.307 6.413 1.00 0.00 C ATOM 0 H LEU A 29 7.331 -3.061 4.645 1.00 0.00 H new ATOM 0 HA LEU A 29 7.908 -0.450 5.697 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.254 -2.802 4.346 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.157 -1.300 4.352 1.00 0.00 H new ATOM 0 HG LEU A 29 10.270 -1.209 6.711 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.781 -2.518 8.204 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.838 -1.483 7.106 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.980 -3.227 6.782 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.958 -3.480 7.453 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.163 -4.185 6.025 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.578 -3.125 5.823 1.00 0.00 H new ATOM 447 N LEU A 30 7.696 -0.539 2.457 1.00 0.00 N ATOM 448 CA LEU A 30 7.694 0.385 1.286 1.00 0.00 C ATOM 449 C LEU A 30 6.819 1.602 1.592 1.00 0.00 C ATOM 450 O LEU A 30 7.213 2.729 1.368 1.00 0.00 O ATOM 451 CB LEU A 30 7.118 -0.443 0.129 1.00 0.00 C ATOM 452 CG LEU A 30 6.044 0.361 -0.608 1.00 0.00 C ATOM 453 CD1 LEU A 30 6.668 1.624 -1.205 1.00 0.00 C ATOM 454 CD2 LEU A 30 5.450 -0.493 -1.730 1.00 0.00 C ATOM 0 H LEU A 30 7.405 -1.497 2.261 1.00 0.00 H new ATOM 0 HA LEU A 30 8.686 0.766 1.043 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.914 -0.720 -0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 30 6.691 -1.370 0.512 1.00 0.00 H new ATOM 0 HG LEU A 30 5.257 0.642 0.092 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.902 2.195 -1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.092 2.233 -0.406 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.455 1.345 -1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.685 0.078 -2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.238 -0.774 -2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.004 -1.392 -1.305 1.00 0.00 H new ATOM 466 N LEU A 31 5.651 1.390 2.125 1.00 0.00 N ATOM 467 CA LEU A 31 4.782 2.549 2.463 1.00 0.00 C ATOM 468 C LEU A 31 5.361 3.250 3.696 1.00 0.00 C ATOM 469 O LEU A 31 5.328 4.459 3.817 1.00 0.00 O ATOM 470 CB LEU A 31 3.402 1.945 2.755 1.00 0.00 C ATOM 471 CG LEU A 31 2.864 2.476 4.085 1.00 0.00 C ATOM 472 CD1 LEU A 31 1.340 2.371 4.098 1.00 0.00 C ATOM 473 CD2 LEU A 31 3.444 1.643 5.229 1.00 0.00 C ATOM 0 H LEU A 31 5.262 0.472 2.340 1.00 0.00 H new ATOM 0 HA LEU A 31 4.717 3.291 1.667 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.711 2.193 1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.473 0.858 2.791 1.00 0.00 H new ATOM 0 HG LEU A 31 3.154 3.520 4.208 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.957 2.749 5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.928 2.960 3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.046 1.328 3.978 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.064 2.017 6.180 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.150 0.601 5.105 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.531 1.717 5.218 1.00 0.00 H new ATOM 485 N SER A 32 5.903 2.492 4.608 1.00 0.00 N ATOM 486 CA SER A 32 6.501 3.099 5.828 1.00 0.00 C ATOM 487 C SER A 32 7.779 3.858 5.463 1.00 0.00 C ATOM 488 O SER A 32 8.116 4.854 6.070 1.00 0.00 O ATOM 489 CB SER A 32 6.820 1.917 6.742 1.00 0.00 C ATOM 490 OG SER A 32 5.697 1.643 7.567 1.00 0.00 O ATOM 0 H SER A 32 5.957 1.475 4.560 1.00 0.00 H new ATOM 0 HA SER A 32 5.832 3.814 6.307 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.070 1.039 6.146 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.691 2.143 7.357 1.00 0.00 H new ATOM 0 HG SER A 32 5.454 0.697 7.485 1.00 0.00 H new ATOM 496 N ALA A 33 8.498 3.388 4.477 1.00 0.00 N ATOM 497 CA ALA A 33 9.758 4.080 4.080 1.00 0.00 C ATOM 498 C ALA A 33 9.447 5.290 3.193 1.00 0.00 C ATOM 499 O ALA A 33 10.242 6.201 3.074 1.00 0.00 O ATOM 500 CB ALA A 33 10.554 3.034 3.301 1.00 0.00 C ATOM 0 H ALA A 33 8.267 2.557 3.932 1.00 0.00 H new ATOM 0 HA ALA A 33 10.310 4.456 4.942 1.00 0.00 H new ATOM 0 HB1 ALA A 33 11.499 3.466 2.972 1.00 0.00 H new ATOM 0 HB2 ALA A 33 10.752 2.175 3.942 1.00 0.00 H new ATOM 0 HB3 ALA A 33 9.980 2.713 2.432 1.00 0.00 H new ATOM 506 N GLU A 34 8.296 5.315 2.579 1.00 0.00 N ATOM 507 CA GLU A 34 7.948 6.483 1.716 1.00 0.00 C ATOM 508 C GLU A 34 6.779 7.266 2.338 1.00 0.00 C ATOM 509 O GLU A 34 6.992 8.301 2.937 1.00 0.00 O ATOM 510 CB GLU A 34 7.572 5.890 0.356 1.00 0.00 C ATOM 511 CG GLU A 34 8.812 5.838 -0.537 1.00 0.00 C ATOM 512 CD GLU A 34 8.533 4.944 -1.747 1.00 0.00 C ATOM 513 OE1 GLU A 34 7.919 5.426 -2.685 1.00 0.00 O ATOM 514 OE2 GLU A 34 8.938 3.794 -1.715 1.00 0.00 O ATOM 0 H GLU A 34 7.586 4.585 2.635 1.00 0.00 H new ATOM 0 HA GLU A 34 8.773 7.188 1.616 1.00 0.00 H new ATOM 0 HB2 GLU A 34 7.161 4.889 0.485 1.00 0.00 H new ATOM 0 HB3 GLU A 34 6.797 6.495 -0.115 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.078 6.842 -0.867 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.662 5.452 0.025 1.00 0.00 H new ATOM 521 N PRO A 35 5.582 6.748 2.197 1.00 0.00 N ATOM 522 CA PRO A 35 4.397 7.428 2.781 1.00 0.00 C ATOM 523 C PRO A 35 4.404 7.286 4.306 1.00 0.00 C ATOM 524 O PRO A 35 3.532 6.670 4.887 1.00 0.00 O ATOM 525 CB PRO A 35 3.215 6.678 2.173 1.00 0.00 C ATOM 526 CG PRO A 35 3.754 5.328 1.826 1.00 0.00 C ATOM 527 CD PRO A 35 5.212 5.512 1.495 1.00 0.00 C ATOM 0 HA PRO A 35 4.369 8.497 2.571 1.00 0.00 H new ATOM 0 HB2 PRO A 35 2.388 6.604 2.880 1.00 0.00 H new ATOM 0 HB3 PRO A 35 2.834 7.190 1.290 1.00 0.00 H new ATOM 0 HG2 PRO A 35 3.631 4.637 2.660 1.00 0.00 H new ATOM 0 HG3 PRO A 35 3.216 4.903 0.978 1.00 0.00 H new ATOM 0 HD2 PRO A 35 5.809 4.666 1.835 1.00 0.00 H new ATOM 0 HD3 PRO A 35 5.369 5.601 0.420 1.00 0.00 H new ATOM 535 N ALA A 36 5.384 7.850 4.959 1.00 0.00 N ATOM 536 CA ALA A 36 5.454 7.746 6.447 1.00 0.00 C ATOM 537 C ALA A 36 4.112 8.130 7.076 1.00 0.00 C ATOM 538 O ALA A 36 3.442 9.040 6.629 1.00 0.00 O ATOM 539 CB ALA A 36 6.538 8.736 6.865 1.00 0.00 C ATOM 0 H ALA A 36 6.141 8.379 4.526 1.00 0.00 H new ATOM 0 HA ALA A 36 5.677 6.730 6.774 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.649 8.718 7.949 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.483 8.459 6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.257 9.740 6.546 1.00 0.00 H new ATOM 545 N GLY A 37 3.714 7.440 8.110 1.00 0.00 N ATOM 546 CA GLY A 37 2.416 7.760 8.766 1.00 0.00 C ATOM 547 C GLY A 37 1.311 6.931 8.118 1.00 0.00 C ATOM 548 O GLY A 37 0.139 7.212 8.268 1.00 0.00 O ATOM 0 H GLY A 37 4.233 6.668 8.529 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.471 7.545 9.833 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.196 8.823 8.666 1.00 0.00 H new ATOM 552 N THR A 38 1.679 5.914 7.390 1.00 0.00 N ATOM 553 CA THR A 38 0.655 5.061 6.718 1.00 0.00 C ATOM 554 C THR A 38 0.993 3.578 6.907 1.00 0.00 C ATOM 555 O THR A 38 2.146 3.201 6.972 1.00 0.00 O ATOM 556 CB THR A 38 0.727 5.447 5.240 1.00 0.00 C ATOM 557 OG1 THR A 38 1.069 6.821 5.129 1.00 0.00 O ATOM 558 CG2 THR A 38 -0.631 5.202 4.582 1.00 0.00 C ATOM 0 H THR A 38 2.647 5.635 7.230 1.00 0.00 H new ATOM 0 HA THR A 38 -0.343 5.211 7.129 1.00 0.00 H new ATOM 0 HB THR A 38 1.484 4.842 4.741 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.039 6.925 5.220 1.00 0.00 H new ATOM 0 HG21 THR A 38 -0.580 5.477 3.529 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.893 4.147 4.669 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.390 5.807 5.078 1.00 0.00 H new ATOM 566 N PHE A 39 -0.001 2.735 6.998 1.00 0.00 N ATOM 567 CA PHE A 39 0.278 1.280 7.185 1.00 0.00 C ATOM 568 C PHE A 39 -0.370 0.471 6.058 1.00 0.00 C ATOM 569 O PHE A 39 -1.452 0.781 5.599 1.00 0.00 O ATOM 570 CB PHE A 39 -0.345 0.925 8.538 1.00 0.00 C ATOM 571 CG PHE A 39 -1.823 0.671 8.365 1.00 0.00 C ATOM 572 CD1 PHE A 39 -2.719 1.745 8.346 1.00 0.00 C ATOM 573 CD2 PHE A 39 -2.296 -0.639 8.218 1.00 0.00 C ATOM 574 CE1 PHE A 39 -4.090 1.510 8.181 1.00 0.00 C ATOM 575 CE2 PHE A 39 -3.666 -0.874 8.055 1.00 0.00 C ATOM 576 CZ PHE A 39 -4.564 0.201 8.035 1.00 0.00 C ATOM 0 H PHE A 39 -0.988 2.988 6.951 1.00 0.00 H new ATOM 0 HA PHE A 39 1.344 1.055 7.162 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.140 0.041 8.952 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.186 1.737 9.247 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.354 2.755 8.459 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.604 -1.468 8.230 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -4.782 2.339 8.166 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -4.031 -1.884 7.945 1.00 0.00 H new ATOM 0 HZ PHE A 39 -5.621 0.020 7.907 1.00 0.00 H new ATOM 586 N LEU A 40 0.294 -0.554 5.601 1.00 0.00 N ATOM 587 CA LEU A 40 -0.267 -1.379 4.492 1.00 0.00 C ATOM 588 C LEU A 40 -0.190 -2.865 4.842 1.00 0.00 C ATOM 589 O LEU A 40 0.684 -3.294 5.567 1.00 0.00 O ATOM 590 CB LEU A 40 0.635 -1.064 3.297 1.00 0.00 C ATOM 591 CG LEU A 40 0.243 -1.927 2.097 1.00 0.00 C ATOM 592 CD1 LEU A 40 0.826 -1.314 0.823 1.00 0.00 C ATOM 593 CD2 