USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 960 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 150 HIS : no HD1:sc= -0.0279 K(o=0.89,f=-1.2) USER MOD Set 1.2: A 154 TYR OH : rot 149:sc= 0.913 USER MOD Single : A 70 THR OG1 : rot 30:sc= 0.495 USER MOD Single : A 72 SER OG : rot 180:sc= -0.0766 USER MOD Single : A 76 ASN : amide:sc= -0.697 K(o=-0.7,f=-6.2!) USER MOD Single : A 83 GLN : amide:sc= -0.0674 X(o=-0.067,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -3.46! C(o=-3.5!,f=-5.7!) USER MOD Single : A 103 TYR OH : rot -173:sc= -3.3 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN :FLIP amide:sc= -4.93! F(o=-5.8,f=-4.9!) USER MOD Single : A 111 LYS NZ :NH3+ -144:sc= -0.0164 (180deg=-0.168) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-3.4!) USER MOD Single : A 122 ASN : amide:sc= -1.47 K(o=-1.5,f=-6.2!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 150:sc= -0.0192 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -111:sc= 0 (180deg=-0.229) USER MOD Single : A 133 THR OG1 : rot 47:sc= 0.484 USER MOD Single : A 134 SER OG : rot -24:sc= 1.02 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ -152:sc= -0.0629 (180deg=-0.51) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 HIS : no HD1:sc= -0.861 X(o=-0.86,f=-0.4) USER MOD Single : A 142 THR OG1 : rot 180:sc= -1.19 USER MOD Single : A 147 THR OG1 : rot -50:sc= -1.29! USER MOD Single : A 148 THR OG1 : rot -160:sc= -1.42 USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot 78:sc= -2.83! USER MOD Single : A 161 ASN : amide:sc= -2.76 K(o=-2.8,f=-4!) USER MOD Single : A 164 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-4.7!) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 THR OG1 : rot 180:sc= -0.957 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 ASN :FLIP amide:sc= -0.187 F(o=-0.93,f=-0.19) USER MOD Single : A 180 ASN : amide:sc= -1.15 X(o=-1.1,f=-1.1!) USER MOD Single : A 183 SER OG : rot -14:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 70 -10.481 -17.256 -2.662 1.00 0.00 N ATOM 2 CA THR A 70 -10.373 -16.114 -3.609 1.00 0.00 C ATOM 3 C THR A 70 -10.658 -16.556 -5.040 1.00 0.00 C ATOM 4 O THR A 70 -10.071 -16.035 -5.989 1.00 0.00 O ATOM 5 CB THR A 70 -8.963 -15.529 -3.508 1.00 0.00 C ATOM 6 OG1 THR A 70 -8.522 -15.512 -2.161 1.00 0.00 O ATOM 7 CG2 THR A 70 -8.862 -14.116 -4.041 1.00 0.00 C ATOM 0 HA THR A 70 -11.113 -15.359 -3.345 1.00 0.00 H new ATOM 0 HB THR A 70 -8.337 -16.177 -4.121 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.942 -16.249 -1.670 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.836 -13.761 -3.940 1.00 0.00 H new ATOM 0 HG22 THR A 70 -9.148 -14.102 -5.093 1.00 0.00 H new ATOM 0 HG23 THR A 70 -9.529 -13.465 -3.475 1.00 0.00 H new ATOM 15 N ALA A 71 -11.562 -17.519 -5.188 1.00 0.00 N ATOM 16 CA ALA A 71 -11.924 -18.030 -6.504 1.00 0.00 C ATOM 17 C ALA A 71 -12.687 -16.983 -7.309 1.00 0.00 C ATOM 18 O ALA A 71 -12.407 -16.767 -8.488 1.00 0.00 O ATOM 19 CB ALA A 71 -12.752 -19.299 -6.366 1.00 0.00 C ATOM 0 H ALA A 71 -12.057 -17.961 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 71 -11.005 -18.264 -7.042 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -13.016 -19.671 -7.356 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -12.173 -20.056 -5.837 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -13.661 -19.081 -5.806 1.00 0.00 H new ATOM 25 N SER A 72 -13.651 -16.335 -6.664 1.00 0.00 N ATOM 26 CA SER A 72 -14.455 -15.310 -7.319 1.00 0.00 C ATOM 27 C SER A 72 -13.682 -14.000 -7.428 1.00 0.00 C ATOM 28 O SER A 72 -12.508 -13.928 -7.065 1.00 0.00 O ATOM 29 CB SER A 72 -15.757 -15.084 -6.550 1.00 0.00 C ATOM 30 OG SER A 72 -16.597 -14.165 -7.227 1.00 0.00 O ATOM 0 H SER A 72 -13.895 -16.502 -5.688 1.00 0.00 H new ATOM 0 HA SER A 72 -14.691 -15.657 -8.325 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.278 -16.033 -6.424 1.00 0.00 H new ATOM 0 HB3 SER A 72 -15.533 -14.709 -5.551 1.00 0.00 H new ATOM 0 HG SER A 72 -17.423 -14.039 -6.716 1.00 0.00 H new ATOM 36 N GLY A 73 -14.347 -12.966 -7.933 1.00 0.00 N ATOM 37 CA GLY A 73 -13.706 -11.672 -8.081 1.00 0.00 C ATOM 38 C GLY A 73 -14.524 -10.714 -8.923 1.00 0.00 C ATOM 39 O GLY A 73 -14.377 -10.668 -10.144 1.00 0.00 O ATOM 0 H GLY A 73 -15.318 -13.001 -8.242 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.542 -11.236 -7.095 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.725 -11.806 -8.537 1.00 0.00 H new ATOM 43 N GLY A 74 -15.389 -9.945 -8.268 1.00 0.00 N ATOM 44 CA GLY A 74 -16.220 -8.991 -8.980 1.00 0.00 C ATOM 45 C GLY A 74 -16.532 -7.761 -8.151 1.00 0.00 C ATOM 46 O GLY A 74 -17.091 -7.865 -7.059 1.00 0.00 O ATOM 0 H GLY A 74 -15.529 -9.966 -7.258 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -15.716 -8.688 -9.898 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -17.152 -9.474 -9.273 1.00 0.00 H new ATOM 50 N GLU A 75 -16.169 -6.593 -8.670 1.00 0.00 N ATOM 51 CA GLU A 75 -16.414 -5.337 -7.971 1.00 0.00 C ATOM 52 C GLU A 75 -17.890 -4.962 -8.024 1.00 0.00 C ATOM 53 O GLU A 75 -18.553 -5.151 -9.044 1.00 0.00 O ATOM 54 CB GLU A 75 -15.568 -4.217 -8.580 1.00 0.00 C ATOM 55 CG GLU A 75 -14.072 -4.458 -8.475 1.00 0.00 C ATOM 56 CD GLU A 75 -13.326 -4.048 -9.730 1.00 0.00 C ATOM 57 OE1 GLU A 75 -13.689 -4.533 -10.822 1.00 0.00 O1- ATOM 58 OE2 GLU A 75 -12.378 -3.242 -9.621 1.00 0.00 O ATOM 0 H GLU A 75 -15.704 -6.490 -9.572 1.00 0.00 H new ATOM 0 HA GLU A 75 -16.131 -5.471 -6.927 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -15.836 -4.101 -9.630 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -15.812 -3.278 -8.083 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -13.677 -3.903 -7.624 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -13.891 -5.515 -8.278 1.00 0.00 H new ATOM 65 N ASN A 76 -18.401 -4.429 -6.918 1.00 0.00 N ATOM 66 CA ASN A 76 -19.800 -4.027 -6.840 1.00 0.00 C ATOM 67 C ASN A 76 -20.009 -2.656 -7.477 1.00 0.00 C ATOM 68 O ASN A 76 -19.406 -1.668 -7.057 1.00 0.00 O ATOM 69 CB ASN A 76 -20.265 -4.001 -5.383 1.00 0.00 C ATOM 70 CG ASN A 76 -21.762 -3.798 -5.256 1.00 0.00 C ATOM 71 OD1 ASN A 76 -22.377 -3.112 -6.071 1.00 0.00 O ATOM 72 ND2 ASN A 76 -22.355 -4.394 -4.228 1.00 0.00 N ATOM 0 H ASN A 76 -17.867 -4.266 -6.064 1.00 0.00 H new ATOM 0 HA ASN A 76 -20.393 -4.758 -7.390 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -19.986 -4.937 -4.899 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -19.747 -3.201 -4.854 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -23.360 -4.292 -4.090 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -21.805 -4.954 -3.577 1.00 0.00 H new ATOM 79 N GLU A 77 -20.866 -2.603 -8.491 1.00 0.00 N ATOM 80 CA GLU A 77 -21.153 -1.354 -9.185 1.00 0.00 C ATOM 81 C GLU A 77 -22.254 -0.573 -8.471 1.00 0.00 C ATOM 82 O GLU A 77 -23.276 -0.232 -9.067 1.00 0.00 O ATOM 83 CB GLU A 77 -21.565 -1.634 -10.632 1.00 0.00 C ATOM 84 CG GLU A 77 -20.392 -1.698 -11.597 1.00 0.00 C ATOM 85 CD GLU A 77 -20.294 -0.469 -12.478 1.00 0.00 C ATOM 86 OE1 GLU A 77 -21.266 -0.182 -13.208 1.00 0.00 O ATOM 87 OE2 GLU A 77 -19.245 0.208 -12.438 1.00 0.00 O1- ATOM 0 H GLU A 77 -21.374 -3.411 -8.850 1.00 0.00 H new ATOM 0 HA GLU A 77 -20.246 -0.750 -9.183 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -22.108 -2.578 -10.670 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -22.254 -0.856 -10.962 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -19.467 -1.810 -11.032 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -20.491 -2.584 -12.225 1.00 0.00 H new ATOM 94 N ARG A 78 -22.038 -0.294 -7.189 1.00 0.00 N ATOM 95 CA ARG A 78 -23.011 0.446 -6.393 1.00 0.00 C ATOM 96 C ARG A 78 -22.508 0.645 -4.965 1.00 0.00 C ATOM 97 O ARG A 78 -23.251 0.455 -4.002 1.00 0.00 O ATOM 98 CB ARG A 78 -24.354 -0.288 -6.376 1.00 0.00 C ATOM 99 CG ARG A 78 -25.556 0.641 -6.348 1.00 0.00 C ATOM 100 CD ARG A 78 -26.107 0.800 -4.939 1.00 0.00 C ATOM 101 NE ARG A 78 -27.565 0.729 -4.911 1.00 0.00 N ATOM 102 CZ ARG A 78 -28.256 -0.398 -5.068 1.00 0.00 C ATOM 103 NH1 ARG A 78 -27.626 -1.549 -5.262 1.00 0.00 N1+ ATOM 104 NH2 ARG A 78 -29.582 -0.374 -5.028 1.00 0.00 N ATOM 0 H ARG A 78 -21.198 -0.569 -6.680 1.00 0.00 H new ATOM 0 HA ARG A 78 -23.147 1.426 -6.851 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -24.420 -0.927 -7.256 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -24.390 -0.941 -5.504 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -25.271 1.617 -6.741 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -26.335 0.249 -7.002 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -25.694 0.021 -4.298 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -25.783 1.756 -4.529 1.00 0.00 H new ATOM 0 HE ARG A 78 -28.085 1.594 -4.762 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -26.607 -1.574 -5.292 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -28.161 -2.409 -5.382 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -30.072 0.508 -4.877 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -30.112 -1.237 -5.148 1.00 0.00 H new ATOM 118 N GLU A 79 -21.242 1.031 -4.836 1.00 0.00 N ATOM 119 CA GLU A 79 -20.643 1.254 -3.526 1.00 0.00 C ATOM 120 C GLU A 79 -19.287 1.941 -3.657 1.00 0.00 C ATOM 121 O GLU A 79 -19.002 2.912 -2.956 1.00 0.00 O ATOM 122 CB GLU A 79 -20.487 -0.071 -2.781 1.00 0.00 C ATOM 123 CG GLU A 79 -20.348 0.090 -1.276 1.00 0.00 C ATOM 124 CD GLU A 79 -20.852 -1.119 -0.512 1.00 0.00 C ATOM 125 OE1 GLU A 79 -22.061 -1.421 -0.609 1.00 0.00 O ATOM 126 OE2 GLU A 79 -20.040 -1.764 0.184 1.00 0.00 O1- ATOM 0 H GLU A 79 -20.613 1.195 -5.622 1.00 0.00 H new ATOM 0 HA GLU A 79 -21.306 1.906 -2.957 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.351 -0.701 -2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -19.610 -0.593 -3.165 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -19.301 0.262 -1.028 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -20.900 0.974 -0.956 1.00 0.00 H new ATOM 133 N ASP A 80 -18.454 1.429 -4.557 1.00 0.00 N ATOM 134 CA ASP A 80 -17.127 1.993 -4.778 1.00 0.00 C ATOM 135 C ASP A 80 -16.993 2.540 -6.195 1.00 0.00 C ATOM 136 O ASP A 80 -16.376 3.582 -6.413 1.00 0.00 O ATOM 137 CB ASP A 80 -16.052 0.935 -4.524 1.00 0.00 C ATOM 138 CG ASP A 80 -14.792 1.524 -3.922 1.00 0.00 C ATOM 139 OD1 ASP A 80 -14.887 2.158 -2.850 1.00 0.00 O1- ATOM 140 OD2 ASP A 80 -13.710 1.350 -4.521 1.00 0.00 O ATOM 0 H ASP A 80 -18.674 0.625 -5.145 1.00 0.00 H new ATOM 0 HA ASP A 80 -16.991 2.817 -4.078 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -16.449 0.172 -3.855 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -15.805 0.439 -5.463 1.00 0.00 H new ATOM 145 N LEU A 81 -17.574 1.830 -7.157 1.00 0.00 N ATOM 146 CA LEU A 81 -17.519 2.244 -8.555 1.00 0.00 C ATOM 147 C LEU A 81 -18.113 3.638 -8.736 1.00 0.00 C ATOM 148 O LEU A 81 -19.306 3.785 -8.999 1.00 0.00 O ATOM 149 CB LEU A 81 -18.263 1.239 -9.435 1.00 0.00 C ATOM 150 CG LEU A 81 -17.410 0.084 -9.961 1.00 0.00 C ATOM 151 CD1 LEU A 81 -16.197 0.614 -10.708 1.00 0.00 C ATOM 152 CD2 LEU A 81 -16.979 -0.823 -8.817 1.00 0.00 C ATOM 0 H LEU A 81 -18.089 0.965 -6.994 1.00 0.00 H new ATOM 0 HA LEU A 81 -16.472 2.276 -8.858 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -19.095 0.826 -8.865 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -18.692 1.770 -10.285 1.00 0.00 H new ATOM 0 HG LEU A 81 -18.012 -0.501 -10.656 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -15.602 -0.222 -11.075 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -16.526 1.223 -11.550 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.592 1.222 -10.035 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -16.373 -1.640 -9.209 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -16.394 -0.249 -8.098 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -17.861 -1.230 -8.323 1.00 0.00 H new ATOM 164 N GLU A 82 -17.271 4.656 -8.594 1.00 0.00 N ATOM 165 CA GLU A 82 -17.711 6.039 -8.744 1.00 0.00 C ATOM 166 C GLU A 82 -16.803 6.794 -9.708 1.00 0.00 C ATOM 167 O GLU A 82 -17.214 7.152 -10.813 1.00 0.00 O ATOM 168 CB GLU A 82 -17.729 6.741 -7.385 1.00 0.00 C ATOM 169 CG GLU A 82 -18.840 6.260 -6.466 1.00 0.00 C ATOM 170 CD GLU A 82 -20.221 6.602 -6.993 1.00 0.00 C ATOM 171 OE1 GLU A 82 -20.556 7.804 -7.041 1.00 0.00 O ATOM 172 OE2 GLU A 82 -20.964 5.668 -7.357 1.00 0.00 O1- ATOM 0 H GLU A 82 -16.280 4.550 -8.375 1.00 0.00 H new ATOM 0 HA GLU A 82 -18.721 6.032 -9.153 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -16.769 6.586 -6.893 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -17.837 7.814 -7.541 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -18.760 5.180 -6.340 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -18.710 6.707 -5.480 1.00 0.00 H new ATOM 179 N GLN A 83 -15.566 7.032 -9.285 1.00 0.00 N ATOM 180 CA GLN A 83 -14.598 7.742 -10.113 1.00 0.00 C ATOM 181 C GLN A 83 -14.025 6.821 -11.185 1.00 0.00 C ATOM 182 O GLN A 83 -13.908 5.613 -10.980 1.00 0.00 O ATOM 183 CB GLN A 83 -13.468 8.304 -9.247 1.00 0.00 C ATOM 184 CG GLN A 83 -12.666 7.235 -8.526 1.00 0.00 C ATOM 185 CD GLN A 83 -12.019 7.749 -7.255 1.00 0.00 C ATOM 186 OE1 GLN A 83 -10.796 7.766 -7.130 1.00 0.00 O ATOM 187 NE2 GLN A 83 -12.843 8.170 -6.303 1.00 0.00 N ATOM 0 H GLN A 83 -15.210 6.744 -8.374 1.00 0.00 H new ATOM 0 HA GLN A 83 -15.112 8.568 -10.605 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -12.796 8.889 -9.875 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -13.891 8.987 -8.511 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -13.320 6.397 -8.283 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -11.894 6.853 -9.194 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -13.852 8.137 -6.451 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -12.467 8.526 -5.424 1.00 0.00 H new ATOM 196 N GLU A 84 -13.671 7.398 -12.329 1.00 0.00 N ATOM 197 CA GLU A 84 -13.112 6.626 -13.432 1.00 0.00 C ATOM 198 C GLU A 84 -11.668 7.030 -13.709 1.00 0.00 C ATOM 199 O GLU A 84 -11.385 7.738 -14.675 1.00 0.00 O ATOM 200 CB GLU A 84 -13.958 6.815 -14.693 1.00 0.00 C ATOM 201 CG GLU A 84 -15.290 6.084 -14.648 1.00 0.00 C ATOM 202 CD GLU A 84 -16.220 6.496 -15.772 1.00 0.00 C ATOM 203 OE1 GLU A 84 -15.986 6.068 -16.922 1.00 0.00 O ATOM 204 OE2 GLU A 84 -17.182 7.245 -15.503 1.00 0.00 O1- ATOM 0 H GLU A 84 -13.761 8.397 -12.516 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.124 5.574 -13.147 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -14.142 7.879 -14.841 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.391 6.467 -15.556 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -15.113 5.010 -14.703 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -15.774 6.278 -13.691 1.00 0.00 H new ATOM 211 N TRP A 85 -10.755 6.571 -12.859 1.00 0.00 N ATOM 212 CA TRP A 85 -9.340 6.882 -13.019 1.00 0.00 C ATOM 213 C TRP A 85 -8.770 6.170 -14.246 1.00 0.00 C ATOM 214 O TRP A 85 -9.081 5.007 -14.502 1.00 0.00 O ATOM 215 CB TRP A 85 -8.560 6.480 -11.757 1.00 0.00 C ATOM 216 CG TRP A 85 -7.092 6.278 -11.998 1.00 0.00 C ATOM 217 CD1 TRP A 85 -6.254 7.104 -12.690 1.00 0.00 C ATOM 218 CD2 TRP A 85 -6.292 5.173 -11.558 1.00 0.00 C ATOM 219 NE1 TRP A 85 -4.985 6.580 -12.706 1.00 0.00 N ATOM 220 CE2 TRP A 85 -4.984 5.399 -12.025 1.00 0.00 C ATOM 221 CE3 TRP A 85 -6.549 4.018 -10.817 1.00 0.00 C ATOM 222 CZ2 TRP A 85 -3.943 4.515 -11.780 1.00 0.00 C ATOM 223 CZ3 TRP A 85 -5.507 3.142 -10.573 1.00 0.00 C ATOM 224 CH2 TRP A 85 -4.223 3.397 -11.055 1.00 0.00 C ATOM 0 H TRP A 85 -10.970 5.983 -12.054 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.237 7.957 -13.166 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -8.693 7.250 -10.997 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -8.984 5.560 -11.355 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -6.546 8.033 -13.156 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -4.174 7.006 -13.155 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.541 3.813 -10.