USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 916 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 135 THR OG1 : rot 89:sc= 2.16 USER MOD Set 1.2: A 136 ASN : amide:sc= -0.795! C(o=1.4!,f=-0.33!) USER MOD Set 2.1: A 91 THR OG1 : rot -86:sc= 1.28 USER MOD Set 2.2: A 112 TYR OH : rot 36:sc= -1.85 USER MOD Set 3.1: A 29 ASN : amide:sc= 0.0647 K(o=-0.89,f=-5.7!) USER MOD Set 3.2: A 30 THR OG1 : rot 33:sc= -0.956! USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-1.8!,f=0) USER MOD Single : A 34 THR OG1 : rot -44:sc= 1.19 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 59:sc= 1.04 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 96:sc= 0.175 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-2,f=0) USER MOD Single : A 50 TYR OH : rot -43:sc= 0.269 USER MOD Single : A 51 LYS NZ :NH3+ 163:sc= -0.0428 (180deg=-0.323) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 95:sc= 1.57 USER MOD Single : A 61 ASN : amide:sc= 1.16 K(o=1.2,f=-0.019) USER MOD Single : A 64 MET CE :methyl -108:sc= -0.79 (180deg=-1.93) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -1.16 K(o=-1.2,f=-5.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 82 LYS NZ :NH3+ -168:sc= 1.16 (180deg=0.824) USER MOD Single : A 87 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.2!) USER MOD Single : A 95 THR OG1 : rot 120:sc= 0.226 USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.0821 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 106 TYR OH : rot 73:sc= 0.663 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.13 USER MOD Single : A 115 ASN : amide:sc= -0.293 X(o=-0.29,f=-0.76) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0.463 K(o=0.46,f=-0.26) USER MOD Single : A 125 ASN : amide:sc= -0.107 K(o=-0.11,f=-4.4!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -69:sc= 0.945 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.459 -1.703 1.464 1.00 0.00 N ATOM 2 CA ASP A 20 29.719 -2.857 1.018 1.00 0.00 C ATOM 3 C ASP A 20 28.818 -3.376 2.112 1.00 0.00 C ATOM 4 O ASP A 20 29.178 -3.393 3.305 1.00 0.00 O ATOM 5 CB ASP A 20 30.666 -3.964 0.533 1.00 0.00 C ATOM 6 CG ASP A 20 31.530 -3.528 -0.626 1.00 0.00 C ATOM 7 OD1 ASP A 20 31.078 -3.593 -1.797 1.00 0.00 O ATOM 8 OD2 ASP A 20 32.669 -3.093 -0.401 1.00 0.00 O ATOM 0 HA ASP A 20 29.096 -2.548 0.179 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.305 -4.277 1.359 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.079 -4.833 0.236 1.00 0.00 H new ATOM 13 N CYS A 21 27.663 -3.784 1.718 1.00 0.00 N ATOM 14 CA CYS A 21 26.657 -4.268 2.612 1.00 0.00 C ATOM 15 C CYS A 21 27.069 -5.624 3.099 1.00 0.00 C ATOM 16 O CYS A 21 27.582 -6.427 2.330 1.00 0.00 O ATOM 17 CB CYS A 21 25.365 -4.444 1.852 1.00 0.00 C ATOM 18 SG CYS A 21 25.225 -3.402 0.393 1.00 0.00 S ATOM 0 H CYS A 21 27.379 -3.793 0.738 1.00 0.00 H new ATOM 0 HA CYS A 21 26.531 -3.567 3.437 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.272 -5.487 1.551 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.531 -4.230 2.520 1.00 0.00 H new ATOM 23 N ASN A 22 26.887 -5.881 4.355 1.00 0.00 N ATOM 24 CA ASN A 22 27.152 -7.199 4.900 1.00 0.00 C ATOM 25 C ASN A 22 25.855 -7.778 5.403 1.00 0.00 C ATOM 26 O ASN A 22 25.824 -8.578 6.335 1.00 0.00 O ATOM 27 CB ASN A 22 28.217 -7.164 6.015 1.00 0.00 C ATOM 28 CG ASN A 22 29.665 -7.134 5.521 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.918 -6.515 4.402 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.555 -7.670 6.169 1.00 0.00 N flip ATOM 0 H ASN A 22 26.554 -5.199 5.036 1.00 0.00 H new ATOM 0 HA ASN A 22 27.560 -7.832 4.112 1.00 0.00 H new ATOM 0 HB2 ASN A 22 28.042 -6.286 6.637 1.00 0.00 H new ATOM 0 HB3 ASN A 22 28.084 -8.038 6.652 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.333 -8.149 7.042 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.519 -7.638 5.836 1.00 0.00 H new ATOM 37 N GLU A 23 24.790 -7.378 4.742 1.00 0.00 N ATOM 38 CA GLU A 23 23.446 -7.802 5.037 1.00 0.00 C ATOM 39 C GLU A 23 22.552 -7.442 3.852 1.00 0.00 C ATOM 40 O GLU A 23 22.913 -6.565 3.041 1.00 0.00 O ATOM 41 CB GLU A 23 22.925 -7.109 6.306 1.00 0.00 C ATOM 42 CG GLU A 23 22.864 -5.591 6.203 1.00 0.00 C ATOM 43 CD GLU A 23 22.325 -4.956 7.444 1.00 0.00 C ATOM 44 OE1 GLU A 23 21.101 -4.986 7.657 1.00 0.00 O ATOM 45 OE2 GLU A 23 23.110 -4.438 8.248 1.00 0.00 O ATOM 0 H GLU A 23 24.842 -6.727 3.959 1.00 0.00 H new ATOM 0 HA GLU A 23 23.436 -8.879 5.207 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.928 -7.488 6.531 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.566 -7.380 7.145 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.863 -5.203 6.004 1.00 0.00 H new ATOM 0 HG3 GLU A 23 22.239 -5.312 5.355 1.00 0.00 H new ATOM 52 N LEU A 24 21.433 -8.121 3.743 1.00 0.00 N ATOM 53 CA LEU A 24 20.415 -7.833 2.750 1.00 0.00 C ATOM 54 C LEU A 24 19.567 -6.665 3.219 1.00 0.00 C ATOM 55 O LEU A 24 19.499 -6.409 4.424 1.00 0.00 O ATOM 56 CB LEU A 24 19.534 -9.079 2.502 1.00 0.00 C ATOM 57 CG LEU A 24 20.095 -10.159 1.562 1.00 0.00 C ATOM 58 CD1 LEU A 24 19.083 -11.271 1.378 1.00 0.00 C ATOM 59 CD2 LEU A 24 20.411 -9.524 0.236 1.00 0.00 C ATOM 0 H LEU A 24 21.197 -8.904 4.352 1.00 0.00 H new ATOM 0 HA LEU A 24 20.897 -7.568 1.809 1.00 0.00 H new ATOM 0 HB2 LEU A 24 19.327 -9.544 3.466 1.00 0.00 H new ATOM 0 HB3 LEU A 24 18.579 -8.743 2.099 1.00 0.00 H new ATOM 0 HG LEU A 24 21.000 -10.588 1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 24 19.493 -12.029 0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.858 -11.722 2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 24 18.169 -10.863 0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 24 20.810 -10.278 -0.442 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.502 -9.098 -0.189 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.150 -8.735 0.377 1.00 0.00 H new ATOM 71 N PRO A 25 18.950 -5.908 2.282 1.00 0.00 N ATOM 72 CA PRO A 25 18.096 -4.770 2.622 1.00 0.00 C ATOM 73 C PRO A 25 16.990 -5.180 3.594 1.00 0.00 C ATOM 74 O PRO A 25 16.301 -6.187 3.376 1.00 0.00 O ATOM 75 CB PRO A 25 17.506 -4.323 1.274 1.00 0.00 C ATOM 76 CG PRO A 25 17.811 -5.428 0.323 1.00 0.00 C ATOM 77 CD PRO A 25 19.048 -6.088 0.831 1.00 0.00 C ATOM 0 HA PRO A 25 18.648 -3.973 3.121 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.432 -4.156 1.351 1.00 0.00 H new ATOM 0 HB3 PRO A 25 17.951 -3.385 0.942 1.00 0.00 H new ATOM 0 HG2 PRO A 25 16.985 -6.137 0.273 1.00 0.00 H new ATOM 0 HG3 PRO A 25 17.962 -5.043 -0.685 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.084 -7.142 0.557 1.00 0.00 H new ATOM 0 HD3 PRO A 25 19.948 -5.623 0.427 1.00 0.00 H new ATOM 85 N PRO A 26 16.821 -4.432 4.681 1.00 0.00 N ATOM 86 CA PRO A 26 15.858 -4.771 5.710 1.00 0.00 C ATOM 87 C PRO A 26 14.433 -4.601 5.206 1.00 0.00 C ATOM 88 O PRO A 26 14.067 -3.522 4.713 1.00 0.00 O ATOM 89 CB PRO A 26 16.166 -3.772 6.832 1.00 0.00 C ATOM 90 CG PRO A 26 16.820 -2.615 6.163 1.00 0.00 C ATOM 91 CD PRO A 26 17.529 -3.165 4.964 1.00 0.00 C ATOM 0 HA PRO A 26 15.933 -5.810 6.032 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.255 -3.465 7.346 1.00 0.00 H new ATOM 0 HB3 PRO A 26 16.822 -4.214 7.582 1.00 0.00 H new ATOM 0 HG2 PRO A 26 16.082 -1.868 5.869 1.00 0.00 H new ATOM 0 HG3 PRO A 26 17.521 -2.122 6.837 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.474 -2.479 4.118 1.00 0.00 H new ATOM 0 HD3 PRO A 26 18.586 -3.335 5.168 1.00 0.00 H new ATOM 99 N ARG A 27 13.625 -5.646 5.335 1.00 0.00 N ATOM 100 CA ARG A 27 12.258 -5.603 4.844 1.00 0.00 C ATOM 101 C ARG A 27 11.509 -4.513 5.536 1.00 0.00 C ATOM 102 O ARG A 27 11.577 -4.358 6.759 1.00 0.00 O ATOM 103 CB ARG A 27 11.525 -6.915 5.006 1.00 0.00 C ATOM 104 CG ARG A 27 12.200 -8.076 4.335 1.00 0.00 C ATOM 105 CD ARG A 27 11.342 -9.312 4.424 1.00 0.00 C ATOM 106 NE ARG A 27 10.228 -9.303 3.449 1.00 0.00 N ATOM 107 CZ ARG A 27 8.940 -9.594 3.728 1.00 0.00 C ATOM 108 NH1 ARG A 27 8.518 -9.678 4.986 1.00 0.00 N ATOM 109 NH2 ARG A 27 8.076 -9.768 2.740 1.00 0.00 N ATOM 0 H ARG A 27 13.893 -6.527 5.773 1.00 0.00 H new ATOM 0 HA ARG A 27 12.312 -5.406 3.773 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.421 -7.133 6.069 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.518 -6.810 4.602 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.394 -7.836 3.290 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.166 -8.263 4.804 1.00 0.00 H new ATOM 0 HD2 ARG A 27 11.961 -10.193 4.254 1.00 0.00 H new ATOM 0 HD3 ARG A 27 10.937 -9.397 5.432 1.00 0.00 H new ATOM 0 HE ARG A 27 10.453 -9.056 2.485 1.00 0.00 H new ATOM 0 HH11 ARG A 27 9.170 -9.522 5.754 1.00 0.00 H new ATOM 0 HH12 ARG A 27 7.542 -9.899 5.183 1.00 0.00 H new ATOM 0 HH21 ARG A 27 8.385 -9.682 1.772 1.00 0.00 H new ATOM 0 HH22 ARG A 27 7.102 -9.988 2.947 1.00 0.00 H new ATOM 123 N ARG A 28 10.802 -3.780 4.773 1.00 0.00 N ATOM 124 CA ARG A 28 10.171 -2.573 5.263 1.00 0.00 C ATOM 125 C ARG A 28 8.828 -2.884 5.855 1.00 0.00 C ATOM 126 O ARG A 28 8.367 -4.022 5.784 1.00 0.00 O ATOM 127 CB ARG A 28 10.009 -1.564 4.139 1.00 0.00 C ATOM 128 CG ARG A 28 11.298 -1.146 3.408 1.00 0.00 C ATOM 129 CD ARG A 28 12.266 -0.357 4.280 1.00 0.00 C ATOM 130 NE ARG A 28 12.849 -1.156 5.365 1.00 0.00 N ATOM 131 CZ ARG A 28 13.152 -0.694 6.578 1.00 0.00 C ATOM 132 NH1 ARG A 28 13.069 0.605 6.840 1.00 0.00 N ATOM 133 NH2 ARG A 28 13.571 -1.529 7.524 1.00 0.00 N ATOM 0 H ARG A 28 10.630 -3.979 3.788 1.00 0.00 H new ATOM 0 HA ARG A 28 10.811 -2.147 6.036 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.318 -1.978 3.405 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.541 -0.668 4.548 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.801 -2.039 3.038 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.034 -0.545 2.538 1.00 0.00 H new ATOM 0 HD2 ARG A 28 13.068 0.037 3.656 1.00 0.00 H new ATOM 0 HD3 ARG A 28 11.745 0.499 4.708 1.00 0.00 H new ATOM 0 HE ARG A 28 13.037 -2.141 5.176 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.772 1.254 6.111 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.302 0.954 7.770 1.00 0.00 H new ATOM 0 HH21 ARG A 28 13.661 -2.525 7.322 1.00 0.00 H new ATOM 0 HH22 ARG A 28 13.802 -1.174 8.452 1.00 0.00 H new ATOM 147 N ASN A 29 8.210 -1.890 6.429 1.00 0.00 N ATOM 148 CA ASN A 29 6.893 -2.033 7.012 1.00 0.00 C ATOM 149 C ASN A 29 5.836 -2.133 5.925 1.00 0.00 C ATOM 150 O ASN A 29 4.962 -2.983 5.980 1.00 0.00 O ATOM 151 CB ASN A 29 6.562 -0.875 7.996 1.00 0.00 C ATOM 152 CG ASN A 29 6.602 0.524 7.371 1.00 0.00 C ATOM 153 OD1 ASN A 29 7.385 0.796 6.450 1.00 0.00 O ATOM 154 ND2 ASN A 29 5.785 1.416 7.865 1.00 0.00 N ATOM 0 H ASN A 29 8.602 -0.952 6.509 1.00 0.00 H new ATOM 0 HA ASN A 29 6.891 -2.958 7.589 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.570 -1.044 8.414 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.268 -0.908 8.826 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.781 2.365 7.492 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.151 1.163 8.623 1.00 0.00 H new ATOM 161 N THR A 30 5.938 -1.306 4.923 1.00 0.00 N ATOM 162 CA THR A 30 4.966 -1.301 3.872 1.00 0.00 C ATOM 163 C THR A 30 5.594 -1.538 2.501 1.00 0.00 C ATOM 164 O THR A 30 4.968 -1.306 1.481 1.00 0.00 O ATOM 165 CB THR A 30 4.142 0.008 3.900 1.00 0.00 C ATOM 166 OG1 THR A 30 5.002 1.136 4.171 1.00 0.00 O ATOM 167 CG2 THR A 30 3.045 -0.057 4.952 1.00 0.00 C ATOM 0 H THR A 30 6.689 -0.624 4.814 1.00 0.00 H new ATOM 0 HA THR A 30 4.288 -2.136 4.049 1.00 0.00 H new ATOM 0 HB THR A 30 3.679 0.131 2.921 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.883 0.979 3.772 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.482 0.876 4.949 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.374 -0.886 4.727 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.492 -0.208 5.935 1.00 0.00 H new ATOM 175 N GLU A 31 6.800 -2.086 2.486 1.00 0.00 N ATOM 176 CA GLU A 31 7.502 -2.306 1.227 1.00 0.00 C ATOM 177 C GLU A 31 8.185 -3.662 1.197 1.00 0.00 C ATOM 178 O GLU A 31 8.615 -4.187 2.240 1.00 0.00 O ATOM 179 CB GLU A 31 8.561 -1.246 0.925 1.00 0.00 C ATOM 180 CG GLU A 31 8.118 0.192 0.965 1.00 0.00 C ATOM 181 CD GLU A 31 8.301 0.847 2.322 1.00 0.00 C ATOM 182 OE1 GLU A 31 9.385 1.395 2.578 1.00 0.00 O ATOM 183 OE2 GLU A 31 7.371 0.836 3.158 1.00 0.00 O ATOM 0 H GLU A 31 7.309 -2.384 3.318 1.00 0.00 H new ATOM 0 HA GLU A 31 6.723 -2.249 0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.377 -1.369 1.637 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.969 -1.447 -0.065 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.678 0.757 0.220 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.067 0.247 0.683 1.00 0.00 H new ATOM 190 N ILE A 32 8.304 -4.218 0.007 1.00 0.00 N ATOM 191 CA ILE A 32 8.934 -5.528 -0.213 1.00 0.00 C ATOM 192 C ILE A 32 9.868 -5.366 -1.372 1.00 0.00 C ATOM 193 O ILE A 32 9.692 -4.491 -2.174 1.00 0.00 O ATOM 194 CB ILE A 32 7.860 -6.614 -0.551 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.688 -6.550 0.445 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.479 -8.009 -0.516 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.514 -7.439 0.081 1.00 0.00 C ATOM 0 H ILE A 32 7.967 -3.778 -0.849 1.00 0.00 H new ATOM 0 HA ILE A 32 9.459 -5.854 0.685 1.00 0.00 H new ATOM 0 HB ILE A 32 7.485 -6.412 -1.555 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.050 -6.832 1.434 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.341 -5.519 0.515 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.717 -8.751 -0.754 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.284 -8.068 -1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.879 -8.205 0.479 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.732 -7.335 0.833 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.123 -7.144 -0.893 1.00 0.00 H new ATOM 0 HD13 ILE A 32 5.843 -8.477 0.041 1.00 0.00 H new ATOM 209 N LEU A 33 10.848 -6.173 -1.430 1.00 0.00 N ATOM 210 CA LEU A 33 11.854 -6.082 -2.433 1.00 0.00 C ATOM 211 C LEU A 33 11.390 -6.605 -3.774 1.00 0.00 C ATOM 212 O LEU A 33 10.588 -7.528 -3.847 1.00 0.00 O ATOM 213 CB LEU A 33 13.057 -6.876 -2.008 1.00 0.00 C ATOM 214 CG LEU A 33 13.982 -6.292 -0.960 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.530 -4.937 -1.349 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.400 -6.298 0.415 1.00 0.00 C ATOM 0 H LEU A 33 10.987 -6.938 -0.770 1.00 0.00 H new ATOM 0 HA LEU A 33 12.094 -5.025 -2.546 1.00 0.00 H new ATOM 0 HB2 LEU A 33 12.704 -7.838 -1.637 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.652 -7.077 -2.899 1.00 0.00 H new ATOM 0 HG LEU A 33 14.835 -6.969 -0.922 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.186 -4.569 -0.560 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.094 -5.026 -2.277 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.706 -4.238 -1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.115 -5.866 1.115 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.483 -5.709 0.424 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.177 -7.323 0.711 1.00 0.00 H new ATOM 228 N THR A 34 11.901 -6.009 -4.820 1.00 0.00 N ATOM 229 CA THR A 34 11.674 -6.508 -6.155 1.00 0.00 C ATOM 230 C THR A 34 12.998 -6.973 -6.718 1.00 0.00 C ATOM 231 O THR A 34 13.939 -6.176 -6.877 1.00 0.00 O ATOM 232 CB THR A 34 10.989 -5.479 -7.110 1.00 0.00 C ATOM 233 OG1 THR A 34 11.719 -4.235 -7.175 1.00 0.00 O ATOM 234 CG2 THR A 34 9.575 -5.206 -6.669 1.00 0.00 C ATOM 0 H THR A 34 12.481 -5.171 -4.774 1.00 0.00 H new ATOM 0 HA THR A 34 10.968 -7.336 -6.085 1.00 0.00 H new ATOM 0 HB THR A 34 10.983 -5.924 -8.105 1.00 0.00 H new ATOM 0 HG1 THR A 34 11.985 -3.964 -6.271 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.115 -4.487 -7.347 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.004 -6.134 -6.683 1.00 0.00 H new ATOM 0 HG23 THR A 34 9.581 -4.799 -5.658 1.00 0.00 H new ATOM 242 N GLY A 35 13.103 -8.244 -6.936 1.00 0.00 N ATOM 243 CA GLY A 35 14.319 -8.799 -7.418 1.00 0.00 C ATOM 244 C GLY A 35 14.543 -10.143 -6.823 1.00 0.00 C ATOM 245 O GLY A 35 13.586 -10.812 -6.425 1.00 0.00 O ATOM 0 H GLY A 35 12.353 -8.919 -6.786 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.286 -8.876 -8.505 1.00 0.00 H new ATOM 0 HA3 GLY A 35 15.151 -8.140 -7.170 1.00 0.00 H new ATOM 249 N SER A 36 15.765 -10.553 -6.753 1.00 0.00 N ATOM 250 CA SER A 36 16.114 -11.806 -6.156 1.00 0.00 C ATOM 251 C SER A 36 17.356 -11.624 -5.309 1.00 0.00 C ATOM 252 O SER A 36 18.470 -11.565 -5.819 1.00 0.00 O ATOM 253 CB SER A 36 16.301 -12.872 -7.240 1.00 0.00 C ATOM 254 OG SER A 36 15.098 -13.002 -8.001 1.00 0.00 O ATOM 0 H SER A 36 16.561 -10.025 -7.111 1.00 0.00 H new ATOM 0 HA SER A 36 15.310 -12.151 -5.505 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.129 -12.598 -7.894 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.559 -13.828 -6.783 1.00 0.00 H new ATOM 0 HG SER A 36 15.222 -13.683 -8.694 1.00 0.00 H new ATOM 260 N TRP A 37 17.148 -11.468 -4.028 1.00 0.00 N ATOM 261 CA TRP A 37 18.222 -11.235 -3.112 1.00 0.00 C ATOM 262 C TRP A 37 18.647 -12.539 -2.506 1.00 0.00 C ATOM 263 O TRP A 37 18.017 -13.041 -1.566 1.00 0.00 O ATOM 264 CB TRP A 37 17.802 -10.275 -2.023 1.00 0.00 C ATOM 265 CG TRP A 37 17.358 -8.946 -2.508 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.085 -8.568 -2.748 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.180 -7.811 -2.811 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.054 -7.275 -3.167 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.323 -6.784 -3.221 1.00 0.00 C ATOM 270 CE3 TRP A 37 19.552 -7.563 -2.772 1.00 0.00 C ATOM 271 CZ2 TRP A 37 17.784 -5.527 -3.590 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.014 -6.314 -3.139 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.133 -5.310 -3.543 1.00 0.00 C ATOM 0 H TRP A 37 16.225 -11.500 -3.594 1.00 0.00 H new ATOM 0 HA TRP A 37 19.056 -10.790 -3.654 1.00 0.00 H new ATOM 0 HB2 TRP A 37 16.992 -10.727 -1.451 1.00 0.00 H new ATOM 0 HB3 TRP A 37 18.638 -10.136 -1.337 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.218 -9.200 -2.625 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.210 -6.753 -3.404 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.241 -8.334 -2.460 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.102 -4.750 -3.902 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.074 -6.111 -3.113 1.00 0.00 H new ATOM 0 HH2 TRP A 37 19.524 -4.343 -3.824 1.00 0.00 H new ATOM 284 N SER A 38 19.671 -13.091 -3.060 1.00 0.00 N ATOM 285 CA SER A 38 20.158 -14.375 -2.674 1.00 0.00 C ATOM 286 C SER A 38 21.455 -14.280 -1.878 1.00 0.00 C ATOM 287 O SER A 38 22.023 -15.298 -1.467 1.00 0.00 O ATOM 288 CB SER A 38 20.382 -15.158 -3.959 1.00 0.00 C ATOM 289 OG SER A 38 21.077 -14.347 -4.928 1.00 0.00 O ATOM 0 H SER A 38 20.206 -12.655 -3.811 1.00 0.00 H new ATOM 0 HA SER A 38 19.436 -14.867 -2.022 1.00 0.00 H new ATOM 0 HB2 SER A 38 20.959 -16.058 -3.748 1.00 0.00 H new ATOM 0 HB3 SER A 38 19.424 -15.482 -4.366 1.00 0.00 H new ATOM 0 HG SER A 38 21.937 -14.059 -4.557 1.00 0.00 H new ATOM 295 N ASP A 39 21.917 -13.080 -1.641 1.00 0.00 N ATOM 296 CA ASP A 39 23.241 -12.913 -1.061 1.00 0.00 C ATOM 297 C ASP A 39 23.211 -12.207 0.255 1.00 0.00 C ATOM 298 O ASP A 39 22.171 -12.093 0.865 1.00 0.00 O ATOM 299 CB ASP A 39 24.207 -12.245 -2.060 1.00 0.00 C ATOM 300 CG ASP A 39 24.520 -13.078 -3.299 1.00 0.00 C ATOM 301 OD1 ASP A 39 23.599 -13.381 -4.116 1.00 0.00 O ATOM 302 OD2 ASP A 39 25.699 -13.434 -3.494 1.00 0.00 O ATOM 0 H ASP A 39 21.414 -12.214 -1.833 1.00 0.00 H new ATOM 0 HA ASP A 39 23.624 -13.912 -0.852 1.00 0.00 H new ATOM 0 HB2 ASP A 39 23.779 -11.294 -2.377 1.00 0.00 H new ATOM 0 HB3 ASP A 39 25.141 -12.019 -1.545 1.00 0.00 H new ATOM 307 N GLN A 40 24.368 -11.831 0.736 1.00 0.00 N ATOM 308 CA GLN A 40 24.478 -11.113 1.976 1.00 0.00 C ATOM 309 C GLN A 40 25.345 -9.891 1.768 1.00 0.00 C ATOM 310 O GLN A 40 25.016 -8.803 2.217 1.00 0.00 O ATOM 311 CB GLN A 40 25.033 -12.020 3.086 1.00 0.00 C ATOM 312 CG GLN A 40 25.035 -11.385 4.468 1.00 0.00 C ATOM 313 CD GLN A 40 25.506 -12.335 5.548 1.00 0.00 C ATOM 314 OE1 GLN A 40 26.690 -12.409 5.851 1.00 0.00 O ATOM 315 NE2 GLN A 40 24.596 -13.080 6.123 1.00 0.00 N ATOM 0 H GLN A 40 25.260 -12.015 0.277 1.00 0.00 H new ATOM 0 HA GLN A 40 23.488 -10.788 2.297 1.00 0.00 H new ATOM 0 HB2 GLN A 40 24.443 -12.936 3.120 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.053 -12.307 2.829 1.00 0.00 H new ATOM 0 HG2 GLN A 40 25.679 -10.505 4.458 1.00 0.00 H new ATOM 0 HG3 GLN A 40 24.029 -11.041 4.706 1.00 0.00 H new ATOM 0 HE21 GLN A 40 23.618 -12.994 5.847 1.00 0.00 H new ATOM 0 HE22 GLN A 40 24.865 -13.747 6.847 1.00 0.00 H new ATOM 324 N THR A 41 26.427 -10.056 1.067 1.00 0.00 N ATOM 325 CA THR A 41 27.285 -8.958 0.805 1.00 0.00 C ATOM 326 C THR A 41 27.006 -8.392 -0.581 1.00 0.00 C ATOM 327 O THR A 41 26.872 -9.146 -1.559 1.00 0.00 O ATOM 328 CB THR A 41 28.767 -9.352 0.977 1.00 0.00 C ATOM 329 OG1 THR A 41 29.109 -10.416 0.074 1.00 0.00 O ATOM 330 CG2 THR A 41 29.006 -9.824 2.405 1.00 0.00 C ATOM 0 H THR A 41 26.730 -10.945 0.669 1.00 0.00 H new ATOM 0 HA THR A 41 27.080 -8.175 1.535 1.00 0.00 H new ATOM 0 HB THR A 41 29.386 -8.481 0.760 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.052 -10.655 0.192 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.053 -10.102 2.526 1.00 0.00 H new ATOM 0 HG22 THR A 41 28.762 -9.020 3.100 1.00 0.00 H new ATOM 0 HG23 THR A 41 28.375 -10.688 2.613 1.00 0.00 H new ATOM 338 N TYR A 42 26.868 -7.090 -0.649 1.00 0.00 N ATOM 339 CA TYR A 42 26.572 -6.378 -1.882 1.00 0.00 C ATOM 340 C TYR A 42 27.396 -5.120 -1.948 1.00 0.00 C ATOM 341 O TYR A 42 27.818 -4.617 -0.916 1.00 0.00 O ATOM 342 CB TYR A 42 25.072 -6.019 -1.981 1.00 0.00 C ATOM 343 CG TYR A 42 24.180 -7.157 -2.394 1.00 0.00 C ATOM 344 CD1 TYR A 42 23.727 -8.079 -1.478 1.00 0.00 C ATOM 345 CD2 TYR A 42 23.789 -7.300 -3.718 1.00 0.00 C ATOM 346 CE1 TYR A 42 22.912 -9.111 -1.859 1.00 0.00 C ATOM 347 CE2 TYR A 42 22.971 -8.335 -4.113 1.00 0.00 C ATOM 348 CZ TYR A 42 22.534 -9.246 -3.170 1.00 0.00 C ATOM 349 OH TYR A 42 21.692 -10.285 -3.530 1.00 0.00 O ATOM 0 H TYR A 42 26.959 -6.479 0.162 1.00 0.00 H new ATOM 0 HA TYR A 42 26.820 -7.032 -2.718 1.00 0.00 H new ATOM 0 HB2 TYR A 42 24.737 -5.645 -1.013 1.00 0.00 H new ATOM 0 HB3 TYR A 42 24.954 -5.204 -2.696 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.019 -7.987 -0.442 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.133 -6.586 -4.452 1.00 0.00 H new ATOM 0 HE1 TYR A 42 22.565 -9.822 -1.124 1.00 0.00 H new ATOM 0 HE2 TYR A 42 22.675 -8.434 -5.147 1.00 0.00 H new ATOM 0 HH TYR A 42 21.516 -10.244 -4.493 1.00 0.00 H new ATOM 359 N PRO A 43 27.663 -4.612 -3.155 1.00 0.00 N ATOM 360 CA PRO A 43 28.426 -3.378 -3.333 1.00 0.00 C ATOM 361 C PRO A 43 27.692 -2.149 -2.781 1.00 0.00 C ATOM 362 O PRO A 43 26.448 -2.100 -2.745 1.00 0.00 O ATOM 363 CB PRO A 43 28.587 -3.264 -4.858 1.00 0.00 C ATOM 364 CG PRO A 43 27.517 -4.134 -5.433 1.00 0.00 C ATOM 365 CD PRO A 43 27.279 -5.222 -4.440 1.00 0.00 C ATOM 0 HA PRO A 43 29.373 -3.411 -2.794 1.00 0.00 H new ATOM 0 HB2 PRO A 43 28.475 -2.232 -5.189 1.00 0.00 H new ATOM 0 HB3 PRO A 43 29.576 -3.595 -5.175 1.00 0.00 H new ATOM 0 HG2 PRO A 43 26.605 -3.563 -5.609 1.00 0.00 H new ATOM 0 HG3 PRO A 43 27.826 -4.546 -6.394 1.00 0.00 H new ATOM 0 HD2 PRO A 43 26.236 -5.540 -4.437 1.00 0.00 H new ATOM 0 HD3 PRO A 43 27.881 -6.104 -4.660 1.00 0.00 H new ATOM 373 N GLU A 44 28.445 -1.175 -2.349 1.00 0.00 N ATOM 374 CA GLU A 44 27.890 0.068 -1.876 1.00 0.00 C ATOM 375 C GLU A 44 27.325 0.810 -3.087 1.00 0.00 C ATOM 376 O GLU A 44 27.824 0.650 -4.192 1.00 0.00 O ATOM 377 CB GLU A 44 28.984 0.894 -1.211 1.00 0.00 C ATOM 378 CG GLU A 44 28.471 2.086 -0.445 1.00 0.00 C ATOM 379 CD GLU A 44 29.562 2.960 0.067 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.368 3.451 -0.739 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.606 3.204 1.278 1.00 0.00 O ATOM 0 H GLU A 44 29.463 -1.219 -2.314 1.00 0.00 H new ATOM 0 HA GLU A 44 27.103 -0.109 -1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.547 0.253 -0.532 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.681 1.238 -1.975 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.816 2.672 -1.090 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.866 1.740 0.393 1.00 0.00 H new ATOM 388 N GLY A 45 26.265 1.566 -2.894 1.00 0.00 N ATOM 389 CA GLY A 45 25.652 2.274 -3.992 1.00 0.00 C ATOM 390 C GLY A 45 24.502 1.492 -4.586 1.00 0.00 C ATOM 391 O GLY A 45 23.723 2.025 -5.377 1.00 0.00 O ATOM 0 H GLY A 45 25.813 1.704 -1.990 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.293 3.243 -3.646 1.00 0.00 H new ATOM 0 HA3 GLY A 45 26.398 2.467 -4.763 1.00 0.00 H new ATOM 395 N THR A 46 24.386 0.236 -4.183 1.00 0.00 N ATOM 396 CA THR A 46 23.342 -0.638 -4.669 1.00 0.00 C ATOM 397 C THR A 46 22.001 -0.178 -4.177 1.00 0.00 C ATOM 398 O THR A 46 21.764 -0.119 -2.976 1.00 0.00 O ATOM 399 CB THR A 46 23.579 -2.101 -4.231 1.00 0.00 C ATOM 400 OG1 THR A 46 24.834 -2.547 -4.743 1.00 0.00 O ATOM 401 CG2 THR A 46 22.471 -3.028 -4.730 1.00 0.00 C ATOM 0 H THR A 46 25.015 -0.201 -3.510 1.00 0.00 H new ATOM 0 HA THR A 46 23.363 -0.597 -5.758 1.00 0.00 H new ATOM 0 HB THR A 46 23.578 -2.132 -3.141 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.525 -2.436 -4.057 1.00 0.00 H new ATOM 0 HG21 THR A 46 22.674 -4.047 -4.402 1.00 0.00 H new ATOM 0 HG22 THR A 46 21.513 -2.700 -4.326 1.00 0.00 H new ATOM 0 HG23 THR A 46 22.435 -2.998 -5.819 1.00 0.00 H new ATOM 409 N GLN A 47 21.166 0.202 -5.098 1.00 0.00 N ATOM 410 CA GLN A 47 19.865 0.617 -4.812 1.00 0.00 C ATOM 411 C GLN A 47 18.894 -0.572 -4.934 1.00 0.00 C ATOM 412 O GLN A 47 18.859 -1.292 -5.929 1.00 0.00 O ATOM 413 CB GLN A 47 19.499 1.778 -5.735 1.00 0.00 C ATOM 414 CG GLN A 47 19.293 1.391 -7.184 1.00 0.00 C ATOM 415 CD GLN A 47 19.093 2.583 -8.088 1.00 0.00 C ATOM 416 OE1 GLN A 47 18.577 3.654 -7.547 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 19.419 2.546 -9.268 1.00 0.00 N flip ATOM 0 H GLN A 47 21.398 0.225 -6.091 1.00 0.00 H new ATOM 0 HA GLN A 47 19.793 0.975 -3.785 1.00 0.00 H new ATOM 0 HB2 GLN A 47 18.587 2.246 -5.364 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.287 2.529 -5.682 1.00 0.00 H new ATOM 0 HG2 GLN A 47 20.156 0.821 -7.529 1.00 0.00 H new ATOM 0 HG3 GLN A 47 18.426 0.735 -7.260 1.00 0.00 H new ATOM 0 HE21 GLN A 47 19.819 1.694 -9.660 1.00 0.00 H new ATOM 0 HE22 GLN A 47 19.290 3.367 -9.859 1.00 0.00 H new ATOM 426 N ALA A 48 18.193 -0.781 -3.894 1.00 0.00 N ATOM 427 CA ALA A 48 17.203 -1.789 -3.755 1.00 0.00 C ATOM 428 C ALA A 48 15.887 -1.180 -4.106 1.00 0.00 C ATOM 429 O ALA A 48 15.488 -0.160 -3.519 1.00 0.00 O ATOM 430 CB ALA A 48 17.165 -2.284 -2.312 1.00 0.00 C ATOM 0 H ALA A 48 18.297 -0.216 -3.051 1.00 0.00 H new ATOM 0 HA ALA A 48 17.426 -2.634 -4.407 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.403 -3.057 -2.213 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.138 -2.696 -2.043 1.00 0.00 H new ATOM 0 HB3 ALA A 48 16.927 -1.453 -1.648 1.00 0.00 H new ATOM 436 N ILE A 49 15.245 -1.745 -5.066 1.00 0.00 N ATOM 437 CA ILE A 49 13.988 -1.247 -5.506 1.00 0.00 C ATOM 438 C ILE A 49 12.874 -1.968 -4.782 1.00 0.00 C ATOM 439 O ILE A 49 12.745 -3.212 -4.867 1.00 0.00 O ATOM 440 CB ILE A 49 13.832 -1.402 -7.027 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.031 -0.751 -7.729 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.534 -0.741 -7.473 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.076 -0.969 -9.225 1.00 0.00 C ATOM 0 H ILE A 49 15.576 -2.567 -5.570 1.00 0.00 H new ATOM 0 HA ILE A 49 13.936 -0.183 -5.275 1.00 0.00 H new ATOM 0 HB ILE A 49 13.798 -2.459 -7.291 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.014 0.321 -7.531 1.00 0.00 H new ATOM 0 HG13 ILE A 49 15.949 -1.142 -7.290 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.422 -0.850 -8.552 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.692 -1.217 -6.971 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.558 0.318 -7.216 1.00 0.00 H new ATOM 0 HD11 ILE A 49 15.955 -0.475 -9.638 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.127 -2.037 -9.436 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.178 -0.552 -9.681 1.00 0.00 H new ATOM 455 N TYR A 50 12.111 -1.225 -4.048 1.00 0.00 N ATOM 456 CA TYR A 50 11.024 -1.766 -3.309 1.00 0.00 C ATOM 457 C TYR A 50 9.715 -1.641 -4.020 1.00 0.00 C ATOM 458 O TYR A 50 9.449 -0.663 -4.724 1.00 0.00 O ATOM 459 CB TYR A 50 10.880 -1.097 -1.963 1.00 0.00 C ATOM 460 CG TYR A 50 11.889 -1.491 -0.935 1.00 0.00 C ATOM 461 CD1 TYR A 50 11.712 -2.630 -0.172 1.00 0.00 C ATOM 462 CD2 TYR A 50 13.006 -0.730 -0.712 1.00 0.00 C ATOM 463 CE1 TYR A 50 12.621 -2.989 0.786 1.00 0.00 C ATOM 464 CE2 TYR A 50 13.915 -1.085 0.236 1.00 0.00 C ATOM 465 CZ TYR A 50 13.727 -2.207 0.983 1.00 0.00 C ATOM 466 OH TYR A 50 14.645 -2.543 1.941 1.00 0.00 O ATOM 0 H TYR A 50 12.228 -0.217 -3.946 1.00 0.00 H new ATOM 0 HA TYR A 50 11.264 -2.822 -3.188 1.00 0.00 H new ATOM 0 HB2 TYR A 50 10.936 -0.018 -2.106 1.00 0.00 H new ATOM 0 HB3 TYR A 50 9.886 -1.316 -1.573 1.00 0.00 H new ATOM 0 HD1 TYR A 50 10.841 -3.247 -0.335 1.00 0.00 H new ATOM 0 HD2 TYR A 50 13.167 0.164 -1.297 1.00 0.00 H new ATOM 0 HE1 TYR A 50 12.468 -3.878 1.379 1.00 0.00 H new ATOM 0 HE2 TYR A 50 14.790 -0.473 0.397 1.00 0.00 H new ATOM 0 HH TYR A 50 14.179 -2.830 2.754 1.00 0.00 H new ATOM 476 N LYS A 51 8.919 -2.638 -3.823 1.00 0.00 N ATOM 477 CA LYS A 51 7.567 -2.660 -4.205 1.00 0.00 C ATOM 478 C LYS A 51 6.844 -2.099 -3.027 1.00 0.00 C ATOM 479 O LYS A 51 7.084 -2.537 -1.900 1.00 0.00 O ATOM 480 CB LYS A 51 7.106 -4.101 -4.441 1.00 0.00 C ATOM 481 CG LYS A 51 5.642 -4.230 -4.784 1.00 0.00 C ATOM 482 CD LYS A 51 5.270 -5.661 -5.130 1.00 0.00 C ATOM 483 CE LYS A 51 3.839 -5.766 -5.644 1.00 0.00 C ATOM 484 NZ LYS A 51 3.632 -5.005 -6.899 1.00 0.00 N ATOM 0 H LYS A 51 9.220 -3.499 -3.367 1.00 0.00 H new ATOM 0 HA LYS A 51 7.388 -2.103 -5.125 1.00 0.00 H new ATOM 0 HB2 LYS A 51 7.697 -4.533 -5.249 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.312 -4.688 -3.546 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.040 -3.891 -3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.407 -3.579 -5.626 1.00 0.00 H new ATOM 0 HD2 LYS A 51 5.956 -6.042 -5.886 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.386 -6.290 -4.248 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.593 -6.814 -5.813 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.154 -5.397 -4.