LEU A 40 0.802 -3.339 2.270 1.00 0.00 C ATOM 0 H LEU A 40 1.204 -0.858 5.948 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.316 -1.159 4.294 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.552 -0.009 3.038 1.00 0.00 H new ATOM 0 HB3 LEU A 40 1.677 -1.246 3.560 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.844 -1.972 2.027 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.549 -1.926 -0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.433 -0.306 0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.912 -1.272 0.903 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.520 -3.950 1.412 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.889 -3.294 2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.397 -3.782 3.180 1.00 0.00 H new ATOM 605 N ILE A 41 -1.086 -3.660 4.319 1.00 0.00 N ATOM 606 CA ILE A 41 -1.041 -5.121 4.615 1.00 0.00 C ATOM 607 C ILE A 41 -0.740 -5.892 3.329 1.00 0.00 C ATOM 608 O ILE A 41 -1.391 -5.711 2.319 1.00 0.00 O ATOM 609 CB ILE A 41 -2.437 -5.474 5.139 1.00 0.00 C ATOM 610 CG1 ILE A 41 -2.362 -6.750 5.982 1.00 0.00 C ATOM 611 CG2 ILE A 41 -3.384 -5.712 3.964 1.00 0.00 C ATOM 612 CD1 ILE A 41 -3.575 -6.819 6.912 1.00 0.00 C ATOM 0 H ILE A 41 -1.843 -3.363 3.703 1.00 0.00 H new ATOM 0 HA ILE A 41 -0.268 -5.376 5.340 1.00 0.00 H new ATOM 0 HB ILE A 41 -2.807 -4.649 5.748 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.337 -7.626 5.334 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -1.442 -6.759 6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.376 -5.963 4.341 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.444 -4.809 3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.009 -6.534 3.355 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -3.522 -7.727 7.512 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -3.580 -5.949 7.569 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.489 -6.830 6.318 1.00 0.00 H new ATOM 624 N ARG A 42 0.242 -6.746 3.355 1.00 0.00 N ATOM 625 CA ARG A 42 0.581 -7.520 2.126 1.00 0.00 C ATOM 626 C ARG A 42 0.431 -9.021 2.392 1.00 0.00 C ATOM 627 O ARG A 42 0.796 -9.516 3.440 1.00 0.00 O ATOM 628 CB ARG A 42 2.040 -7.156 1.828 1.00 0.00 C ATOM 629 CG ARG A 42 2.768 -8.351 1.200 1.00 0.00 C ATOM 630 CD ARG A 42 2.210 -8.614 -0.202 1.00 0.00 C ATOM 631 NE ARG A 42 3.285 -9.369 -0.904 1.00 0.00 N ATOM 632 CZ ARG A 42 3.000 -10.090 -1.954 1.00 0.00 C ATOM 633 NH1 ARG A 42 1.772 -10.151 -2.394 1.00 0.00 N ATOM 634 NH2 ARG A 42 3.943 -10.753 -2.566 1.00 0.00 N ATOM 0 H ARG A 42 0.824 -6.943 4.169 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.074 -7.286 1.286 1.00 0.00 H new ATOM 0 HB2 ARG A 42 2.078 -6.302 1.152 1.00 0.00 H new ATOM 0 HB3 ARG A 42 2.543 -6.857 2.748 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.838 -8.150 1.145 1.00 0.00 H new ATOM 0 HG3 ARG A 42 2.642 -9.236 1.824 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.286 -9.190 -0.158 1.00 0.00 H new ATOM 0 HD3 ARG A 42 1.980 -7.682 -0.718 1.00 0.00 H new ATOM 0 HE ARG A 42 4.245 -9.323 -0.564 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.033 -9.634 -1.917 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.552 -10.715 -3.215 1.00 0.00 H new ATOM 0 HH21 ARG A 42 4.903 -10.708 -2.224 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.720 -11.316 -3.387 1.00 0.00 H new ATOM 648 N ASP A 43 -0.101 -9.750 1.449 1.00 0.00 N ATOM 649 CA ASP A 43 -0.270 -11.218 1.646 1.00 0.00 C ATOM 650 C ASP A 43 1.087 -11.920 1.539 1.00 0.00 C ATOM 651 O ASP A 43 1.892 -11.604 0.686 1.00 0.00 O ATOM 652 CB ASP A 43 -1.198 -11.666 0.516 1.00 0.00 C ATOM 653 CG ASP A 43 -2.252 -12.625 1.069 1.00 0.00 C ATOM 654 OD1 ASP A 43 -1.918 -13.395 1.954 1.00 0.00 O ATOM 655 OD2 ASP A 43 -3.377 -12.574 0.598 1.00 0.00 O ATOM 0 H ASP A 43 -0.426 -9.393 0.551 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.679 -11.461 2.627 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.681 -10.800 0.063 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.622 -12.156 -0.269 1.00 0.00 H new ATOM 660 N SER A 44 1.349 -12.866 2.400 1.00 0.00 N ATOM 661 CA SER A 44 2.656 -13.586 2.350 1.00 0.00 C ATOM 662 C SER A 44 3.082 -13.817 0.898 1.00 0.00 C ATOM 663 O SER A 44 4.016 -13.210 0.411 1.00 0.00 O ATOM 664 CB SER A 44 2.401 -14.919 3.052 1.00 0.00 C ATOM 665 OG SER A 44 1.217 -14.821 3.832 1.00 0.00 O ATOM 0 H SER A 44 0.714 -13.172 3.137 1.00 0.00 H new ATOM 0 HA SER A 44 3.456 -13.020 2.827 1.00 0.00 H new ATOM 0 HB2 SER A 44 2.300 -15.717 2.316 1.00 0.00 H new ATOM 0 HB3 SER A 44 3.248 -15.176 3.687 1.00 0.00 H new ATOM 0 HG SER A 44 1.447 -14.869 4.783 1.00 0.00 H new ATOM 735 N HIS A 49 -2.516 -17.353 1.249 1.00 0.00 N ATOM 736 CA HIS A 49 -1.609 -17.229 2.426 1.00 0.00 C ATOM 737 C HIS A 49 -2.140 -16.170 3.395 1.00 0.00 C ATOM 738 O HIS A 49 -3.140 -15.527 3.142 1.00 0.00 O ATOM 739 CB HIS A 49 -0.263 -16.795 1.843 1.00 0.00 C ATOM 740 CG HIS A 49 0.717 -17.930 1.946 1.00 0.00 C ATOM 741 ND1 HIS A 49 1.627 -18.029 2.987 1.00 0.00 N ATOM 742 CD2 HIS A 49 0.944 -19.022 1.146 1.00 0.00 C ATOM 743 CE1 HIS A 49 2.352 -19.145 2.789 1.00 0.00 C ATOM 744 NE2 HIS A 49 1.977 -19.788 1.680 1.00 0.00 N ATOM 0 HA HIS A 49 -1.530 -18.160 2.987 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -0.384 -16.499 0.801 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.114 -15.925 2.380 1.00 0.00 H new ATOM 0 HD2 HIS A 49 0.403 -19.252 0.240 1.00 0.00 H new ATOM 0 HE1 HIS A 49 3.141 -19.480 3.446 1.00 0.00 H new ATOM 0 HE2 HIS A 49 2.364 -20.654 1.305 1.00 0.00 H new ATOM 752 N PHE A 50 -1.478 -15.983 4.504 1.00 0.00 N ATOM 753 CA PHE A 50 -1.946 -14.964 5.489 1.00 0.00 C ATOM 754 C PHE A 50 -1.516 -13.564 5.045 1.00 0.00 C ATOM 755 O PHE A 50 -0.717 -13.408 4.143 1.00 0.00 O ATOM 756 CB PHE A 50 -1.264 -15.344 6.804 1.00 0.00 C ATOM 757 CG PHE A 50 0.226 -15.130 6.679 1.00 0.00 C ATOM 758 CD1 PHE A 50 0.749 -13.832 6.685 1.00 0.00 C ATOM 759 CD2 PHE A 50 1.082 -16.231 6.559 1.00 0.00 C ATOM 760 CE1 PHE A 50 2.130 -13.634 6.569 1.00 0.00 C ATOM 761 CE2 PHE A 50 2.464 -16.032 6.444 1.00 0.00 C ATOM 762 CZ PHE A 50 2.987 -14.734 6.448 1.00 0.00 C ATOM 0 H PHE A 50 -0.634 -16.490 4.771 1.00 0.00 H new ATOM 0 HA PHE A 50 -3.032 -14.947 5.583 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -1.662 -14.740 7.620 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.473 -16.386 7.047 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.088 -12.983 6.779 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.678 -17.232 6.555 1.00 0.00 H new ATOM 0 HE1 PHE A 50 2.534 -12.632 6.573 1.00 0.00 H new ATOM 0 HE2 PHE A 50 3.126 -16.880 6.352 1.00 0.00 H new ATOM 0 HZ PHE A 50 4.052 -14.581 6.358 1.00 0.00 H new ATOM 772 N PHE A 51 -2.038 -12.545 5.671 1.00 0.00 N ATOM 773 CA PHE A 51 -1.656 -11.159 5.278 1.00 0.00 C ATOM 774 C PHE A 51 -1.092 -10.399 6.482 1.00 0.00 C ATOM 775 O PHE A 51 -1.591 -10.499 7.585 1.00 0.00 O ATOM 776 CB PHE A 51 -2.952 -10.511 4.798 1.00 0.00 C ATOM 777 CG PHE A 51 -4.062 -10.844 5.762 1.00 0.00 C ATOM 778 CD1 PHE A 51 -4.119 -10.212 7.010 1.00 0.00 C ATOM 779 CD2 PHE A 51 -5.034 -11.787 5.408 1.00 0.00 C ATOM 780 CE1 PHE A 51 -5.151 -10.523 7.903 1.00 0.00 C ATOM 781 CE2 PHE A 51 -6.065 -12.096 6.300 1.00 0.00 C ATOM 782 CZ PHE A 51 -6.125 -11.466 7.546 1.00 0.00 C ATOM 0 H PHE A 51 -2.710 -12.612 6.435 1.00 0.00 H new ATOM 0 HA PHE A 51 -0.884 -11.149 4.508 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -2.828 -9.430 4.728 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.203 -10.868 3.799 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.368 -9.486 7.283 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.987 -12.276 4.446 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.197 -10.037 8.866 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.816 -12.822 6.026 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.922 -11.706 8.234 1.00 0.00 H new ATOM 792 N THR A 52 -0.059 -9.638 6.268 1.00 0.00 N ATOM 793 CA THR A 52 0.548 -8.856 7.383 1.00 0.00 C ATOM 794 C THR A 52 0.680 -7.387 6.977 1.00 0.00 C ATOM 795 O THR A 52 0.780 -7.067 5.809 1.00 0.00 O ATOM 796 CB THR A 52 1.927 -9.478 7.602 1.00 0.00 C ATOM 797 OG1 THR A 52 2.605 -8.771 8.633 1.00 0.00 O ATOM 798 CG2 THR A 52 2.739 -9.396 6.309 1.00 0.00 C ATOM 0 H THR A 52 0.396 -9.522 5.363 1.00 0.00 H new ATOM 0 HA THR A 52 -0.057 -8.886 8.289 1.00 0.00 H new ATOM 0 HB THR A 52 1.812 -10.523 7.890 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.957 -8.468 9.303 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.722 -9.840 6.468 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.220 -9.937 5.518 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.855 -8.352 6.018 1.00 0.00 H new ATOM 806 N LEU A 53 0.698 -6.488 7.923 1.00 0.00 N ATOM 807 CA LEU A 53 0.843 -5.050 7.561 1.00 0.00 C ATOM 808 C LEU A 53 1.778 -4.344 8.542 1.00 0.00 C ATOM 809 O LEU A 53 1.894 -4.719 9.693 1.00 0.00 O ATOM 810 CB LEU A 53 -0.563 -4.456 7.634 1.00 0.00 C ATOM 811 CG LEU A 53 -1.049 -4.430 9.081 1.00 0.00 C ATOM 812 CD1 LEU A 53 -0.425 -3.239 9.811 1.00 0.00 C ATOM 813 CD2 LEU A 53 -2.573 -4.290 9.092 1.00 0.00 C ATOM 0 H LEU A 53 0.619 -6.684 8.921 1.00 0.00 H new ATOM 0 HA LEU A 53 1.275 -4.928 6.568 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.561 -3.446 7.225 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.247 -5.045 7.023 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.757 -5.353 9.582 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.773 -3.222 10.844 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.661 -3.331 9.796 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.718 -2.314 9.314 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.929 -4.271 10.122 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.857 -3.364 8.592 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.020 -5.136 8.569 1.00 0.00 H new ATOM 825 N SER A 54 2.446 -3.323 8.088 1.00 0.00 N ATOM 826 CA SER A 54 3.382 -2.581 8.981 1.00 0.00 C ATOM 827 C SER A 54 3.266 -1.074 8.736 1.00 0.00 C ATOM 828 O SER A 54 2.892 -0.638 7.665 1.00 0.00 O ATOM 829 CB SER A 54 4.775 -3.082 8.602 1.00 0.00 C ATOM 830 OG SER A 54 5.429 -2.097 7.812 1.00 0.00 O ATOM 0 H SER A 54 2.385 -2.967 7.134 1.00 0.00 H new ATOM 0 HA SER A 54 3.164 -2.747 10.036 1.00 0.00 H new ATOM 0 HB2 SER A 54 5.356 -3.289 9.500 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.699 -4.018 8.048 1.00 0.00 H new ATOM 0 HG SER A 54 5.998 -1.542 8.386 1.00 0.00 H new ATOM 836 N VAL A 55 3.581 -0.278 9.719 1.00 0.00 N ATOM 837 CA VAL A 55 3.487 1.200 9.543 1.00 0.00 C ATOM 838 C VAL A 55 4.795 1.871 9.971 1.00 0.00 C ATOM 839 O VAL A 55 5.689 1.236 10.492 1.00 0.00 O ATOM 840 CB VAL A 55 2.337 1.635 10.453 1.00 0.00 C ATOM 841 CG1 VAL A 55 2.736 1.425 11.916 1.00 0.00 C ATOM 842 CG2 VAL A 55 2.033 3.115 10.217 1.00 0.00 C ATOM 0 H VAL A 55 3.900 -0.586 10.638 1.00 0.00 H new ATOM 0 HA VAL A 55 3.314 1.481 8.504 1.00 0.00 H new ATOM 0 HB VAL A 55 1.451 1.040 10.228 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.917 1.735 12.565 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.954 0.371 12.086 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.621 2.020 12.141 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.214 3.426 10.865 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.919 3.709 10.442 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.749 3.267 9.175 1.00 0.00 H new ATOM 852 N LYS A 56 4.913 3.153 9.752 1.00 0.00 N ATOM 853 CA LYS A 56 6.162 3.866 10.145 1.00 0.00 C ATOM 854 C LYS A 56 5.858 4.920 11.212 1.00 0.00 C ATOM 855 O LYS A 56 4.864 5.614 11.147 1.00 0.00 O ATOM 856 CB LYS A 56 6.658 4.534 8.862 1.00 0.00 C ATOM 857 CG LYS A 56 8.150 4.847 8.993 1.00 0.00 C ATOM 858 CD LYS A 56 8.425 6.255 8.461 1.00 0.00 C ATOM 859 CE LYS A 56 9.930 6.438 8.252 1.00 0.00 C ATOM 860 NZ LYS A 56 10.548 6.057 9.552 1.00 0.00 N ATOM 0 H LYS A 56 4.198 3.737 9.318 1.00 0.00 H new ATOM 0 HA LYS A 56 6.905 3.190 10.568 1.00 0.00 H new ATOM 0 HB2 LYS A 56 6.487 3.878 8.008 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.098 5.451 8.677 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.457 4.775 10.036 1.00 0.00 H new ATOM 0 HG3 LYS A 56 8.736 4.116 8.436 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.895 6.410 7.521 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.052 7.000 9.164 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.296 5.808 7.441 1.00 0.00 H new ATOM 0 HE3 LYS A 56 10.170 7.468 7.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 11.476 6.518 9.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 9.931 6.362 10.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 10.669 5.025 9.589 1.00 0.00 H new ATOM 874 N THR A 57 6.708 5.044 12.195 1.00 0.00 N ATOM 875 CA THR A 57 6.465 6.054 13.266 1.00 0.00 C ATOM 876 C THR A 57 7.796 6.620 13.769 1.00 0.00 C ATOM 877 O THR A 57 8.843 6.359 13.213 1.00 0.00 O ATOM 878 CB THR A 57 5.753 5.287 14.379 1.00 0.00 C ATOM 879 OG1 THR A 57 6.096 3.910 14.298 1.00 0.00 O ATOM 880 CG2 THR A 57 4.240 5.449 14.226 1.00 0.00 C ATOM 0 H THR A 57 7.558 4.491 12.303 1.00 0.00 H new ATOM 0 HA THR A 57 5.874 6.899 12.912 1.00 0.00 H new ATOM 0 HB THR A 57 6.061 5.681 15.347 1.00 0.00 H new ATOM 0 HG1 THR A 57 5.284 3.378 14.161 1.00 0.00 H new ATOM 0 HG21 THR A 57 3.733 4.901 15.021 1.00 0.00 H new ATOM 0 HG22 THR A 57 3.979 6.505 14.290 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.928 5.056 13.258 1.00 0.00 H new ATOM 888 N GLN A 58 7.762 7.394 14.820 1.00 0.00 N ATOM 889 CA GLN A 58 9.025 7.976 15.358 1.00 0.00 C ATOM 890 C GLN A 58 9.778 6.930 16.185 1.00 0.00 C ATOM 891 O GLN A 58 9.989 7.097 17.370 1.00 0.00 O ATOM 892 CB GLN A 58 8.577 9.140 16.244 1.00 0.00 C ATOM 893 CG GLN A 58 9.304 10.417 15.815 1.00 0.00 C ATOM 894 CD GLN A 58 8.848 11.582 16.696 1.00 0.00 C ATOM 895 OE1 GLN A 58 8.245 11.378 17.731 1.00 0.00 O ATOM 896 NE2 GLN A 58 9.112 12.806 16.326 1.00 0.00 N ATOM 0 H GLN A 58 6.915 7.648 15.329 1.00 0.00 H new ATOM 0 HA GLN A 58 9.701 8.302 14.567 1.00 0.00 H new ATOM 0 HB2 GLN A 58 7.499 9.278 16.164 1.00 0.00 H new ATOM 0 HB3 GLN A 58 8.793 8.919 17.289 1.00 0.00 H new ATOM 0 HG2 GLN A 58 10.382 10.281 15.902 1.00 0.00 H new ATOM 0 HG3 GLN A 58 9.093 10.634 14.768 1.00 0.00 H new ATOM 0 HE21 GLN A 58 9.618 12.978 15.457 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.812 13.590 16.906 1.00 0.00 H new ATOM 905 N SER A 59 10.187 5.856 15.568 1.00 0.00 N ATOM 906 CA SER A 59 10.927 4.801 16.320 1.00 0.00 C ATOM 907 C SER A 59 11.395 3.700 15.365 1.00 0.00 C ATOM 908 O SER A 59 12.434 3.099 15.557 1.00 0.00 O ATOM 909 CB SER A 59 9.917 4.248 17.324 1.00 0.00 C ATOM 910 OG SER A 59 9.061 3.323 16.668 1.00 0.00 O ATOM 0 H SER A 59 10.042 5.662 14.577 1.00 0.00 H new ATOM 0 HA SER A 59 11.817 5.192 16.812 1.00 0.00 H new ATOM 0 HB2 SER A 59 10.437 3.759 18.148 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.332 5.061 17.754 1.00 0.00 H new ATOM 0 HG SER A 59 8.413 2.965 17.310 1.00 0.00 H new ATOM 916 N GLY A 60 10.637 3.429 14.338 1.00 0.00 N ATOM 917 CA GLY A 60 11.040 2.367 13.373 1.00 0.00 C ATOM 918 C GLY A 60 9.793 1.643 12.860 1.00 0.00 C ATOM 919 O GLY A 60 8.906 1.303 13.617 1.00 0.00 O ATOM 0 H GLY A 60 9.756 3.897 14.125 1.00 0.00 H new ATOM 0 HA2 GLY A 60 11.587 2.807 12.539 1.00 0.00 H new ATOM 0 HA3 GLY A 60 11.712 1.658 13.856 1.00 0.00 H new ATOM 923 N THR A 61 9.719 1.404 11.579 1.00 0.00 N ATOM 924 CA THR A 61 8.528 0.703 11.019 1.00 0.00 C ATOM 925 C THR A 61 8.638 -0.806 11.264 1.00 0.00 C ATOM 926 O THR A 61 9.614 -1.433 10.902 1.00 0.00 O ATOM 927 CB THR A 61 8.556 1.007 9.521 1.00 0.00 C ATOM 928 OG1 THR A 61 7.559 0.237 8.864 1.00 0.00 O ATOM 929 CG2 THR A 61 9.932 0.656 8.952 1.00 0.00 C ATOM 0 H THR A 61 10.431 1.663 10.896 1.00 0.00 H new ATOM 0 HA THR A 61 7.599 1.033 11.484 1.00 0.00 H new ATOM 0 HB THR A 61 8.360 2.067 9.362 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.686 0.668 8.976 1.00 0.00 H new ATOM 0 HG21 THR A 61 9.950 0.873 7.884 1.00 0.00 H new ATOM 0 HG22 THR A 61 10.696 1.248 9.456 1.00 0.00 H new ATOM 0 HG23 THR A 61 10.132 -0.404 9.110 1.00 0.00 H new ATOM 937 N LYS A 62 7.645 -1.390 11.875 1.00 0.00 N ATOM 938 CA LYS A 62 7.693 -2.857 12.142 1.00 0.00 C ATOM 939 C LYS A 62 6.467 -3.545 11.534 1.00 0.00 C ATOM 940 O LYS A 62 5.373 -3.018 11.556 1.00 0.00 O ATOM 941 CB LYS A 62 7.679 -2.983 13.665 1.00 0.00 C ATOM 942 CG LYS A 62 8.841 -2.181 14.255 1.00 0.00 C ATOM 943 CD LYS A 62 10.164 -2.861 13.896 1.00 0.00 C ATOM 944 CE LYS A 62 11.264 -1.804 13.771 1.00 0.00 C ATOM 945 NZ LYS A 62 12.107 -2.261 12.631 1.00 0.00 N ATOM 0 H LYS A 62 6.803 -0.916 12.201 1.00 0.00 H new ATOM 0 HA LYS A 62 8.572 -3.329 11.703 1.00 0.00 H new ATOM 0 HB2 LYS A 62 6.732 -2.617 14.062 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.762 -4.031 13.955 1.00 0.00 H new ATOM 0 HG2 LYS A 62 8.827 -1.162 13.868 1.00 0.00 H new ATOM 0 HG3 LYS A 62 8.737 -2.113 15.338 1.00 0.00 H new ATOM 0 HD2 LYS A 62 10.430 -3.589 14.662 1.00 0.00 H new ATOM 0 HD3 LYS A 62 10.062 -3.407 12.958 1.00 0.00 H new ATOM 0 HE2 LYS A 62 10.843 -0.817 13.580 1.00 0.00 H new ATOM 0 HE3 LYS A 62 11.847 -1.730 14.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.981 -1.699 12.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.346 -3.265 12.