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -2.947 4.707 -12.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -5.690 2.245 -10.000 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -3.432 2.691 -10.848 1.00 0.00 H new ATOM 235 N LYS A 86 -7.937 6.879 -15.002 1.00 0.00 N ATOM 236 CA LYS A 86 -7.330 6.326 -16.195 1.00 0.00 C ATOM 237 C LYS A 86 -6.279 5.276 -15.834 1.00 0.00 C ATOM 238 O LYS A 86 -5.391 5.533 -15.021 1.00 0.00 O ATOM 239 CB LYS A 86 -6.694 7.439 -17.031 1.00 0.00 C ATOM 240 CG LYS A 86 -7.061 7.377 -18.504 1.00 0.00 C ATOM 241 CD LYS A 86 -8.416 8.012 -18.768 1.00 0.00 C ATOM 242 CE LYS A 86 -8.599 8.346 -20.240 1.00 0.00 C ATOM 243 NZ LYS A 86 -10.018 8.209 -20.671 1.00 0.00 N1+ ATOM 0 H LYS A 86 -7.670 7.843 -14.803 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.112 5.843 -16.782 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.001 8.405 -16.629 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.610 7.382 -16.932 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.298 7.888 -19.092 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.075 6.338 -18.833 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.206 7.333 -18.447 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.515 8.920 -18.173 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.261 9.365 -20.425 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -7.972 7.688 -20.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.099 8.446 -21.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.334 7.230 -20.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -10.614 8.855 -20.115 1.00 0.00 H new ATOM 257 N PRO A 87 -6.363 4.073 -16.431 1.00 0.00 N ATOM 258 CA PRO A 87 -5.409 2.991 -16.155 1.00 0.00 C ATOM 259 C PRO A 87 -3.961 3.414 -16.401 1.00 0.00 C ATOM 260 O PRO A 87 -3.653 4.032 -17.419 1.00 0.00 O ATOM 261 CB PRO A 87 -5.816 1.891 -17.141 1.00 0.00 C ATOM 262 CG PRO A 87 -7.242 2.175 -17.464 1.00 0.00 C ATOM 263 CD PRO A 87 -7.387 3.669 -17.411 1.00 0.00 C ATOM 0 HA PRO A 87 -5.443 2.680 -15.111 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.196 1.914 -18.037 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -5.700 0.901 -16.699 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -7.503 1.792 -18.451 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.908 1.692 -16.749 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.213 4.125 -18.386 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.387 3.965 -17.094 1.00 0.00 H new ATOM 271 N PRO A 88 -3.049 3.085 -15.467 1.00 0.00 N ATOM 272 CA PRO A 88 -1.634 3.430 -15.584 1.00 0.00 C ATOM 273 C PRO A 88 -0.846 2.384 -16.368 1.00 0.00 C ATOM 274 O PRO A 88 -1.427 1.550 -17.063 1.00 0.00 O ATOM 275 CB PRO A 88 -1.186 3.463 -14.127 1.00 0.00 C ATOM 276 CG PRO A 88 -2.017 2.418 -13.459 1.00 0.00 C ATOM 277 CD PRO A 88 -3.324 2.350 -14.216 1.00 0.00 C ATOM 0 HA PRO A 88 -1.470 4.362 -16.125 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.122 3.245 -14.033 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -1.350 4.445 -13.683 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -1.511 1.453 -13.475 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.189 2.671 -12.413 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.617 1.319 -14.415 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -4.136 2.810 -13.653 1.00 0.00 H new ATOM 285 N ASP A 89 0.478 2.426 -16.245 1.00 0.00 N ATOM 286 CA ASP A 89 1.338 1.485 -16.928 1.00 0.00 C ATOM 287 C ASP A 89 2.188 0.723 -15.923 1.00 0.00 C ATOM 288 O ASP A 89 2.568 1.260 -14.883 1.00 0.00 O ATOM 289 CB ASP A 89 2.234 2.208 -17.935 1.00 0.00 C ATOM 290 CG ASP A 89 1.459 2.728 -19.129 1.00 0.00 C ATOM 291 OD1 ASP A 89 0.845 3.811 -19.014 1.00 0.00 O1- ATOM 292 OD2 ASP A 89 1.465 2.053 -20.180 1.00 0.00 O ATOM 0 H ASP A 89 0.974 3.109 -15.673 1.00 0.00 H new ATOM 0 HA ASP A 89 0.711 0.776 -17.469 1.00 0.00 H new ATOM 0 HB2 ASP A 89 2.735 3.040 -17.440 1.00 0.00 H new ATOM 0 HB3 ASP A 89 3.012 1.527 -18.279 1.00 0.00 H new ATOM 297 N GLU A 90 2.483 -0.530 -16.239 1.00 0.00 N ATOM 298 CA GLU A 90 3.288 -1.368 -15.368 1.00 0.00 C ATOM 299 C GLU A 90 4.607 -0.689 -15.012 1.00 0.00 C ATOM 300 O GLU A 90 5.236 -1.025 -14.009 1.00 0.00 O ATOM 301 CB GLU A 90 3.560 -2.709 -16.040 1.00 0.00 C ATOM 302 CG GLU A 90 3.877 -2.603 -17.524 1.00 0.00 C ATOM 303 CD GLU A 90 2.834 -3.277 -18.394 1.00 0.00 C ATOM 304 OE1 GLU A 90 1.675 -2.810 -18.401 1.00 0.00 O ATOM 305 OE2 GLU A 90 3.175 -4.270 -19.069 1.00 0.00 O1- ATOM 0 H GLU A 90 2.174 -0.988 -17.096 1.00 0.00 H new ATOM 0 HA GLU A 90 2.730 -1.531 -14.446 1.00 0.00 H new ATOM 0 HB2 GLU A 90 4.394 -3.195 -15.534 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.690 -3.353 -15.910 1.00 0.00 H new ATOM 0 HG2 GLU A 90 3.951 -1.552 -17.801 1.00 0.00 H new ATOM 0 HG3 GLU A 90 4.851 -3.053 -17.717 1.00 0.00 H new ATOM 312 N GLU A 91 5.018 0.275 -15.833 1.00 0.00 N ATOM 313 CA GLU A 91 6.258 1.001 -15.591 1.00 0.00 C ATOM 314 C GLU A 91 6.244 1.614 -14.199 1.00 0.00 C ATOM 315 O GLU A 91 7.156 1.404 -13.397 1.00 0.00 O ATOM 316 CB GLU A 91 6.438 2.102 -16.636 1.00 0.00 C ATOM 317 CG GLU A 91 6.337 1.604 -18.069 1.00 0.00 C ATOM 318 CD GLU A 91 6.957 2.564 -19.066 1.00 0.00 C ATOM 319 OE1 GLU A 91 6.361 3.633 -19.310 1.00 0.00 O1- ATOM 320 OE2 GLU A 91 8.040 2.245 -19.600 1.00 0.00 O ATOM 0 H GLU A 91 4.511 0.569 -16.668 1.00 0.00 H new ATOM 0 HA GLU A 91 7.090 0.301 -15.664 1.00 0.00 H new ATOM 0 HB2 GLU A 91 5.684 2.872 -16.474 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.410 2.573 -16.492 1.00 0.00 H new ATOM 0 HG2 GLU A 91 6.830 0.635 -18.148 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.288 1.450 -18.323 1.00 0.00 H new ATOM 327 N LEU A 92 5.190 2.367 -13.918 1.00 0.00 N ATOM 328 CA LEU A 92 5.034 3.011 -12.625 1.00 0.00 C ATOM 329 C LEU A 92 4.608 2.002 -11.562 1.00 0.00 C ATOM 330 O LEU A 92 4.823 2.218 -10.370 1.00 0.00 O ATOM 331 CB LEU A 92 4.013 4.143 -12.723 1.00 0.00 C ATOM 332 CG LEU A 92 4.025 5.140 -11.560 1.00 0.00 C ATOM 333 CD1 LEU A 92 3.403 4.522 -10.318 1.00 0.00 C ATOM 334 CD2 LEU A 92 5.444 5.612 -11.271 1.00 0.00 C ATOM 0 H LEU A 92 4.428 2.546 -14.572 1.00 0.00 H new ATOM 0 HA LEU A 92 5.997 3.427 -12.330 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.189 4.689 -13.650 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.017 3.706 -12.795 1.00 0.00 H new ATOM 0 HG LEU A 92 3.429 6.006 -11.847 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.421 5.246 -9.503 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.372 4.240 -10.530 1.00 0.00 H new ATOM 0 HD13 LEU A 92 3.970 3.637 -10.029 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.430 6.319 -10.442 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.066 4.756 -11.008 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.853 6.099 -12.156 1.00 0.00 H new ATOM 346 N ILE A 93 4.011 0.893 -11.997 1.00 0.00 N ATOM 347 CA ILE A 93 3.570 -0.140 -11.071 1.00 0.00 C ATOM 348 C ILE A 93 4.764 -0.860 -10.458 1.00 0.00 C ATOM 349 O ILE A 93 4.737 -1.244 -9.290 1.00 0.00 O ATOM 350 CB ILE A 93 2.654 -1.163 -11.770 1.00 0.00 C ATOM 351 CG1 ILE A 93 1.441 -0.454 -12.373 1.00 0.00 C ATOM 352 CG2 ILE A 93 2.213 -2.243 -10.794 1.00 0.00 C ATOM 353 CD1 ILE A 93 0.576 -1.354 -13.225 1.00 0.00 C ATOM 0 H ILE A 93 3.824 0.691 -12.979 1.00 0.00 H new ATOM 0 HA ILE A 93 3.003 0.351 -10.280 1.00 0.00 H new ATOM 0 HB ILE A 93 3.214 -1.642 -12.573 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.836 -0.039 -11.567 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.785 0.385 -12.978 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.567 -2.955 -11.307 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.089 -2.762 -10.406 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.666 -1.787 -9.969 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.265 -0.783 -13.619 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.166 -1.749 -14.052 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.202 -2.179 -12.619 1.00 0.00 H new ATOM 365 N LYS A 94 5.814 -1.034 -11.253 1.00 0.00 N ATOM 366 CA LYS A 94 7.022 -1.701 -10.786 1.00 0.00 C ATOM 367 C LYS A 94 7.784 -0.803 -9.818 1.00 0.00 C ATOM 368 O LYS A 94 8.404 -1.281 -8.868 1.00 0.00 O ATOM 369 CB LYS A 94 7.915 -2.082 -11.968 1.00 0.00 C ATOM 370 CG LYS A 94 8.502 -3.479 -11.861 1.00 0.00 C ATOM 371 CD LYS A 94 9.309 -3.840 -13.098 1.00 0.00 C ATOM 372 CE LYS A 94 9.951 -5.212 -12.963 1.00 0.00 C ATOM 373 NZ LYS A 94 9.957 -5.951 -14.255 1.00 0.00 N1+ ATOM 0 H LYS A 94 5.852 -0.722 -12.223 1.00 0.00 H new ATOM 0 HA LYS A 94 6.731 -2.612 -10.263 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.336 -2.010 -12.888 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.728 -1.360 -12.046 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.139 -3.541 -10.979 1.00 0.00 H new ATOM 0 HG3 LYS A 94 7.699 -4.203 -11.725 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.661 -3.825 -13.974 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.082 -3.090 -13.261 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.974 -5.100 -12.604 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.412 -5.793 -12.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.403 -6.881 -14.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.979 -6.080 -14.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.493 -5.409 -14.962 1.00 0.00 H new ATOM 387 N LYS A 95 7.728 0.503 -10.061 1.00 0.00 N ATOM 388 CA LYS A 95 8.407 1.465 -9.199 1.00 0.00 C ATOM 389 C LYS A 95 7.782 1.464 -7.807 1.00 0.00 C ATOM 390 O LYS A 95 8.472 1.278 -6.803 1.00 0.00 O ATOM 391 CB LYS A 95 8.333 2.867 -9.806 1.00 0.00 C ATOM 392 CG LYS A 95 8.939 2.961 -11.195 1.00 0.00 C ATOM 393 CD LYS A 95 10.398 3.384 -11.141 1.00 0.00 C ATOM 394 CE LYS A 95 10.548 4.892 -11.265 1.00 0.00 C ATOM 395 NZ LYS A 95 11.964 5.294 -11.478 1.00 0.00 N1+ ATOM 0 H LYS A 95 7.222 0.918 -10.844 1.00 0.00 H new ATOM 0 HA LYS A 95 9.454 1.174 -9.114 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.290 3.179 -9.852 1.00 0.00 H new ATOM 0 HB3 LYS A 95 8.846 3.567 -9.147 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.858 1.995 -11.694 1.00 0.00 H new ATOM 0 HG3 LYS A 95 8.374 3.677 -11.792 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.840 3.050 -10.202 1.00 0.00 H new ATOM 0 HD3 LYS A 95 10.949 2.896 -11.945 1.00 0.00 H new ATOM 0 HE2 LYS A 95 9.940 5.250 -12.096 1.00 0.00 H new ATOM 0 HE3 LYS A 95 10.167 5.370 -10.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 12.023 6.329 -11.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 12.540 4.975 -10.