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.757 -5.327 -7.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.556 -3.991 -6.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.438 -5.162 -7.537 1.00 0.00 H new ATOM 498 N CYS A 52 5.968 -1.195 -3.258 1.00 0.00 N ATOM 499 CA CYS A 52 5.260 -0.504 -2.199 1.00 0.00 C ATOM 500 C CYS A 52 4.068 -1.376 -1.716 1.00 0.00 C ATOM 501 O CYS A 52 3.032 -0.876 -1.369 1.00 0.00 O ATOM 502 CB CYS A 52 4.787 0.839 -2.784 1.00 0.00 C ATOM 503 SG CYS A 52 4.217 2.075 -1.588 1.00 0.00 S ATOM 0 H CYS A 52 5.704 -0.895 -4.196 1.00 0.00 H new ATOM 0 HA CYS A 52 5.895 -0.325 -1.332 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.607 1.270 -3.358 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.976 0.641 -3.485 1.00 0.00 H new ATOM 508 N ARG A 53 4.282 -2.707 -1.668 1.00 0.00 N ATOM 509 CA ARG A 53 3.262 -3.710 -1.302 1.00 0.00 C ATOM 510 C ARG A 53 2.038 -3.706 -2.222 1.00 0.00 C ATOM 511 O ARG A 53 1.725 -2.706 -2.890 1.00 0.00 O ATOM 512 CB ARG A 53 2.811 -3.609 0.166 1.00 0.00 C ATOM 513 CG ARG A 53 3.767 -4.216 1.172 1.00 0.00 C ATOM 514 CD ARG A 53 3.150 -4.201 2.553 1.00 0.00 C ATOM 515 NE ARG A 53 3.985 -4.857 3.560 1.00 0.00 N ATOM 516 CZ ARG A 53 3.558 -5.795 4.424 1.00 0.00 C ATOM 517 NH1 ARG A 53 2.361 -6.364 4.268 1.00 0.00 N ATOM 518 NH2 ARG A 53 4.360 -6.201 5.402 1.00 0.00 N ATOM 0 H ARG A 53 5.187 -3.123 -1.887 1.00 0.00 H new ATOM 0 HA ARG A 53 3.774 -4.663 -1.436 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.665 -2.558 0.414 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.842 -4.098 0.267 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.008 -5.239 0.884 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.703 -3.658 1.178 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.971 -3.169 2.854 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.179 -4.695 2.516 1.00 0.00 H new ATOM 0 HE ARG A 53 4.966 -4.582 3.610 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.763 -6.088 3.489 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.044 -7.075 4.928 1.00 0.00 H new ATOM 0 HH21 ARG A 53 5.294 -5.802 5.495 1.00 0.00 H new ATOM 0 HH22 ARG A 53 4.042 -6.912 6.060 1.00 0.00 H new ATOM 532 N PRO A 54 1.345 -4.835 -2.323 1.00 0.00 N ATOM 533 CA PRO A 54 0.115 -4.891 -3.058 1.00 0.00 C ATOM 534 C PRO A 54 -0.981 -4.100 -2.332 1.00 0.00 C ATOM 535 O PRO A 54 -1.629 -4.597 -1.403 1.00 0.00 O ATOM 536 CB PRO A 54 -0.221 -6.386 -3.127 1.00 0.00 C ATOM 537 CG PRO A 54 0.489 -6.992 -1.968 1.00 0.00 C ATOM 538 CD PRO A 54 1.719 -6.158 -1.757 1.00 0.00 C ATOM 0 HA PRO A 54 0.195 -4.448 -4.051 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.296 -6.553 -3.063 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.114 -6.823 -4.068 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.142 -6.990 -1.079 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.751 -8.031 -2.170 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.977 -6.084 -0.701 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.584 -6.582 -2.267 1.00 0.00 H new ATOM 546 N GLY A 55 -1.114 -2.842 -2.697 1.00 0.00 N ATOM 547 CA GLY A 55 -2.131 -2.023 -2.117 1.00 0.00 C ATOM 548 C GLY A 55 -1.662 -0.634 -1.773 1.00 0.00 C ATOM 549 O GLY A 55 -2.460 0.283 -1.653 1.00 0.00 O ATOM 0 H GLY A 55 -0.529 -2.376 -3.390 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -2.969 -1.953 -2.810 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.504 -2.506 -1.214 1.00 0.00 H new ATOM 553 N TYR A 56 -0.399 -0.445 -1.622 1.00 0.00 N ATOM 554 CA TYR A 56 0.076 0.884 -1.314 1.00 0.00 C ATOM 555 C TYR A 56 0.678 1.521 -2.549 1.00 0.00 C ATOM 556 O TYR A 56 0.833 0.861 -3.595 1.00 0.00 O ATOM 557 CB TYR A 56 1.069 0.891 -0.136 1.00 0.00 C ATOM 558 CG TYR A 56 0.480 0.484 1.197 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.312 -0.851 1.541 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.086 1.445 2.108 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.235 -1.206 2.759 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.461 1.100 3.321 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.619 -0.220 3.644 1.00 0.00 C ATOM 564 OH TYR A 56 -1.186 -0.554 4.848 1.00 0.00 O ATOM 0 H TYR A 56 0.319 -1.165 -1.701 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.781 1.478 -0.997 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.895 0.220 -0.372 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.490 1.892 -0.040 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.613 -1.622 0.847 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.210 2.489 1.862 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.361 -2.247 3.016 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.765 1.868 4.017 1.00 0.00 H new ATOM 0 HH TYR A 56 -1.395 0.262 5.349 1.00 0.00 H new ATOM 574 N ARG A 57 0.931 2.792 -2.463 1.00 0.00 N ATOM 575 CA ARG A 57 1.567 3.537 -3.509 1.00 0.00 C ATOM 576 C ARG A 57 2.321 4.669 -2.869 1.00 0.00 C ATOM 577 O ARG A 57 2.237 4.870 -1.663 1.00 0.00 O ATOM 578 CB ARG A 57 0.572 4.127 -4.527 1.00 0.00 C ATOM 579 CG ARG A 57 -0.365 5.195 -3.963 1.00 0.00 C ATOM 580 CD ARG A 57 -0.852 6.114 -5.071 1.00 0.00 C ATOM 581 NE ARG A 57 0.279 6.863 -5.654 1.00 0.00 N ATOM 582 CZ ARG A 57 0.289 7.499 -6.835 1.00 0.00 C ATOM 583 NH1 ARG A 57 -0.813 7.599 -7.564 1.00 0.00 N ATOM 584 NH2 ARG A 57 1.413 8.058 -7.259 1.00 0.00 N ATOM 0 H ARG A 57 0.696 3.354 -1.645 1.00 0.00 H new ATOM 0 HA ARG A 57 2.218 2.855 -4.057 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.134 4.558 -5.355 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.030 3.316 -4.938 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.217 4.720 -3.476 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.154 5.777 -3.201 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.347 5.529 -5.846 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.592 6.810 -4.676 1.00 0.00 H new ATOM 0 HE ARG A 57 1.137 6.901 -5.104 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.685 7.189 -7.229 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.789 8.086 -8.460 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.257 8.002 -6.689 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.434 8.545 -8.155 1.00 0.00 H new ATOM 598 N SER A 58 3.016 5.404 -3.649 1.00 0.00 N ATOM 599 CA SER A 58 3.738 6.519 -3.175 1.00 0.00 C ATOM 600 C SER A 58 4.016 7.414 -4.353 1.00 0.00 C ATOM 601 O SER A 58 3.401 7.260 -5.425 1.00 0.00 O ATOM 602 CB SER A 58 5.028 6.023 -2.478 1.00 0.00 C ATOM 603 OG SER A 58 5.744 7.083 -1.849 1.00 0.00 O ATOM 0 H SER A 58 3.101 5.245 -4.653 1.00 0.00 H new ATOM 0 HA SER A 58 3.178 7.091 -2.435 1.00 0.00 H new ATOM 0 HB2 SER A 58 4.770 5.270 -1.734 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.672 5.538 -3.212 1.00 0.00 H new ATOM 0 HG SER A 58 5.484 7.139 -0.906 1.00 0.00 H new ATOM 609 N LEU A 59 4.902 8.325 -4.165 1.00 0.00 N ATOM 610 CA LEU A 59 5.289 9.271 -5.173 1.00 0.00 C ATOM 611 C LEU A 59 6.256 8.593 -6.152 1.00 0.00 C ATOM 612 O LEU A 59 6.553 9.104 -7.238 1.00 0.00 O ATOM 613 CB LEU A 59 5.946 10.488 -4.509 1.00 0.00 C ATOM 614 CG LEU A 59 5.074 11.396 -3.597 1.00 0.00 C ATOM 615 CD1 LEU A 59 3.766 11.786 -4.262 1.00 0.00 C ATOM 616 CD2 LEU A 59 4.838 10.781 -2.219 1.00 0.00 C ATOM 0 H LEU A 59 5.398 8.444 -3.282 1.00 0.00 H new ATOM 0 HA LEU A 59 4.413 9.613 -5.725 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.785 10.128 -3.914 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.361 11.113 -5.300 1.00 0.00 H new ATOM 0 HG LEU A 59 5.645 12.312 -3.443 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.190 12.420 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.974 12.331 -5.183 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.193 10.888 -4.493 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.224 11.454 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.326 9.825 -2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.795 10.625 -1.722 1.00 0.00 H new ATOM 628 N GLY A 60 6.730 7.442 -5.747 1.00 0.00 N ATOM 629 CA GLY A 60 7.589 6.639 -6.538 1.00 0.00 C ATOM 630 C GLY A 60 7.943 5.415 -5.763 1.00 0.00 C ATOM 631 O GLY A 60 7.551 5.312 -4.591 1.00 0.00 O ATOM 0 H GLY A 60 6.516 7.039 -4.834 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.098 6.366 -7.472 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.490 7.194 -6.801 1.00 0.00 H new ATOM 635 N ASN A 61 8.633 4.488 -6.380 1.00 0.00 N ATOM 636 CA ASN A 61 9.077 3.283 -5.690 1.00 0.00 C ATOM 637 C ASN A 61 10.094 3.647 -4.630 1.00 0.00 C ATOM 638 O ASN A 61 10.940 4.521 -4.849 1.00 0.00 O ATOM 639 CB ASN A 61 9.677 2.246 -6.670 1.00 0.00 C ATOM 640 CG ASN A 61 8.631 1.480 -7.478 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.184 1.926 -8.538 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.265 0.308 -7.011 1.00 0.00 N ATOM 0 H ASN A 61 8.904 4.537 -7.362 1.00 0.00 H new ATOM 0 HA ASN A 61 8.206 2.825 -5.222 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.350 2.758 -7.358 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.279 1.534 -6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.594 -0.260 -7.528 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.652 -0.034 -6.131 1.00 0.00 H new ATOM 649 N VAL A 62 9.980 3.027 -3.476 1.00 0.00 N ATOM 650 CA VAL A 62 10.904 3.263 -2.392 1.00 0.00 C ATOM 651 C VAL A 62 12.246 2.653 -2.765 1.00 0.00 C ATOM 652 O VAL A 62 12.324 1.474 -3.118 1.00 0.00 O ATOM 653 CB VAL A 62 10.378 2.667 -1.054 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.373 2.883 0.082 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.029 3.285 -0.695 1.00 0.00 C ATOM 0 H VAL A 62 9.248 2.349 -3.265 1.00 0.00 H new ATOM 0 HA VAL A 62 11.012 4.337 -2.237 1.00 0.00 H new ATOM 0 HB VAL A 62 10.255 1.593 -1.193 1.00 0.00 H new ATOM 0 HG11 VAL A 62 10.974 2.455 1.001 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.317 2.398 -0.164 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.539 3.951 0.222 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.672 2.860 0.243 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.141 4.364 -0.585 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.310 3.074 -1.486 1.00 0.00 H new ATOM 665 N ILE A 63 13.274 3.458 -2.748 1.00 0.00 N ATOM 666 CA ILE A 63 14.577 3.011 -3.157 1.00 0.00 C ATOM 667 C ILE A 63 15.547 3.100 -1.991 1.00 0.00 C ATOM 668 O ILE A 63 15.718 4.175 -1.384 1.00 0.00 O ATOM 669 CB ILE A 63 15.112 3.858 -4.347 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.118 3.856 -5.528 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.466 3.346 -4.806 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.831 2.486 -6.096 1.00 0.00 C ATOM 0 H ILE A 63 13.233 4.434 -2.453 1.00 0.00 H new ATOM 0 HA ILE A 63 14.491 1.974 -3.483 1.00 0.00 H new ATOM 0 HB ILE A 63 15.224 4.884 -3.996 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.180 4.304 -5.199 1.00 0.00 H new ATOM 0 HG13 ILE A 63 14.513 4.490 -6.322 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.821 3.953 -5.639 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.177 3.409 -3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.373 2.308 -5.127 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.124 2.575 -6.921 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.758 2.041 -6.459 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.404 1.852 -5.319 1.00 0.00 H new ATOM 684 N MET A 64 16.191 1.999 -1.690 1.00 0.00 N ATOM 685 CA MET A 64 17.146 1.948 -0.580 1.00 0.00 C ATOM 686 C MET A 64 18.412 1.491 -1.046 1.00 0.00 C ATOM 687 O MET A 64 18.506 0.555 -1.749 1.00 0.00 O ATOM 688 CB MET A 64 16.721 1.125 0.602 1.00 0.00 C ATOM 689 CG MET A 64 15.575 1.698 1.375 1.00 0.00 C ATOM 690 SD MET A 64 15.182 0.721 2.840 1.00 0.00 S ATOM 691 CE MET A 64 16.722 0.876 3.748 1.00 0.00 C ATOM 0 H MET A 64 16.080 1.118 -2.192 1.00 0.00 H new ATOM 0 HA MET A 64 17.203 2.973 -0.214 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.447 0.128 0.256 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.573 1.007 1.272 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.815 2.718 1.675 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.697 1.754 0.732 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.257 -0.074 3.722 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.337 1.651 3.291 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.509 1.144 4.783 1.00 0.00 H new ATOM 701 N VAL A 65 19.390 2.149 -0.637 1.00 0.00 N ATOM 702 CA VAL A 65 20.651 1.960 -1.196 1.00 0.00 C ATOM 703 C VAL A 65 21.657 1.749 -0.117 1.00 0.00 C ATOM 704 O VAL A 65 21.508 2.239 1.005 1.00 0.00 O ATOM 705 CB VAL A 65 20.998 3.160 -2.109 1.00 0.00 C ATOM 706 CG1 VAL A 65 19.823 3.639 -2.797 1.00 0.00 C ATOM 707 CG2 VAL A 65 21.895 4.228 -1.508 1.00 0.00 C ATOM 0 H VAL A 65 19.348 2.847 0.106 1.00 0.00 H new ATOM 0 HA VAL A 65 20.658 1.065 -1.818 1.00 0.00 H new ATOM 0 HB VAL A 65 21.670 2.770 -2.873 1.00 0.00 H new ATOM 0 HG11 VAL A 65 20.092 4.483 -3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 65 19.410 2.839 -3.411 1.00 0.00 H new ATOM 0 HG13 VAL A 65 19.079 3.958 -2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.066 5.015 -2.242 1.00 0.00 H new ATOM 0 HG22 VAL A 65 21.415 4.653 -0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.849 3.784 -1.223 1.00 0.00 H new ATOM 717 N CYS A 66 22.623 1.005 -0.441 1.00 0.00 N ATOM 718 CA CYS A 66 23.645 0.647 0.466 1.00 0.00 C ATOM 719 C CYS A 66 24.677 1.755 0.520 1.00 0.00 C ATOM 720 O CYS A 66 25.144 2.224 -0.524 1.00 0.00 O ATOM 721 CB CYS A 66 24.263 -0.616 -0.044 1.00 0.00 C ATOM 722 SG CYS A 66 25.274 -1.517 1.125 1.00 0.00 S ATOM 0 H CYS A 66 22.739 0.609 -1.374 1.00 0.00 H new ATOM 0 HA CYS A 66 23.251 0.498 1.472 