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 11.583 -2.138 11.741 1.00 0.00 H new ATOM 959 N ASN A 63 6.643 -4.719 10.993 1.00 0.00 N ATOM 960 CA ASN A 63 5.487 -5.441 10.384 1.00 0.00 C ATOM 961 C ASN A 63 5.223 -6.744 11.142 1.00 0.00 C ATOM 962 O ASN A 63 6.136 -7.450 11.515 1.00 0.00 O ATOM 963 CB ASN A 63 5.918 -5.736 8.946 1.00 0.00 C ATOM 964 CG ASN A 63 6.960 -6.856 8.943 1.00 0.00 C ATOM 965 OD1 ASN A 63 6.637 -8.002 8.702 1.00 0.00 O ATOM 966 ND2 ASN A 63 8.207 -6.571 9.202 1.00 0.00 N ATOM 0 H ASN A 63 7.536 -5.210 10.946 1.00 0.00 H new ATOM 0 HA ASN A 63 4.567 -4.857 10.422 1.00 0.00 H new ATOM 0 HB2 ASN A 63 5.054 -6.028 8.349 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.333 -4.838 8.488 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.910 -7.310 9.202 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.479 -5.609 9.404 1.00 0.00 H new ATOM 973 N LEU A 64 3.981 -7.069 11.372 1.00 0.00 N ATOM 974 CA LEU A 64 3.670 -8.328 12.109 1.00 0.00 C ATOM 975 C LEU A 64 2.586 -9.122 11.376 1.00 0.00 C ATOM 976 O LEU A 64 1.559 -8.591 11.004 1.00 0.00 O ATOM 977 CB LEU A 64 3.168 -7.871 13.478 1.00 0.00 C ATOM 978 CG LEU A 64 4.361 -7.508 14.364 1.00 0.00 C ATOM 979 CD1 LEU A 64 4.162 -6.107 14.944 1.00 0.00 C ATOM 980 CD2 LEU A 64 4.472 -8.521 15.506 1.00 0.00 C ATOM 0 H LEU A 64 3.171 -6.521 11.083 1.00 0.00 H new ATOM 0 HA LEU A 64 4.538 -8.982 12.190 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.509 -7.010 13.367 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.582 -8.663 13.945 1.00 0.00 H new ATOM 0 HG LEU A 64 5.274 -7.526 13.769 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.013 -5.850 15.575 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.082 -5.385 14.131 1.00 0.00 H new ATOM 0 HD13 LEU A 64 3.249 -6.086 15.540 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.322 -8.264 16.139 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.558 -8.501 16.100 1.00 0.00 H new ATOM 0 HD23 LEU A 64 4.615 -9.520 15.094 1.00 0.00 H new ATOM 992 N ARG A 65 2.808 -10.391 11.168 1.00 0.00 N ATOM 993 CA ARG A 65 1.790 -11.220 10.461 1.00 0.00 C ATOM 994 C ARG A 65 0.910 -11.951 11.479 1.00 0.00 C ATOM 995 O ARG A 65 1.300 -12.166 12.608 1.00 0.00 O ATOM 996 CB ARG A 65 2.597 -12.222 9.633 1.00 0.00 C ATOM 997 CG ARG A 65 3.753 -11.500 8.938 1.00 0.00 C ATOM 998 CD ARG A 65 5.083 -12.084 9.417 1.00 0.00 C ATOM 999 NE ARG A 65 5.463 -13.079 8.376 1.00 0.00 N ATOM 1000 CZ ARG A 65 6.698 -13.495 8.288 1.00 0.00 C ATOM 1001 NH1 ARG A 65 7.603 -13.037 9.110 1.00 0.00 N ATOM 1002 NH2 ARG A 65 7.029 -14.368 7.376 1.00 0.00 N ATOM 0 H ARG A 65 3.650 -10.890 11.457 1.00 0.00 H new ATOM 0 HA ARG A 65 1.127 -10.619 9.838 1.00 0.00 H new ATOM 0 HB2 ARG A 65 2.983 -13.013 10.276 1.00 0.00 H new ATOM 0 HB3 ARG A 65 1.954 -12.698 8.892 1.00 0.00 H new ATOM 0 HG2 ARG A 65 3.665 -11.608 7.857 1.00 0.00 H new ATOM 0 HG3 ARG A 65 3.713 -10.433 9.156 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.842 -11.308 9.517 1.00 0.00 H new ATOM 0 HD3 ARG A 65 4.978 -12.555 10.394 1.00 0.00 H new ATOM 0 HE ARG A 65 4.758 -13.436 7.731 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.346 -12.353 9.822 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.567 -13.363 9.040 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.323 -14.725 6.732 1.00 0.00 H new ATOM 0 HH22 ARG A 65 7.993 -14.693 7.307 1.00 0.00 H new ATOM 1016 N ILE A 66 -0.274 -12.336 11.087 1.00 0.00 N ATOM 1017 CA ILE A 66 -1.174 -13.054 12.034 1.00 0.00 C ATOM 1018 C ILE A 66 -1.136 -14.559 11.759 1.00 0.00 C ATOM 1019 O ILE A 66 -1.172 -14.994 10.625 1.00 0.00 O ATOM 1020 CB ILE A 66 -2.568 -12.491 11.760 1.00 0.00 C ATOM 1021 CG1 ILE A 66 -2.531 -10.965 11.865 1.00 0.00 C ATOM 1022 CG2 ILE A 66 -3.553 -13.046 12.790 1.00 0.00 C ATOM 1023 CD1 ILE A 66 -2.034 -10.375 10.544 1.00 0.00 C ATOM 0 H ILE A 66 -0.657 -12.185 10.154 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.877 -12.915 13.074 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.886 -12.780 10.758 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.525 -10.581 12.096 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.875 -10.662 12.681 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.548 -12.645 12.595 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.580 -14.133 12.719 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.234 -12.756 13.791 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.007 -9.288 10.618 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.032 -10.749 10.333 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.708 -10.667 9.739 1.00 0.00 H new ATOM 1035 N GLN A 67 -1.061 -15.358 12.788 1.00 0.00 N ATOM 1036 CA GLN A 67 -1.017 -16.835 12.584 1.00 0.00 C ATOM 1037 C GLN A 67 -2.209 -17.502 13.276 1.00 0.00 C ATOM 1038 O GLN A 67 -2.718 -17.013 14.266 1.00 0.00 O ATOM 1039 CB GLN A 67 0.296 -17.283 13.226 1.00 0.00 C ATOM 1040 CG GLN A 67 1.468 -16.612 12.507 1.00 0.00 C ATOM 1041 CD GLN A 67 2.785 -17.201 13.016 1.00 0.00 C ATOM 1042 OE1 GLN A 67 3.320 -16.757 14.012 1.00 0.00 O ATOM 1043 NE2 GLN A 67 3.335 -18.191 12.366 1.00 0.00 N ATOM 0 H GLN A 67 -1.028 -15.053 13.761 1.00 0.00 H new ATOM 0 HA GLN A 67 -1.070 -17.108 11.530 1.00 0.00 H new ATOM 0 HB2 GLN A 67 0.305 -17.020 14.284 1.00 0.00 H new ATOM 0 HB3 GLN A 67 0.391 -18.367 13.167 1.00 0.00 H new ATOM 0 HG2 GLN A 67 1.382 -16.762 11.431 1.00 0.00 H new ATOM 0 HG3 GLN A 67 1.447 -15.536 12.681 1.00 0.00 H new ATOM 0 HE21 GLN A 67 2.886 -18.564 11.530 1.00 0.00 H new ATOM 0 HE22 GLN A 67 4.214 -18.591 12.695 1.00 0.00 H new ATOM 1052 N CYS A 68 -2.658 -18.613 12.763 1.00 0.00 N ATOM 1053 CA CYS A 68 -3.817 -19.311 13.391 1.00 0.00 C ATOM 1054 C CYS A 68 -3.330 -20.270 14.481 1.00 0.00 C ATOM 1055 O CYS A 68 -2.436 -21.065 14.269 1.00 0.00 O ATOM 1056 CB CYS A 68 -4.479 -20.086 12.250 1.00 0.00 C ATOM 1057 SG CYS A 68 -3.406 -21.455 11.748 1.00 0.00 S ATOM 0 H CYS A 68 -2.273 -19.069 11.936 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.509 -18.616 13.867 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -5.448 -20.468 12.570 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -4.661 -19.424 11.404 1.00 0.00 H new ATOM 0 HG CYS A 68 -2.652 -21.804 12.748 1.00 0.00 H new ATOM 1063 N GLU A 69 -3.912 -20.200 15.648 1.00 0.00 N ATOM 1064 CA GLU A 69 -3.481 -21.108 16.751 1.00 0.00 C ATOM 1065 C GLU A 69 -4.641 -22.017 17.165 1.00 0.00 C ATOM 1066 O GLU A 69 -5.711 -21.557 17.510 1.00 0.00 O ATOM 1067 CB GLU A 69 -3.090 -20.179 17.900 1.00 0.00 C ATOM 1068 CG GLU A 69 -1.705 -20.567 18.421 1.00 0.00 C ATOM 1069 CD GLU A 69 -1.781 -20.837 19.925 1.00 0.00 C ATOM 1070 OE1 GLU A 69 -1.839 -19.877 20.676 1.00 0.00 O ATOM 1071 OE2 GLU A 69 -1.782 -21.997 20.299 1.00 0.00 O ATOM 0 H GLU A 69 -4.666 -19.555 15.885 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.656 -21.757 16.456 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.085 -19.144 17.559 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.824 -20.247 18.703 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.344 -21.454 17.900 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.992 -19.767 18.220 1.00 0.00 H new ATOM 1078 N GLY A 70 -4.436 -23.305 17.134 1.00 0.00 N ATOM 1079 CA GLY A 70 -5.528 -24.242 17.524 1.00 0.00 C ATOM 1080 C GLY A 70 -6.677 -24.132 16.521 1.00 0.00 C ATOM 1081 O GLY A 70 -6.871 -24.994 15.688 1.00 0.00 O ATOM 0 H GLY A 70 -3.561 -23.749 16.856 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -5.152 -25.265 17.551 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -5.883 -24.006 18.527 1.00 0.00 H new ATOM 1085 N GLY A 71 -7.439 -23.076 16.594 1.00 0.00 N ATOM 1086 CA GLY A 71 -8.576 -22.910 15.644 1.00 0.00 C ATOM 1087 C GLY A 71 -8.962 -21.433 15.562 1.00 0.00 C ATOM 1088 O GLY A 71 -10.061 -21.089 15.171 1.00 0.00 O ATOM 0 H GLY A 71 -7.324 -22.321 17.270 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.296 -23.279 14.657 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -9.429 -23.502 15.975 1.00 0.00 H new ATOM 1092 N SER A 72 -8.070 -20.556 15.929 1.00 0.00 N ATOM 1093 CA SER A 72 -8.384 -19.101 15.875 1.00 0.00 C ATOM 1094 C SER A 72 -7.225 -18.333 15.234 1.00 0.00 C ATOM 1095 O SER A 72 -6.124 -18.834 15.122 1.00 0.00 O ATOM 1096 CB SER A 72 -8.566 -18.683 17.332 1.00 0.00 C ATOM 1097 OG SER A 72 -7.446 -19.123 18.089 1.00 0.00 O ATOM 0 H SER A 72 -7.134 -20.785 16.265 1.00 0.00 H new ATOM 0 HA SER A 72 -9.271 -18.890 15.277 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.664 -17.600 17.402 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.483 -19.113 17.734 1.00 0.00 H new ATOM 0 HG SER A 72 -7.558 -18.855 19.025 1.00 0.00 H new ATOM 1103 N PHE A 73 -7.464 -17.122 14.812 1.00 0.00 N ATOM 1104 CA PHE A 73 -6.375 -16.324 14.177 1.00 0.00 C ATOM 1105 C PHE A 73 -5.965 -15.168 15.095 1.00 0.00 C ATOM 1106 O PHE A 73 -6.796 -14.430 15.588 1.00 0.00 O ATOM 1107 CB PHE A 73 -6.986 -15.789 12.882 1.00 0.00 C ATOM 1108 CG PHE A 73 -5.944 -15.792 11.790 1.00 0.00 C ATOM 1109 CD1 PHE A 73 -5.250 -16.969 11.486 1.00 0.00 C ATOM 1110 CD2 PHE A 73 -5.672 -14.617 11.081 1.00 0.00 C ATOM 1111 CE1 PHE A 73 -4.283 -16.969 10.474 1.00 0.00 C ATOM 1112 CE2 PHE A 73 -4.706 -14.616 10.069 1.00 0.00 C ATOM 1113 CZ PHE A 73 -4.011 -15.793 9.764 1.00 0.00 C ATOM 0 H PHE A 73 -8.366 -16.650 14.879 1.00 0.00 H new ATOM 0 HA PHE A 73 -5.479 -16.916 13.992 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -7.837 -16.404 12.588 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -7.362 -14.778 13.036 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.461 -17.877 12.032 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.209 -13.709 11.315 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.746 -17.877 10.241 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -4.496 -13.708 9.523 1.00 0.00 H new ATOM 0 HZ PHE A 73 -3.266 -15.794 8.982 1.00 0.00 H new ATOM 1123 N SER A 74 -4.691 -15.007 15.330 1.00 0.00 N ATOM 1124 CA SER A 74 -4.232 -13.901 16.220 1.00 0.00 C ATOM 1125 C SER A 74 -2.888 -13.350 15.732 1.00 0.00 C ATOM 1126 O SER A 74 -2.228 -13.943 14.902 1.00 0.00 O ATOM 1127 CB SER A 74 -4.079 -14.540 17.599 1.00 0.00 C ATOM 1128 OG SER A 74 -2.801 -15.156 17.692 1.00 0.00 O ATOM 0 H SER A 74 -3.949 -15.592 14.945 1.00 0.00 H new ATOM 0 HA SER A 74 -4.932 -13.065 16.233 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.189 -13.784 18.377 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.864 -15.279 17.759 1.00 0.00 H new ATOM 0 HG SER A 74 -2.699 -15.566 18.576 1.00 0.00 H new ATOM 1134 N LEU A 75 -2.479 -12.219 16.242 1.00 0.00 N ATOM 1135 CA LEU A 75 -1.179 -11.631 15.807 1.00 0.00 C ATOM 1136 C LEU A 75 -0.020 -12.519 16.274 1.00 0.00 C ATOM 1137 O LEU A 75 0.194 -12.707 17.455 1.00 0.00 O ATOM 1138 CB LEU A 75 -1.113 -10.262 16.487 1.00 0.00 C ATOM 1139 CG LEU A 75 -1.290 -9.162 15.438 1.00 0.00 C ATOM 1140 CD1 LEU A 75 -1.369 -7.800 16.133 1.00 0.00 C ATOM 1141 CD2 LEU A 75 -0.096 -9.174 14.481 1.00 0.00 C ATOM 0 H LEU A 75 -2.988 -11.677 16.940 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.104 -11.549 14.723 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.891 -10.184 17.247 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.157 -10.143 16.997 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.209 -9.339 14.879 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.495 -7.017 15.385 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.218 -7.789 16.817 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.450 -7.623 16.692 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -0.221 -8.391 13.733 1.00 0.00 H new ATOM 0 HD22 LEU A 75 0.822 -8.997 15.042 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.037 -10.143 13.985 1.00 0.00 H new ATOM 1384 N VAL A 91 -8.753 -11.999 12.439 1.00 0.00 N ATOM 1385 CA VAL A 91 -8.006 -10.772 12.038 1.00 0.00 C ATOM 1386 C VAL A 91 -8.940 -9.559 12.082 1.00 0.00 C ATOM 1387 O VAL A 91 -8.509 -8.440 12.272 1.00 0.00 O ATOM 1388 CB VAL A 91 -7.507 -11.037 10.611 1.00 0.00 C ATOM 1389 CG1 VAL A 91 -7.752 -9.805 9.735 1.00 0.00 C ATOM 1390 CG2 VAL A 91 -6.007 -11.335 10.654 1.00 0.00 C ATOM 0 HA VAL A 91 -7.174 -10.557 12.708 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.045 -11.887 10.192 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.395 -10.001 8.724 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.819 -9.585 9.707 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.216 -8.951 10.150 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.645 -11.524 9.644 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.478 -10.480 11.075 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.828 -12.213 11.274 1.00 0.00 H new ATOM 1400 N LEU A 92 -10.218 -9.771 11.910 1.00 0.00 N ATOM 1401 CA LEU A 92 -11.168 -8.623 11.947 1.00 0.00 C ATOM 1402 C LEU A 92 -11.042 -7.897 13.287 1.00 0.00 C ATOM 1403 O LEU A 92 -10.941 -6.688 13.342 1.00 0.00 O ATOM 1404 CB LEU A 92 -12.555 -9.249 11.799 1.00 0.00 C ATOM 1405 CG LEU A 92 -12.885 -9.415 10.314 1.00 0.00 C ATOM 1406 CD1 LEU A 92 -11.761 -10.190 9.625 1.00 0.00 C ATOM 1407 CD2 LEU A 92 -14.199 -10.184 10.168 1.00 0.00 C ATOM 0 H LEU A 92 -10.642 -10.684 11.746 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.973 -7.891 11.163 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -12.584 -10.217 12.299 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -13.303 -8.619 12.280 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.985 -8.433 9.851 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.996 -10.308 8.567 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.824 -9.642 9.730 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.660 -11.172 10.086 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.435 -10.303 9.111 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.099 -11.166 10.630 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -15.000 -9.632 10.659 1.00 0.00 H new ATOM 1419 N LYS A 93 -11.024 -8.629 14.368 1.00 0.00 N ATOM 1420 CA LYS A 93 -10.877 -7.977 15.700 1.00 0.00 C ATOM 1421 C LYS A 93 -9.478 -7.370 15.806 1.00 0.00 C ATOM 1422 O LYS A 93 -9.288 -6.296 16.341 1.00 0.00 O ATOM 1423 CB LYS A 93 -11.058 -9.102 16.719 1.00 0.00 C ATOM 1424 CG LYS A 93 -12.484 -9.066 17.273 1.00 0.00 C ATOM 1425 CD LYS A 93 -13.105 -10.460 17.180 1.00 0.00 C ATOM 1426 CE LYS A 93 -12.136 -11.491 17.762 1.00 0.00 C ATOM 1427 NZ LYS A 93 -12.934 -12.240 18.772 1.00 0.00 N ATOM 0 H LYS A 93 -11.104 -9.646 14.386 1.00 0.00 H new ATOM 0 HA LYS A 93 -11.598 -7.176 15.863 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -10.863 -10.066 16.250 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -10.339 -8.991 17.530 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -12.474 -8.730 18.310 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -13.085 -8.351 16.712 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -14.050 -10.486 17.723 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -13.328 -10.701 16.141 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -11.755 -12.156 16.987 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -11.273 -11.008 18.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -12.337 -12.967 19.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -13.278 -11.582 19.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -13.745 -12.695 18.306 1.00 0.00 H new ATOM 1441 N LEU A 94 -8.499 -8.056 15.281 1.00 0.00 N ATOM 1442 CA LEU A 94 -7.103 -7.537 15.324 1.00 0.00 C ATOM 1443 C LEU A 94 -6.981 -6.301 14.431 1.00 0.00 C ATOM 1444 O LEU A 94 -6.246 -5.380 14.724 1.00 0.00 O ATOM 1445 CB LEU A 94 -6.240 -8.675 14.780 1.00 0.00 C ATOM 1446 CG LEU A 94 -5.772 -9.559 15.935 1.00 0.00 C ATOM 1447 CD1 LEU A 94 -5.346 -10.923 15.392 1.00 0.00 C ATOM 1448 CD2 LEU A 94 -4.583 -8.896 16.634 1.00 0.00 C ATOM 0 H LEU A 94 -8.608 -8.960 14.821 1.00 0.00 H new ATOM 0 HA LEU A 94 -6.800 -7.242 16.328 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.810 -9.267 14.063 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.380 -8.270 14.247 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.587 -9.689 16.647 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.012 -11.554 16.215 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.191 -11.396 14.892 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.530 -10.793 14.681 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.248 -9.526 17.458 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.768 -8.767 15.922 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.885 -7.923 17.021 1.00 0.00 H new ATOM 1460 N VAL A 95 -7.695 -6.279 13.338 1.00 0.00 N ATOM 1461 CA VAL A 95 -7.616 -5.109 12.420 1.00 0.00 C ATOM 1462 C VAL A 95 -7.914 -3.820 13.187 1.00 0.00 C ATOM 1463 O VAL A 95 -7.307 -2.796 12.950 1.00 0.00 O ATOM 1464 CB VAL A 95 -8.687 -5.363 11.361 1.00 0.00 C ATOM 1465 CG1 VAL A 95 -8.964 -4.070 10.593 1.00 0.00 C ATOM 1466 CG2 VAL A 95 -8.195 -6.438 10.388 1.00 0.00 C ATOM 0 H VAL A 95 -8.329 -7.021 13.042 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.626 -4.995 11.977 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.603 -5.700 11.845 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.728 -4.252 9.838 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.313 -3.304 11.285 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.048 -3.731 10.108 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.958 -6.621 9.631 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -7.279 -6.099 9.905 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -7.998 -7.360 10.934 1.00 0.00 H new ATOM 1476 N HIS A 96 -8.835 -3.858 14.110 1.00 0.00 N ATOM 1477 CA HIS A 96 -9.148 -2.626 14.887 1.00 0.00 C ATOM 1478 C HIS A 96 -7.858 -2.068 15.494 1.00 0.00 C ATOM 1479 O HIS A 96 -7.664 -0.872 15.589 1.00 0.00 O ATOM 1480 CB HIS A 96 -10.110 -3.081 15.985 1.00 0.00 C ATOM 1481 CG HIS A 96 -11.370 -3.611 15.359 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -11.961 -4.794 15.776 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -12.164 -3.132 14.346 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -13.060 -4.985 15.023 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -13.230 -4.002 14.135 1.00 0.00 N ATOM 0 H HIS A 96 -9.381 -4.683 14.359 1.00 0.00 H new ATOM 0 HA HIS A 96 -9.586 -1.839 14.273 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -9.642 -3.853 16.596 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -10.343 -2.247 16.648 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -11.988 -2.219 13.797 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -13.724 -5.831 15.125 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -13.980 -3.909 13.450 1.00 0.00 H new ATOM 1493 N HIS A 97 -6.970 -2.937 15.890 1.00 0.00 N ATOM 1494 CA HIS A 97 -5.675 -2.491 16.480 1.00 0.00 C ATOM 1495 C HIS A 97 -4.723 -2.044 15.364 1.00 0.00 C ATOM 1496 O HIS A 97 -3.920 -1.149 15.536 1.00 0.00 O ATOM 1497 CB HIS A 97 -5.131 -3.719 17.223 1.00 0.00 C ATOM 1498 CG HIS A 97 -3.898 -4.246 16.535 1.00 0.00 C ATOM 1499 ND1 HIS A 97 -3.965 -4.969 15.354 1.00 0.00 N ATOM 1500 CD2 HIS A 97 -2.563 -4.170 16.852 1.00 0.00 C ATOM 1501 CE1 HIS A 97 -2.706 -5.296 15.006 1.00 0.00 C ATOM 1502 NE2 HIS A 97 -1.814 -4.835 15.886 1.00 0.00 N ATOM 0 H HIS A 97 -7.087 -3.948 15.830 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.787 -1.641 17.153 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.895 -3.453 18.253 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.894 -4.496 17.261 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.814 -5.210 14.842 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.157 -3.670 17.719 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -2.449 -5.862 14.123 1.00 0.00 H new ATOM 1510 N TYR A 98 -4.796 -2.685 14.229 1.00 0.00 N ATOM 1511 CA TYR A 98 -3.885 -2.335 13.101 1.00 0.00 C ATOM 1512 C TYR A 98 -4.100 -0.888 12.639 1.00 0.00 C ATOM 1513 O TYR A 98 -3.227 -0.290 12.042 1.00 0.00 O ATOM 1514 CB TYR A 98 -4.279 -3.297 11.982 1.00 0.00 C ATOM 1515 CG TYR A 98 -3.249 -4.391 11.849 1.00 0.00 C ATOM 1516 CD1 TYR A 98 -1.892 -4.103 12.026 1.00 0.00 C ATOM 1517 CD2 TYR A 98 -3.654 -5.695 11.538 1.00 0.00 C ATOM 1518 CE1 TYR A 98 -0.938 -5.120 11.893 1.00 0.00 C ATOM 1519 CE2 TYR A 98 -2.701 -6.712 11.402 1.00 0.00 C ATOM 1520 CZ TYR A 98 -1.343 -6.424 11.581 1.00 0.00 C ATOM 1521 OH TYR A 98 -0.403 -7.425 11.449 1.00 0.00 O ATOM 0 H TYR A 98 -5.452 -3.441 14.033 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.837 -2.417 13.389 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -5.256 -3.731 12.193 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -4.368 -2.755 11.041 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -1.580 -3.097 12.265 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.702 -5.917 11.403 1.00 0.00 H new ATOM 0 HE1 TYR A 98 0.110 -4.899 12.031 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -3.013 -7.717 11.159 1.00 0.00 H new ATOM 0 HH TYR A 98 0.453 -7.035 11.175 1.00 0.00 H new ATOM 1531 N MET A 99 -5.241 -0.316 12.907 1.00 0.00 N ATOM 1532 CA MET A 99 -5.468 1.095 12.467 1.00 0.00 C ATOM 1533 C MET A 99 -6.884 1.575 12.819 1.00 0.00 C ATOM 1534 O MET A 99 -7.044 2.574 13.490 1.00 0.00 O ATOM 1535 CB MET A 99 -5.267 1.073 10.949 1.00 0.00 C ATOM 1536 CG MET A 99 -5.864 2.340 10.329 1.00 0.00 C ATOM 1537 SD MET A 99 -7.073 1.881 9.063 1.00 0.00 S ATOM 1538 CE MET A 99 -8.181 3.295 9.285 1.00 0.00 C ATOM 0 H MET A 99 -6.017 -0.754 13.404 1.00 0.00 H new ATOM 0 HA MET A 99 -4.786 1.784 12.966 1.00 0.00 H new ATOM 0 HB2 MET A 99 -4.205 1.008 10.714 1.00 0.00 H new ATOM 0 HB3 MET A 99 -5.742 0.190 10.523 1.00 0.00 H new ATOM 0 HG2 MET A 99 -6.341 2.945 11.100 1.00 0.00 H new ATOM 0 HG3 MET A 99 -5.074 2.949 9.889 1.00 0.00 H new ATOM 0 HE1 MET A 99 -9.016 3.215 8.589 1.00 0.00 H new ATOM 0 HE2 MET A 99 -8.560 3.304 10.307 1.00 0.00 H new ATOM 0 HE3 MET A 99 -7.635 4.219 9.092 1.00 0.00 H new ATOM 2022 N ARG A 134 -8.202 -1.592 20.737 1.00 0.00 N ATOM 2023 CA ARG A 134 -7.318 -1.118 19.633 1.00 0.00 C ATOM 2024 C ARG A 134 -6.070 -0.445 20.209 1.00 0.00 C ATOM 2025 O ARG A 134 -6.121 0.211 21.230 1.00 0.00 O ATOM 2026 CB ARG A 134 -8.159 -0.104 18.856 1.00 0.00 C ATOM 2027 CG ARG A 134 -7.265 0.655 17.873 1.00 0.00 C ATOM 2028 CD ARG A 134 -6.756 1.941 18.528 1.00 0.00 C ATOM 2029 NE ARG A 134 -7.975 2.620 19.046 1.00 0.00 N ATOM 2030 CZ ARG A 134 -7.868 3.547 19.960 1.00 0.00 C ATOM 2031 NH1 ARG A 134 -6.693 3.880 20.420 1.00 0.00 N ATOM 2032 NH2 ARG A 134 -8.938 4.141 20.414 1.00 0.00 N ATOM 0 HA ARG A 134 -6.977 -1.936 18.999 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.958 -0.614 18.318 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -8.634 0.594 19.545 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -6.424 0.030 17.574 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -7.823 0.893 16.967 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.054 1.723 19.333 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -6.231 2.569 17.808 1.00 0.00 H new ATOM 0 HE ARG A 134 -8.894 2.361 18.687 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -5.856 3.416 20.066 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -6.611 4.604 21.134 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -9.857 3.881 20.055 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -8.855 4.865 21.128 1.00 0.00 H new ATOM 2046 N ALA A 135 -4.947 -0.601 19.560 1.00 0.00 N ATOM 2047 CA ALA A 135 -3.697 0.033 20.070 1.00 0.00 C ATOM 2048 C ALA A 135 -2.488 -0.544 19.340 1.00 0.00 C ATOM 2049 O ALA A 135 -2.127 -1.687 19.534 1.00 0.00 O ATOM 2050 CB ALA A 135 -3.635 -0.326 21.559 1.00 0.00 C ATOM 0 H ALA A 135 -4.841 -1.139 18.700 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.692 1.112 19.913 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -2.738 0.108 22.001 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -4.516 0.068 22.065 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -3.606 -1.410 21.671 1.00 0.00 H new ATOM 2056 N TYR A 136 -1.850 0.226 18.505 1.00 0.00 N ATOM 2057 CA TYR A 136 -0.663 -0.315 17.795 1.00 0.00 C ATOM 2058 C TYR A 136 0.589 0.435 18.244 1.00 0.00 C ATOM 2059 O TYR A 136 0.700 1.630 18.079 1.00 0.00 O ATOM 2060 CB TYR A 136 -0.951 -0.034 16.318 1.00 0.00 C ATOM 2061 CG TYR A 136 -0.270 -1.064 15.453 1.00 0.00 C ATOM 2062 CD1 TYR A 136 -0.930 -2.256 15.138 1.00 0.00 C ATOM 2063 CD2 TYR A 136 1.018 -0.823 14.960 1.00 0.00 C ATOM 2064 CE1 TYR A 136 -0.301 -3.211 14.331 1.00 0.00 C ATOM 2065 CE2 TYR A 136 1.647 -1.777 14.152 1.00 0.00 C ATOM 2066 CZ TYR A 136 0.989 -2.971 13.838 1.00 0.00 C ATOM 2067 OH TYR A 136 1.611 -3.912 13.043 1.00 0.00 O ATOM 0 H TYR A 136 -2.095 1.192 18.287 1.00 0.00 H new ATOM 0 HA TYR A 136 -0.492 -1.374 17.991 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.026 -0.051 16.139 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -0.600 0.964 16.054 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -1.924 -2.440 15.517 1.00 0.00 H new ATOM 0 HD2 TYR A 136 1.526 0.099 15.203 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -0.809 -4.132 14.088 1.00 0.00 H new ATOM 0 HE2 TYR A 136 2.640 -1.591 13.771 1.00 0.00 H new ATOM 0 HH TYR A 136 1.531 -3.650 12.102 1.00 0.00 H new ATOM 2077 N TYR A 137 1.545 -0.256 18.788 1.00 0.00 N ATOM 2078 CA TYR A 137 2.790 0.428 19.221 1.00 0.00 C ATOM 2079 C TYR A 137 3.940 -0.574 19.288 1.00 0.00 C ATOM 2080 O TYR A 137 3.737 -1.768 19.212 1.00 0.00 O ATOM 2081 CB TYR A 137 2.454 1.067 20.567 1.00 0.00 C ATOM 2082 CG TYR A 137 2.634 0.108 21.708 1.00 0.00 C ATOM 2083 CD1 TYR A 137 3.909 -0.195 22.191 1.00 0.00 C ATOM 2084 CD2 TYR A 137 1.505 -0.448 22.305 1.00 0.00 C ATOM 2085 CE1 TYR A 137 4.051 -1.065 23.276 1.00 0.00 C ATOM 2086 CE2 TYR A 137 1.638 -1.320 23.385 1.00 0.00 C ATOM 2087 CZ TYR A 137 2.914 -1.632 23.875 1.00 0.00 C ATOM 2088 OH TYR A 137 3.051 -2.490 24.947 1.00 0.00 O ATOM 0 H TYR A 137 1.519 -1.262 18.952 1.00 0.00 H new ATOM 0 HA TYR A 137 3.126 1.196 18.524 1.00 0.00 H new ATOM 0 HB2 TYR A 137 3.090 1.939 20.723 1.00 0.00 H new ATOM 0 HB3 TYR A 137 1.424 1.423 20.552 1.00 0.00 H new ATOM 0 HD1 TYR A 137 4.782 0.241 21.728 1.00 0.00 H new ATOM 0 HD2 TYR A 137 0.522 -0.203 21.930 1.00 0.00 H new ATOM 0 HE1 TYR A 137 5.035 -1.301 23.654 1.00 0.00 H new ATOM 0 HE2 TYR A 137 0.761 -1.754 23.842 1.00 0.00 H new ATOM 0 HH TYR A 137 3.591 -3.263 24.680 1.00 0.00 H new ATOM 2098 N ILE A 138 5.147 -0.109 19.395 1.00 0.00 N ATOM 2099 CA ILE A 138 6.294 -1.061 19.421 1.00 0.00 C ATOM 2100 C ILE A 138 7.081 -0.953 20.723 1.00 0.00 C ATOM 2101 O ILE A 138 7.200 0.103 21.310 1.00 0.00 O ATOM 2102 CB ILE A 138 7.168 -0.649 18.237 1.00 0.00 C ATOM 2103 CG1 ILE A 138 6.487 -1.068 16.932 1.00 0.00 C ATOM 2104 CG2 ILE A 138 8.530 -1.337 18.344 1.00 0.00 C ATOM 2105 CD1 ILE A 138 6.074 0.178 16.147 1.00 0.00 C ATOM 0 H ILE A 138 5.393 0.878 19.465 1.00 0.00 H new ATOM 0 HA ILE A 138 5.957 -2.096 19.356 1.00 0.00 H new ATOM 0 HB ILE A 138 7.306 0.432 18.246 1.00 0.00 H new ATOM 0 HG12 ILE A 138 7.165 -1.678 16.335 1.00 0.00 H new ATOM 0 HG13 ILE A 138 5.612 -1.682 17.147 1.00 0.00 H new ATOM 0 HG21 ILE A 138 9.153 -1.043 17.500 1.00 0.00 H new ATOM 0 HG22 ILE A 138 9.015 -1.040 19.274 1.00 0.00 H new ATOM 0 HG23 ILE A 138 8.393 -2.418 18.335 1.00 0.00 H new ATOM 0 HD11 ILE A 138 5.589 -0.121 15.218 1.00 