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 12.321 4.859 -12.353 1.00 0.00 H new ATOM 409 N LEU A 96 6.468 1.666 -7.756 1.00 0.00 N ATOM 410 CA LEU A 96 5.740 1.683 -6.493 1.00 0.00 C ATOM 411 C LEU A 96 5.971 0.390 -5.715 1.00 0.00 C ATOM 412 O LEU A 96 6.401 0.413 -4.561 1.00 0.00 O ATOM 413 CB LEU A 96 4.243 1.873 -6.751 1.00 0.00 C ATOM 414 CG LEU A 96 3.684 3.226 -6.330 1.00 0.00 C ATOM 415 CD1 LEU A 96 2.639 3.712 -7.322 1.00 0.00 C ATOM 416 CD2 LEU A 96 3.100 3.145 -4.929 1.00 0.00 C ATOM 0 H LEU A 96 5.885 1.821 -8.579 1.00 0.00 H new ATOM 0 HA LEU A 96 6.111 2.517 -5.897 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.052 1.733 -7.815 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.697 1.091 -6.224 1.00 0.00 H new ATOM 0 HG LEU A 96 4.501 3.947 -6.322 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.254 4.680 -7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.092 3.811 -8.308 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.820 2.994 -7.369 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.705 4.120 -4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.297 2.408 -4.912 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.879 2.849 -4.227 1.00 0.00 H new ATOM 428 N VAL A 97 5.677 -0.736 -6.357 1.00 0.00 N ATOM 429 CA VAL A 97 5.847 -2.041 -5.731 1.00 0.00 C ATOM 430 C VAL A 97 7.269 -2.223 -5.209 1.00 0.00 C ATOM 431 O VAL A 97 7.482 -2.819 -4.154 1.00 0.00 O ATOM 432 CB VAL A 97 5.521 -3.179 -6.716 1.00 0.00 C ATOM 433 CG1 VAL A 97 6.522 -3.204 -7.859 1.00 0.00 C ATOM 434 CG2 VAL A 97 5.492 -4.517 -5.994 1.00 0.00 C ATOM 0 H VAL A 97 5.319 -0.770 -7.312 1.00 0.00 H new ATOM 0 HA VAL A 97 5.151 -2.084 -4.893 1.00 0.00 H new ATOM 0 HB VAL A 97 4.532 -2.996 -7.137 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.273 -4.015 -8.543 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.487 -2.255 -8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.525 -3.360 -7.461 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.260 -5.309 -6.706 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.466 -4.708 -5.543 1.00 0.00 H new ATOM 0 HG23 VAL A 97 4.729 -4.494 -5.216 1.00 0.00 H new ATOM 444 N ASP A 98 8.236 -1.702 -5.957 1.00 0.00 N ATOM 445 CA ASP A 98 9.638 -1.804 -5.570 1.00 0.00 C ATOM 446 C ASP A 98 9.857 -1.222 -4.178 1.00 0.00 C ATOM 447 O ASP A 98 10.724 -1.679 -3.432 1.00 0.00 O ATOM 448 CB ASP A 98 10.522 -1.079 -6.588 1.00 0.00 C ATOM 449 CG ASP A 98 11.313 -2.040 -7.454 1.00 0.00 C ATOM 450 OD1 ASP A 98 12.444 -2.398 -7.064 1.00 0.00 O1- ATOM 451 OD2 ASP A 98 10.801 -2.435 -8.523 1.00 0.00 O ATOM 0 H ASP A 98 8.075 -1.206 -6.833 1.00 0.00 H new ATOM 0 HA ASP A 98 9.912 -2.859 -5.550 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.899 -0.450 -7.224 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.210 -0.418 -6.062 1.00 0.00 H new ATOM 456 N GLN A 99 9.063 -0.214 -3.832 1.00 0.00 N ATOM 457 CA GLN A 99 9.170 0.423 -2.528 1.00 0.00 C ATOM 458 C GLN A 99 8.593 -0.475 -1.442 1.00 0.00 C ATOM 459 O GLN A 99 9.053 -0.457 -0.300 1.00 0.00 O ATOM 460 CB GLN A 99 8.447 1.770 -2.535 1.00 0.00 C ATOM 461 CG GLN A 99 9.336 2.935 -2.941 1.00 0.00 C ATOM 462 CD GLN A 99 9.288 4.081 -1.949 1.00 0.00 C ATOM 463 OE1 GLN A 99 10.312 4.687 -1.632 1.00 0.00 O ATOM 464 NE2 GLN A 99 8.094 4.384 -1.454 1.00 0.00 N ATOM 0 H GLN A 99 8.340 0.177 -4.436 1.00 0.00 H new ATOM 0 HA GLN A 99 10.226 0.590 -2.314 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.600 1.715 -3.219 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.043 1.961 -1.541 1.00 0.00 H new ATOM 0 HG2 GLN A 99 10.364 2.586 -3.037 1.00 0.00 H new ATOM 0 HG3 GLN A 99 9.029 3.296 -3.922 1.00 0.00 H new ATOM 0 HE21 GLN A 99 7.272 3.855 -1.745 1.00 0.00 H new ATOM 0 HE22 GLN A 99 7.999 5.146 -0.783 1.00 0.00 H new ATOM 473 N ILE A 100 7.584 -1.261 -1.802 1.00 0.00 N ATOM 474 CA ILE A 100 6.949 -2.162 -0.858 1.00 0.00 C ATOM 475 C ILE A 100 7.854 -3.323 -0.516 1.00 0.00 C ATOM 476 O ILE A 100 8.282 -3.486 0.623 1.00 0.00 O ATOM 477 CB ILE A 100 5.630 -2.724 -1.413 1.00 0.00 C ATOM 478 CG1 ILE A 100 4.841 -1.638 -2.143 1.00 0.00 C ATOM 479 CG2 ILE A 100 4.807 -3.310 -0.287 1.00 0.00 C ATOM 480 CD1 ILE A 100 4.733 -0.359 -1.353 1.00 0.00 C ATOM 0 H ILE A 100 7.191 -1.289 -2.743 1.00 0.00 H new ATOM 0 HA ILE A 100 6.745 -1.576 0.038 1.00 0.00 H new ATOM 0 HB ILE A 100 5.861 -3.511 -2.130 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.320 -1.429 -3.099 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.840 -2.009 -2.363 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.874 -3.707 -0.687 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.366 -4.113 0.193 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.587 -2.533 0.445 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.162 0.374 -1.923 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.228 -0.557 -0.408 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.731 0.032 -1.156 1.00 0.00 H new ATOM 492 N GLU A 101 8.158 -4.123 -1.519 1.00 0.00 N ATOM 493 CA GLU A 101 9.036 -5.269 -1.328 1.00 0.00 C ATOM 494 C GLU A 101 10.309 -4.841 -0.602 1.00 0.00 C ATOM 495 O GLU A 101 10.977 -5.651 0.040 1.00 0.00 O ATOM 496 CB GLU A 101 9.394 -5.901 -2.675 1.00 0.00 C ATOM 497 CG GLU A 101 10.199 -7.184 -2.551 1.00 0.00 C ATOM 498 CD GLU A 101 11.060 -7.453 -3.769 1.00 0.00 C ATOM 499 OE1 GLU A 101 12.002 -6.670 -4.015 1.00 0.00 O ATOM 500 OE2 GLU A 101 10.794 -8.447 -4.476 1.00 0.00 O1- ATOM 0 H GLU A 101 7.814 -4.005 -2.472 1.00 0.00 H new ATOM 0 HA GLU A 101 8.511 -6.008 -0.723 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.476 -6.110 -3.224 1.00 0.00 H new ATOM 0 HB3 GLU A 101 9.962 -5.181 -3.265 1.00 0.00 H new ATOM 0 HG2 GLU A 101 10.835 -7.126 -1.667 1.00 0.00 H new ATOM 0 HG3 GLU A 101 9.519 -8.022 -2.400 1.00 0.00 H new ATOM 507 N PHE A 102 10.636 -3.556 -0.722 1.00 0.00 N ATOM 508 CA PHE A 102 11.829 -3.004 -0.090 1.00 0.00 C ATOM 509 C PHE A 102 11.575 -2.561 1.350 1.00 0.00 C ATOM 510 O PHE A 102 12.423 -2.751 2.220 1.00 0.00 O ATOM 511 CB PHE A 102 12.353 -1.821 -0.905 1.00 0.00 C ATOM 512 CG PHE A 102 13.679 -1.301 -0.426 1.00 0.00 C ATOM 513 CD1 PHE A 102 13.739 -0.324 0.554 1.00 0.00 C ATOM 514 CD2 PHE A 102 14.862 -1.789 -0.957 1.00 0.00 C ATOM 515 CE1 PHE A 102 14.957 0.157 0.997 1.00 0.00 C ATOM 516 CE2 PHE A 102 16.082 -1.311 -0.518 1.00 0.00 C ATOM 517 CZ PHE A 102 16.130 -0.337 0.460 1.00 0.00 C ATOM 0 H PHE A 102 10.089 -2.878 -1.252 1.00 0.00 H new ATOM 0 HA PHE A 102 12.574 -3.799 -0.062 1.00 0.00 H new ATOM 0 HB2 PHE A 102 12.446 -2.122 -1.949 1.00 0.00 H new ATOM 0 HB3 PHE A 102 11.621 -1.014 -0.870 1.00 0.00 H new ATOM 0 HD1 PHE A 102 12.825 0.066 0.976 1.00 0.00 H new ATOM 0 HD2 PHE A 102 14.830 -2.551 -1.722 1.00 0.00 H new ATOM 0 HE1 PHE A 102 14.991 0.918 1.762 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.998 -1.699 -0.940 1.00 0.00 H new ATOM 0 HZ PHE A 102 17.083 0.038 0.804 1.00 0.00 H new ATOM 527 N TYR A 103 10.422 -1.941 1.589 1.00 0.00 N ATOM 528 CA TYR A 103 10.092 -1.438 2.920 1.00 0.00 C ATOM 529 C TYR A 103 9.604 -2.536 3.851 1.00 0.00 C ATOM 530 O TYR A 103 9.576 -2.364 5.070 1.00 0.00 O ATOM 531 CB TYR A 103 9.102 -0.266 2.823 1.00 0.00 C ATOM 532 CG TYR A 103 7.633 -0.583 2.549 1.00 0.00 C ATOM 533 CD1 TYR A 103 7.136 -1.880 2.429 1.00 0.00 C ATOM 534 CD2 TYR A 103 6.728 0.465 2.413 1.00 0.00 C ATOM 535 CE1 TYR A 103 5.803 -2.116 2.187 1.00 0.00 C ATOM 536 CE2 TYR A 103 5.389 0.233 2.171 1.00 0.00 C ATOM 537 CZ TYR A 103 4.932 -1.058 2.060 1.00 0.00 C ATOM 538 OH TYR A 103 3.596 -1.295 1.820 1.00 0.00 O ATOM 0 H TYR A 103 9.704 -1.775 0.883 1.00 0.00 H new ATOM 0 HA TYR A 103 11.010 -1.060 3.370 1.00 0.00 H new ATOM 0 HB2 TYR A 103 9.153 0.292 3.758 1.00 0.00 H new ATOM 0 HB3 TYR A 103 9.451 0.401 2.035 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.812 -2.717 2.528 1.00 0.00 H new ATOM 0 HD2 TYR A 103 7.081 1.482 2.499 1.00 0.00 H new ATOM 0 HE1 TYR A 103 5.440 -3.129 2.097 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.704 1.062 2.069 1.00 0.00 H new ATOM 0 HH TYR A 103 3.139 -0.446 1.647 1.00 0.00 H new ATOM 548 N PHE A 104 9.239 -3.667 3.275 1.00 0.00 N ATOM 549 CA PHE A 104 8.773 -4.800 4.058 1.00 0.00 C ATOM 550 C PHE A 104 9.937 -5.715 4.426 1.00 0.00 C ATOM 551 O PHE A 104 9.767 -6.676 5.177 1.00 0.00 O ATOM 552 CB PHE A 104 7.704 -5.583 3.290 1.00 0.00 C ATOM 553 CG PHE A 104 6.371 -5.639 3.984 1.00 0.00 C ATOM 554 CD1 PHE A 104 6.291 -5.721 5.366 1.00 0.00 C ATOM 555 CD2 PHE A 104 5.196 -5.613 3.251 1.00 0.00 C ATOM 556 CE1 PHE A 104 5.066 -5.776 6.002 1.00 0.00 C ATOM 557 CE2 PHE A 104 3.968 -5.666 3.882 1.00 0.00 C ATOM 558 CZ PHE A 104 3.903 -5.748 5.258 1.00 0.00 C ATOM 0 H PHE A 104 9.256 -3.827 2.268 1.00 0.00 H new ATOM 0 HA PHE A 104 8.329 -4.418 4.977 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.572 -5.130 2.307 1.00 0.00 H new ATOM 0 HB3 PHE A 104 8.060 -6.600 3.127 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.198 -5.742 5.952 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.240 -5.551 2.174 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.018 -5.841 7.079 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.059 -5.643 3.299 1.00 0.00 H new ATOM 0 HZ PHE A 104 2.944 -5.790 5.752 1.00 0.00 H new ATOM 568 N SER A 105 11.119 -5.404 3.906 1.00 0.00 N ATOM 569 CA SER A 105 12.307 -6.199 4.200 1.00 0.00 C ATOM 570 C SER A 105 12.584 -6.205 5.701 1.00 0.00 C ATOM 571 O SER A 105 12.400 -5.193 6.375 1.00 0.00 O ATOM 572 CB SER A 105 13.518 -5.645 3.445 1.00 0.00 C ATOM 573 OG SER A 105 14.347 -6.693 2.972 1.00 0.00 O ATOM 0 H SER A 105 11.281 -4.613 3.283 1.00 0.00 H new ATOM 0 HA SER A 105 12.127 -7.223 3.872 1.00 0.00 H new ATOM 0 HB2 SER A 105 13.180 -5.037 2.606 1.00 0.00 H new ATOM 0 HB3 SER A 105 14.092 -4.991 4.102 1.00 0.00 H new ATOM 0 HG SER A 105 15.112 -6.313 2.492 1.00 0.00 H new ATOM 579 N ASP A 106 13.023 -7.349 6.222 1.00 0.00 N ATOM 580 CA ASP A 106 13.319 -7.484 7.651 1.00 0.00 C ATOM 581 C ASP A 106 14.084 -6.263 8.179 1.00 0.00 C ATOM 582 O ASP A 106 13.731 -5.686 9.213 1.00 0.00 O ATOM 583 CB ASP A 106 14.127 -8.768 7.902 1.00 0.00 C ATOM 584 CG ASP A 106 15.623 -8.591 7.702 1.00 0.00 C ATOM 585 OD1 ASP A 106 16.055 -8.461 6.537 1.00 0.00 O1- ATOM 586 OD2 ASP A 106 16.360 -8.584 8.710 1.00 0.00 O ATOM 0 H ASP A 106 13.182 -8.197 5.678 1.00 0.00 H new ATOM 0 HA ASP A 106 12.373 -7.545 8.189 1.00 0.00 H new ATOM 0 HB2 ASP A 106 13.943 -9.111 8.920 1.00 0.00 H new ATOM 0 HB3 ASP A 106 13.769 -9.550 7.232 1.00 0.00 H new ATOM 591 N GLU A 107 15.133 -5.883 7.457 1.00 0.00 N ATOM 592 CA GLU A 107 15.965 -4.745 7.832 1.00 0.00 C ATOM 593 C GLU A 107 15.241 -3.425 7.612 1.00 0.00 C ATOM 594 O GLU A 107 15.587 -2.408 8.213 1.00 0.00 O ATOM 595 CB GLU A 107 17.253 -4.756 7.014 1.00 0.00 C ATOM 596 CG GLU A 107 18.113 -5.981 7.260 1.00 0.00 C ATOM 597 CD GLU A 107 18.773 -5.967 8.625 1.00 0.00 C ATOM 598 OE1 GLU A 107 18.041 -5.987 9.638 1.00 0.00 O ATOM 599 OE2 GLU A 107 20.020 -5.939 8.681 1.00 0.00 O1- ATOM 0 H GLU A 107 15.429 -6.352 6.601 1.00 0.00 H new ATOM 0 HA GLU A 107 16.194 -4.836 8.894 1.00 0.00 H new ATOM 0 HB2 GLU A 107 17.002 -4.704 5.955 1.00 0.00 H new ATOM 0 HB3 GLU A 107 17.831 -3.862 7.249 1.00 0.00 H new ATOM 0 HG2 GLU A 107 17.498 -6.876 7.167 1.00 0.00 H new ATOM 0 HG3 GLU A 107 18.882 -6.041 6.490 1.00 0.00 H new ATOM 606 N ASN A 108 14.239 -3.446 6.748 1.00 0.00 N ATOM 607 CA ASN A 108 13.468 -2.248 6.452 1.00 0.00 C ATOM 608 C ASN A 108 12.357 -2.069 7.473 1.00 0.00 C ATOM 609 O ASN A 108 11.851 -0.966 7.668 1.00 0.00 O ATOM 610 CB ASN A 108 12.890 -2.316 5.037 1.00 0.00 C ATOM 611 CG ASN A 108 13.332 -1.145 4.181 1.00 0.00 C ATOM 612 OD1 ASN A 108 12.779 0.032 4.455 1.00 0.00 O flip ATOM 613 ND2 ASN A 108 14.163 -1.294 3.285 1.00 0.00 N flip ATOM 0 H ASN A 108 13.940 -4.278 6.239 1.00 0.00 H new ATOM 0 HA ASN A 108 14.133 -1.386 6.509 1.00 0.00 H new ATOM 0 HB2 ASN A 108 13.201 -3.247 4.564 1.00 0.00 H new ATOM 0 HB3 ASN A 108 11.802 -2.334 5.091 1.00 0.00 H new ATOM 0 HD21 ASN A 108 14.563 -2.216 3.108 1.00 0.00 H new ATOM 0 HD22 ASN A 108 14.452 -0.496 2.719 1.00 0.00 H new ATOM 620 N LEU A 109 11.993 -3.161 8.137 1.00 0.00 N ATOM 621 CA LEU A 109 10.968 -3.127 9.147 1.00 0.00 C ATOM 622 C LEU A 109 11.473 -2.367 10.351 1.00 0.00 C ATOM 623 O LEU A 109 10.786 -1.500 10.892 1.00 0.00 O ATOM 624 CB LEU A 109 10.590 -4.539 9.527 1.00 0.00 C ATOM 625 CG LEU A 109 9.540 -5.176 8.629 1.00 0.00 C ATOM 626 CD1 LEU A 109 8.185 -5.094 9.299 1.00 0.00 C ATOM 627 CD2 LEU A 109 9.489 -4.510 7.262 1.00 0.00 C ATOM 0 H LEU A 109 12.403 -4.083 7.984 1.00 0.00 H new ATOM 0 HA LEU A 109 10.083 -2.621 8.761 1.00 0.00 H new ATOM 0 HB2 LEU A 109 11.487 -5.158 9.511 1.00 0.00 H new ATOM 0 HB3 LEU A 109 10.221 -4.539 10.553 1.00 0.00 H new ATOM 0 HG LEU A 109 9.813 -6.220 8.475 1.00 0.00 H new ATOM 0 HD11 LEU A 109 7.433 -5.550 8.656 1.00 0.00 H new ATOM 0 HD12 LEU A 109 8.217 -5.623 10.251 1.00 0.00 H new ATOM 0 HD13 LEU A 109 7.928 -4.049 9.473 1.00 0.00 H new ATOM 0 HD21 LEU A 109 8.727 -4.993 6.650 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.244 -3.455 7.380 1.00 0.00 H new ATOM 0 HD23 LEU A 109 10.459 -4.605 6.775 1.00 0.00 H new ATOM 639 N GLU A 110 12.706 -2.673 10.747 1.00 0.00 N ATOM 640 CA GLU A 110 13.333 -2.001 11.850 1.00 0.00 C ATOM 641 C GLU A 110 13.367 -0.494 11.598 1.00 0.00 C ATOM 642 O GLU A 110 13.656 0.293 12.499 1.00 0.00 O ATOM 643 CB GLU A 110 14.757 -2.519 12.052 1.00 0.00 C ATOM 644 CG GLU A 110 14.966 -3.987 11.707 1.00 0.00 C ATOM 645 CD GLU A 110 16.370 -4.464 12.028 1.00 0.00 C ATOM 646 OE1 GLU A 110 17.289 -3.620 12.070 1.00 0.00 O1- ATOM 647 OE2 GLU A 110 16.549 -5.683 12.236 1.00 0.00 O ATOM 0 H GLU A 110 13.283 -3.390 10.308 1.00 0.00 H new ATOM 0 HA GLU A 110 12.752 -2.202 12.750 1.00 0.00 H new ATOM 0 HB2 GLU A 110 15.435 -1.919 11.444 1.00 0.00 H new ATOM 0 HB3 GLU A 110 15.039 -2.363 13.093 1.00 0.00 H new ATOM 0 HG2 GLU A 110 14.245 -4.592 12.257 1.00 0.00 H new ATOM 0 HG3 GLU A 110 14.767 -4.140 10.646 1.00 0.00 H new ATOM 654 N LYS A 111 13.081 -0.108 10.353 1.00 0.00 N ATOM 655 CA LYS A 111 13.090 1.287 9.958 1.00 0.00 C ATOM 656 C LYS A 111 11.692 1.764 9.570 1.00 0.00 C ATOM 657 O LYS A 111 11.402 2.959 9.614 1.00 0.00 O ATOM 658 CB LYS A 111 14.043 1.466 8.779 1.00 0.00 C ATOM 659 CG LYS A 111 15.466 1.795 9.194 1.00 0.00 C ATOM 660 CD LYS A 111 15.525 3.066 10.028 1.00 0.00 C ATOM 661 CE LYS A 111 15.668 2.756 11.510 1.00 0.00 C ATOM 662 NZ LYS A 111 14.769 3.603 12.343 1.00 0.00 N1+ ATOM 0 H LYS A 111 12.839 -0.754 9.601 1.00 0.00 H new ATOM 0 HA LYS A 111 13.424 1.886 10.805 1.00 0.00 H new ATOM 0 HB2 LYS A 111 14.048 0.552 8.185 1.00 0.00 H new ATOM 0 HB3 LYS A 111 13.667 2.262 8.136 1.00 0.00 H new ATOM 0 HG2 LYS A 111 15.881 0.964 9.765 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.087 1.912 8.306 1.00 0.00 H new ATOM 0 HD2 LYS A 111 16.366 3.678 9.701 1.00 0.00 H new ATOM 0 HD3 LYS A 111 14.621 3.652 9.864 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.441 1.704 11.685 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.702 2.914 11.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 15.247 3.843 13.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.539 4.476 11.