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.466 -1.274 -0.389 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.875 -0.374 -0.913 1.00 0.00 H new ATOM 727 N ARG A 67 24.997 2.196 1.703 1.00 0.00 N ATOM 728 CA ARG A 67 25.980 3.226 1.900 1.00 0.00 C ATOM 729 C ARG A 67 26.582 3.066 3.273 1.00 0.00 C ATOM 730 O ARG A 67 25.850 3.078 4.272 1.00 0.00 O ATOM 731 CB ARG A 67 25.347 4.613 1.744 1.00 0.00 C ATOM 732 CG ARG A 67 26.329 5.768 1.878 1.00 0.00 C ATOM 733 CD ARG A 67 25.661 7.102 1.608 1.00 0.00 C ATOM 734 NE ARG A 67 24.596 7.418 2.570 1.00 0.00 N ATOM 735 CZ ARG A 67 23.461 8.087 2.267 1.00 0.00 C ATOM 736 NH1 ARG A 67 23.122 8.311 0.999 1.00 0.00 N ATOM 737 NH2 ARG A 67 22.642 8.476 3.228 1.00 0.00 N ATOM 0 H ARG A 67 24.580 1.848 2.566 1.00 0.00 H new ATOM 0 HA ARG A 67 26.762 3.134 1.147 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.866 4.672 0.768 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.564 4.728 2.493 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.755 5.770 2.881 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.155 5.627 1.181 1.00 0.00 H new ATOM 0 HD2 ARG A 67 26.413 7.890 1.636 1.00 0.00 H new ATOM 0 HD3 ARG A 67 25.243 7.095 0.601 1.00 0.00 H new ATOM 0 HE ARG A 67 24.722 7.111 3.534 1.00 0.00 H new ATOM 0 HH11 ARG A 67 23.721 7.977 0.244 1.00 0.00 H new ATOM 0 HH12 ARG A 67 22.263 8.817 0.782 1.00 0.00 H new ATOM 0 HH21 ARG A 67 22.865 8.272 4.202 1.00 0.00 H new ATOM 0 HH22 ARG A 67 21.786 8.981 2.996 1.00 0.00 H new ATOM 751 N LYS A 68 27.904 2.895 3.318 1.00 0.00 N ATOM 752 CA LYS A 68 28.663 2.714 4.563 1.00 0.00 C ATOM 753 C LYS A 68 28.261 1.428 5.261 1.00 0.00 C ATOM 754 O LYS A 68 28.276 1.329 6.487 1.00 0.00 O ATOM 755 CB LYS A 68 28.482 3.917 5.487 1.00 0.00 C ATOM 756 CG LYS A 68 28.922 5.240 4.855 1.00 0.00 C ATOM 757 CD LYS A 68 30.397 5.224 4.477 1.00 0.00 C ATOM 758 CE LYS A 68 30.826 6.534 3.827 1.00 0.00 C ATOM 759 NZ LYS A 68 32.256 6.526 3.433 1.00 0.00 N ATOM 0 H LYS A 68 28.488 2.878 2.482 1.00 0.00 H new ATOM 0 HA LYS A 68 29.720 2.640 4.308 1.00 0.00 H new ATOM 0 HB2 LYS A 68 27.433 3.991 5.774 1.00 0.00 H new ATOM 0 HB3 LYS A 68 29.052 3.752 6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 68 28.321 5.436 3.967 1.00 0.00 H new ATOM 0 HG3 LYS A 68 28.735 6.056 5.553 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.999 5.045 5.368 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.588 4.398 3.792 1.00 0.00 H new ATOM 0 HE2 LYS A 68 30.210 6.719 2.947 1.00 0.00 H new ATOM 0 HE3 LYS A 68 30.647 7.356 4.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 32.501 7.437 2.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 32.847 6.376 4.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 32.424 5.759 2.751 1.00 0.00 H new ATOM 773 N GLY A 69 27.903 0.446 4.468 1.00 0.00 N ATOM 774 CA GLY A 69 27.554 -0.854 4.982 1.00 0.00 C ATOM 775 C GLY A 69 26.099 -0.977 5.369 1.00 0.00 C ATOM 776 O GLY A 69 25.590 -2.100 5.521 1.00 0.00 O ATOM 0 H GLY A 69 27.846 0.526 3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 69 27.787 -1.608 4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 69 28.173 -1.070 5.853 1.00 0.00 H new ATOM 780 N GLU A 70 25.427 0.140 5.555 1.00 0.00 N ATOM 781 CA GLU A 70 24.034 0.093 5.925 1.00 0.00 C ATOM 782 C GLU A 70 23.144 0.370 4.733 1.00 0.00 C ATOM 783 O GLU A 70 23.607 0.869 3.698 1.00 0.00 O ATOM 784 CB GLU A 70 23.727 1.017 7.121 1.00 0.00 C ATOM 785 CG GLU A 70 24.093 2.481 6.944 1.00 0.00 C ATOM 786 CD GLU A 70 23.986 3.237 8.243 1.00 0.00 C ATOM 787 OE1 GLU A 70 24.954 3.225 9.027 1.00 0.00 O ATOM 788 OE2 GLU A 70 22.917 3.852 8.523 1.00 0.00 O ATOM 0 H GLU A 70 25.818 1.077 5.457 1.00 0.00 H new ATOM 0 HA GLU A 70 23.812 -0.920 6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.661 0.954 7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 70 24.254 0.634 7.995 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.110 2.559 6.559 1.00 0.00 H new ATOM 0 HG3 GLU A 70 23.435 2.935 6.202 1.00 0.00 H new ATOM 795 N TRP A 71 21.890 0.071 4.884 1.00 0.00 N ATOM 796 CA TRP A 71 20.931 0.244 3.850 1.00 0.00 C ATOM 797 C TRP A 71 20.120 1.412 4.211 1.00 0.00 C ATOM 798 O TRP A 71 19.438 1.428 5.239 1.00 0.00 O ATOM 799 CB TRP A 71 20.062 -1.001 3.643 1.00 0.00 C ATOM 800 CG TRP A 71 20.759 -2.136 2.942 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.424 -3.184 3.509 1.00 0.00 C ATOM 802 CD2 TRP A 71 20.838 -2.331 1.522 1.00 0.00 C ATOM 803 NE1 TRP A 71 21.905 -4.021 2.525 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.562 -3.515 1.297 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.363 -1.614 0.424 1.00 0.00 C ATOM 806 CZ2 TRP A 71 21.822 -3.998 0.006 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.621 -2.091 -0.842 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.343 -3.269 -1.043 1.00 0.00 C ATOM 0 H TRP A 71 21.503 -0.307 5.749 1.00 0.00 H new ATOM 0 HA TRP A 71 21.437 0.401 2.897 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.712 -1.350 4.614 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.180 -0.722 3.067 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.554 -3.335 4.570 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.432 -4.880 2.685 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.803 -0.701 0.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.379 -4.910 -0.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.257 -1.542 -1.698 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.526 -3.611 -2.051 1.00 0.00 H new ATOM 819 N VAL A 72 20.209 2.391 3.417 1.00 0.00 N ATOM 820 CA VAL A 72 19.605 3.600 3.690 1.00 0.00 C ATOM 821 C VAL A 72 18.776 4.007 2.548 1.00 0.00 C ATOM 822 O VAL A 72 18.550 3.261 1.645 1.00 0.00 O ATOM 823 CB VAL A 72 20.681 4.611 3.977 1.00 0.00 C ATOM 824 CG1 VAL A 72 21.426 5.278 2.837 1.00 0.00 C ATOM 825 CG2 VAL A 72 20.580 5.316 5.277 1.00 0.00 C ATOM 0 H VAL A 72 20.721 2.365 2.535 1.00 0.00 H new ATOM 0 HA VAL A 72 18.952 3.520 4.559 1.00 0.00 H new ATOM 0 HB VAL A 72 21.507 3.924 4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.161 5.974 3.241 1.00 0.00 H new ATOM 0 HG12 VAL A 72 21.933 4.520 2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 72 20.720 5.821 2.209 1.00 0.00 H new ATOM 0 HG21 VAL A 72 21.407 6.019 5.375 1.00 0.00 H new ATOM 0 HG22 VAL A 72 19.635 5.858 5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 72 20.623 4.590 6.089 1.00 0.00 H new ATOM 835 N ALA A 73 18.404 5.166 2.577 1.00 0.00 N ATOM 836 CA ALA A 73 17.474 5.698 1.662 1.00 0.00 C ATOM 837 C ALA A 73 18.146 6.483 0.546 1.00 0.00 C ATOM 838 O ALA A 73 18.969 7.370 0.810 1.00 0.00 O ATOM 839 CB ALA A 73 16.597 6.569 2.453 1.00 0.00 C ATOM 0 H ALA A 73 18.736 5.842 3.265 1.00 0.00 H new ATOM 0 HA ALA A 73 16.924 4.899 1.166 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.847 7.018 1.802 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.102 5.981 3.226 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.190 7.356 2.919 1.00 0.00 H new ATOM 845 N LEU A 74 17.812 6.143 -0.702 1.00 0.00 N ATOM 846 CA LEU A 74 18.299 6.914 -1.850 1.00 0.00 C ATOM 847 C LEU A 74 17.408 8.096 -1.936 1.00 0.00 C ATOM 848 O LEU A 74 17.824 9.254 -1.955 1.00 0.00 O ATOM 849 CB LEU A 74 18.056 6.167 -3.152 1.00 0.00 C ATOM 850 CG LEU A 74 18.853 6.611 -4.414 1.00 0.00 C ATOM 851 CD1 LEU A 74 18.239 7.814 -5.107 1.00 0.00 C ATOM 852 CD2 LEU A 74 20.325 6.903 -4.110 1.00 0.00 C ATOM 0 H LEU A 74 17.215 5.351 -0.942 1.00 0.00 H new ATOM 0 HA LEU A 74 19.360 7.128 -1.723 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.271 5.113 -2.976 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.994 6.241 -3.386 1.00 0.00 H new ATOM 0 HG LEU A 74 18.798 5.757 -5.090 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.838 8.077 -5.979 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.224 7.573 -5.423 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.213 8.657 -4.417 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.832 7.208 -5.025 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.393 7.704 -3.374 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.800 6.005 -3.714 1.00 0.00 H new ATOM 864 N ASN A 75 16.133 7.751 -2.006 1.00 0.00 N ATOM 865 CA ASN A 75 15.081 8.679 -2.120 1.00 0.00 C ATOM 866 C ASN A 75 14.368 8.732 -0.786 1.00 0.00 C ATOM 867 O ASN A 75 13.514 7.890 -0.508 1.00 0.00 O ATOM 868 CB ASN A 75 14.059 8.266 -3.207 1.00 0.00 C ATOM 869 CG ASN A 75 14.605 8.193 -4.619 1.00 0.00 C ATOM 870 OD1 ASN A 75 15.084 7.149 -5.064 1.00 0.00 O ATOM 871 ND2 ASN A 75 14.519 9.275 -5.331 1.00 0.00 N ATOM 0 H ASN A 75 15.819 6.781 -1.982 1.00 0.00 H new ATOM 0 HA ASN A 75 15.497 9.646 -2.402 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.648 7.291 -2.944 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.232 8.975 -3.192 1.00 0.00 H new ATOM 0 HD21 ASN A 75 14.855 9.280 -6.294 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.116 10.120 -4.927 1.00 0.00 H new ATOM 878 N PRO A 76 14.730 9.669 0.086 1.00 0.00 N ATOM 879 CA PRO A 76 14.122 9.782 1.412 1.00 0.00 C ATOM 880 C PRO A 76 12.691 10.328 1.362 1.00 0.00 C ATOM 881 O PRO A 76 11.961 10.279 2.342 1.00 0.00 O ATOM 882 CB PRO A 76 15.045 10.746 2.150 1.00 0.00 C ATOM 883 CG PRO A 76 15.725 11.538 1.083 1.00 0.00 C ATOM 884 CD PRO A 76 15.779 10.676 -0.133 1.00 0.00 C ATOM 0 HA PRO A 76 14.029 8.810 1.897 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.481 11.394 2.821 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.769 10.207 2.761 1.00 0.00 H new ATOM 0 HG2 PRO A 76 15.179 12.459 0.879 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.729 11.826 1.397 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.592 11.254 -1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.758 10.211 -0.248 1.00 0.00 H new ATOM 892 N LEU A 77 12.283 10.804 0.197 1.00 0.00 N ATOM 893 CA LEU A 77 10.954 11.367 0.000 1.00 0.00 C ATOM 894 C LEU A 77 9.979 10.283 -0.425 1.00 0.00 C ATOM 895 O LEU A 77 8.968 10.546 -1.097 1.00 0.00 O ATOM 896 CB LEU A 77 10.976 12.504 -1.049 1.00 0.00 C ATOM 897 CG LEU A 77 11.788 13.766 -0.705 1.00 0.00 C ATOM 898 CD1 LEU A 77 11.414 14.314 0.663 1.00 0.00 C ATOM 899 CD2 LEU A 77 13.282 13.534 -0.826 1.00 0.00 C ATOM 0 H LEU A 77 12.864 10.812 -0.641 1.00 0.00 H new ATOM 0 HA LEU A 77 10.625 11.789 0.950 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.366 12.095 -1.981 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.946 12.807 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 77 11.526 14.524 -1.443 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.007 15.204 0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.355 14.572 0.675 1.00 0.00 H new ATOM 0 HD13 LEU A 77 11.612 13.559 1.424 1.00 0.00 H new ATOM 0 HD21 LEU A 77 13.814 14.451 -0.574 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.583 12.740 -0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.523 13.244 -1.849 1.00 0.00 H new ATOM 911 N ARG A 78 10.271 9.071 -0.032 1.00 0.00 N ATOM 912 CA ARG A 78 9.437 7.946 -0.339 1.00 0.00 C ATOM 913 C ARG A 78 9.009 7.256 0.925 1.00 0.00 C ATOM 914 O ARG A 78 9.786 7.127 1.866 1.00 0.00 O ATOM 915 CB ARG A 78 10.135 6.947 -1.263 1.00 0.00 C ATOM 916 CG ARG A 78 10.592 7.531 -2.576 1.00 0.00 C ATOM 917 CD ARG A 78 9.451 8.183 -3.319 1.00 0.00 C ATOM 918 NE ARG A 78 9.911 8.813 -4.539 1.00 0.00 N ATOM 919 CZ ARG A 78 9.751 10.097 -4.856 1.00 0.00 C ATOM 920 NH1 ARG A 78 9.247 10.962 -3.966 1.00 0.00 N ATOM 921 NH2 ARG A 78 10.149 10.527 -6.038 1.00 0.00 N ATOM 0 H ARG A 78 11.101 8.838 0.514 1.00 0.00 H new ATOM 0 HA ARG A 78 8.561 8.327 -0.864 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.998 6.531 -0.743 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.455 6.119 -1.464 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.377 8.266 -2.395 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.027 6.745 -3.193 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.694 7.436 -3.556 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.975 8.927 -2.680 1.00 0.00 H new ATOM 0 HE ARG A 78 10.399 8.223 -5.213 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.982 10.640 -3.035 1.00 0.00 H new ATOM 0 HH12 ARG A 78 9.129 11.943 -4.219 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.575 9.878 -6.700 1.00 0.00 H new ATOM 0 HH22 ARG A 78 10.031 11.508 -6.290 1.00 0.00 H new ATOM 935 N LYS A 79 7.776 6.850 0.934 1.00 0.00 N ATOM 936 CA LYS A 79 7.166 6.122 2.024 1.00 0.00 C ATOM 937 C LYS A 79 5.875 5.586 1.478 1.00 0.00 C ATOM 938 O LYS A 79 5.264 6.237 0.620 1.00 0.00 O ATOM 939 CB LYS A 79 6.903 7.039 3.247 1.00 0.00 C ATOM 940 CG LYS A 79 5.805 8.093 3.054 1.00 0.00 C ATOM 941 CD LYS A 79 5.715 9.038 4.247 1.00 0.00 C ATOM 942 CE LYS A 79 6.902 9.986 4.290 1.00 0.00 C ATOM 943 NZ LYS A 79 6.931 10.802 5.520 1.00 0.00 N ATOM 0 H LYS A 79 7.137 7.019 0.157 1.00 0.00 H new ATOM 0 HA LYS A 79 7.821 5.327 2.379 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.637 6.413 4.099 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.832 7.549 3.504 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.006 8.667 2.149 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.845 7.597 2.910 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.790 9.612 4.190 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.675 8.459 5.170 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.825 9.411 4.218 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.868 10.644 3.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.759 11.431 5.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 6.064 11.373 5.