0.00 H new ATOM 0 HD12 ILE A 138 5.380 0.771 16.744 1.00 0.00 H new ATOM 0 HD13 ILE A 138 6.958 0.774 15.919 1.00 0.00 H new ATOM 2117 N TYR A 139 7.626 -2.049 21.169 1.00 0.00 N ATOM 2118 CA TYR A 139 8.419 -2.024 22.431 1.00 0.00 C ATOM 2119 C TYR A 139 9.858 -1.599 22.128 1.00 0.00 C ATOM 2120 O TYR A 139 10.629 -2.344 21.557 1.00 0.00 O ATOM 2121 CB TYR A 139 8.396 -3.460 22.966 1.00 0.00 C ATOM 2122 CG TYR A 139 7.015 -4.051 22.815 1.00 0.00 C ATOM 2123 CD1 TYR A 139 5.908 -3.215 22.638 1.00 0.00 C ATOM 2124 CD2 TYR A 139 6.843 -5.439 22.851 1.00 0.00 C ATOM 2125 CE1 TYR A 139 4.628 -3.767 22.495 1.00 0.00 C ATOM 2126 CE2 TYR A 139 5.566 -5.993 22.709 1.00 0.00 C ATOM 2127 CZ TYR A 139 4.458 -5.156 22.530 1.00 0.00 C ATOM 2128 OH TYR A 139 3.197 -5.701 22.390 1.00 0.00 O ATOM 0 H TYR A 139 7.558 -2.960 20.716 1.00 0.00 H new ATOM 0 HA TYR A 139 8.010 -1.320 23.155 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.121 -4.069 22.426 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.691 -3.470 24.015 1.00 0.00 H new ATOM 0 HD1 TYR A 139 6.040 -2.143 22.612 1.00 0.00 H new ATOM 0 HD2 TYR A 139 7.698 -6.084 22.989 1.00 0.00 H new ATOM 0 HE1 TYR A 139 3.773 -3.121 22.358 1.00 0.00 H new ATOM 0 HE2 TYR A 139 5.435 -7.065 22.737 1.00 0.00 H new ATOM 0 HH TYR A 139 2.898 -5.600 21.462 1.00 0.00 H new ATOM 2138 N SER A 140 10.225 -0.406 22.506 1.00 0.00 N ATOM 2139 CA SER A 140 11.614 0.068 22.240 1.00 0.00 C ATOM 2140 C SER A 140 12.517 -0.240 23.436 1.00 0.00 C ATOM 2141 O SER A 140 12.235 0.145 24.554 1.00 0.00 O ATOM 2142 CB SER A 140 11.486 1.578 22.039 1.00 0.00 C ATOM 2143 OG SER A 140 12.772 2.174 22.141 1.00 0.00 O ATOM 0 H SER A 140 9.624 0.262 22.988 1.00 0.00 H new ATOM 0 HA SER A 140 12.058 -0.422 21.374 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.050 1.791 21.063 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.816 2.001 22.787 1.00 0.00 H new ATOM 0 HG SER A 140 12.695 3.142 22.011 1.00 0.00 H new ATOM 2149 N GLY A 141 13.600 -0.932 23.212 1.00 0.00 N ATOM 2150 CA GLY A 141 14.520 -1.262 24.338 1.00 0.00 C ATOM 2151 C GLY A 141 13.705 -1.736 25.542 1.00 0.00 C ATOM 2152 O GLY A 141 13.730 -1.132 26.596 1.00 0.00 O ATOM 0 H GLY A 141 13.888 -1.283 22.299 1.00 0.00 H new ATOM 0 HA2 GLY A 141 15.222 -2.038 24.032 1.00 0.00 H new ATOM 0 HA3 GLY A 141 15.111 -0.386 24.607 1.00 0.00 H new ATOM 2156 N GLY A 142 12.983 -2.813 25.395 1.00 0.00 N ATOM 2157 CA GLY A 142 12.168 -3.327 26.533 1.00 0.00 C ATOM 2158 C GLY A 142 11.206 -2.237 27.008 1.00 0.00 C ATOM 2159 O GLY A 142 10.709 -2.273 28.115 1.00 0.00 O ATOM 0 H GLY A 142 12.922 -3.360 24.536 1.00 0.00 H new ATOM 0 HA2 GLY A 142 11.609 -4.210 26.224 1.00 0.00 H new ATOM 0 HA3 GLY A 142 12.820 -3.633 27.351 1.00 0.00 H new ATOM 2163 N GLU A 143 10.936 -1.266 26.177 1.00 0.00 N ATOM 2164 CA GLU A 143 10.001 -0.178 26.583 1.00 0.00 C ATOM 2165 C GLU A 143 8.808 -0.133 25.629 1.00 0.00 C ATOM 2166 O GLU A 143 8.962 0.032 24.435 1.00 0.00 O ATOM 2167 CB GLU A 143 10.821 1.109 26.480 1.00 0.00 C ATOM 2168 CG GLU A 143 10.485 2.023 27.660 1.00 0.00 C ATOM 2169 CD GLU A 143 11.749 2.285 28.481 1.00 0.00 C ATOM 2170 OE1 GLU A 143 12.756 2.630 27.886 1.00 0.00 O ATOM 2171 OE2 GLU A 143 11.688 2.134 29.690 1.00 0.00 O ATOM 0 H GLU A 143 11.322 -1.180 25.237 1.00 0.00 H new ATOM 0 HA GLU A 143 9.603 -0.325 27.587 1.00 0.00 H new ATOM 0 HB2 GLU A 143 11.886 0.875 26.479 1.00 0.00 H new ATOM 0 HB3 GLU A 143 10.605 1.616 25.540 1.00 0.00 H new ATOM 0 HG2 GLU A 143 10.072 2.965 27.298 1.00 0.00 H new ATOM 0 HG3 GLU A 143 9.722 1.560 28.286 1.00 0.00 H new ATOM 2178 N LYS A 144 7.618 -0.281 26.138 1.00 0.00 N ATOM 2179 CA LYS A 144 6.425 -0.253 25.250 1.00 0.00 C ATOM 2180 C LYS A 144 6.039 1.189 24.907 1.00 0.00 C ATOM 2181 O LYS A 144 5.473 1.901 25.712 1.00 0.00 O ATOM 2182 CB LYS A 144 5.314 -0.924 26.060 1.00 0.00 C ATOM 2183 CG LYS A 144 5.223 -0.275 27.442 1.00 0.00 C ATOM 2184 CD LYS A 144 3.767 0.082 27.744 1.00 0.00 C ATOM 2185 CE LYS A 144 3.514 -0.035 29.249 1.00 0.00 C ATOM 2186 NZ LYS A 144 2.318 -0.914 29.371 1.00 0.00 N ATOM 0 H LYS A 144 7.420 -0.420 27.129 1.00 0.00 H new ATOM 0 HA LYS A 144 6.610 -0.761 24.303 1.00 0.00 H new ATOM 0 HB2 LYS A 144 4.362 -0.828 25.539 1.00 0.00 H new ATOM 0 HB3 LYS A 144 5.517 -1.990 26.160 1.00 0.00 H new ATOM 0 HG2 LYS A 144 5.606 -0.957 28.201 1.00 0.00 H new ATOM 0 HG3 LYS A 144 5.843 0.621 27.476 1.00 0.00 H new ATOM 0 HD2 LYS A 144 3.553 1.096 27.406 1.00 0.00 H new ATOM 0 HD3 LYS A 144 3.098 -0.584 27.199 1.00 0.00 H new ATOM 0 HE2 LYS A 144 4.374 -0.465 29.762 1.00 0.00 H new ATOM 0 HE3 LYS A 144 3.333 0.942 29.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 2.082 -1.042 30.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 1.513 -0.475 28.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 2.522 -1.840 28.943 1.00 0.00 H new ATOM 2200 N ILE A 145 6.321 1.609 23.706 1.00 0.00 N ATOM 2201 CA ILE A 145 5.953 2.990 23.286 1.00 0.00 C ATOM 2202 C ILE A 145 4.639 2.920 22.508 1.00 0.00 C ATOM 2203 O ILE A 145 4.582 2.310 21.463 1.00 0.00 O ATOM 2204 CB ILE A 145 7.102 3.449 22.387 1.00 0.00 C ATOM 2205 CG1 ILE A 145 8.093 4.275 23.210 1.00 0.00 C ATOM 2206 CG2 ILE A 145 6.557 4.302 21.241 1.00 0.00 C ATOM 2207 CD1 ILE A 145 8.988 3.335 24.020 1.00 0.00 C ATOM 0 H ILE A 145 6.793 1.052 22.993 1.00 0.00 H new ATOM 0 HA ILE A 145 5.811 3.678 24.119 1.00 0.00 H new ATOM 0 HB ILE A 145 7.606 2.575 21.975 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.701 4.896 22.552 1.00 0.00 H new ATOM 0 HG13 ILE A 145 7.556 4.949 23.878 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.381 4.626 20.605 1.00 0.00 H new ATOM 0 HG22 ILE A 145 5.853 3.714 20.652 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.048 5.176 21.648 1.00 0.00 H new ATOM 0 HD11 ILE A 145 9.695 3.922 24.607 1.00 0.00 H new ATOM 0 HD12 ILE A 145 8.373 2.733 24.689 1.00 0.00 H new ATOM 0 HD13 ILE A 145 9.535 2.680 23.342 1.00 0.00 H new ATOM 2219 N PRO A 146 3.619 3.519 23.061 1.00 0.00 N ATOM 2220 CA PRO A 146 2.281 3.482 22.419 1.00 0.00 C ATOM 2221 C PRO A 146 2.219 4.352 21.159 1.00 0.00 C ATOM 2222 O PRO A 146 2.562 5.517 21.165 1.00 0.00 O ATOM 2223 CB PRO A 146 1.352 4.023 23.500 1.00 0.00 C ATOM 2224 CG PRO A 146 2.225 4.866 24.375 1.00 0.00 C ATOM 2225 CD PRO A 146 3.611 4.276 24.317 1.00 0.00 C ATOM 0 HA PRO A 146 2.015 2.480 22.081 1.00 0.00 H new ATOM 0 HB2 PRO A 146 0.543 4.611 23.067 1.00 0.00 H new ATOM 0 HB3 PRO A 146 0.891 3.213 24.065 1.00 0.00 H new ATOM 0 HG2 PRO A 146 2.232 5.900 24.031 1.00 0.00 H new ATOM 0 HG3 PRO A 146 1.852 4.873 25.399 1.00 0.00 H new ATOM 0 HD2 PRO A 146 4.376 5.052 24.321 1.00 0.00 H new ATOM 0 HD3 PRO A 146 3.807 3.631 25.174 1.00 0.00 H new ATOM 2233 N LEU A 147 1.757 3.775 20.084 1.00 0.00 N ATOM 2234 CA LEU A 147 1.621 4.515 18.799 1.00 0.00 C ATOM 2235 C LEU A 147 0.185 4.376 18.294 1.00 0.00 C ATOM 2236 O LEU A 147 -0.385 3.306 18.338 1.00 0.00 O ATOM 2237 CB LEU A 147 2.601 3.843 17.836 1.00 0.00 C ATOM 2238 CG LEU A 147 4.033 4.185 18.246 1.00 0.00 C ATOM 2239 CD1 LEU A 147 4.787 2.898 18.582 1.00 0.00 C ATOM 2240 CD2 LEU A 147 4.737 4.899 17.090 1.00 0.00 C ATOM 0 H LEU A 147 1.462 2.800 20.043 1.00 0.00 H new ATOM 0 HA LEU A 147 1.836 5.579 18.900 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.456 2.763 17.848 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.413 4.179 16.816 1.00 0.00 H new ATOM 0 HG LEU A 147 4.015 4.836 19.120 1.00 0.00 H new ATOM 0 HD11 LEU A 147 5.809 3.141 18.875 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.286 2.387 19.404 1.00 0.00 H new ATOM 0 HD13 LEU A 147 4.805 2.248 17.707 1.00 0.00 H new ATOM 0 HD21 LEU A 147 5.758 5.143 17.381 1.00 0.00 H new ATOM 0 HD22 LEU A 147 4.755 4.247 16.217 1.00 0.00 H new ATOM 0 HD23 LEU A 147 4.200 5.816 16.847 1.00 0.00 H new ATOM 2252 N VAL A 148 -0.425 5.418 17.821 1.00 0.00 N ATOM 2253 CA VAL A 148 -1.822 5.250 17.337 1.00 0.00 C ATOM 2254 C VAL A 148 -1.827 5.065 15.817 1.00 0.00 C ATOM 2255 O VAL A 148 -1.445 5.945 15.071 1.00 0.00 O ATOM 2256 CB VAL A 148 -2.535 6.545 17.724 1.00 0.00 C ATOM 2257 CG1 VAL A 148 -4.009 6.457 17.321 1.00 0.00 C ATOM 2258 CG2 VAL A 148 -2.433 6.750 19.236 1.00 0.00 C ATOM 0 H VAL A 148 -0.034 6.357 17.747 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.310 4.376 17.768 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.067 7.384 17.210 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -4.517 7.381 17.597 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -4.083 6.310 16.244 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -4.477 5.618 17.835 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.941 7.674 19.513 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -2.901 5.910 19.749 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.384 6.813 19.525 1.00 0.00 H new ATOM 2268 N LEU A 149 -2.265 3.922 15.355 1.00 0.00 N ATOM 2269 CA LEU A 149 -2.304 3.674 13.886 1.00 0.00 C ATOM 2270 