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 13.893 3.082 12.549 1.00 0.00 H new ATOM 676 N ASP A 112 10.831 0.827 9.178 1.00 0.00 N ATOM 677 CA ASP A 112 9.473 1.166 8.774 1.00 0.00 C ATOM 678 C ASP A 112 8.450 0.629 9.762 1.00 0.00 C ATOM 679 O ASP A 112 7.774 -0.369 9.505 1.00 0.00 O ATOM 680 CB ASP A 112 9.191 0.628 7.376 1.00 0.00 C ATOM 681 CG ASP A 112 7.786 0.937 6.898 1.00 0.00 C ATOM 682 OD1 ASP A 112 7.009 1.528 7.677 1.00 0.00 O1- ATOM 683 OD2 ASP A 112 7.462 0.587 5.743 1.00 0.00 O ATOM 0 H ASP A 112 11.051 -0.168 9.132 1.00 0.00 H new ATOM 0 HA ASP A 112 9.387 2.253 8.762 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.910 1.054 6.676 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.342 -0.451 7.370 1.00 0.00 H new ATOM 688 N ALA A 113 8.337 1.314 10.883 1.00 0.00 N ATOM 689 CA ALA A 113 7.391 0.936 11.923 1.00 0.00 C ATOM 690 C ALA A 113 5.984 1.404 11.566 1.00 0.00 C ATOM 691 O ALA A 113 4.994 0.767 11.927 1.00 0.00 O ATOM 692 CB ALA A 113 7.819 1.511 13.265 1.00 0.00 C ATOM 0 H ALA A 113 8.892 2.142 11.101 1.00 0.00 H new ATOM 0 HA ALA A 113 7.381 -0.151 11.999 1.00 0.00 H new ATOM 0 HB1 ALA A 113 7.101 1.219 14.032 1.00 0.00 H new ATOM 0 HB2 ALA A 113 8.805 1.128 13.527 1.00 0.00 H new ATOM 0 HB3 ALA A 113 7.858 2.598 13.199 1.00 0.00 H new ATOM 698 N PHE A 114 5.906 2.524 10.855 1.00 0.00 N ATOM 699 CA PHE A 114 4.624 3.086 10.446 1.00 0.00 C ATOM 700 C PHE A 114 3.849 2.109 9.567 1.00 0.00 C ATOM 701 O PHE A 114 2.620 2.132 9.539 1.00 0.00 O ATOM 702 CB PHE A 114 4.834 4.408 9.702 1.00 0.00 C ATOM 703 CG PHE A 114 5.882 4.335 8.628 1.00 0.00 C ATOM 704 CD1 PHE A 114 5.555 3.906 7.351 1.00 0.00 C ATOM 705 CD2 PHE A 114 7.192 4.698 8.893 1.00 0.00 C ATOM 706 CE1 PHE A 114 6.516 3.841 6.360 1.00 0.00 C ATOM 707 CE2 PHE A 114 8.158 4.634 7.907 1.00 0.00 C ATOM 708 CZ PHE A 114 7.819 4.205 6.639 1.00 0.00 C ATOM 0 H PHE A 114 6.717 3.061 10.550 1.00 0.00 H new ATOM 0 HA PHE A 114 4.039 3.273 11.346 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.889 4.718 9.255 1.00 0.00 H new ATOM 0 HB3 PHE A 114 5.115 5.179 10.420 1.00 0.00 H new ATOM 0 HD1 PHE A 114 4.538 3.619 7.128 1.00 0.00 H new ATOM 0 HD2 PHE A 114 7.462 5.035 9.883 1.00 0.00 H new ATOM 0 HE1 PHE A 114 6.249 3.506 5.369 1.00 0.00 H new ATOM 0 HE2 PHE A 114 9.176 4.919 8.128 1.00 0.00 H new ATOM 0 HZ PHE A 114 8.572 4.154 5.866 1.00 0.00 H new ATOM 718 N LEU A 115 4.570 1.252 8.852 1.00 0.00 N ATOM 719 CA LEU A 115 3.933 0.271 7.980 1.00 0.00 C ATOM 720 C LEU A 115 3.516 -0.968 8.769 1.00 0.00 C ATOM 721 O LEU A 115 2.333 -1.306 8.830 1.00 0.00 O ATOM 722 CB LEU A 115 4.874 -0.126 6.837 1.00 0.00 C ATOM 723 CG LEU A 115 4.203 -0.835 5.657 1.00 0.00 C ATOM 724 CD1 LEU A 115 3.709 0.181 4.637 1.00 0.00 C ATOM 725 CD2 LEU A 115 5.163 -1.824 5.006 1.00 0.00 C ATOM 0 H LEU A 115 5.589 1.216 8.858 1.00 0.00 H new ATOM 0 HA LEU A 115 3.039 0.729 7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.369 0.772 6.467 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.651 -0.777 7.237 1.00 0.00 H new ATOM 0 HG LEU A 115 3.345 -1.391 6.034 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.235 -0.340 3.805 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.986 0.847 5.108 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.552 0.764 4.267 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.666 -2.317 4.170 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.043 -1.292 4.643 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.468 -2.571 5.739 1.00 0.00 H new ATOM 737 N LEU A 116 4.493 -1.642 9.369 1.00 0.00 N ATOM 738 CA LEU A 116 4.224 -2.846 10.151 1.00 0.00 C ATOM 739 C LEU A 116 3.813 -2.513 11.584 1.00 0.00 C ATOM 740 O LEU A 116 2.696 -2.813 12.006 1.00 0.00 O ATOM 741 CB LEU A 116 5.454 -3.756 10.163 1.00 0.00 C ATOM 742 CG LEU A 116 5.176 -5.213 10.536 1.00 0.00 C ATOM 743 CD1 LEU A 116 4.770 -5.322 11.998 1.00 0.00 C ATOM 744 CD2 LEU A 116 4.096 -5.796 9.637 1.00 0.00 C ATOM 0 H LEU A 116 5.477 -1.376 9.329 1.00 0.00 H new ATOM 0 HA LEU A 116 3.391 -3.364 9.675 1.00 0.00 H new ATOM 0 HB2 LEU A 116 5.916 -3.731 9.176 1.00 0.00 H new ATOM 0 HB3 LEU A 116 6.182 -3.349 10.865 1.00 0.00 H new ATOM 0 HG LEU A 116 6.092 -5.786 10.391 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.576 -6.366 12.245 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.575 -4.943 12.628 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.868 -4.735 12.170 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.911 -6.833 9.916 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.178 -5.220 9.751 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.425 -5.753 8.599 1.00 0.00 H new ATOM 756 N LYS A 117 4.735 -1.910 12.334 1.00 0.00 N ATOM 757 CA LYS A 117 4.489 -1.551 13.732 1.00 0.00 C ATOM 758 C LYS A 117 3.113 -0.919 13.933 1.00 0.00 C ATOM 759 O LYS A 117 2.505 -1.069 14.993 1.00 0.00 O ATOM 760 CB LYS A 117 5.574 -0.597 14.231 1.00 0.00 C ATOM 761 CG LYS A 117 5.950 -0.812 15.688 1.00 0.00 C ATOM 762 CD LYS A 117 7.202 -0.035 16.062 1.00 0.00 C ATOM 763 CE LYS A 117 7.449 -0.068 17.562 1.00 0.00 C ATOM 764 NZ LYS A 117 8.439 0.962 17.984 1.00 0.00 N1+ ATOM 0 H LYS A 117 5.664 -1.659 11.995 1.00 0.00 H new ATOM 0 HA LYS A 117 4.516 -2.474 14.311 1.00 0.00 H new ATOM 0 HB2 LYS A 117 6.464 -0.717 13.613 1.00 0.00 H new ATOM 0 HB3 LYS A 117 5.232 0.430 14.100 1.00 0.00 H new ATOM 0 HG2 LYS A 117 5.124 -0.502 16.327 1.00 0.00 H new ATOM 0 HG3 LYS A 117 6.112 -1.874 15.870 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.062 -0.456 15.541 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.103 0.999 15.731 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.509 0.095 18.089 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.808 -1.056 17.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 8.580 0.907 19.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 9.344 0.792 17.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.085 1.907 17.733 1.00 0.00 H new ATOM 778 N HIS A 118 2.626 -0.211 12.920 1.00 0.00 N ATOM 779 CA HIS A 118 1.322 0.442 13.006 1.00 0.00 C ATOM 780 C HIS A 118 0.237 -0.552 13.412 1.00 0.00 C ATOM 781 O HIS A 118 -0.421 -0.385 14.439 1.00 0.00 O ATOM 782 CB HIS A 118 0.960 1.088 11.667 1.00 0.00 C ATOM 783 CG HIS A 118 1.019 2.584 11.692 1.00 0.00 C ATOM 784 ND1 HIS A 118 1.873 3.291 12.513 1.00 0.00 N ATOM 785 CD2 HIS A 118 0.323 3.510 10.991 1.00 0.00 C ATOM 786 CE1 HIS A 118 1.699 4.586 12.316 1.00 0.00 C ATOM 787 NE2 HIS A 118 0.765 4.746 11.397 1.00 0.00 N ATOM 0 H HIS A 118 3.111 -0.074 12.033 1.00 0.00 H new ATOM 0 HA HIS A 118 1.385 1.216 13.771 1.00 0.00 H new ATOM 0 HB2 HIS A 118 1.639 0.718 10.899 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -0.045 0.776 11.382 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -0.438 3.314 10.250 1.00 0.00 H new ATOM 0 HE1 HIS A 118 2.231 5.379 12.821 1.00 0.00 H new ATOM 0 HE2 HIS A 118 0.426 5.642 11.045 1.00 0.00 H new ATOM 796 N VAL A 119 0.058 -1.587 12.600 1.00 0.00 N ATOM 797 CA VAL A 119 -0.944 -2.610 12.875 1.00 0.00 C ATOM 798 C VAL A 119 -0.398 -3.682 13.811 1.00 0.00 C ATOM 799 O VAL A 119 -1.147 -4.304 14.564 1.00 0.00 O ATOM 800 CB VAL A 119 -1.446 -3.278 11.579 1.00 0.00 C ATOM 801 CG1 VAL A 119 -2.423 -2.366 10.853 1.00 0.00 C ATOM 802 CG2 VAL A 119 -0.279 -3.648 10.675 1.00 0.00 C ATOM 0 H VAL A 119 0.594 -1.740 11.746 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.781 -2.105 13.357 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.969 -4.196 11.847 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.767 -2.854 9.941 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.277 -2.160 11.498 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.926 -1.430 10.599 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.657 -4.118 9.767 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.278 -2.748 10.413 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.379 -4.343 11.196 1.00 0.00 H new ATOM 812 N ARG A 120 0.915 -3.893 13.762 1.00 0.00 N ATOM 813 CA ARG A 120 1.562 -4.889 14.608 1.00 0.00 C ATOM 814 C ARG A 120 1.033 -6.289 14.306 1.00 0.00 C ATOM 815 O ARG A 120 -0.101 -6.450 13.852 1.00 0.00 O ATOM 816 CB ARG A 120 1.344 -4.556 16.084 1.00 0.00 C ATOM 817 CG ARG A 120 2.320 -5.256 17.017 1.00 0.00 C ATOM 818 CD ARG A 120 1.607 -6.211 17.963 1.00 0.00 C ATOM 819 NE ARG A 120 2.345 -7.459 18.140 1.00 0.00 N ATOM 820 CZ ARG A 120 3.473 -7.561 18.838 1.00 0.00 C ATOM 821 NH1 ARG A 120 3.997 -6.493 19.426 1.00 0.00 N1+ ATOM 822 NH2 ARG A 120 4.080 -8.735 18.948 1.00 0.00 N ATOM 0 H ARG A 120 1.551 -3.387 13.145 1.00 0.00 H new ATOM 0 HA ARG A 120 2.630 -4.871 14.393 1.00 0.00 H new ATOM 0 HB2 ARG A 120 1.432 -3.478 16.222 1.00 0.00 H new ATOM 0 HB3 ARG A 120 0.327 -4.831 16.363 1.00 0.00 H new ATOM 0 HG2 ARG A 120 3.054 -5.807 16.429 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.868 -4.512 17.595 1.00 0.00 H new ATOM 0 HD2 ARG A 120 1.473 -5.729 18.931 1.00 0.00 H new ATOM 0 HD3 ARG A 120 0.612 -6.430 17.575 1.00 0.00 H new ATOM 0 HE ARG A 120 1.974 -8.302 17.703 1.00 0.00 H new ATOM 0 HH11 ARG A 120 3.535 -5.587 19.344 1.00 0.00 H new ATOM 0 HH12 ARG A 120 4.862 -6.578 19.960 1.00 0.00 H new ATOM 0 HH21 ARG A 120 3.682 -9.559 18.498 1.00 0.00 H new ATOM 0 HH22 ARG A 120 4.945 -8.814 19.483 1.00 0.00 H new ATOM 836 N ARG A 121 1.860 -7.296 14.561 1.00 0.00 N ATOM 837 CA ARG A 121 1.476 -8.681 14.317 1.00 0.00 C ATOM 838 C ARG A 121 0.729 -9.260 15.515 1.00 0.00 C ATOM 839 O ARG A 121 1.271 -9.336 16.618 1.00 0.00 O ATOM 840 CB ARG A 121 2.712 -9.530 14.013 1.00 0.00 C ATOM 841 CG ARG A 121 3.681 -9.634 15.179 1.00 0.00 C ATOM 842 CD ARG A 121 5.061 -10.080 14.720 1.00 0.00 C ATOM 843 NE ARG A 121 5.591 -11.160 15.549 1.00 0.00 N ATOM 844 CZ ARG A 121 5.229 -12.435 15.425 1.00 0.00 C ATOM 845 NH1 ARG A 121 4.339 -12.793 14.509 1.00 0.00 N1+ ATOM 846 NH2 ARG A 121 5.760 -13.355 16.220 1.00 0.00 N ATOM 0 H ARG A 121 2.801 -7.179 14.937 1.00 0.00 H new ATOM 0 HA ARG A 121 0.810 -8.699 13.454 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.393 -10.532 13.727 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.233 -9.104 13.155 1.00 0.00 H new ATOM 0 HG2 ARG A 121 3.757 -8.668 15.677 1.00 0.00 H new ATOM 0 HG3 ARG A 121 3.294 -10.341 15.913 1.00 0.00 H new ATOM 0 HD2 ARG A 121 5.009 -10.411 13.683 1.00 0.00 H new ATOM 0 HD3 ARG A 121 5.745 -9.232 14.749 1.00 0.00 H new ATOM 0 HE ARG A 121 6.278 -10.923 16.264 1.00 0.00 H new ATOM 0 HH11 ARG A 121 3.928 -12.090 13.895 1.00 0.00 H new ATOM 0 HH12 ARG A 121 4.066 -13.771 14.419 1.00 0.00 H new ATOM 0 HH21 ARG A 121 6.445 -13.085 16.926 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.483 -14.332 16.125 1.00 0.00 H new ATOM 860 N ASN A 122 -0.515 -9.668 15.289 1.00 0.00 N ATOM 861 CA ASN A 122 -1.338 -10.241 16.349 1.00 0.00 C ATOM 862 C ASN A 122 -2.695 -10.676 15.805 1.00 0.00 C ATOM 863 O ASN A 122 -2.963 -11.868 15.657 1.00 0.00 O ATOM 864 CB ASN A 122 -1.526 -9.229 17.482 1.00 0.00 C ATOM 865 CG ASN A 122 -0.749 -9.606 18.729 1.00 0.00 C ATOM 866 OD1 ASN A 122 0.369 -9.137 18.944 1.00 0.00 O ATOM 867 ND2 ASN A 122 -1.339 -10.459 19.558 1.00 0.00 N ATOM 0 H ASN A 122 -0.976 -9.613 14.381 1.00 0.00 H new ATOM 0 HA ASN A 122 -0.825 -11.119 16.741 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -1.207 -8.244 17.142 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -2.586 -9.154 17.726 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.865 -10.750 20.413 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -2.267 -10.823 19.340 1.00 0.00 H new ATOM 874 N LYS A 123 -3.547 -9.700 15.510 1.00 0.00 N ATOM 875 CA LYS A 123 -4.877 -9.980 14.980 1.00 0.00 C ATOM 876 C LYS A 123 -5.024 -9.435 13.563 1.00 0.00 C ATOM 877 O LYS A 123 -5.654 -10.058 12.709 1.00 0.00 O ATOM 878 CB LYS A 123 -5.948 -9.374 15.891 1.00 0.00 C ATOM 879 CG LYS A 123 -7.013 -10.369 16.323 1.00 0.00 C ATOM 880 CD LYS A 123 -8.356 -10.069 15.676 1.00 0.00 C ATOM 881 CE LYS A 123 -9.511 -10.454 16.586 1.00 0.00 C ATOM 882 NZ LYS A 123 -10.624 -9.466 16.521 1.00 0.00 N1+ ATOM 0 H LYS A 123 -3.341 -8.708 15.629 1.00 0.00 H new ATOM 0 HA LYS A 123 -5.010 -11.061 14.946 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -5.467 -8.961 16.778 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.427 -8.544 15.372 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -6.698 -11.378 16.057 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -7.117 -10.343 17.408 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -8.417 -9.007 15.438 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -8.437 -10.612 14.734 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -9.883 -11.439 16.303 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -9.154 -10.531 17.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -11.391 -9.765 17.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -10.276 -8.531 16.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -10.983 -9.411 15.546 1.00 0.00 H new ATOM 896 N LEU A 124 -4.438 -8.266 13.320 1.00 0.00 N ATOM 897 CA LEU A 124 -4.502 -7.636 12.007 1.00 0.00 C ATOM 898 C LEU A 124 -3.162 -7.751 11.284 1.00 0.00 C ATOM 899 O LEU A 124 -3.020 -8.526 10.338 1.00 0.00 O ATOM 900 CB LEU A 124 -4.901 -6.165 12.144 1.00 0.00 C ATOM 901 CG LEU A 124 -6.223 -5.919 12.875 1.00 0.00 C ATOM 902 CD1 LEU A 124 -5.986 -5.775 14.370 1.00 0.00 C ATOM 903 CD2 LEU A 124 -6.920 -4.683 12.319 1.00 0.00 C ATOM 0 H LEU A 124 -3.913 -7.736 14.016 1.00 0.00 H new ATOM 0 HA LEU A 124 -5.257 -8.155 11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.107 -5.636 12.672 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -4.967 -5.728 11.148 1.00 0.00 H new ATOM 0 HG LEU A 124 -6.872 -6.779 12.712 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.937 -5.601 14.874 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.533 -6.688 14.756 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.318 -4.933 14.553 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.858 -4.524 12.851 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -6.277 -3.813 12.450 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.124 -4.827 11.258 1.00 0.00 H new ATOM 915 N GLY A 125 -2.181 -6.978 11.739 1.00 0.00 N ATOM 916 CA GLY A 125 -0.863 -7.009 11.132 1.00 0.00 C ATOM 917 C GLY A 125 -0.884 -6.710 9.643 1.00 0.00 C ATOM 918 O GLY A 125 0.064 -7.034 8.929 1.00 0.00 O ATOM 0 H GLY A 125 -2.276 -6.329 12.520 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -0.222 -6.283 11.633 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -0.419 -7.991 11.293 1.00 0.00 H new ATOM 922 N TYR A 126 -1.963 -6.089 9.170 1.00 0.00 N ATOM 923 CA TYR A 126 -2.083 -5.751 7.756 1.00 0.00 C ATOM 924 C TYR A 126 -1.792 -4.273 7.519 1.00 0.00 C ATOM 925 O TYR A 126 -2.123 -3.425 8.347 1.00 0.00 O ATOM 926 CB TYR A 126 -3.477 -6.105 7.232 1.00 0.00 C ATOM 927 CG TYR A 126 -4.593 -5.294 7.856 1.00 0.00 C ATOM 928 CD1 TYR A 126 -4.746 -3.944 7.565 1.00 0.00 C ATOM 929 CD2 TYR A 126 -5.497 -5.883 8.731 1.00 0.00 C ATOM 930 CE1 TYR A 126 -5.765 -3.203 8.131 1.00 0.00 C ATOM 931 CE2 TYR A 126 -6.520 -5.148 9.300 1.00 0.00 C ATOM 932 CZ TYR A 126 -6.650 -3.810 8.997 1.00 0.00 C ATOM 933 OH TYR A 126 -7.667 -3.075 9.562 1.00 0.00 O ATOM 0 H TYR A 126 -2.761 -5.812 9.742 1.00 0.00 H new ATOM 0 HA TYR A 126 -1.344 -6.338 7.210 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -3.496 -5.959 