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.991 10.178 6.350 1.00 0.00 H new ATOM 957 N CYS A 80 5.476 4.439 1.893 1.00 0.00 N ATOM 958 CA CYS A 80 4.263 3.868 1.372 1.00 0.00 C ATOM 959 C CYS A 80 3.021 4.457 1.967 1.00 0.00 C ATOM 960 O CYS A 80 2.861 4.559 3.195 1.00 0.00 O ATOM 961 CB CYS A 80 4.267 2.366 1.403 1.00 0.00 C ATOM 962 SG CYS A 80 5.275 1.656 0.090 1.00 0.00 S ATOM 0 H CYS A 80 5.960 3.871 2.588 1.00 0.00 H new ATOM 0 HA CYS A 80 4.240 4.151 0.320 1.00 0.00 H new ATOM 0 HB2 CYS A 80 4.641 2.026 2.369 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.244 2.000 1.310 1.00 0.00 H new ATOM 967 N GLN A 81 2.172 4.900 1.084 1.00 0.00 N ATOM 968 CA GLN A 81 0.922 5.518 1.426 1.00 0.00 C ATOM 969 C GLN A 81 -0.194 4.687 0.821 1.00 0.00 C ATOM 970 O GLN A 81 0.024 3.989 -0.175 1.00 0.00 O ATOM 971 CB GLN A 81 0.905 6.925 0.840 1.00 0.00 C ATOM 972 CG GLN A 81 2.112 7.748 1.254 1.00 0.00 C ATOM 973 CD GLN A 81 2.185 9.087 0.580 1.00 0.00 C ATOM 974 OE1 GLN A 81 1.726 9.259 -0.546 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.748 10.042 1.255 1.00 0.00 N ATOM 0 H GLN A 81 2.334 4.840 0.079 1.00 0.00 H new ATOM 0 HA GLN A 81 0.791 5.576 2.507 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.870 6.861 -0.248 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.004 7.436 1.158 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.088 7.895 2.334 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.019 7.187 1.028 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.117 9.858 2.188 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.821 10.976 0.853 1.00 0.00 H new ATOM 984 N LYS A 82 -1.357 4.723 1.402 1.00 0.00 N ATOM 985 CA LYS A 82 -2.459 3.949 0.876 1.00 0.00 C ATOM 986 C LYS A 82 -2.960 4.556 -0.416 1.00 0.00 C ATOM 987 O LYS A 82 -3.098 5.782 -0.526 1.00 0.00 O ATOM 988 CB LYS A 82 -3.608 3.864 1.866 1.00 0.00 C ATOM 989 CG LYS A 82 -3.281 3.189 3.178 1.00 0.00 C ATOM 990 CD LYS A 82 -4.521 3.127 4.019 1.00 0.00 C ATOM 991 CE LYS A 82 -4.296 2.525 5.381 1.00 0.00 C ATOM 992 NZ LYS A 82 -5.565 2.489 6.137 1.00 0.00 N ATOM 0 H LYS A 82 -1.573 5.273 2.233 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.087 2.941 0.691 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.962 4.874 2.074 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.432 3.328 1.396 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.897 2.185 2.999 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.499 3.741 3.700 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.920 4.134 4.138 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.278 2.544 3.494 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.896 1.516 5.280 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.555 3.109 5.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.369 2.266 7.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.033 3.416 6.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.188 1.760 5.735 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.214 3.715 -1.391 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.740 4.183 -2.650 1.00 0.00 C ATOM 1008 C ARG A 83 -5.228 4.452 -2.487 1.00 0.00 C ATOM 1009 O ARG A 83 -5.897 3.766 -1.702 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.476 3.170 -3.782 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.149 1.828 -3.600 1.00 0.00 C ATOM 1012 CD ARG A 83 -3.782 0.868 -4.709 1.00 0.00 C ATOM 1013 NE ARG A 83 -2.323 0.597 -4.792 1.00 0.00 N ATOM 1014 CZ ARG A 83 -1.751 -0.210 -5.701 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -2.506 -0.909 -6.528 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -0.425 -0.352 -5.736 1.00 0.00 N ATOM 0 H ARG A 83 -3.065 2.707 -1.337 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.233 5.106 -2.932 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.810 3.604 -4.724 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.401 3.013 -3.867 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.860 1.403 -2.639 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.230 1.962 -3.577 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.311 -0.073 -4.556 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -4.124 1.275 -5.661 1.00 0.00 H new ATOM 0 HE ARG A 83 -1.715 1.055 -4.113 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.522 -0.836 -6.476 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.073 -1.522 -7.219 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.160 0.153 -5.070 1.00 0.00 H new ATOM 0 HH22 ARG A 83 0.004 -0.966 -6.428 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.754 5.466 -3.166 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.166 5.809 -3.078 1.00 0.00 C ATOM 1032 C PRO A 84 -8.051 4.829 -3.863 1.00 0.00 C ATOM 1033 O PRO A 84 -7.564 4.025 -4.682 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.223 7.195 -3.713 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.119 7.190 -4.695 1.00 0.00 C ATOM 1036 CD PRO A 84 -5.023 6.386 -4.065 1.00 0.00 C ATOM 0 HA PRO A 84 -7.536 5.773 -2.053 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.184 7.373 -4.195 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -7.090 7.980 -2.968 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.436 6.748 -5.639 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.785 8.204 -4.914 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.442 5.843 -4.811 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.325 7.017 -3.515 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.334 4.894 -3.608 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.296 4.036 -4.278 1.00 0.00 C ATOM 1046 C CYS A 85 -11.305 4.879 -5.039 1.00 0.00 C ATOM 1047 O CYS A 85 -12.321 4.378 -5.539 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.999 3.192 -3.250 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.868 2.294 -2.174 1.00 0.00 S ATOM 0 H CYS A 85 -9.746 5.539 -2.934 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.778 3.391 -4.988 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.639 3.831 -2.641 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.650 2.480 -3.758 1.00 0.00 H new ATOM 1054 N GLY A 86 -11.024 6.159 -5.085 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.829 7.102 -5.806 1.00 0.00 C ATOM 1056 C GLY A 86 -13.119 7.386 -5.100 1.00 0.00 C ATOM 1057 O GLY A 86 -13.174 8.190 -4.173 1.00 0.00 O ATOM 0 H GLY A 86 -10.220 6.575 -4.616 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.273 8.031 -5.935 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -12.038 6.714 -6.803 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.139 6.708 -5.512 1.00 0.00 N ATOM 1062 CA HIS A 87 -15.447 6.858 -4.962 1.00 0.00 C ATOM 1063 C HIS A 87 -16.100 5.489 -5.123 1.00 0.00 C ATOM 1064 O HIS A 87 -15.893 4.841 -6.148 1.00 0.00 O ATOM 1065 CB HIS A 87 -16.191 7.929 -5.782 1.00 0.00 C ATOM 1066 CG HIS A 87 -17.339 8.612 -5.102 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -18.652 8.398 -5.435 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -17.353 9.595 -4.171 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -19.420 9.218 -4.753 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -18.658 9.950 -3.980 1.00 0.00 N ATOM 0 H HIS A 87 -14.085 6.016 -6.260 1.00 0.00 H new ATOM 0 HA HIS A 87 -15.453 7.172 -3.918 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -15.471 8.690 -6.083 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -16.563 7.463 -6.695 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -18.982 7.708 -6.109 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -16.494 10.019 -3.673 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.496 9.278 -4.819 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.841 5.002 -4.125 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.477 3.665 -4.167 1.00 0.00 C ATOM 1081 C PRO A 88 -18.741 3.656 -5.023 1.00 0.00 C ATOM 1082 O PRO A 88 -19.815 3.201 -4.580 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.823 3.424 -2.696 1.00 0.00 C ATOM 1084 CG PRO A 88 -18.087 4.778 -2.153 1.00 0.00 C ATOM 1085 CD PRO A 88 -17.136 5.701 -2.862 1.00 0.00 C ATOM 0 HA PRO A 88 -16.834 2.904 -4.609 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.695 2.778 -2.594 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.002 2.938 -2.169 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -19.121 5.074 -2.328 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.926 4.804 -1.075 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.586 6.678 -3.041 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.231 5.869 -2.277 1.00 0.00 H new ATOM 1093 N GLY A 89 -18.596 4.110 -6.242 1.00 0.00 N ATOM 1094 CA GLY A 89 -19.689 4.184 -7.145 1.00 0.00 C ATOM 1095 C GLY A 89 -20.569 5.330 -6.795 1.00 0.00 C ATOM 1096 O GLY A 89 -20.086 6.372 -6.353 1.00 0.00 O ATOM 0 H GLY A 89 -17.709 4.437 -6.626 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -19.320 4.297 -8.165 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -20.259 3.256 -7.114 1.00 0.00 H new ATOM 1100 N ASP A 90 -21.826 5.146 -6.961 1.00 0.00 N ATOM 1101 CA ASP A 90 -22.801 6.135 -6.622 1.00 0.00 C ATOM 1102 C ASP A 90 -24.089 5.422 -6.333 1.00 0.00 C ATOM 1103 O ASP A 90 -24.308 4.311 -6.823 1.00 0.00 O ATOM 1104 CB ASP A 90 -22.995 7.161 -7.760 1.00 0.00 C ATOM 1105 CG ASP A 90 -23.582 6.571 -9.027 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -22.808 6.097 -9.911 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -24.812 6.595 -9.188 1.00 0.00 O ATOM 0 H ASP A 90 -22.223 4.288 -7.344 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.464 6.696 -5.750 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -23.647 7.960 -7.408 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -22.032 7.615 -7.995 1.00 0.00 H new ATOM 1112 N THR A 91 -24.907 6.007 -5.531 1.00 0.00 N ATOM 1113 CA THR A 91 -26.153 5.424 -5.182 1.00 0.00 C ATOM 1114 C THR A 91 -27.119 6.572 -4.902 1.00 0.00 C ATOM 1115 O THR A 91 -26.711 7.562 -4.296 1.00 0.00 O ATOM 1116 CB THR A 91 -25.993 4.458 -3.934 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.204 3.728 -3.671 1.00 0.00 O ATOM 1118 CG2 THR A 91 -25.548 5.201 -2.661 1.00 0.00 C ATOM 0 H THR A 91 -24.728 6.912 -5.095 1.00 0.00 H new ATOM 0 HA THR A 91 -26.540 4.805 -5.992 1.00 0.00 H new ATOM 0 HB THR A 91 -25.205 3.754 -4.203 1.00 0.00 H new ATOM 0 HG1 THR A 91 -27.790 4.263 -3.096 1.00 0.00 H new ATOM 0 HG21 THR A 91 -25.455 4.491 -1.839 1.00 0.00 H new ATOM 0 HG22 THR A 91 -24.585 5.681 -2.837 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.289 5.958 -2.404 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.365 6.515 -5.413 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.355 7.571 -5.165 1.00 0.00 C ATOM 1128 C PRO A 92 -29.556 7.755 -3.662 1.00 0.00 C ATOM 1129 O PRO A 92 -29.257 8.810 -3.092 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.640 7.037 -5.835 1.00 0.00 C ATOM 1131 CG PRO A 92 -30.375 5.594 -6.129 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.893 5.450 -6.282 1.00 0.00 C ATOM 0 HA PRO A 92 -29.057 8.543 -5.558 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -31.501 7.150 -5.176 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -30.863 7.588 -6.749 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.744 4.961 -5.322 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -30.890 5.284 -7.038 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -28.549 4.465 -5.968 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.580 5.582 -7.318 1.00 0.00 H new ATOM 1140 N PHE A 93 -29.980 6.707 -3.034 1.00 0.00 N ATOM 1141 CA PHE A 93 -30.144 6.665 -1.626 1.00 0.00 C ATOM 1142 C PHE A 93 -29.311 5.511 -1.130 1.00 0.00 C ATOM 1143 O PHE A 93 -29.015 4.590 -1.906 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.636 6.534 -1.230 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.363 5.332 -1.790 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -32.936 5.373 -3.053 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -32.492 4.174 -1.044 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -33.617 4.284 -3.555 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -33.169 3.084 -1.546 1.00 0.00 C ATOM 1150 CZ PHE A 93 -33.732 3.138 -2.800 1.00 0.00 C ATOM 0 H PHE A 93 -30.227 5.836 -3.503 1.00 0.00 H new ATOM 0 HA PHE A 93 -29.810 7.594 -1.164 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -31.702 6.501 -0.143 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.159 7.434 -1.554 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -32.848 6.269 -3.650 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -32.057 4.124 -0.057 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -34.060 4.330 -4.539 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -33.258 2.185 -0.954 1.00 0.00 H new ATOM 0 HZ PHE A 93 -34.263 2.283 -3.192 1.00 0.00 H new ATOM 1160 N GLY A 94 -28.899 5.573 0.082 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.056 4.561 0.629 1.00 0.00 C ATOM 1162 C GLY A 94 -26.884 5.182 1.308 1.00 0.00 C ATOM 1163 O GLY A 94 -26.440 6.249 0.901 1.00 0.00 O ATOM 0 H GLY A 94 -29.134 6.326 0.729 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -28.618 3.954 1.339 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -27.716 3.893 -0.163 1.00 0.00 H new ATOM 1167 N THR A 95 -26.357 4.540 2.317 1.00 0.00 N ATOM 1168 CA THR A 95 -25.277 5.121 3.080 1.00 0.00 C ATOM 1169 C THR A 95 -24.356 4.000 3.512 1.00 0.00 C ATOM 1170 O THR A 95 -24.768 2.828 3.558 1.00 0.00 O ATOM 1171 CB THR A 95 -25.816 5.841 4.347 1.00 0.00 C ATOM 1172 OG1 THR A 95 -27.002 6.593 4.021 1.00 0.00 O ATOM 1173 CG2 THR A 95 -24.778 6.806 4.931 1.00 0.00 C ATOM 0 H THR A 95 -26.655 3.617 2.631 1.00 0.00 H new ATOM 0 HA THR A 95 -24.754 5.852 2.464 1.00 0.00 H new ATOM 0 HB THR A 95 -26.041 5.072 5.086 1.00 0.00 H new ATOM 0 HG1 THR A 95 -27.754 6.266 4.557 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.190 7.291 5.816 1.00 0.00 H new ATOM 0 HG22 THR A 95 -23.880 6.252 5.206 1.00 0.00 H new ATOM 0 HG23 THR A 95 -24.525 7.562 4.187 1.00 0.00 H new ATOM 1181 N PHE A 96 -23.154 4.340 3.820 1.00 0.00 N ATOM 1182 CA PHE A 96 -22.161 3.398 4.240 1.00 0.00 C ATOM 1183 C PHE A 96 -21.279 4.042 5.291 1.00 0.00 C ATOM 1184 O PHE A 96 -21.263 5.263 5.417 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.312 2.928 3.039 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.583 4.032 2.322 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.315 4.418 2.724 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -21.168 4.679 1.248 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.649 5.429 2.074 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.505 5.691 0.591 1.00 0.00 C ATOM 1191 CZ PHE A 96 -19.242 6.067 1.006 1.00 0.00 C ATOM 0 H PHE A 96 -22.820 5.303 3.788 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.653 2.523 4.665 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.584 2.196 3.389 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.962 2.417 2.328 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.844 3.919 3.558 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -22.155 4.387 0.922 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.662 5.723 2.400 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -20.971 6.189 -0.246 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.719 6.861 0.493 1.00 0.00 H new ATOM 1201 N THR A 97 -20.594 3.233 6.033 1.00 0.00 N ATOM 1202 CA THR A 97 -19.651 3.683 7.022 1.00 0.00 C ATOM 1203 C THR A 97 -18.300 3.076 6.715 1.00 0.00 C ATOM 1204 O THR A 97 -18.233 1.945 6.233 1.00 0.00 O ATOM 1205 CB THR A 97 -20.102 3.269 8.432 1.00 0.00 C ATOM 1206 OG1 THR A 97 -20.426 1.855 8.445 1.00 0.00 O ATOM 1207 CG2 THR A 97 -21.306 4.082 8.874 1.00 0.00 C ATOM 0 H THR A 97 -20.672 2.218 5.972 1.00 0.00 H new ATOM 0 HA THR A 97 -19.589 4.771 6.992 1.00 0.00 