C LEU A 149 -3.668 4.088 13.324 1.00 0.00 C ATOM 2271 O LEU A 149 -4.699 3.643 13.787 1.00 0.00 O ATOM 2272 CB LEU A 149 -2.098 2.165 13.740 1.00 0.00 C ATOM 2273 CG LEU A 149 -1.255 1.876 12.496 1.00 0.00 C ATOM 2274 CD1 LEU A 149 -0.793 0.417 12.519 1.00 0.00 C ATOM 2275 CD2 LEU A 149 -2.097 2.124 11.242 1.00 0.00 C ATOM 0 H LEU A 149 -2.597 3.150 15.933 1.00 0.00 H new ATOM 0 HA LEU A 149 -1.549 4.243 13.344 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -1.603 1.769 14.626 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -3.062 1.663 13.662 1.00 0.00 H new ATOM 0 HG LEU A 149 -0.385 2.532 12.487 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -0.193 0.211 11.633 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -0.194 0.239 13.412 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.663 -0.240 12.528 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.498 1.919 10.355 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -2.967 1.467 11.252 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -2.427 3.163 11.225 1.00 0.00 H new ATOM 2287 N SER A 150 -3.686 4.939 12.334 1.00 0.00 N ATOM 2288 CA SER A 150 -4.991 5.375 11.758 1.00 0.00 C ATOM 2289 C SER A 150 -4.784 6.073 10.409 1.00 0.00 C ATOM 2290 O SER A 150 -5.351 7.115 10.148 1.00 0.00 O ATOM 2291 CB SER A 150 -5.566 6.352 12.781 1.00 0.00 C ATOM 2292 OG SER A 150 -5.046 7.652 12.533 1.00 0.00 O ATOM 0 H SER A 150 -2.859 5.349 11.901 1.00 0.00 H new ATOM 0 HA SER A 150 -5.656 4.532 11.573 1.00 0.00 H new ATOM 0 HB2 SER A 150 -6.654 6.365 12.717 1.00 0.00 H new ATOM 0 HB3 SER A 150 -5.310 6.032 13.791 1.00 0.00 H new ATOM 0 HG SER A 150 -5.367 7.973 11.664 1.00 0.00 H new ATOM 2298 N ARG A 151 -3.983 5.506 9.548 1.00 0.00 N ATOM 2299 CA ARG A 151 -3.753 6.143 8.219 1.00 0.00 C ATOM 2300 C ARG A 151 -3.849 5.092 7.109 1.00 0.00 C ATOM 2301 O ARG A 151 -3.157 4.094 7.137 1.00 0.00 O ATOM 2302 CB ARG A 151 -2.340 6.718 8.293 1.00 0.00 C ATOM 2303 CG ARG A 151 -2.280 7.787 9.385 1.00 0.00 C ATOM 2304 CD ARG A 151 -1.791 9.107 8.784 1.00 0.00 C ATOM 2305 NE ARG A 151 -3.002 9.724 8.176 1.00 0.00 N ATOM 2306 CZ ARG A 151 -2.900 10.840 7.507 1.00 0.00 C ATOM 2307 NH1 ARG A 151 -1.738 11.418 7.369 1.00 0.00 N ATOM 2308 NH2 ARG A 151 -3.963 11.380 6.974 1.00 0.00 N ATOM 0 H ARG A 151 -3.480 4.633 9.706 1.00 0.00 H new ATOM 0 HA ARG A 151 -4.492 6.912 7.995 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -1.624 5.924 8.507 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -2.061 7.149 7.332 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -3.265 7.922 9.831 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -1.610 7.469 10.183 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -1.360 9.753 9.549 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -1.016 8.937 8.036 1.00 0.00 H new ATOM 0 HE ARG A 151 -3.911 9.274 8.282 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -0.907 10.998 7.784 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -1.661 12.290 6.846 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -4.872 10.930 7.081 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -3.884 12.252 6.451 1.00 0.00 H new ATOM 2322 N PRO A 152 -4.711 5.353 6.165 1.00 0.00 N ATOM 2323 CA PRO A 152 -4.906 4.417 5.033 1.00 0.00 C ATOM 2324 C PRO A 152 -3.758 4.535 4.027 1.00 0.00 C ATOM 2325 O PRO A 152 -3.187 5.591 3.838 1.00 0.00 O ATOM 2326 CB PRO A 152 -6.219 4.879 4.409 1.00 0.00 C ATOM 2327 CG PRO A 152 -6.345 6.323 4.783 1.00 0.00 C ATOM 2328 CD PRO A 152 -5.581 6.530 6.068 1.00 0.00 C ATOM 0 HA PRO A 152 -4.927 3.373 5.345 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -6.206 4.752 3.326 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -7.061 4.299 4.788 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -5.946 6.959 3.993 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -7.393 6.595 4.912 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -5.001 7.452 6.042 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -6.253 6.600 6.924 1.00 0.00 H new ATOM 2336 N LEU A 153 -3.419 3.454 3.379 1.00 0.00 N ATOM 2337 CA LEU A 153 -2.311 3.493 2.381 1.00 0.00 C ATOM 2338 C LEU A 153 -2.853 3.875 1.002 1.00 0.00 C ATOM 2339 O LEU A 153 -4.023 3.711 0.722 1.00 0.00 O ATOM 2340 CB LEU A 153 -1.748 2.072 2.358 1.00 0.00 C ATOM 2341 CG LEU A 153 -2.819 1.101 1.853 1.00 0.00 C ATOM 2342 CD1 LEU A 153 -2.906 1.175 0.327 1.00 0.00 C ATOM 2343 CD2 LEU A 153 -2.446 -0.322 2.270 1.00 0.00 C ATOM 0 H LEU A 153 -3.862 2.543 3.498 1.00 0.00 H new ATOM 0 HA LEU A 153 -1.550 4.230 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -0.871 2.028 1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -1.423 1.783 3.358 1.00 0.00 H new ATOM 0 HG LEU A 153 -3.784 1.371 2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -3.669 0.482 -0.028 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -3.168 2.189 0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -1.942 0.906 -0.106 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -3.206 -1.017 1.913 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.481 -0.586 1.838 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -2.385 -0.379 3.357 1.00 0.00 H new ATOM 2355 N SER A 154 -2.003 4.376 0.141 1.00 0.00 N ATOM 2356 CA SER A 154 -2.447 4.768 -1.233 1.00 0.00 C ATOM 2357 C SER A 154 -3.958 5.023 -1.272 1.00 0.00 C ATOM 2358 O SER A 154 -4.416 6.126 -1.052 1.00 0.00 O ATOM 2359 CB SER A 154 -2.085 3.576 -2.117 1.00 0.00 C ATOM 2360 OG SER A 154 -2.717 3.720 -3.382 1.00 0.00 O ATOM 0 H SER A 154 -1.013 4.532 0.332 1.00 0.00 H new ATOM 0 HA SER A 154 -1.971 5.691 -1.564 1.00 0.00 H new ATOM 0 HB2 SER A 154 -1.004 3.517 -2.242 1.00 0.00 H new ATOM 0 HB3 SER A 154 -2.402 2.647 -1.643 1.00 0.00 H new ATOM 0 HG SER A 154 -2.485 2.957 -3.952 1.00 0.00 H new ATOM 2510 N SER B 165 8.890 -6.208 15.871 1.00 0.00 N ATOM 2511 CA SER B 165 8.664 -6.497 17.317 1.00 0.00 C ATOM 2512 C SER B 165 7.225 -6.972 17.540 1.00 0.00 C ATOM 2513 O SER B 165 6.931 -8.148 17.464 1.00 0.00 O ATOM 2514 CB SER B 165 8.907 -5.169 18.030 1.00 0.00 C ATOM 2515 OG SER B 165 10.301 -4.882 18.028 1.00 0.00 O ATOM 0 HA SER B 165 9.320 -7.283 17.689 1.00 0.00 H new ATOM 0 HB2 SER B 165 8.359 -4.370 17.531 1.00 0.00 H new ATOM 0 HB3 SER B 165 8.536 -5.219 19.054 1.00 0.00 H new ATOM 0 HG SER B 165 10.697 -5.188 17.185 1.00 0.00 H new ATOM 2521 N THR B 166 6.327 -6.065 17.816 1.00 0.00 N ATOM 2522 CA THR B 166 4.907 -6.464 18.044 1.00 0.00 C ATOM 2523 C THR B 166 4.093 -5.268 18.550 1.00 0.00 C ATOM 2524 O THR B 166 4.639 -4.255 18.937 1.00 0.00 O ATOM 2525 CB THR B 166 4.966 -7.562 19.108 1.00 0.00 C ATOM 2526 OG1 THR B 166 3.685 -7.708 19.707 1.00 0.00 O ATOM 2527 CG2 THR B 166 5.993 -7.188 20.178 1.00 0.00 C ATOM 0 H THR B 166 6.515 -5.065 17.894 1.00 0.00 H new ATOM 0 HA THR B 166 4.426 -6.810 17.129 1.00 0.00 H new ATOM 0 HB THR B 166 5.260 -8.503 18.642 1.00 0.00 H new ATOM 0 HG1 THR B 166 3.721 -8.412 20.388 1.00 0.00 H new ATOM 0 HG21 THR B 166 6.033 -7.972 20.934 1.00 0.00 H new ATOM 0 HG22 THR B 166 6.975 -7.078 19.717 1.00 0.00 H new ATOM 0 HG23 THR B 166 5.705 -6.247 20.646 1.00 0.00 H new ATOM 2535 N VAL B 167 2.793 -5.381 18.548 1.00 0.00 N ATOM 2536 CA VAL B 167 1.944 -4.250 19.030 1.00 0.00 C ATOM 2537 C VAL B 167 1.027 -4.720 20.161 1.00 0.00 C ATOM 2538 O VAL B 167 1.252 -5.745 20.772 1.00 0.00 O ATOM 2539 CB VAL B 167 1.117 -3.808 17.817 1.00 0.00 C ATOM 2540 CG1 VAL B 167 1.765 -2.582 17.173 1.00 0.00 C ATOM 2541 CG2 VAL B 167 1.052 -4.942 16.791 1.00 0.00 C ATOM 0 H VAL B 167 2.281 -6.205 18.234 1.00 0.00 H new ATOM 0 HA VAL B 167 2.546 -3.432 19.425 1.00 0.00 H new ATOM 0 HB VAL B 167 0.108 -3.559 18.146 1.00 0.00 H new ATOM 0 HG11 VAL B 167 1.176 -2.270 16.311 1.00 0.00 H new ATOM 0 HG12 VAL B 167 1.806 -1.769 17.898 1.00 0.00 H new ATOM 0 HG13 VAL B 167 2.776 -2.832 16.850 1.00 0.00 H new ATOM 0 HG21 VAL B 167 0.463 -4.622 15.932 1.00 0.00 H new ATOM 0 HG22 VAL B 167 2.061 -5.196 16.465 1.00 0.00 H new ATOM 0 HG23 VAL B 167 0.586 -5.817 17.245 1.00 0.00 H new ATOM 2551 N VAL B 168 -0.006 -3.975 20.445 1.00 0.00 N ATOM 2552 CA VAL B 168 -0.938 -4.375 21.540 1.00 0.00 C ATOM 2553 C VAL B 168 -1.865 -5.496 21.065 1.00 0.00 C ATOM 2554 O VAL B 168 -2.438 -5.432 19.997 1.00 0.00 O ATOM 2555 CB VAL B 168 -1.740 -3.111 21.858 1.00 0.00 C ATOM 2556 CG1 VAL B 168 -2.428 -3.272 23.213 1.00 0.00 C ATOM 2557 CG2 VAL B 168 -0.793 -1.909 21.907 1.00 0.00 C ATOM 0 H VAL B 168 -0.246 -3.107 19.967 1.00 0.00 H new ATOM 0 HA VAL B 168 -0.409 -4.753 22.415 1.00 0.00 H new ATOM 0 HB VAL B 168 -2.492 -2.952 21.085 1.00 0.00 H new ATOM 0 HG11 VAL B 168 -2.999 -2.372 23.440 1.00 0.00 H new ATOM 0 HG12 VAL B 168 -3.100 -4.130 23.180 1.00 0.00 H new ATOM 0 HG13 VAL B 168 -1.676 -3.429 23.986 1.00 0.00 H new ATOM 0 HG21 VAL B 168 -1.361 -1.007 22.133 1.00 0.00 H new ATOM 0 HG22 VAL B 168 -0.042 -2.069 22.681 1.00 0.00 H new ATOM 0 HG23 VAL B 168 -0.300 -1.795 20.942 1.00 0.00 H new