6.152 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.665 -7.163 7.414 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -4.057 -3.466 6.885 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -5.399 -6.932 8.970 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -5.868 -2.154 7.897 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.214 -5.620 9.979 1.00 0.00 H new ATOM 0 HH TYR A 126 -8.437 -3.658 9.732 1.00 0.00 H new ATOM 943 N VAL A 127 -1.173 -3.968 6.380 1.00 0.00 N ATOM 944 CA VAL A 127 -0.845 -2.594 6.037 1.00 0.00 C ATOM 945 C VAL A 127 -1.887 -2.012 5.092 1.00 0.00 C ATOM 946 O VAL A 127 -2.117 -2.543 4.008 1.00 0.00 O ATOM 947 CB VAL A 127 0.535 -2.510 5.369 1.00 0.00 C ATOM 948 CG1 VAL A 127 0.907 -1.071 5.069 1.00 0.00 C ATOM 949 CG2 VAL A 127 1.591 -3.175 6.239 1.00 0.00 C ATOM 0 H VAL A 127 -0.890 -4.656 5.682 1.00 0.00 H new ATOM 0 HA VAL A 127 -0.832 -2.020 6.963 1.00 0.00 H new ATOM 0 HB VAL A 127 0.487 -3.046 4.421 1.00 0.00 H new ATOM 0 HG11 VAL A 127 1.889 -1.040 4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.167 -0.636 4.397 1.00 0.00 H new ATOM 0 HG13 VAL A 127 0.933 -0.501 5.998 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.562 -3.106 5.749 1.00 0.00 H new ATOM 0 HG22 VAL A 127 1.635 -2.673 7.205 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.333 -4.224 6.387 1.00 0.00 H new ATOM 959 N SER A 128 -2.514 -0.921 5.505 1.00 0.00 N ATOM 960 CA SER A 128 -3.532 -0.285 4.684 1.00 0.00 C ATOM 961 C SER A 128 -2.905 0.529 3.555 1.00 0.00 C ATOM 962 O SER A 128 -2.106 1.439 3.794 1.00 0.00 O ATOM 963 CB SER A 128 -4.427 0.611 5.542 1.00 0.00 C ATOM 964 OG SER A 128 -5.449 -0.141 6.172 1.00 0.00 O ATOM 0 H SER A 128 -2.337 -0.460 6.398 1.00 0.00 H new ATOM 0 HA SER A 128 -4.139 -1.073 4.238 1.00 0.00 H new ATOM 0 HB2 SER A 128 -3.824 1.115 6.297 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.873 1.387 4.920 1.00 0.00 H new ATOM 0 HG SER A 128 -6.006 0.455 6.716 1.00 0.00 H new ATOM 970 N VAL A 129 -3.273 0.197 2.322 1.00 0.00 N ATOM 971 CA VAL A 129 -2.750 0.897 1.160 1.00 0.00 C ATOM 972 C VAL A 129 -3.091 2.385 1.218 1.00 0.00 C ATOM 973 O VAL A 129 -2.400 3.215 0.629 1.00 0.00 O ATOM 974 CB VAL A 129 -3.284 0.293 -0.158 1.00 0.00 C ATOM 975 CG1 VAL A 129 -4.698 0.776 -0.452 1.00 0.00 C ATOM 976 CG2 VAL A 129 -2.343 0.622 -1.309 1.00 0.00 C ATOM 0 H VAL A 129 -3.931 -0.552 2.104 1.00 0.00 H new ATOM 0 HA VAL A 129 -1.667 0.778 1.178 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.325 -0.790 -0.046 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -5.047 0.334 -1.385 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -5.361 0.478 0.360 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.700 1.862 -0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -2.732 0.190 -2.231 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.267 1.704 -1.419 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -1.356 0.208 -1.102 1.00 0.00 H new ATOM 986 N LYS A 130 -4.161 2.716 1.939 1.00 0.00 N ATOM 987 CA LYS A 130 -4.588 4.103 2.078 1.00 0.00 C ATOM 988 C LYS A 130 -3.442 4.964 2.597 1.00 0.00 C ATOM 989 O LYS A 130 -3.315 6.134 2.235 1.00 0.00 O ATOM 990 CB LYS A 130 -5.785 4.199 3.026 1.00 0.00 C ATOM 991 CG LYS A 130 -7.076 3.659 2.432 1.00 0.00 C ATOM 992 CD LYS A 130 -8.211 3.693 3.442 1.00 0.00 C ATOM 993 CE LYS A 130 -9.001 4.988 3.350 1.00 0.00 C ATOM 994 NZ LYS A 130 -8.487 6.022 4.290 1.00 0.00 N1+ ATOM 0 H LYS A 130 -4.746 2.043 2.434 1.00 0.00 H new ATOM 0 HA LYS A 130 -4.886 4.471 1.096 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.558 3.651 3.941 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.932 5.242 3.307 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -7.349 4.248 1.556 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -6.921 2.635 2.092 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.877 2.847 3.271 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -7.807 3.583 4.448 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -8.954 5.370 2.330 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -10.050 4.789 3.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -9.185 6.184 5.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -7.594 5.696 4.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -8.323 6.910 3.774 1.00 0.00 H new ATOM 1008 N LEU A 131 -2.605 4.370 3.442 1.00 0.00 N ATOM 1009 CA LEU A 131 -1.463 5.075 4.006 1.00 0.00 C ATOM 1010 C LEU A 131 -0.278 5.034 3.042 1.00 0.00 C ATOM 1011 O LEU A 131 0.536 5.957 3.005 1.00 0.00 O ATOM 1012 CB LEU A 131 -1.090 4.480 5.368 1.00 0.00 C ATOM 1013 CG LEU A 131 0.084 3.511 5.353 1.00 0.00 C ATOM 1014 CD1 LEU A 131 1.380 4.248 5.641 1.00 0.00 C ATOM 1015 CD2 LEU A 131 -0.131 2.382 6.350 1.00 0.00 C ATOM 0 H LEU A 131 -2.698 3.402 3.750 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.735 6.120 4.156 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -0.858 5.296 6.052 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -1.961 3.964 5.772 1.00 0.00 H new ATOM 0 HG LEU A 131 0.153 3.069 4.359 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.211 3.542 5.627 1.00 0.00 H new ATOM 0 HD12 LEU A 131 1.540 5.013 4.881 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.320 4.719 6.622 1.00 0.00 H new ATOM 0 HD21 LEU A 131 0.721 1.703 6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.230 2.796 7.353 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.039 1.836 6.092 1.00 0.00 H new ATOM 1027 N LEU A 132 -0.194 3.960 2.259 1.00 0.00 N ATOM 1028 CA LEU A 132 0.887 3.802 1.290 1.00 0.00 C ATOM 1029 C LEU A 132 0.971 5.010 0.363 1.00 0.00 C ATOM 1030 O LEU A 132 2.060 5.428 -0.033 1.00 0.00 O ATOM 1031 CB LEU A 132 0.674 2.532 0.465 1.00 0.00 C ATOM 1032 CG LEU A 132 1.343 1.273 1.017 1.00 0.00 C ATOM 1033 CD1 LEU A 132 1.088 1.135 2.511 1.00 0.00 C ATOM 1034 CD2 LEU A 132 0.842 0.042 0.277 1.00 0.00 C ATOM 0 H LEU A 132 -0.861 3.188 2.277 1.00 0.00 H new ATOM 0 HA LEU A 132 1.825 3.723 1.840 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -0.397 2.348 0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 132 1.046 2.708 -0.544 1.00 0.00 H new ATOM 0 HG LEU A 132 2.418 1.361 0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.574 0.232 2.881 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.492 2.004 3.031 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.015 1.070 2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 132 1.327 -0.847 0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -0.237 -0.044 0.403 1.00 0.00 H new ATOM 0 HD23 LEU A 132 1.077 0.134 -0.783 1.00 0.00 H new ATOM 1046 N THR A 133 -0.186 5.566 0.022 1.00 0.00 N ATOM 1047 CA THR A 133 -0.253 6.720 -0.854 1.00 0.00 C ATOM 1048 C THR A 133 0.225 7.970 -0.133 1.00 0.00 C ATOM 1049 O THR A 133 0.906 8.818 -0.712 1.00 0.00 O ATOM 1050 CB THR A 133 -1.685 6.904 -1.334 1.00 0.00 C ATOM 1051 OG1 THR A 133 -2.604 6.419 -0.370 1.00 0.00 O ATOM 1052 CG2 THR A 133 -1.963 6.190 -2.632 1.00 0.00 C ATOM 0 H THR A 133 -1.094 5.230 0.344 1.00 0.00 H new ATOM 0 HA THR A 133 0.399 6.554 -1.711 1.00 0.00 H new ATOM 0 HB THR A 133 -1.809 7.976 -1.488 1.00 0.00 H new ATOM 0 HG1 THR A 133 -2.355 6.753 0.517 1.00 0.00 H new ATOM 0 HG21 THR A 133 -3.000 6.357 -2.925 1.00 0.00 H new ATOM 0 HG22 THR A 133 -1.301 6.574 -3.408 1.00 0.00 H new ATOM 0 HG23 THR A 133 -1.790 5.121 -2.504 1.00 0.00 H new ATOM 1060 N SER A 134 -0.127 8.066 1.140 1.00 0.00 N ATOM 1061 CA SER A 134 0.273 9.200 1.962 1.00 0.00 C ATOM 1062 C SER A 134 1.663 8.970 2.550 1.00 0.00 C ATOM 1063 O SER A 134 2.178 9.801 3.297 1.00 0.00 O ATOM 1064 CB SER A 134 -0.740 9.425 3.088 1.00 0.00 C ATOM 1065 OG SER A 134 -0.293 10.429 3.983 1.00 0.00 O ATOM 0 H SER A 134 -0.691 7.370 1.628 1.00 0.00 H new ATOM 0 HA SER A 134 0.302 10.088 1.331 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.702 9.713 2.664 1.00 0.00 H new ATOM 0 HB3 SER A 134 -0.898 8.493 3.631 1.00 0.00 H new ATOM 0 HG SER A 134 0.684 10.497 3.937 1.00 0.00 H new ATOM 1071 N PHE A 135 2.264 7.835 2.201 1.00 0.00 N ATOM 1072 CA PHE A 135 3.592 7.486 2.685 1.00 0.00 C ATOM 1073 C PHE A 135 4.635 8.472 2.163 1.00 0.00 C ATOM 1074 O PHE A 135 4.899 8.537 0.963 1.00 0.00 O ATOM 1075 CB PHE A 135 3.940 6.057 2.259 1.00 0.00 C ATOM 1076 CG PHE A 135 5.301 5.594 2.702 1.00 0.00 C ATOM 1077 CD1 PHE A 135 5.946 6.195 3.773 1.00 0.00 C ATOM 1078 CD2 PHE A 135 5.933 4.548 2.047 1.00 0.00 C ATOM 1079 CE1 PHE A 135 7.193 5.765 4.179 1.00 0.00 C ATOM 1080 CE2 PHE A 135 7.182 4.113 2.451 1.00 0.00 C ATOM 1081 CZ PHE A 135 7.812 4.722 3.518 1.00 0.00 C ATOM 0 H PHE A 135 1.848 7.140 1.581 1.00 0.00 H new ATOM 0 HA PHE A 135 3.594 7.541 3.774 1.00 0.00 H new ATOM 0 HB2 PHE A 135 3.189 5.377 2.661 1.00 0.00 H new ATOM 0 HB3 PHE A 135 3.882 5.990 1.173 1.00 0.00 H new ATOM 0 HD1 PHE A 135 5.466 7.009 4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 135 5.444 4.068 1.212 1.00 0.00 H new ATOM 0 HE1 PHE A 135 7.685 6.244 5.013 1.00 0.00 H new ATOM 0 HE2 PHE A 135 7.664 3.298 1.932 1.00 0.00 H new ATOM 0 HZ PHE A 135 8.787 4.383 3.835 1.00 0.00 H new ATOM 1091 N LYS A 136 5.207 9.253 3.077 1.00 0.00 N ATOM 1092 CA LYS A 136 6.210 10.262 2.732 1.00 0.00 C ATOM 1093 C LYS A 136 7.227 9.753 1.709 1.00 0.00 C ATOM 1094 O LYS A 136 7.766 10.532 0.922 1.00 0.00 O ATOM 1095 CB LYS A 136 6.940 10.726 3.993 1.00 0.00 C ATOM 1096 CG LYS A 136 7.760 9.629 4.660 1.00 0.00 C ATOM 1097 CD LYS A 136 9.208 10.050 4.850 1.00 0.00 C ATOM 1098 CE LYS A 136 9.885 9.239 5.943 1.00 0.00 C ATOM 1099 NZ LYS A 136 9.924 9.974 7.237 1.00 0.00 N1+ ATOM 0 H LYS A 136 4.991 9.206 4.073 1.00 0.00 H new ATOM 0 HA LYS A 136 5.678 11.098 2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 136 7.599 11.556 3.737 1.00 0.00 H new ATOM 0 HB3 LYS A 136 6.209 11.107 4.707 1.00 0.00 H new ATOM 0 HG2 LYS A 136 7.322 9.384 5.627 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.720 8.724 4.053 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.751 9.924 3.913 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.250 11.109 5.103 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.354 8.296 6.077 1.00 0.00 H new ATOM 0 HE3 LYS A 136 10.901 8.992 5.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 10.393 9.387 7.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 10.452 10.862 7.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.954 10.188 7.544 1.00 0.00 H new ATOM 1113 N LYS A 137 7.495 8.451 1.724 1.00 0.00 N ATOM 1114 CA LYS A 137 8.455 7.862 0.798 1.00 0.00 C ATOM 1115 C LYS A 137 7.819 7.597 -0.561 1.00 0.00 C ATOM 1116 O LYS A 137 8.488 7.654 -1.593 1.00 0.00 O ATOM 1117 CB LYS A 137 9.020 6.562 1.372 1.00 0.00 C ATOM 1118 CG LYS A 137 10.451 6.280 0.944 1.00 0.00 C ATOM 1119 CD LYS A 137 11.447 7.114 1.736 1.00 0.00 C ATOM 1120 CE LYS A 137 12.363 6.242 2.579 1.00 0.00 C ATOM 1121 NZ LYS A 137 11.596 5.327 3.469 1.00 0.00 N1+ ATOM 0 H LYS A 137 7.062 7.786 2.365 1.00 0.00 H new ATOM 0 HA LYS A 137 9.268 8.575 0.662 1.00 0.00 H new ATOM 0 HB2 LYS A 137 8.977 6.606 2.460 1.00 0.00 H new ATOM 0 HB3 LYS A 137 8.386 5.731 1.061 1.00 0.00 H new ATOM 0 HG2 LYS A 137 10.671 5.221 1.082 1.00 0.00 H new ATOM 0 HG3 LYS A 137 10.562 6.492 -0.119 1.00 0.00 H new ATOM 0 HD2 LYS A 137 12.045 7.715 1.051 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.909 7.808 2.382 1.00 0.00 H new ATOM 0 HE2 LYS A 137 13.008 5.655 1.925 1.00 0.00 H new ATOM 0 HE3 LYS A 137 13.012 6.876 3.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 12.160 5.113 4.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.706 5.784 3.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 11.386 4.444 2.961 1.00 0.00 H new ATOM 1135 N VAL A 138 6.523 7.311 -0.557 1.00 0.00 N ATOM 1136 CA VAL A 138 5.801 7.040 -1.790 1.00 0.00 C ATOM 1137 C VAL A 138 5.331 8.339 -2.434 1.00 0.00 C ATOM 1138 O VAL A 138 5.476 8.534 -3.640 1.00 0.00 O ATOM 1139 CB VAL A 138 4.588 6.115 -1.542 1.00 0.00 C ATOM 1140 CG1 VAL A 138 3.668 6.085 -2.754 1.00 0.00 C ATOM 1141 CG2 VAL A 138 5.053 4.710 -1.186 1.00 0.00 C ATOM 0 H VAL A 138 5.952 7.261 0.287 1.00 0.00 H new ATOM 0 HA VAL A 138 6.489 6.532 -2.466 1.00 0.00 H new ATOM 0 HB VAL A 138 4.023 6.516 -0.701 1.00 0.00 H new ATOM 0 HG11 VAL A 138 2.823 5.427 -2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 138 3.303 7.092 -2.959 1.00 0.00 H new ATOM 0 HG13 VAL A 138 4.218 5.715 -3.619 1.00 0.00 H new ATOM 0 HG21 VAL A 138 4.186 4.072 -1.015 1.00 0.00 H new ATOM 0 HG22 VAL A 138 5.646 4.304 -2.006 1.00 0.00 H new ATOM 0 HG23 VAL A 138 5.661 4.746 -0.282 1.00 0.00 H new ATOM 1151 N LYS A 139 4.763 9.222 -1.626 1.00 0.00 N ATOM 1152 CA LYS A 139 4.270 10.498 -2.127 1.00 0.00 C ATOM 1153 C LYS A 139 5.381 11.299 -2.793 1.00 0.00 C ATOM 1154 O LYS A 139 5.117 12.184 -3.607 1.00 0.00 O ATOM 1155 CB LYS A 139 3.653 11.322 -1.004 1.00 0.00 C ATOM 1156 CG LYS A 139 4.590 11.554 0.168 1.00 0.00 C ATOM 1157 CD LYS A 139 5.539 12.711 -0.098 1.00 0.00 C ATOM 1158 CE LYS A 139 5.778 13.537 1.154 1.00 0.00 C ATOM 1159 NZ LYS A 139 6.532 14.786 0.861 1.00 0.00 N1+ ATOM 0 H LYS A 139 4.632 9.080 -0.624 1.00 0.00 H new ATOM 0 HA LYS A 139 3.504 10.277 -2.871 1.00 0.00 H new ATOM 0 HB2 LYS A 139 3.339 12.286 -1.403 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.755 10.818 -0.646 1.00 0.00 H new ATOM 0 HG2 LYS A 139 4.007 11.759 1.066 1.00 0.00 H new ATOM 0 HG3 LYS A 139 5.164 10.648 0.361 1.00 0.00 H new ATOM 0 HD2 LYS A 139 6.489 12.325 -0.467 1.00 0.00 H new ATOM 0 HD3 LYS A 139 5.127 13.347 -0.881 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.821 13.790 1.610 1.00 0.00 H new ATOM 0 HE3 LYS A 139 6.330 12.942 1.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 6.674 15.321 1.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 7.456 14.545 0.