H new ATOM 0 HB THR A 97 -19.286 3.461 9.129 1.00 0.00 H new ATOM 0 HG1 THR A 97 -20.712 1.593 9.345 1.00 0.00 H new ATOM 0 HG21 THR A 97 -21.607 3.772 9.874 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.046 5.140 8.885 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.130 3.918 8.180 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.253 3.791 6.989 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.922 3.341 6.677 1.00 0.00 C ATOM 1217 C LEU A 98 -15.211 2.873 7.932 1.00 0.00 C ATOM 1218 O LEU A 98 -15.553 3.292 9.041 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.134 4.483 6.030 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.656 4.991 4.681 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.907 6.232 4.272 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.496 3.927 3.608 1.00 0.00 C ATOM 0 H LEU A 98 -17.292 4.707 7.437 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.988 2.503 5.983 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.113 5.321 6.726 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.103 4.154 5.896 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.715 5.224 4.791 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -15.285 6.585 3.313 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -15.048 7.007 5.025 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.845 6.003 4.182 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.873 4.308 2.659 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.442 3.671 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -16.059 3.037 3.891 1.00 0.00 H new ATOM 1234 N THR A 99 -14.273 1.995 7.767 1.00 0.00 N ATOM 1235 CA THR A 99 -13.448 1.542 8.846 1.00 0.00 C ATOM 1236 C THR A 99 -12.082 1.193 8.272 1.00 0.00 C ATOM 1237 O THR A 99 -11.997 0.666 7.156 1.00 0.00 O ATOM 1238 CB THR A 99 -14.075 0.334 9.618 1.00 0.00 C ATOM 1239 OG1 THR A 99 -13.310 0.018 10.790 1.00 0.00 O ATOM 1240 CG2 THR A 99 -14.195 -0.902 8.750 1.00 0.00 C ATOM 0 H THR A 99 -14.054 1.566 6.868 1.00 0.00 H new ATOM 0 HA THR A 99 -13.356 2.337 9.586 1.00 0.00 H new ATOM 0 HB THR A 99 -15.078 0.644 9.911 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.723 -0.739 11.256 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.635 -1.713 9.330 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.830 -0.684 7.892 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.206 -1.200 8.403 1.00 0.00 H new ATOM 1248 N GLY A 100 -11.033 1.553 8.981 1.00 0.00 N ATOM 1249 CA GLY A 100 -9.686 1.324 8.496 1.00 0.00 C ATOM 1250 C GLY A 100 -9.118 2.605 7.934 1.00 0.00 C ATOM 1251 O GLY A 100 -7.917 2.729 7.692 1.00 0.00 O ATOM 0 H GLY A 100 -11.085 2.005 9.894 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.055 0.961 9.307 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.693 0.551 7.727 1.00 0.00 H new ATOM 1255 N GLY A 101 -10.002 3.548 7.752 1.00 0.00 N ATOM 1256 CA GLY A 101 -9.694 4.830 7.240 1.00 0.00 C ATOM 1257 C GLY A 101 -10.956 5.634 7.220 1.00 0.00 C ATOM 1258 O GLY A 101 -12.034 5.081 7.462 1.00 0.00 O ATOM 0 H GLY A 101 -10.991 3.427 7.969 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.941 5.317 7.860 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.277 4.750 6.236 1.00 0.00 H new ATOM 1262 N ASN A 102 -10.859 6.906 6.961 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.037 7.768 6.941 1.00 0.00 C ATOM 1264 C ASN A 102 -12.308 8.222 5.532 1.00 0.00 C ATOM 1265 O ASN A 102 -13.159 9.070 5.287 1.00 0.00 O ATOM 1266 CB ASN A 102 -11.841 8.995 7.843 1.00 0.00 C ATOM 1267 CG ASN A 102 -11.608 8.677 9.316 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -12.171 7.594 9.814 1.00 0.00 O flip ATOM 1269 ND2 ASN A 102 -10.910 9.423 10.012 1.00 0.00 N flip ATOM 0 H ASN A 102 -9.981 7.383 6.759 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.884 7.195 7.317 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -10.992 9.569 7.471 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -12.720 9.634 7.759 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -10.486 10.255 9.601 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -10.758 9.207 10.997 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.628 7.620 4.605 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.751 7.984 3.240 1.00 0.00 C ATOM 1278 C VAL A 103 -11.712 6.727 2.434 1.00 0.00 C ATOM 1279 O VAL A 103 -11.782 5.626 2.963 1.00 0.00 O ATOM 1280 CB VAL A 103 -10.603 8.955 2.816 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.238 8.310 2.619 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -10.979 9.997 1.745 1.00 0.00 C ATOM 0 H VAL A 103 -10.971 6.860 4.782 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.690 8.512 3.072 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.469 9.555 3.716 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.515 9.071 2.326 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.918 7.844 3.551 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.303 7.552 1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.112 10.620 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -11.301 9.486 0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.790 10.623 2.116 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.550 6.903 1.216 1.00 0.00 N ATOM 1293 CA PHE A 104 -11.547 5.831 0.264 1.00 0.00 C ATOM 1294 C PHE A 104 -10.112 5.489 -0.050 1.00 0.00 C ATOM 1295 O PHE A 104 -9.512 6.056 -0.973 1.00 0.00 O ATOM 1296 CB PHE A 104 -12.311 6.234 -1.000 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.635 6.864 -0.696 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -14.644 6.133 -0.106 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.861 8.200 -0.985 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.848 6.717 0.194 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -15.069 8.790 -0.692 1.00 0.00 C ATOM 1302 CZ PHE A 104 -16.063 8.046 -0.100 1.00 0.00 C ATOM 0 H PHE A 104 -11.407 7.823 0.799 1.00 0.00 H new ATOM 0 HA PHE A 104 -12.049 4.956 0.677 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.706 6.931 -1.579 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.466 5.353 -1.623 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.485 5.090 0.122 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -13.079 8.786 -1.446 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.628 6.135 0.661 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.236 9.831 -0.925 1.00 0.00 H new ATOM 0 HZ PHE A 104 -17.013 8.504 0.135 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.554 4.639 0.768 1.00 0.00 N ATOM 1313 CA GLU A 105 -8.169 4.255 0.688 1.00 0.00 C ATOM 1314 C GLU A 105 -8.040 2.752 0.874 1.00 0.00 C ATOM 1315 O GLU A 105 -8.887 2.139 1.509 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.367 4.994 1.778 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.926 4.795 3.202 1.00 0.00 C ATOM 1318 CD GLU A 105 -7.089 5.441 4.289 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -6.685 6.608 4.149 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -6.787 4.777 5.301 1.00 0.00 O ATOM 0 H GLU A 105 -10.061 4.183 1.527 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.774 4.524 -0.292 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.333 4.650 1.752 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.354 6.059 1.548 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.936 5.203 3.245 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.004 3.727 3.405 1.00 0.00 H new ATOM 1327 N TYR A 106 -7.011 2.170 0.294 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.717 0.747 0.439 1.00 0.00 C ATOM 1329 C TYR A 106 -6.766 0.294 1.897 1.00 0.00 C ATOM 1330 O TYR A 106 -6.091 0.847 2.757 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.361 0.417 -0.200 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.800 -0.948 0.140 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.198 -2.079 -0.541 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.842 -1.086 1.137 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -4.656 -3.316 -0.246 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.304 -2.311 1.443 1.00 0.00 C ATOM 1337 CZ TYR A 106 -3.709 -3.422 0.751 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.137 -4.642 1.029 1.00 0.00 O ATOM 0 H TYR A 106 -6.346 2.669 -0.297 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.495 0.193 -0.086 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.461 0.491 -1.283 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.640 1.175 0.106 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -5.945 -1.997 -1.317 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.515 -0.213 1.681 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -4.972 -4.193 -0.792 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.565 -2.399 2.226 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.516 -4.883 0.311 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.577 -0.702 2.160 1.00 0.00 N ATOM 1349 CA GLY A 107 -7.701 -1.196 3.495 1.00 0.00 C ATOM 1350 C GLY A 107 -8.963 -0.726 4.179 1.00 0.00 C ATOM 1351 O GLY A 107 -9.310 -1.232 5.244 1.00 0.00 O ATOM 0 H GLY A 107 -8.154 -1.179 1.467 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.687 -2.286 3.477 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.837 -0.876 4.077 1.00 0.00 H new ATOM 1355 N VAL A 108 -9.652 0.240 3.593 1.00 0.00 N ATOM 1356 CA VAL A 108 -10.876 0.729 4.190 1.00 0.00 C ATOM 1357 C VAL A 108 -12.044 -0.180 3.789 1.00 0.00 C ATOM 1358 O VAL A 108 -12.052 -0.761 2.687 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.185 2.224 3.805 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -11.747 2.380 2.396 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.085 2.888 4.820 1.00 0.00 C ATOM 0 H VAL A 108 -9.387 0.693 2.718 1.00 0.00 H new ATOM 0 HA VAL A 108 -10.744 0.707 5.272 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.222 2.735 3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.938 3.434 2.195 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -11.027 1.997 1.673 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -12.679 1.820 2.312 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.275 3.918 4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -13.029 2.347 4.878 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -11.601 2.879 5.797 1.00 0.00 H new ATOM 1371 N LYS A 109 -12.966 -0.359 4.688 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.156 -1.120 4.412 1.00 0.00 C ATOM 1373 C LYS A 109 -15.340 -0.187 4.386 1.00 0.00 C ATOM 1374 O LYS A 109 -15.554 0.561 5.343 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.407 -2.169 5.495 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.608 -3.065 5.191 1.00 0.00 C ATOM 1377 CD LYS A 109 -15.917 -4.039 6.320 1.00 0.00 C ATOM 1378 CE LYS A 109 -14.894 -5.151 6.428 1.00 0.00 C ATOM 1379 NZ LYS A 109 -15.148 -6.013 7.597 1.00 0.00 N ATOM 0 H LYS A 109 -12.918 0.017 5.635 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.023 -1.621 3.453 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.517 -2.789 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.567 -1.667 6.449 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.483 -2.442 5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.415 -3.625 4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.957 -3.495 7.263 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -16.904 -4.473 6.160 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -14.914 -5.754 5.520 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.895 -4.721 6.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.428 -6.763 7.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.104 -5.442 8.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.091 -6.443 7.513 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.086 -0.216 3.319 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.295 0.544 3.235 1.00 0.00 C ATOM 1395 C ALA A 110 -18.461 -0.356 3.572 1.00 0.00 C ATOM 1396 O ALA A 110 -18.933 -1.124 2.724 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.464 1.157 1.852 1.00 0.00 C ATOM 0 H ALA A 110 -15.872 -0.766 2.487 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.252 1.368 3.948 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.391 1.729 1.818 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.623 1.817 1.641 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.499 0.364 1.105 1.00 0.00 H new ATOM 1403 N VAL A 111 -18.865 -0.321 4.818 1.00 0.00 N ATOM 1404 CA VAL A 111 -19.985 -1.105 5.299 1.00 0.00 C ATOM 1405 C VAL A 111 -21.248 -0.373 4.934 1.00 0.00 C ATOM 1406 O VAL A 111 -21.494 0.723 5.432 1.00 0.00 O ATOM 1407 CB VAL A 111 -19.944 -1.294 6.839 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -21.091 -2.175 7.314 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -18.613 -1.866 7.281 1.00 0.00 C ATOM 0 H VAL A 111 -18.425 0.255 5.535 1.00 0.00 H new ATOM 0 HA VAL A 111 -19.941 -2.094 4.843 1.00 0.00 H new ATOM 0 HB VAL A 111 -20.060 -0.311 7.296 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -21.037 -2.290 8.397 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -22.041 -1.712 7.045 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -21.018 -3.154 6.841 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -18.611 -1.988 8.364 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -18.458 -2.835 6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -17.811 -1.187 6.991 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.021 -0.953 4.078 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.206 -0.331 3.566 1.00 0.00 C ATOM 1421 C TYR A 112 -24.316 -0.604 4.546 1.00 0.00 C ATOM 1422 O TYR A 112 -24.448 -1.713 5.059 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.480 -0.891 2.168 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.367 -0.063 1.271 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -23.859 1.042 0.599 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -25.685 -0.404 1.057 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -24.650 1.784 -0.252 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -26.479 0.329 0.213 1.00 0.00 C ATOM 1429 CZ TYR A 112 -25.960 1.420 -0.443 1.00 0.00 C ATOM 1430 OH TYR A 112 -26.759 2.159 -1.277 1.00 0.00 O ATOM 0 H TYR A 112 -21.849 -1.887 3.706 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.108 0.750 3.462 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.524 -1.033 1.664 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -23.932 -1.877 2.278 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -22.827 1.324 0.746 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -26.100 -1.263 1.563 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -24.243 