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 5.993 15.367 0.187 1.00 0.00 H new ATOM 1173 N HIS A 140 6.628 10.984 -2.454 1.00 0.00 N ATOM 1174 CA HIS A 140 7.770 11.676 -3.036 1.00 0.00 C ATOM 1175 C HIS A 140 7.905 11.343 -4.520 1.00 0.00 C ATOM 1176 O HIS A 140 8.771 11.882 -5.210 1.00 0.00 O ATOM 1177 CB HIS A 140 9.054 11.297 -2.297 1.00 0.00 C ATOM 1178 CG HIS A 140 10.262 12.041 -2.775 1.00 0.00 C ATOM 1179 ND1 HIS A 140 11.540 11.524 -2.712 1.00 0.00 N ATOM 1180 CD2 HIS A 140 10.384 13.272 -3.327 1.00 0.00 C ATOM 1181 CE1 HIS A 140 12.393 12.404 -3.204 1.00 0.00 C ATOM 1182 NE2 HIS A 140 11.718 13.472 -3.584 1.00 0.00 N ATOM 0 H HIS A 140 6.871 10.257 -1.782 1.00 0.00 H new ATOM 0 HA HIS A 140 7.606 12.749 -2.934 1.00 0.00 H new ATOM 0 HB2 HIS A 140 8.919 11.485 -1.232 1.00 0.00 H new ATOM 0 HB3 HIS A 140 9.227 10.227 -2.412 1.00 0.00 H new ATOM 0 HD2 HIS A 140 9.582 13.967 -3.528 1.00 0.00 H new ATOM 0 HE1 HIS A 140 13.462 12.272 -3.282 1.00 0.00 H new ATOM 0 HE2 HIS A 140 12.122 14.311 -4.001 1.00 0.00 H new ATOM 1191 N LEU A 141 7.045 10.450 -5.006 1.00 0.00 N ATOM 1192 CA LEU A 141 7.069 10.041 -6.402 1.00 0.00 C ATOM 1193 C LEU A 141 6.296 11.025 -7.276 1.00 0.00 C ATOM 1194 O LEU A 141 6.883 11.777 -8.054 1.00 0.00 O ATOM 1195 CB LEU A 141 6.470 8.642 -6.545 1.00 0.00 C ATOM 1196 CG LEU A 141 7.080 7.582 -5.630 1.00 0.00 C ATOM 1197 CD1 LEU A 141 6.110 6.430 -5.430 1.00 0.00 C ATOM 1198 CD2 LEU A 141 8.398 7.085 -6.198 1.00 0.00 C ATOM 0 H LEU A 141 6.322 9.996 -4.448 1.00 0.00 H new ATOM 0 HA LEU A 141 8.107 10.029 -6.735 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.400 8.699 -6.347 1.00 0.00 H new ATOM 0 HB3 LEU A 141 6.585 8.318 -7.579 1.00 0.00 H new ATOM 0 HG LEU A 141 7.276 8.034 -4.658 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.561 5.684 -4.776 1.00 0.00 H new ATOM 0 HD12 LEU A 141 5.191 6.802 -4.977 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.881 5.976 -6.394 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.819 6.330 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU A 141 8.228 6.648 -7.182 1.00 0.00 H new ATOM 0 HD23 LEU A 141 9.094 7.919 -6.286 1.00 0.00 H new ATOM 1210 N THR A 142 4.974 11.005 -7.145 1.00 0.00 N ATOM 1211 CA THR A 142 4.108 11.883 -7.922 1.00 0.00 C ATOM 1212 C THR A 142 2.700 11.879 -7.343 1.00 0.00 C ATOM 1213 O THR A 142 2.465 11.342 -6.262 1.00 0.00 O ATOM 1214 CB THR A 142 4.057 11.419 -9.385 1.00 0.00 C ATOM 1215 OG1 THR A 142 5.193 10.634 -9.703 1.00 0.00 O ATOM 1216 CG2 THR A 142 4.000 12.563 -10.374 1.00 0.00 C ATOM 0 H THR A 142 4.477 10.386 -6.504 1.00 0.00 H new ATOM 0 HA THR A 142 4.514 12.894 -7.878 1.00 0.00 H new ATOM 0 HB THR A 142 3.139 10.838 -9.471 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.141 10.347 -10.639 1.00 0.00 H new ATOM 0 HG21 THR A 142 3.966 12.166 -11.388 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.108 13.161 -10.188 1.00 0.00 H new ATOM 0 HG23 THR A 142 4.886 13.188 -10.259 1.00 0.00 H new ATOM 1224 N ARG A 143 1.760 12.451 -8.086 1.00 0.00 N ATOM 1225 CA ARG A 143 0.369 12.478 -7.659 1.00 0.00 C ATOM 1226 C ARG A 143 -0.351 11.249 -8.208 1.00 0.00 C ATOM 1227 O ARG A 143 -1.546 11.288 -8.502 1.00 0.00 O ATOM 1228 CB ARG A 143 -0.318 13.757 -8.147 1.00 0.00 C ATOM 1229 CG ARG A 143 -1.235 14.386 -7.112 1.00 0.00 C ATOM 1230 CD ARG A 143 -0.487 15.377 -6.235 1.00 0.00 C ATOM 1231 NE ARG A 143 -0.570 16.741 -6.754 1.00 0.00 N ATOM 1232 CZ ARG A 143 0.070 17.778 -6.220 1.00 0.00 C ATOM 1233 NH1 ARG A 143 0.839 17.613 -5.152 1.00 0.00 N1+ ATOM 1234 NH2 ARG A 143 -0.061 18.984 -6.756 1.00 0.00 N ATOM 0 H ARG A 143 1.936 12.901 -8.984 1.00 0.00 H new ATOM 0 HA ARG A 143 0.329 12.465 -6.570 1.00 0.00 H new ATOM 0 HB2 ARG A 143 0.444 14.482 -8.434 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -0.896 13.530 -9.043 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -2.059 14.893 -7.614 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -1.673 13.605 -6.490 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -0.896 15.348 -5.225 1.00 0.00 H new ATOM 0 HD3 ARG A 143 0.559 15.080 -6.163 1.00 0.00 H new ATOM 0 HE ARG A 143 -1.153 16.908 -7.574 1.00 0.00 H new ATOM 0 HH11 ARG A 143 0.942 16.687 -4.736 1.00 0.00 H new ATOM 0 HH12 ARG A 143 1.327 18.412 -4.747 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -0.652 19.116 -7.577 1.00 0.00 H new ATOM 0 HH22 ARG A 143 0.429 19.780 -6.347 1.00 0.00 H new ATOM 1248 N ASP A 144 0.405 10.163 -8.355 1.00 0.00 N ATOM 1249 CA ASP A 144 -0.119 8.914 -8.879 1.00 0.00 C ATOM 1250 C ASP A 144 -0.560 7.983 -7.754 1.00 0.00 C ATOM 1251 O ASP A 144 -0.351 6.771 -7.821 1.00 0.00 O ATOM 1252 CB ASP A 144 0.952 8.234 -9.736 1.00 0.00 C ATOM 1253 CG ASP A 144 0.828 8.589 -11.205 1.00 0.00 C ATOM 1254 OD1 ASP A 144 0.204 9.625 -11.515 1.00 0.00 O1- ATOM 1255 OD2 ASP A 144 1.354 7.829 -12.046 1.00 0.00 O ATOM 0 H ASP A 144 1.395 10.129 -8.113 1.00 0.00 H new ATOM 0 HA ASP A 144 -0.994 9.135 -9.490 1.00 0.00 H new ATOM 0 HB2 ASP A 144 1.939 8.524 -9.377 1.00 0.00 H new ATOM 0 HB3 ASP A 144 0.875 7.153 -9.618 1.00 0.00 H new ATOM 1260 N TRP A 145 -1.179 8.553 -6.726 1.00 0.00 N ATOM 1261 CA TRP A 145 -1.657 7.771 -5.598 1.00 0.00 C ATOM 1262 C TRP A 145 -2.661 6.730 -6.071 1.00 0.00 C ATOM 1263 O TRP A 145 -2.659 5.590 -5.606 1.00 0.00 O ATOM 1264 CB TRP A 145 -2.266 8.699 -4.545 1.00 0.00 C ATOM 1265 CG TRP A 145 -1.228 9.510 -3.829 1.00 0.00 C ATOM 1266 CD1 TRP A 145 0.102 9.582 -4.136 1.00 0.00 C ATOM 1267 CD2 TRP A 145 -1.424 10.362 -2.695 1.00 0.00 C ATOM 1268 NE1 TRP A 145 0.745 10.422 -3.264 1.00 0.00 N ATOM 1269 CE2 TRP A 145 -0.170 10.915 -2.368 1.00 0.00 C ATOM 1270 CE3 TRP A 145 -2.536 10.711 -1.923 1.00 0.00 C ATOM 1271 CZ2 TRP A 145 0.000 11.798 -1.305 1.00 0.00 C ATOM 1272 CZ3 TRP A 145 -2.365 11.587 -0.867 1.00 0.00 C ATOM 1273 CH2 TRP A 145 -1.107 12.122 -0.567 1.00 0.00 C ATOM 0 H TRP A 145 -1.360 9.554 -6.653 1.00 0.00 H new ATOM 0 HA TRP A 145 -0.821 7.243 -5.141 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -2.980 9.369 -5.024 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -2.823 8.105 -3.820 1.00 0.00 H new ATOM 0 HD1 TRP A 145 0.578 9.053 -4.949 1.00 0.00 H new ATOM 0 HE1 TRP A 145 1.740 10.644 -3.279 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -3.511 10.304 -2.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 0.970 12.212 -1.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -3.217 11.863 -0.263 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -1.007 12.805 0.264 1.00 0.00 H new ATOM 1284 N ARG A 146 -3.491 7.121 -7.030 1.00 0.00 N ATOM 1285 CA ARG A 146 -4.474 6.216 -7.610 1.00 0.00 C ATOM 1286 C ARG A 146 -3.762 5.013 -8.214 1.00 0.00 C ATOM 1287 O ARG A 146 -4.294 3.902 -8.241 1.00 0.00 O ATOM 1288 CB ARG A 146 -5.275 6.933 -8.702 1.00 0.00 C ATOM 1289 CG ARG A 146 -4.406 7.740 -9.657 1.00 0.00 C ATOM 1290 CD ARG A 146 -4.991 9.119 -9.924 1.00 0.00 C ATOM 1291 NE ARG A 146 -6.440 9.078 -10.111 1.00 0.00 N ATOM 1292 CZ ARG A 146 -7.204 10.163 -10.217 1.00 0.00 C ATOM 1293 NH1 ARG A 146 -6.662 11.373 -10.161 1.00 0.00 N1+ ATOM 1294 NH2 ARG A 146 -8.515 10.038 -10.383 1.00 0.00 N ATOM 0 H ARG A 146 -3.502 8.062 -7.423 1.00 0.00 H new ATOM 0 HA ARG A 146 -5.157 5.886 -6.827 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -5.840 6.195 -9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -6.001 7.597 -8.233 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -3.405 7.845 -9.238 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -4.302 7.200 -10.598 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -4.753 9.780 -9.091 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -4.524 9.544 -10.812 1.00 0.00 H new ATOM 0 HE ARG A 146 -6.892 8.165 -10.163 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -5.655 11.475 -10.036 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -7.253 12.201 -10.243 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -8.937 9.111 -10.429 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -9.100 10.869 -10.464 1.00 0.00 H new ATOM 1308 N THR A 147 -2.547 5.255 -8.691 1.00 0.00 N ATOM 1309 CA THR A 147 -1.735 4.211 -9.295 1.00 0.00 C ATOM 1310 C THR A 147 -1.087 3.348 -8.220 1.00 0.00 C ATOM 1311 O THR A 147 -0.776 2.182 -8.454 1.00 0.00 O ATOM 1312 CB THR A 147 -0.677 4.819 -10.227 1.00 0.00 C ATOM 1313 OG1 THR A 147 0.567 4.958 -9.565 1.00 0.00 O ATOM 1314 CG2 THR A 147 -1.062 6.179 -10.775 1.00 0.00 C ATOM 0 H THR A 147 -2.102 6.172 -8.670 1.00 0.00 H new ATOM 0 HA THR A 147 -2.384 3.572 -9.895 1.00 0.00 H new ATOM 0 HB THR A 147 -0.602 4.119 -11.059 1.00 0.00 H new ATOM 0 HG1 THR A 147 0.433 5.415 -8.709 1.00 0.00 H new ATOM 0 HG21 THR A 147 -0.268 6.547 -11.425 1.00 0.00 H new ATOM 0 HG22 THR A 147 -1.987 6.093 -11.345 1.00 0.00 H new ATOM 0 HG23 THR A 147 -1.208 6.876 -9.950 1.00 0.00 H new ATOM 1322 N THR A 148 -0.906 3.920 -7.036 1.00 0.00 N ATOM 1323 CA THR A 148 -0.316 3.193 -5.919 1.00 0.00 C ATOM 1324 C THR A 148 -1.232 2.055 -5.483 1.00 0.00 C ATOM 1325 O THR A 148 -0.769 0.999 -5.046 1.00 0.00 O ATOM 1326 CB THR A 148 -0.070 4.141 -4.742 1.00 0.00 C ATOM 1327 OG1 THR A 148 0.836 5.168 -5.102 1.00 0.00 O ATOM 1328 CG2 THR A 148 0.485 3.448 -3.514 1.00 0.00 C ATOM 0 H THR A 148 -1.159 4.885 -6.825 1.00 0.00 H new ATOM 0 HA THR A 148 0.636 2.774 -6.244 1.00 0.00 H new ATOM 0 HB THR A 148 -1.051 4.548 -4.495 1.00 0.00 H new ATOM 0 HG1 THR A 148 1.223 5.561 -4.292 1.00 0.00 H new ATOM 0 HG21 THR A 148 0.635 4.179 -2.720 1.00 0.00 H new ATOM 0 HG22 THR A 148 -0.218 2.686 -3.178 1.00 0.00 H new ATOM 0 HG23 THR A 148 1.438 2.980 -3.760 1.00 0.00 H new ATOM 1336 N ALA A 149 -2.536 2.282 -5.602 1.00 0.00 N ATOM 1337 CA ALA A 149 -3.524 1.287 -5.212 1.00 0.00 C ATOM 1338 C ALA A 149 -3.627 0.165 -6.242 1.00 0.00 C ATOM 1339 O ALA A 149 -3.664 -1.012 -5.883 1.00 0.00 O ATOM 1340 CB ALA A 149 -4.873 1.955 -5.000 1.00 0.00 C ATOM 0 H ALA A 149 -2.932 3.149 -5.966 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.202 0.834 -4.274 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.608 1.205 -4.708 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -4.788 2.705 -4.214 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.191 2.434 -5.926 1.00 0.00 H new ATOM 1346 N HIS A 150 -3.668 0.529 -7.519 1.00 0.00 N ATOM 1347 CA HIS A 150 -3.762 -0.462 -8.587 1.00 0.00 C ATOM 1348 C HIS A 150 -2.411 -1.114 -8.840 1.00 0.00 C ATOM 1349 O HIS A 150 -2.325 -2.322 -9.052 1.00 0.00 O ATOM 1350 CB HIS A 150 -4.275 0.179 -9.874 1.00 0.00 C ATOM 1351 CG HIS A 150 -5.702 -0.158 -10.181 1.00 0.00 C ATOM 1352 ND1 HIS A 150 -6.103 -0.729 -11.371 1.00 0.00 N ATOM 1353 CD2 HIS A 150 -6.828 -0.003 -9.444 1.00 0.00 C ATOM 1354 CE1 HIS A 150 -7.412 -0.908 -11.353 1.00 0.00 C ATOM 1355 NE2 HIS A 150 -7.875 -0.478 -10.195 1.00 0.00 N ATOM 0 H HIS A 150 -3.638 1.497 -7.840 1.00 0.00 H new ATOM 0 HA HIS A 150 -4.468 -1.229 -8.269 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -4.174 1.262 -9.797 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -3.647 -0.141 -10.706 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -6.891 0.416 -8.451 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -8.002 -1.334 -12.151 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -8.853 -0.496 -9.904 1.00 0.00 H new ATOM 1364 N ALA A 151 -1.351 -0.312 -8.813 1.00 0.00 N ATOM 1365 CA ALA A 151 -0.006 -0.834 -9.042 1.00 0.00 C ATOM 1366 C ALA A 151 0.254 -2.045 -8.155 1.00 0.00 C ATOM 1367 O ALA A 151 0.778 -3.062 -8.610 1.00 0.00 O ATOM 1368 CB ALA A 151 1.038 0.241 -8.779 1.00 0.00 C ATOM 0 H ALA A 151 -1.395 0.692 -8.637 1.00 0.00 H new ATOM 0 HA ALA A 151 0.067 -1.142 -10.085 1.00 0.00 H new ATOM 0 HB1 ALA A 151 2.033 -0.167 -8.955 1.00 0.00 H new ATOM 0 HB2 ALA A 151 0.868 1.084 -9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 151 0.962 0.577 -7.745 1.00 0.00 H new ATOM 1374 N LEU A 152 -0.131 -1.933 -6.889 1.00 0.00 N ATOM 1375 CA LEU A 152 0.043 -3.018 -5.940 1.00 0.00 C ATOM 1376 C LEU A 152 -0.854 -4.186 -6.300 1.00 0.00 C ATOM 1377 O LEU A 152 -0.464 -5.347 -6.182 1.00 0.00 O ATOM 1378 CB LEU A 152 -0.275 -2.518 -4.539 1.00 0.00 C ATOM 1379 CG LEU A 152 0.930 -2.037 -3.739 1.00 0.00 C ATOM 1380 CD1 LEU A 152 2.004 -1.456 -4.654 1.00 0.00 C ATOM 1381 CD2 LEU A 152 0.498 -1.010 -2.707 1.00 0.00 C ATOM 0 H LEU A 152 -0.567 -1.098 -6.498 1.00 0.00 H new ATOM 0 HA LEU A 152 1.077 -3.361 -5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.992 -1.700 -4.615 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -0.764 -3.320 -3.985 1.00 0.00 H new ATOM 0 HG LEU A 152 1.360 -2.896 -3.224 1.00 0.00 H new ATOM 0 HD11 LEU A 152 2.851 -1.121 -4.055 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.336 -2.221 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.593 -0.610 -5.206 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.367 -0.674 -2.142 1.00 0.00 H new ATOM 0 HD22 LEU A 152 0.041 -0.158 -3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -0.225 -1.460 -2.027 1.00 0.00 H new ATOM 1393 N LYS A 153 -2.052 -3.868 -6.760 1.00 0.00 N ATOM 1394 CA LYS A 153 -3.008 -4.890 -7.171 1.00 0.00 C ATOM 1395 C LYS A 153 -2.346 -5.839 -8.174 1.00 0.00 C ATOM 1396 O LYS A 153 -2.727 -7.004 -8.292 1.00 0.00 O ATOM 1397 CB LYS A 153 -4.263 -4.235 -7.772 1.00 0.00 C ATOM 1398 CG LYS A 153 -4.852 -4.974 -8.967 1.00 0.00 C ATOM 1399 CD LYS A 153 -6.251 -4.475 -9.296 1.00 0.00 C ATOM 1400 CE LYS A 153 -7.164 -5.615 -9.718 1.00 0.00 C ATOM 1401 NZ LYS A 153 -8.576 -5.373 -9.311 1.00 0.00 N1+ ATOM 0 H LYS A 153 -2.389 -2.910 -6.859 1.00 0.00 H new ATOM 0 HA LYS A 153 -3.318 -5.468 -6.300 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -5.025 -4.160 -6.996 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -4.016 -3.218 -8.076 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -4.204 -4.842 -9.834 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -4.886 -6.043 -8.755 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -6.673 -3.972 -8.426 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -6.196 -3.736 -10.096 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -7.114 -5.739 -10.800 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -6.812 -6.546 -9.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -9.167 -6.172 -9.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -8.628 -5.279 -8.