2.644 -0.764 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -27.511 0.049 0.064 1.00 0.00 H new ATOM 0 HH TYR A 112 -26.231 2.478 -2.038 1.00 0.00 H new ATOM 1440 N THR A 113 -25.047 0.414 4.882 1.00 0.00 N ATOM 1441 CA THR A 113 -26.029 0.281 5.925 1.00 0.00 C ATOM 1442 C THR A 113 -27.317 1.074 5.647 1.00 0.00 C ATOM 1443 O THR A 113 -28.397 0.719 6.098 1.00 0.00 O ATOM 1444 CB THR A 113 -25.394 0.670 7.278 1.00 0.00 C ATOM 1445 OG1 THR A 113 -24.191 -0.104 7.490 1.00 0.00 O ATOM 1446 CG2 THR A 113 -26.336 0.399 8.392 1.00 0.00 C ATOM 0 H THR A 113 -24.987 1.339 4.457 1.00 0.00 H new ATOM 0 HA THR A 113 -26.340 -0.763 5.961 1.00 0.00 H new ATOM 0 HB THR A 113 -25.159 1.734 7.255 1.00 0.00 H new ATOM 0 HG1 THR A 113 -23.789 0.145 8.348 1.00 0.00 H new ATOM 0 HG21 THR A 113 -25.872 0.679 9.337 1.00 0.00 H new ATOM 0 HG22 THR A 113 -27.246 0.981 8.248 1.00 0.00 H new ATOM 0 HG23 THR A 113 -26.583 -0.663 8.410 1.00 0.00 H new ATOM 1454 N CYS A 114 -27.170 2.114 4.925 1.00 0.00 N ATOM 1455 CA CYS A 114 -28.271 2.982 4.501 1.00 0.00 C ATOM 1456 C CYS A 114 -28.907 3.799 5.601 1.00 0.00 C ATOM 1457 O CYS A 114 -28.357 4.825 6.011 1.00 0.00 O ATOM 1458 CB CYS A 114 -29.342 2.257 3.673 1.00 0.00 C ATOM 1459 SG CYS A 114 -28.773 1.653 2.089 1.00 0.00 S ATOM 0 H CYS A 114 -26.260 2.423 4.584 1.00 0.00 H new ATOM 0 HA CYS A 114 -27.770 3.697 3.848 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -29.723 1.416 4.252 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -30.178 2.937 3.509 1.00 0.00 H new ATOM 1464 N ASN A 115 -30.031 3.330 6.109 1.00 0.00 N ATOM 1465 CA ASN A 115 -30.866 4.128 6.979 1.00 0.00 C ATOM 1466 C ASN A 115 -31.561 3.207 7.958 1.00 0.00 C ATOM 1467 O ASN A 115 -31.106 2.075 8.185 1.00 0.00 O ATOM 1468 CB ASN A 115 -31.935 4.896 6.140 1.00 0.00 C ATOM 1469 CG ASN A 115 -31.367 5.794 5.041 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -31.192 5.356 3.903 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -31.069 7.034 5.360 1.00 0.00 N ATOM 0 H ASN A 115 -30.387 2.391 5.930 1.00 0.00 H new ATOM 0 HA ASN A 115 -30.251 4.853 7.513 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -32.608 4.170 5.684 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -32.535 5.507 6.815 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -30.681 7.663 4.656 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -31.225 7.368 6.311 1.00 0.00 H new ATOM 1478 N GLU A 116 -32.652 3.668 8.520 1.00 0.00 N ATOM 1479 CA GLU A 116 -33.401 2.925 9.505 1.00 0.00 C ATOM 1480 C GLU A 116 -34.195 1.798 8.849 1.00 0.00 C ATOM 1481 O GLU A 116 -33.991 0.622 9.146 1.00 0.00 O ATOM 1482 CB GLU A 116 -34.315 3.891 10.262 1.00 0.00 C ATOM 1483 CG GLU A 116 -35.101 3.285 11.394 1.00 0.00 C ATOM 1484 CD GLU A 116 -35.838 4.335 12.164 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -35.270 4.893 13.114 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -36.996 4.642 11.835 1.00 0.00 O ATOM 0 H GLU A 116 -33.050 4.582 8.303 1.00 0.00 H new ATOM 0 HA GLU A 116 -32.716 2.458 10.212 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -33.707 4.704 10.659 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -35.014 4.333 9.553 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -35.809 2.556 10.999 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -34.427 2.747 12.061 1.00 0.00 H new ATOM 1493 N GLY A 117 -35.039 2.161 7.929 1.00 0.00 N ATOM 1494 CA GLY A 117 -35.896 1.195 7.269 1.00 0.00 C ATOM 1495 C GLY A 117 -35.298 0.657 5.985 1.00 0.00 C ATOM 1496 O GLY A 117 -35.939 -0.114 5.267 1.00 0.00 O ATOM 0 H GLY A 117 -35.160 3.122 7.611 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -36.091 0.365 7.949 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -36.857 1.660 7.049 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.089 1.053 5.698 1.00 0.00 N ATOM 1501 CA TYR A 118 -33.392 0.624 4.495 1.00 0.00 C ATOM 1502 C TYR A 118 -32.156 -0.142 4.869 1.00 0.00 C ATOM 1503 O TYR A 118 -31.406 0.304 5.742 1.00 0.00 O ATOM 1504 CB TYR A 118 -32.973 1.831 3.649 1.00 0.00 C ATOM 1505 CG TYR A 118 -34.105 2.604 3.038 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -34.801 3.563 3.760 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -34.474 2.376 1.733 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -35.837 4.265 3.190 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -35.500 3.072 1.155 1.00 0.00 C ATOM 1510 CZ TYR A 118 -36.179 4.014 1.880 1.00 0.00 C ATOM 1511 OH TYR A 118 -37.221 4.689 1.294 1.00 0.00 O ATOM 0 H TYR A 118 -33.548 1.685 6.288 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.071 -0.005 3.919 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -32.387 2.506 4.273 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -32.317 1.485 2.850 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -34.525 3.761 4.785 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -33.944 1.634 1.154 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -36.376 5.005 3.763 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -35.774 2.879 0.128 1.00 0.00 H new ATOM 0 HH TYR A 118 -37.324 4.390 0.367 1.00 0.00 H new ATOM 1521 N GLN A 119 -31.939 -1.276 4.233 1.00 0.00 N ATOM 1522 CA GLN A 119 -30.748 -2.050 4.428 1.00 0.00 C ATOM 1523 C GLN A 119 -30.122 -2.335 3.084 1.00 0.00 C ATOM 1524 O GLN A 119 -29.535 -1.430 2.505 1.00 0.00 O ATOM 1525 CB GLN A 119 -30.970 -3.330 5.258 1.00 0.00 C ATOM 1526 CG GLN A 119 -31.245 -3.089 6.746 1.00 0.00 C ATOM 1527 CD GLN A 119 -30.047 -2.499 7.496 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -29.209 -3.223 8.039 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -29.942 -1.206 7.523 1.00 0.00 N ATOM 0 H GLN A 119 -32.593 -1.682 3.564 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.057 -1.459 5.030 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -31.808 -3.882 4.832 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -30.089 -3.965 5.164 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -32.096 -2.415 6.847 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -31.529 -4.032 7.213 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -30.647 -0.627 7.067 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -29.154 -0.768 8.000 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.333 -3.545 2.528 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.724 -3.910 1.246 1.00 0.00 C ATOM 1540 C LEU A 120 -30.074 -5.318 0.761 1.00 0.00 C ATOM 1541 O LEU A 120 -30.276 -6.252 1.554 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.192 -3.717 1.286 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.467 -4.343 2.477 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -27.087 -5.805 2.231 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -26.271 -3.514 2.861 1.00 0.00 C ATOM 0 H LEU A 120 -30.913 -4.273 2.945 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.158 -3.227 0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -27.770 -4.132 0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -27.980 -2.648 1.279 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.163 -4.349 3.316 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.575 -6.200 3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -27.988 -6.389 2.043 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.427 -5.869 1.366 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -25.767 -3.974 3.711 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -25.582 -3.456 2.018 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -26.596 -2.510 3.133 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.189 -5.422 -0.538 1.00 0.00 N ATOM 1558 CA LEU A 121 -30.326 -6.655 -1.251 1.00 0.00 C ATOM 1559 C LEU A 121 -28.955 -7.095 -1.718 1.00 0.00 C ATOM 1560 O LEU A 121 -28.114 -6.254 -2.097 1.00 0.00 O ATOM 1561 CB LEU A 121 -31.242 -6.455 -2.456 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.694 -6.912 -2.326 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -32.784 -8.425 -2.284 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -33.364 -6.319 -1.106 1.00 0.00 C ATOM 0 H LEU A 121 -30.189 -4.607 -1.152 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.761 -7.415 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -31.245 -5.393 -2.703 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.800 -6.978 -3.304 1.00 0.00 H new ATOM 0 HG LEU A 121 -33.222 -6.551 -3.208 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -33.828 -8.725 -2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -32.367 -8.840 -3.202 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -32.222 -8.799 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -34.395 -6.669 -1.051 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.827 -6.629 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -33.354 -5.231 -1.178 1.00 0.00 H new ATOM 1576 N GLY A 122 -28.730 -8.375 -1.682 1.00 0.00 N ATOM 1577 CA GLY A 122 -27.464 -8.928 -2.052 1.00 0.00 C ATOM 1578 C GLY A 122 -26.965 -9.802 -0.943 1.00 0.00 C ATOM 1579 O GLY A 122 -27.696 -10.045 0.031 1.00 0.00 O ATOM 0 H GLY A 122 -29.423 -9.066 -1.394 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -27.561 -9.506 -2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -26.749 -8.130 -2.251 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.767 -10.293 -1.055 1.00 0.00 N ATOM 1584 CA GLU A 123 -25.208 -11.113 -0.005 1.00 0.00 C ATOM 1585 C GLU A 123 -24.036 -10.433 0.646 1.00 0.00 C ATOM 1586 O GLU A 123 -23.547 -10.885 1.686 1.00 0.00 O ATOM 1587 CB GLU A 123 -24.779 -12.469 -0.526 1.00 0.00 C ATOM 1588 CG GLU A 123 -25.900 -13.284 -1.116 1.00 0.00 C ATOM 1589 CD GLU A 123 -25.479 -14.678 -1.427 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -24.678 -14.880 -2.348 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -25.944 -15.612 -0.744 1.00 0.00 O ATOM 0 H GLU A 123 -25.154 -10.145 -1.857 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.994 -11.258 0.736 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -24.009 -12.328 -1.284 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -24.325 -13.032 0.289 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -26.737 -13.306 -0.418 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -26.257 -12.802 -2.026 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.563 -9.379 0.038 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.438 -8.665 0.554 1.00 0.00 C ATOM 1600 C ILE A 124 -22.871 -7.260 0.924 1.00 0.00 C ATOM 1601 O ILE A 124 -23.248 -6.470 0.067 1.00 0.00 O ATOM 1602 CB ILE A 124 -21.266 -8.632 -0.462 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.890 -10.062 -0.903 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -20.056 -7.942 0.145 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -20.420 -10.971 0.221 1.00 0.00 C ATOM 0 H ILE A 124 -23.948 -8.996 -0.825 1.00 0.00 H new ATOM 0 HA ILE A 124 -22.073 -9.181 1.442 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.590 -8.069 -1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.755 -10.519 -1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.103 -10.001 -1.655 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.243 -7.928 -0.581 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.318 -6.919 0.416 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.737 -8.483 1.036 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -20.178 -11.954 -0.183 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.533 -10.543 0.689 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -21.211 -11.069 0.965 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.810 -6.965 2.196 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.283 -5.692 2.749 1.00 0.00 C ATOM 1619 C ASN A 125 -22.168 -4.660 2.804 1.00 0.00 C ATOM 1620 O ASN A 125 -22.289 -3.639 3.472 1.00 0.00 O ATOM 1621 CB ASN A 125 -23.829 -5.901 4.181 1.00 0.00 C ATOM 1622 CG ASN A 125 -22.761 -6.306 5.199 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -21.776 -6.971 4.876 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -22.946 -5.908 6.427 1.00 0.00 N ATOM 0 H ASN A 125 -22.429 -7.599 2.898 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.073 -5.328 2.092 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.305 -4.979 4.516 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.603 -6.668 4.156 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -22.265 -6.146 7.148 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -23.771 -5.358 6.666 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.124 -4.880 2.075 1.00 0.00 N ATOM 1632 CA TYR A 126 -19.971 -4.016 2.168 1.00 0.00 C ATOM 1633 C TYR A 126 -19.130 -4.142 0.943 1.00 0.00 C ATOM 1634 O TYR A 126 -19.464 -4.876 0.027 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.119 -4.376 3.430 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.290 -5.656 3.297 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -18.857 -6.914 3.432 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -16.932 -5.581 3.017 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -18.093 -8.056 3.287 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -16.160 -6.706 2.877 1.00 0.00 C ATOM 1641 CZ TYR A 126 -16.746 -7.946 3.011 1.00 0.00 C ATOM 1642 OH TYR A 126 -15.993 -9.078 2.852 1.00 0.00 O ATOM 0 H TYR A 126 -21.036 -5.646 1.407 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.320 -2.987 2.257 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.448 -3.545 3.648 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -19.787 -4.479 4.285 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -19.910 -7.002 3.654 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -16.471 -4.611 2.906 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -18.548 -9.030 3.389 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -15.105 -6.621 2.664 1.00 0.00 H new ATOM 0 HH TYR A 126 -15.065 -8.829 2.661 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.076 -3.387 0.924 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.065 -3.480 -0.064 1.00 0.00 C ATOM 1654 C ARG A 127 -15.797 -2.878 0.487 1.00 0.00 C ATOM 1655 O ARG A 127 -15.824 -1.812 1.094 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.516 -2.885 -1.404 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.024 -1.461 -1.392 1.00 0.00 C ATOM 1658 CD ARG A 127 -18.758 -1.203 -2.698 1.00 0.00 C ATOM 1659 NE ARG A 127 -19.316 0.157 -2.815 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.461 0.580 -2.249 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -21.078 -0.177 -1.330 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -20.979 1.761 -2.591 1.00 0.00 N ATOM 0 H ARG A 127 -17.897 -2.666 1.623 1.00 0.00 H new ATOM 0 HA ARG A 127 -16.861 -4.525 -0.296 