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -8.920 -4.498 -9.755 1.00 0.00 H new ATOM 1415 N TYR A 154 -1.335 -5.326 -8.877 1.00 0.00 N ATOM 1416 CA TYR A 154 -0.592 -6.116 -9.853 1.00 0.00 C ATOM 1417 C TYR A 154 0.781 -6.489 -9.297 1.00 0.00 C ATOM 1418 O TYR A 154 1.706 -6.799 -10.048 1.00 0.00 O ATOM 1419 CB TYR A 154 -0.428 -5.335 -11.159 1.00 0.00 C ATOM 1420 CG TYR A 154 -1.713 -4.728 -11.673 1.00 0.00 C ATOM 1421 CD1 TYR A 154 -2.662 -5.508 -12.323 1.00 0.00 C ATOM 1422 CD2 TYR A 154 -1.975 -3.375 -11.510 1.00 0.00 C ATOM 1423 CE1 TYR A 154 -3.837 -4.954 -12.795 1.00 0.00 C ATOM 1424 CE2 TYR A 154 -3.148 -2.814 -11.979 1.00 0.00 C ATOM 1425 CZ TYR A 154 -4.075 -3.607 -12.620 1.00 0.00 C ATOM 1426 OH TYR A 154 -5.243 -3.051 -13.089 1.00 0.00 O ATOM 0 H TYR A 154 -1.013 -4.362 -8.786 1.00 0.00 H new ATOM 0 HA TYR A 154 -1.153 -7.028 -10.056 1.00 0.00 H new ATOM 0 HB2 TYR A 154 0.303 -4.541 -11.007 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -0.021 -6.000 -11.921 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -2.479 -6.563 -12.461 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -1.251 -2.750 -11.009 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -4.565 -5.573 -13.298 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.337 -1.759 -11.844 1.00 0.00 H new ATOM 0 HH TYR A 154 -5.503 -2.302 -12.513 1.00 0.00 H new ATOM 1436 N SER A 155 0.900 -6.456 -7.973 1.00 0.00 N ATOM 1437 CA SER A 155 2.142 -6.786 -7.295 1.00 0.00 C ATOM 1438 C SER A 155 1.925 -7.963 -6.366 1.00 0.00 C ATOM 1439 O SER A 155 1.392 -7.814 -5.265 1.00 0.00 O ATOM 1440 CB SER A 155 2.648 -5.582 -6.503 1.00 0.00 C ATOM 1441 OG SER A 155 3.121 -4.568 -7.369 1.00 0.00 O ATOM 0 H SER A 155 0.138 -6.200 -7.345 1.00 0.00 H new ATOM 0 HA SER A 155 2.890 -7.054 -8.041 1.00 0.00 H new ATOM 0 HB2 SER A 155 1.845 -5.188 -5.880 1.00 0.00 H new ATOM 0 HB3 SER A 155 3.448 -5.894 -5.831 1.00 0.00 H new ATOM 0 HG SER A 155 2.360 -4.082 -7.750 1.00 0.00 H new ATOM 1447 N VAL A 156 2.327 -9.136 -6.818 1.00 0.00 N ATOM 1448 CA VAL A 156 2.164 -10.344 -6.037 1.00 0.00 C ATOM 1449 C VAL A 156 3.405 -10.639 -5.200 1.00 0.00 C ATOM 1450 O VAL A 156 3.470 -11.657 -4.510 1.00 0.00 O ATOM 1451 CB VAL A 156 1.839 -11.535 -6.952 1.00 0.00 C ATOM 1452 CG1 VAL A 156 3.049 -11.926 -7.790 1.00 0.00 C ATOM 1453 CG2 VAL A 156 1.334 -12.716 -6.140 1.00 0.00 C ATOM 0 H VAL A 156 2.770 -9.276 -7.726 1.00 0.00 H new ATOM 0 HA VAL A 156 1.330 -10.188 -5.353 1.00 0.00 H new ATOM 0 HB VAL A 156 1.046 -11.230 -7.634 1.00 0.00 H new ATOM 0 HG11 VAL A 156 2.792 -12.771 -8.428 1.00 0.00 H new ATOM 0 HG12 VAL A 156 3.351 -11.082 -8.410 1.00 0.00 H new ATOM 0 HG13 VAL A 156 3.872 -12.205 -7.132 1.00 0.00 H new ATOM 0 HG21 VAL A 156 1.110 -13.548 -6.808 1.00 0.00 H new ATOM 0 HG22 VAL A 156 2.099 -13.020 -5.426 1.00 0.00 H new ATOM 0 HG23 VAL A 156 0.430 -12.428 -5.603 1.00 0.00 H new ATOM 1463 N VAL A 157 4.381 -9.734 -5.249 1.00 0.00 N ATOM 1464 CA VAL A 157 5.600 -9.897 -4.476 1.00 0.00 C ATOM 1465 C VAL A 157 5.278 -9.862 -2.990 1.00 0.00 C ATOM 1466 O VAL A 157 5.841 -10.616 -2.198 1.00 0.00 O ATOM 1467 CB VAL A 157 6.629 -8.798 -4.801 1.00 0.00 C ATOM 1468 CG1 VAL A 157 7.928 -9.036 -4.046 1.00 0.00 C ATOM 1469 CG2 VAL A 157 6.878 -8.730 -6.300 1.00 0.00 C ATOM 0 H VAL A 157 4.347 -8.886 -5.815 1.00 0.00 H new ATOM 0 HA VAL A 157 6.035 -10.861 -4.742 1.00 0.00 H new ATOM 0 HB VAL A 157 6.223 -7.839 -4.478 1.00 0.00 H new ATOM 0 HG11 VAL A 157 8.640 -8.248 -4.290 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.732 -9.028 -2.974 1.00 0.00 H new ATOM 0 HG13 VAL A 157 8.343 -10.002 -4.332 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.607 -7.948 -6.513 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.261 -9.689 -6.649 1.00 0.00 H new ATOM 0 HG23 VAL A 157 5.944 -8.504 -6.814 1.00 0.00 H new ATOM 1479 N LEU A 158 4.344 -8.987 -2.628 1.00 0.00 N ATOM 1480 CA LEU A 158 3.910 -8.853 -1.246 1.00 0.00 C ATOM 1481 C LEU A 158 2.488 -9.386 -1.119 1.00 0.00 C ATOM 1482 O LEU A 158 1.837 -9.666 -2.126 1.00 0.00 O ATOM 1483 CB LEU A 158 3.947 -7.382 -0.799 1.00 0.00 C ATOM 1484 CG LEU A 158 5.325 -6.702 -0.794 1.00 0.00 C ATOM 1485 CD1 LEU A 158 6.150 -7.138 0.408 1.00 0.00 C ATOM 1486 CD2 LEU A 158 6.077 -6.977 -2.087 1.00 0.00 C ATOM 0 H LEU A 158 3.873 -8.358 -3.278 1.00 0.00 H new ATOM 0 HA LEU A 158 4.586 -9.423 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 158 3.287 -6.810 -1.451 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.532 -7.321 0.207 1.00 0.00 H new ATOM 0 HG LEU A 158 5.160 -5.627 -0.719 1.00 0.00 H new ATOM 0 HD11 LEU A 158 7.119 -6.640 0.384 1.00 0.00 H new ATOM 0 HD12 LEU A 158 5.627 -6.869 1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 158 6.296 -8.218 0.377 1.00 0.00 H new ATOM 0 HD21 LEU A 158 7.048 -6.483 -2.055 1.00 0.00 H new ATOM 0 HD22 LEU A 158 6.220 -8.051 -2.204 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.503 -6.594 -2.930 1.00 0.00 H new ATOM 1498 N GLU A 159 1.996 -9.510 0.104 1.00 0.00 N ATOM 1499 CA GLU A 159 0.636 -9.991 0.314 1.00 0.00 C ATOM 1500 C GLU A 159 -0.295 -8.806 0.518 1.00 0.00 C ATOM 1501 O GLU A 159 -0.219 -8.121 1.524 1.00 0.00 O ATOM 1502 CB GLU A 159 0.553 -10.935 1.521 1.00 0.00 C ATOM 1503 CG GLU A 159 1.903 -11.402 2.043 1.00 0.00 C ATOM 1504 CD GLU A 159 2.653 -12.255 1.040 1.00 0.00 C ATOM 1505 OE1 GLU A 159 1.993 -12.914 0.209 1.00 0.00 O ATOM 1506 OE2 GLU A 159 3.901 -12.263 1.085 1.00 0.00 O1- ATOM 0 H GLU A 159 2.509 -9.288 0.957 1.00 0.00 H new ATOM 0 HA GLU A 159 0.333 -10.553 -0.569 1.00 0.00 H new ATOM 0 HB2 GLU A 159 0.020 -10.430 2.327 1.00 0.00 H new ATOM 0 HB3 GLU A 159 -0.039 -11.808 1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 159 2.509 -10.533 2.300 1.00 0.00 H new ATOM 0 HG3 GLU A 159 1.756 -11.972 2.961 1.00 0.00 H new ATOM 1513 N LEU A 160 -1.158 -8.562 -0.452 1.00 0.00 N ATOM 1514 CA LEU A 160 -2.088 -7.444 -0.384 1.00 0.00 C ATOM 1515 C LEU A 160 -3.432 -7.878 0.181 1.00 0.00 C ATOM 1516 O LEU A 160 -3.872 -9.000 -0.070 1.00 0.00 O ATOM 1517 CB LEU A 160 -2.303 -6.891 -1.793 1.00 0.00 C ATOM 1518 CG LEU A 160 -1.358 -5.784 -2.249 1.00 0.00 C ATOM 1519 CD1 LEU A 160 -2.064 -4.435 -2.237 1.00 0.00 C ATOM 1520 CD2 LEU A 160 -0.088 -5.764 -1.407 1.00 0.00 C ATOM 0 H LEU A 160 -1.236 -9.124 -1.300 1.00 0.00 H new ATOM 0 HA LEU A 160 -1.664 -6.684 0.272 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -2.223 -7.718 -2.498 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -3.324 -6.514 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 160 -1.059 -5.991 -3.277 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -1.372 -3.659 -2.566 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -2.920 -4.467 -2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -2.406 -4.212 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 160 0.567 -4.965 -1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -0.347 -5.592 -0.362 1.00 0.00 H new ATOM 0 HD23 LEU A 160 0.426 -6.721 -1.501 1.00 0.00 H new ATOM 1532 N ASN A 161 -4.126 -6.984 0.899 1.00 0.00 N ATOM 1533 CA ASN A 161 -5.449 -7.356 1.400 1.00 0.00 C ATOM 1534 C ASN A 161 -6.297 -7.580 0.183 1.00 0.00 C ATOM 1535 O ASN A 161 -5.989 -6.975 -0.842 1.00 0.00 O ATOM 1536 CB ASN A 161 -6.082 -6.269 2.272 1.00 0.00 C ATOM 1537 CG ASN A 161 -7.554 -6.522 2.545 1.00 0.00 C ATOM 1538 OD1 ASN A 161 -8.426 -5.917 1.922 1.00 0.00 O ATOM 1539 ND2 ASN A 161 -7.835 -7.421 3.480 1.00 0.00 N ATOM 0 H ASN A 161 -3.811 -6.043 1.136 1.00 0.00 H new ATOM 0 HA ASN A 161 -5.368 -8.240 2.033 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -5.546 -6.210 3.219 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -5.968 -5.303 1.781 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -8.806 -7.634 3.707 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -7.080 -7.899 3.972 1.00 0.00 H new ATOM 1546 N GLU A 162 -7.330 -8.431 0.346 1.00 0.00 N ATOM 1547 CA GLU A 162 -8.268 -8.876 -0.707 1.00 0.00 C ATOM 1548 C GLU A 162 -8.637 -7.844 -1.759 1.00 0.00 C ATOM 1549 O GLU A 162 -8.510 -8.122 -2.953 1.00 0.00 O ATOM 1550 CB GLU A 162 -9.547 -9.399 -0.052 1.00 0.00 C ATOM 1551 CG GLU A 162 -10.327 -8.334 0.701 1.00 0.00 C ATOM 1552 CD GLU A 162 -11.303 -8.924 1.700 1.00 0.00 C ATOM 1553 OE1 GLU A 162 -10.878 -9.234 2.832 1.00 0.00 O1- ATOM 1554 OE2 GLU A 162 -12.492 -9.074 1.349 1.00 0.00 O ATOM 0 H GLU A 162 -7.543 -8.845 1.253 1.00 0.00 H new ATOM 0 HA GLU A 162 -7.728 -9.651 -1.251 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -10.188 -9.831 -0.821 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -9.289 -10.203 0.637 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -9.630 -7.679 1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.872 -7.716 -0.012 1.00 0.00 H new ATOM 1561 N ASP A 163 -9.064 -6.667 -1.362 1.00 0.00 N ATOM 1562 CA ASP A 163 -9.399 -5.648 -2.343 1.00 0.00 C ATOM 1563 C ASP A 163 -8.117 -4.942 -2.719 1.00 0.00 C ATOM 1564 O ASP A 163 -8.107 -3.762 -3.067 1.00 0.00 O ATOM 1565 CB ASP A 163 -10.417 -4.656 -1.773 1.00 0.00 C ATOM 1566 CG ASP A 163 -10.816 -3.594 -2.779 1.00 0.00 C ATOM 1567 OD1 ASP A 163 -10.913 -3.920 -3.980 1.00 0.00 O ATOM 1568 OD2 ASP A 163 -11.033 -2.436 -2.364 1.00 0.00 O1- ATOM 0 H ASP A 163 -9.187 -6.390 -0.388 1.00 0.00 H new ATOM 0 HA ASP A 163 -9.855 -6.104 -3.222 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -11.306 -5.198 -1.449 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -9.997 -4.176 -0.889 1.00 0.00 H new ATOM 1573 N HIS A 164 -7.017 -5.685 -2.563 1.00 0.00 N ATOM 1574 CA HIS A 164 -5.689 -5.178 -2.785 1.00 0.00 C ATOM 1575 C HIS A 164 -5.586 -3.803 -2.185 1.00 0.00 C ATOM 1576 O HIS A 164 -4.858 -2.930 -2.654 1.00 0.00 O ATOM 1577 CB HIS A 164 -5.304 -5.231 -4.254 1.00 0.00 C ATOM 1578 CG HIS A 164 -5.201 -6.645 -4.729 1.00 0.00 C ATOM 1579 ND1 HIS A 164 -5.041 -7.000 -6.050 1.00 0.00 N ATOM 1580 CD2 HIS A 164 -5.238 -7.807 -4.025 1.00 0.00 C ATOM 1581 CE1 HIS A 164 -4.986 -8.318 -6.144 1.00 0.00 C ATOM 1582 NE2 HIS A 164 -5.102 -8.830 -4.931 1.00 0.00 N ATOM 0 H HIS A 164 -7.040 -6.663 -2.276 1.00 0.00 H new ATOM 0 HA HIS A 164 -4.961 -5.816 -2.284 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -6.046 -4.697 -4.848 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -4.351 -4.723 -4.403 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -5.353 -7.907 -2.956 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -4.866 -8.881 -7.058 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -5.092 -9.824 -4.704 1.00 0.00 H new ATOM 1591 N ARG A 165 -6.340 -3.654 -1.102 1.00 0.00 N ATOM 1592 CA ARG A 165 -6.380 -2.441 -0.357 1.00 0.00 C ATOM 1593 C ARG A 165 -5.312 -2.471 0.699 1.00 0.00 C ATOM 1594 O ARG A 165 -4.997 -1.431 1.279 1.00 0.00 O ATOM 1595 CB ARG A 165 -7.756 -2.241 0.283 1.00 0.00 C ATOM 1596 CG ARG A 165 -8.823 -1.778 -0.698 1.00 0.00 C ATOM 1597 CD ARG A 165 -8.399 -0.516 -1.432 1.00 0.00 C ATOM 1598 NE ARG A 165 -9.388 0.551 -1.302 1.00 0.00 N ATOM 1599 CZ ARG A 165 -9.449 1.608 -2.109 1.00 0.00 C ATOM 1600 NH1 ARG A 165 -8.581 1.742 -3.104 1.00 0.00 N1+ ATOM 1601 NH2 ARG A 165 -10.380 2.532 -1.922 1.00 0.00 N ATOM 0 H ARG A 165 -6.939 -4.390 -0.728 1.00 0.00 H new ATOM 0 HA ARG A 165 -6.199 -1.604 -1.032 1.00 0.00 H new ATOM 0 HB2 ARG A 165 -8.075 -3.178 0.738 1.00 0.00 H new ATOM 0 HB3 ARG A 165 -7.671 -1.509 1.086 1.00 0.00 H new ATOM 0 HG2 ARG A 165 -9.022 -2.570 -1.420 1.00 0.00 H new ATOM 0 HG3 ARG A 165 -9.754 -1.593 -0.163 1.00 0.00 H new ATOM 0 HD2 ARG A 165 -7.442 -0.173 -1.040 1.00 0.00 H new ATOM 0 HD3 ARG A 165 -8.248 -0.744 -2.487 1.00 0.00 H new ATOM 0 HE ARG A 165 -10.072 0.482 -0.549 1.00 0.00 H new ATOM 0 HH11 ARG A 165 -7.863 1.033 -3.253 1.00 0.00 H new ATOM 0 HH12 ARG A 165 -8.632 2.554 -3.719 1.00 0.00 H new ATOM 0 HH21 ARG A 165 -11.050 2.434 -1.159 1.00 0.00 H new ATOM 0 HH22 ARG A 165 -10.426 3.342 -2.541 1.00 0.00 H new ATOM 1615 N LYS A 166 -4.719 -3.649 0.961 1.00 0.00 N ATOM 1616 CA LYS A 166 -3.661 -3.654 1.981 1.00 0.00 C ATOM 1617 C LYS A 166 -2.427 -4.391 1.522 1.00 0.00 C ATOM 1618 O LYS A 166 -2.389 -4.933 0.425 1.00 0.00 O ATOM 1619 CB LYS A 166 -4.154 -4.219 3.313 1.00 0.00 C ATOM 1620 CG LYS A 166 -5.188 -3.338 4.001 1.00 0.00 C ATOM 1621 CD LYS A 166 -6.528 -4.042 4.147 1.00 0.00 C ATOM 1622 CE LYS A 166 -7.473 -3.261 5.044 1.00 0.00 C ATOM 1623 NZ LYS A 166 -8.682 -4.053 5.403 1.00 0.00 N1+ ATOM 0 H LYS A 166 -4.932 -4.544 0.520 1.00 0.00 H new ATOM 0 HA LYS A 166 -3.387 -2.610 2.136 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -4.585 -5.206 3.143 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -3.302 -4.354 3.979 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -4.821 -3.049 4.986 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -5.321 -2.420 3.429 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -6.981 -4.171 3.164 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -6.373 -5.039 4.560 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -6.949 -2.966 5.953 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -7.777 -2.344 4.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -9.301 -3.484 6.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -9.196 -4.313 4.