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -16.676 -2.938 -2.097 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -18.303 -3.521 -1.808 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.691 -1.303 -0.544 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -17.194 -0.763 -1.279 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -18.073 -1.376 -3.528 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -19.567 -1.926 -2.797 1.00 0.00 H new ATOM 0 HE ARG A 127 -18.791 0.832 -3.371 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.679 -1.076 -1.059 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -21.946 0.146 -0.902 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -20.507 2.344 -3.282 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.847 2.081 -2.161 1.00 0.00 H new ATOM 1676 N GLU A 128 -14.725 -3.597 0.363 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.450 -3.192 0.894 1.00 0.00 C ATOM 1678 C GLU A 128 -12.542 -2.726 -0.207 1.00 0.00 C ATOM 1679 O GLU A 128 -12.751 -3.052 -1.371 1.00 0.00 O ATOM 1680 CB GLU A 128 -12.789 -4.355 1.639 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.282 -4.583 3.033 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.574 -5.726 3.710 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -11.379 -5.591 4.060 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.196 -6.772 3.933 1.00 0.00 O ATOM 0 H GLU A 128 -14.705 -4.497 -0.117 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.620 -2.369 1.588 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -12.942 -5.268 1.063 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -11.714 -4.178 1.676 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.142 -3.674 3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.353 -4.785 3.009 1.00 0.00 H new ATOM 1691 N CYS A 129 -11.588 -1.936 0.144 1.00 0.00 N ATOM 1692 CA CYS A 129 -10.567 -1.549 -0.780 1.00 0.00 C ATOM 1693 C CYS A 129 -9.420 -2.535 -0.793 1.00 0.00 C ATOM 1694 O CYS A 129 -8.741 -2.744 0.227 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.034 -0.177 -0.489 1.00 0.00 C ATOM 1696 SG CYS A 129 -11.090 1.186 -0.997 1.00 0.00 S ATOM 0 H CYS A 129 -11.489 -1.537 1.078 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.039 -1.540 -1.762 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -9.855 -0.095 0.583 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -9.068 -0.069 -0.982 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.235 -3.136 -1.936 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.153 -4.050 -2.213 1.00 0.00 C ATOM 1703 C ASP A 130 -7.129 -3.276 -3.076 1.00 0.00 C ATOM 1704 O ASP A 130 -7.138 -2.048 -3.079 1.00 0.00 O ATOM 1705 CB ASP A 130 -8.713 -5.304 -2.953 1.00 0.00 C ATOM 1706 CG ASP A 130 -7.700 -6.434 -3.160 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -7.497 -7.252 -2.252 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -7.072 -6.493 -4.251 1.00 0.00 O ATOM 0 H ASP A 130 -9.856 -2.999 -2.733 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.670 -4.407 -1.304 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -9.560 -5.693 -2.388 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.094 -4.994 -3.926 1.00 0.00 H new ATOM 1713 N THR A 131 -6.303 -3.968 -3.792 1.00 0.00 N ATOM 1714 CA THR A 131 -5.212 -3.402 -4.539 1.00 0.00 C ATOM 1715 C THR A 131 -5.677 -2.537 -5.712 1.00 0.00 C ATOM 1716 O THR A 131 -5.149 -1.457 -5.939 1.00 0.00 O ATOM 1717 CB THR A 131 -4.308 -4.538 -5.031 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.081 -5.472 -5.817 1.00 0.00 O ATOM 1719 CG2 THR A 131 -3.761 -5.275 -3.850 1.00 0.00 C ATOM 0 H THR A 131 -6.367 -4.982 -3.880 1.00 0.00 H new ATOM 0 HA THR A 131 -4.660 -2.737 -3.875 1.00 0.00 H new ATOM 0 HB THR A 131 -3.503 -4.116 -5.632 1.00 0.00 H new ATOM 0 HG1 THR A 131 -5.705 -5.953 -5.234 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.117 -6.085 -4.193 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.184 -4.590 -3.229 1.00 0.00 H new ATOM 0 HG23 THR A 131 -4.583 -5.688 -3.266 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.638 -3.012 -6.458 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.161 -2.225 -7.558 1.00 0.00 C ATOM 1729 C ASP A 132 -8.176 -1.239 -7.041 1.00 0.00 C ATOM 1730 O ASP A 132 -8.165 -0.045 -7.397 1.00 0.00 O ATOM 1731 CB ASP A 132 -7.795 -3.101 -8.634 1.00 0.00 C ATOM 1732 CG ASP A 132 -8.432 -2.281 -9.743 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -7.713 -1.811 -10.642 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -9.670 -2.084 -9.723 1.00 0.00 O ATOM 0 H ASP A 132 -7.074 -3.926 -6.333 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.325 -1.694 -8.013 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.035 -3.756 -9.060 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -8.550 -3.742 -8.179 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.015 -1.712 -6.169 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.070 -0.890 -5.674 1.00 0.00 C ATOM 1741 C GLY A 133 -11.057 -1.674 -4.878 1.00 0.00 C ATOM 1742 O GLY A 133 -10.673 -2.466 -4.038 1.00 0.00 O ATOM 0 H GLY A 133 -8.988 -2.658 -5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.652 -0.096 -5.055 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -10.578 -0.408 -6.510 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.307 -1.520 -5.189 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.369 -2.102 -4.395 1.00 0.00 C ATOM 1748 C TRP A 134 -13.556 -3.591 -4.686 1.00 0.00 C ATOM 1749 O TRP A 134 -13.733 -4.002 -5.843 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.662 -1.302 -4.577 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.489 0.147 -4.191 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.244 1.203 -5.029 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.512 0.685 -2.867 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.114 2.365 -4.306 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.285 2.072 -2.970 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.708 0.128 -1.602 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.249 2.904 -1.853 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.669 0.953 -0.498 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.444 2.327 -0.628 1.00 0.00 C ATOM 0 H TRP A 134 -12.630 -0.989 -5.998 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.083 -2.041 -3.345 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -14.984 -1.364 -5.617 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.452 -1.747 -3.972 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.164 1.133 -6.104 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.923 3.289 -4.693 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.887 -0.931 -1.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -14.074 3.965 -1.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.815 0.530 0.485 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.424 2.946 0.257 1.00 0.00 H new ATOM 1770 N THR A 135 -13.497 -4.383 -3.627 1.00 0.00 N ATOM 1771 CA THR A 135 -13.596 -5.838 -3.679 1.00 0.00 C ATOM 1772 C THR A 135 -14.959 -6.316 -4.145 1.00 0.00 C ATOM 1773 O THR A 135 -15.091 -7.401 -4.705 1.00 0.00 O ATOM 1774 CB THR A 135 -13.352 -6.432 -2.275 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.248 -5.812 -1.322 1.00 0.00 O ATOM 1776 CG2 THR A 135 -11.920 -6.232 -1.831 1.00 0.00 C ATOM 0 H THR A 135 -13.376 -4.024 -2.680 1.00 0.00 H new ATOM 0 HA THR A 135 -12.843 -6.171 -4.393 1.00 0.00 H new ATOM 0 HB THR A 135 -13.544 -7.504 -2.323 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.089 -6.314 -1.289 1.00 0.00 H new ATOM 0 HG21 THR A 135 -11.783 -6.662 -0.839 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.249 -6.724 -2.535 1.00 0.00 H new ATOM 0 HG23 THR A 135 -11.695 -5.166 -1.799 1.00 0.00 H new ATOM 1784 N ASN A 136 -15.959 -5.503 -3.930 1.00 0.00 N ATOM 1785 CA ASN A 136 -17.307 -5.885 -4.169 1.00 0.00 C ATOM 1786 C ASN A 136 -18.008 -4.741 -4.810 1.00 0.00 C ATOM 1787 O ASN A 136 -17.473 -3.624 -4.856 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.008 -6.265 -2.844 1.00 0.00 C ATOM 1789 CG ASN A 136 -17.408 -7.482 -2.157 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -16.488 -7.362 -1.332 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -17.904 -8.647 -2.484 1.00 0.00 N ATOM 0 H ASN A 136 -15.850 -4.551 -3.581 1.00 0.00 H new ATOM 0 HA ASN A 136 -17.333 -6.757 -4.823 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -17.961 -5.415 -2.163 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.062 -6.456 -3.044 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -17.535 -9.497 -2.057 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -18.660 -8.706 -3.166 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.174 -4.999 -5.288 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.980 -4.012 -5.960 1.00 0.00 C ATOM 1800 C ASP A 137 -20.886 -3.331 -4.924 1.00 0.00 C ATOM 1801 O ASP A 137 -20.766 -3.595 -3.726 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.780 -4.723 -7.064 1.00 0.00 C ATOM 1803 CG ASP A 137 -21.583 -3.811 -7.977 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -21.019 -3.236 -8.926 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -22.795 -3.648 -7.748 1.00 0.00 O ATOM 0 H ASP A 137 -19.613 -5.918 -5.227 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.373 -3.236 -6.426 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -20.088 -5.303 -7.675 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -21.462 -5.432 -6.595 1.00 0.00 H new ATOM 1810 N ILE A 138 -21.769 -2.486 -5.367 1.00 0.00 N ATOM 1811 CA ILE A 138 -22.643 -1.726 -4.511 1.00 0.00 C ATOM 1812 C ILE A 138 -23.894 -2.553 -4.205 1.00 0.00 C ATOM 1813 O ILE A 138 -24.660 -2.870 -5.123 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.080 -0.432 -5.246 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -21.856 0.353 -5.721 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -23.957 0.453 -4.351 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -22.204 1.432 -6.700 1.00 0.00 C ATOM 0 H ILE A 138 -21.908 -2.298 -6.360 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.120 -1.477 -3.588 1.00 0.00 H new ATOM 0 HB ILE A 138 -23.672 -0.729 -6.112 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -21.358 0.797 -4.859 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.145 -0.334 -6.181 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.245 1.351 -4.898 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -24.852 -0.097 -4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.398 0.735 -3.459 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -21.297 1.956 -7.002 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -22.677 0.989 -7.577 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -22.892 2.138 -6.234 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.090 -2.983 -2.944 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.308 -3.678 -2.552 1.00 0.00 C ATOM 1831 C PRO A 139 -26.517 -2.765 -2.764 1.00 0.00 C ATOM 1832 O PRO A 139 -26.413 -1.534 -2.623 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.103 -4.006 -1.065 1.00 0.00 C ATOM 1834 CG PRO A 139 -23.965 -3.160 -0.618 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.141 -2.861 -1.830 1.00 0.00 C ATOM 0 HA PRO A 139 -25.496 -4.578 -3.138 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.002 -3.788 -0.489 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.883 -5.064 -0.925 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.326 -2.239 -0.160 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.371 -3.679 0.134 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -22.708 -1.862 -1.782 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.313 -3.562 -1.933 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.629 -3.347 -3.107 1.00 0.00 N ATOM 1844 CA ILE A 140 -28.804 -2.585 -3.465 1.00 0.00 C ATOM 1845 C ILE A 140 -29.556 -2.130 -2.232 1.00 0.00 C ATOM 1846 O ILE A 140 -30.151 -2.942 -1.543 1.00 0.00 O ATOM 1847 CB ILE A 140 -29.729 -3.409 -4.406 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.016 -3.716 -5.735 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.072 -2.723 -4.640 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.541 -2.482 -6.485 1.00 0.00 C ATOM 0 H ILE A 140 -27.754 -4.359 -3.148 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.477 -1.695 -4.003 1.00 0.00 H new ATOM 0 HB ILE A 140 -29.944 -4.354 -3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -28.159 -4.359 -5.535 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -29.694 -4.279 -6.377 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -31.683 -3.336 -5.303 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.586 -2.595 -3.687 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -30.907 -1.747 -5.097 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -28.050 -2.785 -7.410 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -29.396 -1.847 -6.719 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -27.837 -1.928 -5.865 1.00 0.00 H new ATOM 1862 N CYS A 141 -29.498 -0.845 -1.955 1.00 0.00 N ATOM 1863 CA CYS A 141 -30.173 -0.260 -0.809 1.00 0.00 C ATOM 1864 C CYS A 141 -31.678 -0.443 -0.976 1.00 0.00 C ATOM 1865 O CYS A 141 -32.259 0.030 -1.958 1.00 0.00 O ATOM 1866 CB CYS A 141 -29.841 1.223 -0.708 1.00 0.00 C ATOM 1867 SG CYS A 141 -30.346 1.996 0.854 1.00 0.00 S ATOM 0 H CYS A 141 -28.980 -0.171 -2.519 1.00 0.00 H new ATOM 0 HA CYS A 141 -29.839 -0.755 0.103 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -28.766 1.352 -0.833 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -30.323 1.748 -1.532 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.280 -1.144 -0.051 1.00 0.00 N ATOM 1873 CA GLU A 142 -33.676 -1.503 -0.106 1.00 0.00 C ATOM 1874 C GLU A 142 -34.241 -1.527 1.301 1.00 0.00 C ATOM 1875 O GLU A 142 -35.249 -0.843 1.558 1.00 0.00 O ATOM 1876 CB GLU A 142 -33.832 -2.874 -0.778 1.00 0.00 C ATOM 1877 CG GLU A 142 -33.842 -2.875 -2.303 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.156 -2.449 -2.895 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.165 -3.164 -2.708 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -35.220 -1.419 -3.578 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.630 -2.191 2.186 1.00 0.00 O ATOM 0 H GLU A 142 -31.803 -1.490 0.782 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.226 -0.768 -0.694 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.019 -3.517 -0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -34.761 -3.324 -0.428 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -33.057 -2.210 -2.664 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -33.600 -3.876 -2.659 1.00 0.00 H new TER 1888 GLU A 142