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -8.395 -4.916 5.907 1.00 0.00 H new ATOM 1637 N VAL A 167 -1.417 -4.403 2.378 1.00 0.00 N ATOM 1638 CA VAL A 167 -0.173 -5.079 2.075 1.00 0.00 C ATOM 1639 C VAL A 167 0.462 -5.621 3.346 1.00 0.00 C ATOM 1640 O VAL A 167 1.138 -4.911 4.086 1.00 0.00 O ATOM 1641 CB VAL A 167 0.810 -4.166 1.307 1.00 0.00 C ATOM 1642 CG1 VAL A 167 0.963 -2.811 1.986 1.00 0.00 C ATOM 1643 CG2 VAL A 167 2.164 -4.840 1.133 1.00 0.00 C ATOM 0 H VAL A 167 -1.439 -3.949 3.291 1.00 0.00 H new ATOM 0 HA VAL A 167 -0.405 -5.918 1.419 1.00 0.00 H new ATOM 0 HB VAL A 167 0.387 -3.994 0.317 1.00 0.00 H new ATOM 0 HG11 VAL A 167 1.661 -2.196 1.418 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -0.006 -2.314 2.029 1.00 0.00 H new ATOM 0 HG13 VAL A 167 1.343 -2.952 2.998 1.00 0.00 H new ATOM 0 HG21 VAL A 167 2.835 -4.174 0.589 1.00 0.00 H new ATOM 0 HG22 VAL A 167 2.588 -5.062 2.112 1.00 0.00 H new ATOM 0 HG23 VAL A 167 2.040 -5.767 0.573 1.00 0.00 H new ATOM 1653 N ARG A 168 0.217 -6.897 3.582 1.00 0.00 N ATOM 1654 CA ARG A 168 0.745 -7.584 4.755 1.00 0.00 C ATOM 1655 C ARG A 168 1.848 -8.554 4.349 1.00 0.00 C ATOM 1656 O ARG A 168 2.068 -8.785 3.164 1.00 0.00 O ATOM 1657 CB ARG A 168 -0.368 -8.346 5.478 1.00 0.00 C ATOM 1658 CG ARG A 168 -1.348 -9.036 4.542 1.00 0.00 C ATOM 1659 CD ARG A 168 -2.435 -9.768 5.313 1.00 0.00 C ATOM 1660 NE ARG A 168 -2.690 -11.100 4.770 1.00 0.00 N ATOM 1661 CZ ARG A 168 -3.353 -11.325 3.639 1.00 0.00 C ATOM 1662 NH1 ARG A 168 -3.830 -10.310 2.927 1.00 0.00 N1+ ATOM 1663 NH2 ARG A 168 -3.542 -12.568 3.216 1.00 0.00 N ATOM 0 H ARG A 168 -0.350 -7.487 2.972 1.00 0.00 H new ATOM 0 HA ARG A 168 1.158 -6.835 5.431 1.00 0.00 H new ATOM 0 HB2 ARG A 168 0.082 -9.093 6.133 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -0.916 -7.652 6.115 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -1.803 -8.298 3.882 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -0.812 -9.742 3.908 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -2.142 -9.853 6.359 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -3.355 -9.184 5.286 1.00 0.00 H new ATOM 0 HE ARG A 168 -2.339 -11.905 5.289 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -3.689 -9.352 3.247 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -4.338 -10.489 2.061 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -3.179 -13.352 3.758 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -4.051 -12.740 2.349 1.00 0.00 H new ATOM 1677 N ARG A 169 2.532 -9.123 5.337 1.00 0.00 N ATOM 1678 CA ARG A 169 3.601 -10.079 5.070 1.00 0.00 C ATOM 1679 C ARG A 169 3.161 -11.494 5.428 1.00 0.00 C ATOM 1680 O ARG A 169 2.628 -11.731 6.512 1.00 0.00 O ATOM 1681 CB ARG A 169 4.864 -9.718 5.856 1.00 0.00 C ATOM 1682 CG ARG A 169 5.831 -8.838 5.083 1.00 0.00 C ATOM 1683 CD ARG A 169 6.885 -9.666 4.366 1.00 0.00 C ATOM 1684 NE ARG A 169 7.455 -8.958 3.222 1.00 0.00 N ATOM 1685 CZ ARG A 169 8.624 -9.267 2.666 1.00 0.00 C ATOM 1686 NH1 ARG A 169 9.348 -10.274 3.139 1.00 0.00 N1+ ATOM 1687 NH2 ARG A 169 9.072 -8.568 1.631 1.00 0.00 N ATOM 0 H ARG A 169 2.366 -8.939 6.326 1.00 0.00 H new ATOM 0 HA ARG A 169 3.826 -10.037 4.004 1.00 0.00 H new ATOM 0 HB2 ARG A 169 4.576 -9.207 6.775 1.00 0.00 H new ATOM 0 HB3 ARG A 169 5.375 -10.636 6.148 1.00 0.00 H new ATOM 0 HG2 ARG A 169 5.280 -8.240 4.357 1.00 0.00 H new ATOM 0 HG3 ARG A 169 6.317 -8.141 5.766 1.00 0.00 H new ATOM 0 HD2 ARG A 169 7.680 -9.924 5.065 1.00 0.00 H new ATOM 0 HD3 ARG A 169 6.442 -10.603 4.028 1.00 0.00 H new ATOM 0 HE ARG A 169 6.926 -8.181 2.826 1.00 0.00 H new ATOM 0 HH11 ARG A 169 9.009 -10.817 3.934 1.00 0.00 H new ATOM 0 HH12 ARG A 169 10.243 -10.505 2.708 1.00 0.00 H new ATOM 0 HH21 ARG A 169 8.520 -7.794 1.261 1.00 0.00 H new ATOM 0 HH22 ARG A 169 9.968 -8.805 1.205 1.00 0.00 H new ATOM 1701 N THR A 170 3.395 -12.433 4.519 1.00 0.00 N ATOM 1702 CA THR A 170 3.031 -13.824 4.753 1.00 0.00 C ATOM 1703 C THR A 170 3.867 -14.401 5.885 1.00 0.00 C ATOM 1704 O THR A 170 3.357 -15.084 6.772 1.00 0.00 O ATOM 1705 CB THR A 170 3.241 -14.650 3.485 1.00 0.00 C ATOM 1706 OG1 THR A 170 4.292 -14.110 2.703 1.00 0.00 O ATOM 1707 CG2 THR A 170 2.012 -14.726 2.611 1.00 0.00 C ATOM 0 H THR A 170 3.834 -12.257 3.615 1.00 0.00 H new ATOM 0 HA THR A 170 1.977 -13.863 5.030 1.00 0.00 H new ATOM 0 HB THR A 170 3.483 -15.655 3.832 1.00 0.00 H new ATOM 0 HG1 THR A 170 4.412 -14.653 1.896 1.00 0.00 H new ATOM 0 HG21 THR A 170 2.230 -15.327 1.728 1.00 0.00 H new ATOM 0 HG22 THR A 170 1.196 -15.185 3.170 1.00 0.00 H new ATOM 0 HG23 THR A 170 1.722 -13.721 2.303 1.00 0.00 H new ATOM 1715 N THR A 171 5.161 -14.118 5.835 1.00 0.00 N ATOM 1716 CA THR A 171 6.096 -14.601 6.843 1.00 0.00 C ATOM 1717 C THR A 171 6.962 -13.461 7.377 1.00 0.00 C ATOM 1718 O THR A 171 8.163 -13.407 7.110 1.00 0.00 O ATOM 1719 CB THR A 171 6.987 -15.688 6.246 1.00 0.00 C ATOM 1720 OG1 THR A 171 7.892 -16.186 7.215 1.00 0.00 O ATOM 1721 CG2 THR A 171 7.797 -15.198 5.065 1.00 0.00 C ATOM 0 H THR A 171 5.590 -13.553 5.102 1.00 0.00 H new ATOM 0 HA THR A 171 5.521 -15.014 7.672 1.00 0.00 H new ATOM 0 HB THR A 171 6.310 -16.472 5.908 1.00 0.00 H new ATOM 0 HG1 THR A 171 8.452 -16.882 6.812 1.00 0.00 H new ATOM 0 HG21 THR A 171 8.411 -16.013 4.682 1.00 0.00 H new ATOM 0 HG22 THR A 171 7.124 -14.851 4.281 1.00 0.00 H new ATOM 0 HG23 THR A 171 8.440 -14.376 5.381 1.00 0.00 H new ATOM 1729 N PRO A 172 6.367 -12.531 8.143 1.00 0.00 N ATOM 1730 CA PRO A 172 7.103 -11.397 8.710 1.00 0.00 C ATOM 1731 C PRO A 172 8.342 -11.845 9.474 1.00 0.00 C ATOM 1732 O PRO A 172 8.352 -12.915 10.083 1.00 0.00 O ATOM 1733 CB PRO A 172 6.092 -10.752 9.659 1.00 0.00 C ATOM 1734 CG PRO A 172 4.760 -11.144 9.120 1.00 0.00 C ATOM 1735 CD PRO A 172 4.943 -12.512 8.520 1.00 0.00 C ATOM 0 HA PRO A 172 7.470 -10.720 7.939 1.00 0.00 H new ATOM 0 HB2 PRO A 172 6.226 -11.108 10.681 1.00 0.00 H new ATOM 0 HB3 PRO A 172 6.206 -9.668 9.681 1.00 0.00 H new ATOM 0 HG2 PRO A 172 4.009 -11.161 9.910 1.00 0.00 H new ATOM 0 HG3 PRO A 172 4.417 -10.431 8.370 1.00 0.00 H new ATOM 0 HD2 PRO A 172 4.706 -13.300 9.235 1.00 0.00 H new ATOM 0 HD3 PRO A 172 4.296 -12.662 7.655 1.00 0.00 H new ATOM 1743 N VAL A 173 9.387 -11.026 9.437 1.00 0.00 N ATOM 1744 CA VAL A 173 10.630 -11.348 10.125 1.00 0.00 C ATOM 1745 C VAL A 173 10.923 -10.305 11.201 1.00 0.00 C ATOM 1746 O VAL A 173 10.632 -9.123 11.020 1.00 0.00 O ATOM 1747 CB VAL A 173 11.807 -11.451 9.119 1.00 0.00 C ATOM 1748 CG1 VAL A 173 11.643 -10.448 7.988 1.00 0.00 C ATOM 1749 CG2 VAL A 173 13.162 -11.277 9.801 1.00 0.00 C ATOM 0 H VAL A 173 9.398 -10.136 8.939 1.00 0.00 H new ATOM 0 HA VAL A 173 10.517 -12.319 10.607 1.00 0.00 H new ATOM 0 HB VAL A 173 11.782 -12.456 8.699 1.00 0.00 H new ATOM 0 HG11 VAL A 173 12.480 -10.540 7.296 1.00 0.00 H new ATOM 0 HG12 VAL A 173 10.711 -10.646 7.458 1.00 0.00 H new ATOM 0 HG13 VAL A 173 11.620 -9.438 8.398 1.00 0.00 H new ATOM 0 HG21 VAL A 173 13.956 -11.357 9.058 1.00 0.00 H new ATOM 0 HG22 VAL A 173 13.207 -10.297 10.277 1.00 0.00 H new ATOM 0 HG23 VAL A 173 13.292 -12.053 10.556 1.00 0.00 H new ATOM 1759 N PRO A 174 11.494 -10.726 12.343 1.00 0.00 N ATOM 1760 CA PRO A 174 11.810 -9.815 13.447 1.00 0.00 C ATOM 1761 C PRO A 174 12.704 -8.664 13.003 1.00 0.00 C ATOM 1762 O PRO A 174 13.671 -8.860 12.268 1.00 0.00 O ATOM 1763 CB PRO A 174 12.540 -10.704 14.465 1.00 0.00 C ATOM 1764 CG PRO A 174 12.915 -11.940 13.716 1.00 0.00 C ATOM 1765 CD PRO A 174 11.863 -12.114 12.661 1.00 0.00 C ATOM 0 HA PRO A 174 10.914 -9.344 13.851 1.00 0.00 H new ATOM 0 HB2 PRO A 174 13.422 -10.203 14.863 1.00 0.00 H new ATOM 0 HB3 PRO A 174 11.897 -10.939 15.314 1.00 0.00 H new ATOM 0 HG2 PRO A 174 13.904 -11.841 13.269 1.00 0.00 H new ATOM 0 HG3 PRO A 174 12.950 -12.804 14.380 1.00 0.00 H new ATOM 0 HD2 PRO A 174 12.248 -12.641 11.788 1.00 0.00 H new ATOM 0 HD3 PRO A 174 11.011 -12.686 13.029 1.00 0.00 H new ATOM 1773 N LEU A 175 12.364 -7.462 13.453 1.00 0.00 N ATOM 1774 CA LEU A 175 13.102 -6.276 13.116 1.00 0.00 C ATOM 1775 C LEU A 175 13.835 -5.728 14.335 1.00 0.00 C ATOM 1776 O LEU A 175 14.975 -5.274 14.246 1.00 0.00 O ATOM 1777 CB LEU A 175 12.160 -5.191 12.586 1.00 0.00 C ATOM 1778 CG LEU A 175 10.651 -5.425 12.719 1.00 0.00 C ATOM 1779 CD1 LEU A 175 10.230 -6.576 11.837 1.00 0.00 C ATOM 1780 CD2 LEU A 175 10.211 -5.645 14.166 1.00 0.00 C ATOM 0 H LEU A 175 11.564 -7.294 14.063 1.00 0.00 H new ATOM 0 HA LEU A 175 13.826 -6.547 12.347 1.00 0.00 H new ATOM 0 HB2 LEU A 175 12.401 -4.260 13.098 1.00 0.00 H new ATOM 0 HB3 LEU A 175 12.383 -5.041 11.530 1.00 0.00 H new ATOM 0 HG LEU A 175 10.148 -4.517 12.387 1.00 0.00 H new ATOM 0 HD11 LEU A 175 9.157 -6.737 11.936 1.00 0.00 H new ATOM 0 HD12 LEU A 175 10.468 -6.345 10.799 1.00 0.00 H new ATOM 0 HD13 LEU A 175 10.762 -7.479 12.138 1.00 0.00 H new ATOM 0 HD21 LEU A 175 9.133 -5.805 14.198 1.00 0.00 H new ATOM 0 HD22 LEU A 175 10.720 -6.519 14.572 1.00 0.00 H new ATOM 0 HD23 LEU A 175 10.465 -4.768 14.761 1.00 0.00 H new ATOM 1792 N PHE A 176 13.159 -5.779 15.472 1.00 0.00 N ATOM 1793 CA PHE A 176 13.712 -5.298 16.723 1.00 0.00 C ATOM 1794 C PHE A 176 13.211 -6.165 17.863 1.00 0.00 C ATOM 1795 O PHE A 176 12.064 -6.048 18.295 1.00 0.00 O ATOM 1796 CB PHE A 176 13.286 -3.846 16.953 1.00 0.00 C ATOM 1797 CG PHE A 176 12.021 -3.454 16.238 1.00 0.00 C ATOM 1798 CD1 PHE A 176 12.039 -3.113 14.894 1.00 0.00 C ATOM 1799 CD2 PHE A 176 10.808 -3.450 16.908 1.00 0.00 C ATOM 1800 CE1 PHE A 176 10.870 -2.773 14.235 1.00 0.00 C ATOM 1801 CE2 PHE A 176 9.639 -3.107 16.256 1.00 0.00 C ATOM 1802 CZ PHE A 176 9.670 -2.770 14.918 1.00 0.00 C ATOM 0 H PHE A 176 12.214 -6.155 15.551 1.00 0.00 H new ATOM 0 HA PHE A 176 14.800 -5.348 16.680 1.00 0.00 H new ATOM 0 HB2 PHE A 176 13.151 -3.684 18.022 1.00 0.00 H new ATOM 0 HB3 PHE A 176 14.092 -3.187 16.630 1.00 0.00 H new ATOM 0 HD1 PHE A 176 12.975 -3.113 14.356 1.00 0.00 H new ATOM 0 HD2 PHE A 176 10.776 -3.719 17.954 1.00 0.00 H new ATOM 0 HE1 PHE A 176 10.897 -2.510 13.188 1.00 0.00 H new ATOM 0 HE2 PHE A 176 8.702 -3.103 16.793 1.00 0.00 H new ATOM 0 HZ PHE A 176 8.757 -2.504 14.406 1.00 0.00 H new ATOM 1812 N PRO A 177 14.068 -7.053 18.360 1.00 0.00 N ATOM 1813 CA PRO A 177 13.746 -7.970 19.454 1.00 0.00 C ATOM 1814 C PRO A 177 13.708 -7.280 20.813 1.00 0.00 C ATOM 1815 O PRO A 177 13.089 -7.779 21.754 1.00 0.00 O ATOM 1816 CB PRO A 177 14.878 -9.010 19.366 1.00 0.00 C ATOM 1817 CG PRO A 177 15.488 -8.756 18.026 1.00 0.00 C ATOM 1818 CD PRO A 177 15.432 -7.281 17.889 1.00 0.00 C ATOM 0 HA PRO A 177 12.750 -8.402 19.361 1.00 0.00 H new ATOM 0 HB2 PRO A 177 15.605 -8.880 20.168 1.00 0.00 H new ATOM 0 HB3 PRO A 177 14.494 -10.027 19.445 1.00 0.00 H new ATOM 0 HG2 PRO A 177 16.513 -9.124 17.976 1.00 0.00 H new ATOM 0 HG3 PRO A 177 14.931 -9.253 17.232 1.00 0.00 H new ATOM 0 HD2 PRO A 177 16.178 -6.774 18.501 1.00 0.00 H new ATOM 0 HD3 PRO A 177 15.583 -6.949 16.862 1.00 0.00 H new ATOM 1826 N ASN A 178 14.380 -6.136 20.916 1.00 0.00 N ATOM 1827 CA ASN A 178 14.429 -5.391 22.162 1.00 0.00 C ATOM 1828 C ASN A 178 13.452 -4.230 22.137 1.00 0.00 C ATOM 1829 O ASN A 178 12.974 -3.781 23.178 1.00 0.00 O ATOM 1830 CB ASN A 178 15.846 -4.874 22.419 1.00 0.00 C ATOM 1831 CG ASN A 178 16.523 -4.360 21.162 1.00 0.00 C ATOM 1832 OD1 ASN A 178 16.056 -3.221 20.663 1.00 0.00 O flip ATOM 1833 ND2 ASN A 178 17.454 -4.979 20.647 1.00 0.00 N flip ATOM 0 H ASN A 178 14.897 -5.708 20.148 1.00 0.00 H new ATOM 0 HA ASN A 178 14.145 -6.066 22.970 1.00 0.00 H new ATOM 0 HB2 ASN A 178 15.807 -4.074 23.158 1.00 0.00 H new ATOM 0 HB3 ASN A 178 16.448 -5.675 22.848 1.00 0.00 H new ATOM 0 HD21 ASN A 178 17.780 -5.850 21.065 1.00 0.00 H new ATOM 0 HD22 ASN A 178 17.899 -4.621 19.802 1.00 0.00 H new ATOM 1840 N GLU A 179 13.172 -3.735 20.939 1.00 0.00 N ATOM 1841 CA GLU A 179 12.266 -2.610 20.779 1.00 0.00 C ATOM 1842 C GLU A 179 10.828 -3.072 20.577 1.00 0.00 C ATOM 1843 O GLU A 179 9.885 -2.303 20.765 1.00 0.00 O ATOM 1844 CB GLU A 179 12.722 -1.767 19.600 1.00 0.00 C ATOM 1845 CG GLU A 179 11.869 -0.532 19.357 1.00 0.00 C ATOM 1846 CD GLU A 179 12.698 0.730 19.217 1.00 0.00 C ATOM 1847 OE1 GLU A 179 13.512 0.805 18.273 1.00 0.00 O1- ATOM 1848 OE2 GLU A 179 12.532 1.644 20.053 1.00 0.00 O ATOM 0 H GLU A 179 13.559 -4.095 20.067 1.00 0.00 H new ATOM 0 HA GLU A 179 12.289 -2.013 21.691 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.754 -1.457 19.766 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.715 -2.384 18.701 1.00 0.00 H new ATOM 0 HG2 GLU A 179 11.277 -0.676 18.453 1.00 0.00 H new ATOM 0 HG3 GLU A 179 11.167 -0.412 20.182 1.00 0.00 H new ATOM 1855 N ASN A 180 10.672 -4.328 20.199 1.00 0.00 N ATOM 1856 CA ASN A 180 9.351 -4.902 19.973 1.00 0.00 C ATOM 1857 C ASN A 180 8.815 -5.547 21.249 1.00 0.00 C ATOM 1858 O ASN A 180 8.563 -6.752 21.292 1.00 0.00 O ATOM 1859 CB ASN A 180 9.403 -5.937 18.846 1.00 0.00 C ATOM 1860 CG ASN A 180 8.021 -6.374 18.400 1.00 0.00 C ATOM 1861 OD1 ASN A 180 7.188 -6.766 19.216 1.00 0.00 O ATOM 1862 ND2 ASN A 180 7.772 -6.311 17.096 1.00 0.00 N ATOM 0 H ASN A 180 11.445 -4.975 20.041 1.00 0.00 H new ATOM 0 HA ASN A 180 8.677 -4.096 19.682 1.00 0.00 H new ATOM 0 HB2 ASN A 180 9.941 -5.518 17.996 1.00 0.00 H new ATOM 0 HB3 ASN A 180 9.966 -6.808 19.182 1.00 0.00 H new ATOM 0 HD21 ASN A 180 6.860 -6.594 16.737 1.00 0.00 H new ATOM 0 HD22 ASN A 180 8.493 -5.979 16.455 1.00 0.00 H new ATOM 1869 N LEU A 181 8.643 -4.735 22.287 1.00 0.00 N ATOM 1870 CA LEU A 181 8.137 -5.224 23.564 1.00 0.00 C ATOM 1871 C LEU A 181 6.637 -4.963 23.692 1.00 0.00 C ATOM 1872 O LEU A 181 6.156 -3.887 23.337 1.00 0.00 O ATOM 1873 CB LEU A 181 8.883 -4.554 24.720 1.00 0.00 C ATOM 1874 CG LEU A 181 8.690 -5.215 26.086 1.00 0.00 C ATOM 1875 CD1 LEU A 181 9.454 -6.528 26.157 1.00 0.00 C ATOM 1876 CD2 LEU A 181 9.135 -4.276 27.198 1.00 0.00 C ATOM 0 H LEU A 181 8.847 -3.736 22.269 1.00 0.00 H new ATOM 0 HA LEU A 181 8.305 -6.300 23.606 1.00 0.00 H new ATOM 0 HB2 LEU A 181 9.948 -4.542 24.487 1.00 0.00 H new ATOM 0 HB3 LEU A 181 8.560 -3.515 24.787 1.00 0.00 H new ATOM 0 HG LEU A 181 7.630 -5.429 26.219 1.00 0.00 H new ATOM 0 HD11 LEU A 181 9.305 -6.983 27.136 1.00 0.00 H new ATOM 0 HD12 LEU A 181 9.089 -7.203 25.383 1.00 0.00 H new ATOM 0 HD13 LEU A 181 10.516 -6.340 26.003 1.00 0.00 H new ATOM 0 HD21 LEU A 181 8.991 -4.761 28.163 1.00 0.00 H new ATOM 0 HD22 LEU A 181 10.189 -4.032 27.068 1.00 0.00 H new ATOM 0 HD23 LEU A 181 8.544 -3.361 27.160 1.00 0.00 H new ATOM 1888 N PRO A 182 5.874 -5.947 24.202 1.00 0.00 N ATOM 1889 CA PRO A 182 4.424 -5.810 24.372 1.00 0.00 C ATOM 1890 C PRO A 182 4.061 -4.853 25.502 1.00 0.00 C ATOM 1891 O PRO A 182 4.924 -4.423 26.267 1.00 0.00 O ATOM 1892 CB PRO A 182 3.971 -7.231 24.709 1.00 0.00 C ATOM 1893 CG PRO A 182 5.163 -7.867 25.335 1.00 0.00 C ATOM 1894 CD PRO A 182 6.361 -7.265 24.653 1.00 0.00 C ATOM 0 HA PRO A 182 3.947 -5.395 23.484 1.00 0.00 H new ATOM 0 HB2 PRO A 182 3.121 -7.225 25.391 1.00 0.00 H new ATOM 0 HB3 PRO A 182 3.658 -7.770 23.815 1.00 0.00 H new ATOM 0 HG2 PRO A 182 5.188 -7.677 26.408 1.00 0.00 H new ATOM 0 HG3 PRO A 182 5.142 -8.949 25.204 1.00 0.00 H new ATOM 0 HD2 PRO A 182 7.205 -7.169 25.336 1.00 0.00 H new ATOM 0 HD3 PRO A 182 6.696 -7.877 23.816 1.00 0.00 H new ATOM 1902 N SER A 183 2.777 -4.524 25.603 1.00 0.00 N ATOM 1903 CA SER A 183 2.299 -3.617 26.640 1.00 0.00 C ATOM 1904 C SER A 183 2.973 -2.255 26.525 1.00 0.00 C ATOM 1905 O SER A 183 2.752 -1.409 27.417 1.00 0.00 O ATOM 1906 CB SER A 183 2.559 -4.213 28.025 1.00 0.00 C ATOM 1907 OG SER A 183 2.280 -3.270 29.046 1.00 0.00 O ATOM 1908 OXT SER A 183 3.716 -2.043 25.544 1.00 0.00 O ATOM 0 H SER A 183 2.049 -4.872 24.979 1.00 0.00 H new ATOM 0 HA SER A 183 1.226 -3.483 26.505 1.00 0.00 H new ATOM 0 HB2 SER A 183 1.940 -5.099 28.165 1.00 0.00 H new ATOM 0 HB3 SER A 183 3.598 -4.535 28.097 1.00 0.00 H new ATOM 0 HG SER A 183 2.199 -2.376 28.653 1.00 0.00 H new TER 1914 SER A 183