USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=20 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 Single : A 70 THR OG1 : rot 180:sc= -0.472 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -1.89 K(o=-1.9,f=-2.6!) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -154:sc= -0.315 (180deg=-1.34!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -1.66 X(o=-1.7,f=-2.1) USER MOD Single : A 103 TYR OH : rot 180:sc= -0.153 USER MOD Single : A 105 SER OG : rot 42:sc= 0.396 USER MOD Single : A 108 ASN : amide:sc= -3.16! K(o=-3.2!,f=-2.4) USER MOD Single : A 111 LYS NZ :NH3+ 152:sc= -0.114 (180deg=-0.456) USER MOD Single : A 117 LYS NZ :NH3+ 170:sc= -0.141 (180deg=-0.303) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 ASN : amide:sc= -1.04 K(o=-1,f=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= -1.01 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 69:sc= 1.24 USER MOD Single : A 134 SER OG : rot -38:sc= 1.2 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 HIS : no HD1:sc= -0.0585 X(o=-0.058,f=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= -0.373 USER MOD Single : A 147 THR OG1 : rot -174:sc= -1.04 USER MOD Single : A 148 THR OG1 : rot 46:sc= 1.09 USER MOD Single : A 150 HIS : no HD1:sc= -1.15 K(o=-1.2,f=-1.7) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 SER OG : rot -137:sc= -3.2! USER MOD Single : A 161 ASN : amide:sc= -1.81 K(o=-1.8,f=-4.8!) USER MOD Single : A 164 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-5.8!) USER MOD Single : A 166 LYS NZ :NH3+ -127:sc= -0.429 (180deg=-2.65!) USER MOD Single : A 170 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot -65:sc= 0.739 USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=0.23) USER MOD Single : A 180 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 70 -29.876 -11.105 -17.139 1.00 0.00 N ATOM 2 CA THR A 70 -30.394 -12.401 -17.648 1.00 0.00 C ATOM 3 C THR A 70 -31.315 -12.195 -18.846 1.00 0.00 C ATOM 4 O THR A 70 -31.062 -12.712 -19.933 1.00 0.00 O ATOM 5 CB THR A 70 -31.147 -13.103 -16.517 1.00 0.00 C ATOM 6 OG1 THR A 70 -32.348 -12.418 -16.213 1.00 0.00 O ATOM 7 CG2 THR A 70 -30.343 -13.209 -15.239 1.00 0.00 C ATOM 0 HA THR A 70 -29.557 -13.015 -17.980 1.00 0.00 H new ATOM 0 HB THR A 70 -31.349 -14.109 -16.885 1.00 0.00 H new ATOM 0 HG1 THR A 70 -32.816 -12.883 -15.488 1.00 0.00 H new ATOM 0 HG21 THR A 70 -30.935 -13.717 -14.478 1.00 0.00 H new ATOM 0 HG22 THR A 70 -29.432 -13.776 -15.428 1.00 0.00 H new ATOM 0 HG23 THR A 70 -30.082 -12.210 -14.889 1.00 0.00 H new ATOM 15 N ALA A 71 -32.386 -11.435 -18.637 1.00 0.00 N ATOM 16 CA ALA A 71 -33.346 -11.160 -19.700 1.00 0.00 C ATOM 17 C ALA A 71 -33.209 -9.729 -20.207 1.00 0.00 C ATOM 18 O ALA A 71 -34.012 -8.859 -19.868 1.00 0.00 O ATOM 19 CB ALA A 71 -34.763 -11.415 -19.209 1.00 0.00 C ATOM 0 H ALA A 71 -32.610 -10.999 -17.742 1.00 0.00 H new ATOM 0 HA ALA A 71 -33.134 -11.833 -20.531 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -35.470 -11.206 -20.012 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -34.860 -12.456 -18.902 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -34.976 -10.766 -18.360 1.00 0.00 H new ATOM 25 N SER A 72 -32.185 -9.491 -21.021 1.00 0.00 N ATOM 26 CA SER A 72 -31.942 -8.164 -21.576 1.00 0.00 C ATOM 27 C SER A 72 -31.683 -7.150 -20.466 1.00 0.00 C ATOM 28 O SER A 72 -32.118 -7.334 -19.330 1.00 0.00 O ATOM 29 CB SER A 72 -33.133 -7.716 -22.425 1.00 0.00 C ATOM 30 OG SER A 72 -32.703 -7.000 -23.570 1.00 0.00 O ATOM 0 H SER A 72 -31.511 -10.199 -21.311 1.00 0.00 H new ATOM 0 HA SER A 72 -31.056 -8.219 -22.208 1.00 0.00 H new ATOM 0 HB2 SER A 72 -33.712 -8.587 -22.733 1.00 0.00 H new ATOM 0 HB3 SER A 72 -33.794 -7.089 -21.827 1.00 0.00 H new ATOM 0 HG SER A 72 -33.483 -6.726 -24.097 1.00 0.00 H new ATOM 36 N GLY A 73 -30.973 -6.079 -20.805 1.00 0.00 N ATOM 37 CA GLY A 73 -30.670 -5.051 -19.827 1.00 0.00 C ATOM 38 C GLY A 73 -29.463 -4.219 -20.215 1.00 0.00 C ATOM 39 O GLY A 73 -29.148 -4.083 -21.396 1.00 0.00 O ATOM 0 H GLY A 73 -30.602 -5.905 -21.739 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -31.535 -4.398 -19.711 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -30.490 -5.517 -18.858 1.00 0.00 H new ATOM 43 N GLY A 74 -28.786 -3.660 -19.216 1.00 0.00 N ATOM 44 CA GLY A 74 -27.615 -2.844 -19.480 1.00 0.00 C ATOM 45 C GLY A 74 -26.322 -3.559 -19.145 1.00 0.00 C ATOM 46 O GLY A 74 -26.336 -4.636 -18.548 1.00 0.00 O ATOM 0 H GLY A 74 -29.027 -3.758 -18.230 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -27.606 -2.557 -20.531 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -27.679 -1.924 -18.899 1.00 0.00 H new ATOM 50 N GLU A 75 -25.199 -2.961 -19.530 1.00 0.00 N ATOM 51 CA GLU A 75 -23.890 -3.549 -19.269 1.00 0.00 C ATOM 52 C GLU A 75 -23.054 -2.637 -18.374 1.00 0.00 C ATOM 53 O GLU A 75 -22.415 -3.097 -17.429 1.00 0.00 O ATOM 54 CB GLU A 75 -23.153 -3.809 -20.583 1.00 0.00 C ATOM 55 CG GLU A 75 -23.951 -4.640 -21.574 1.00 0.00 C ATOM 56 CD GLU A 75 -23.628 -4.296 -23.015 1.00 0.00 C ATOM 57 OE1 GLU A 75 -23.351 -3.111 -23.295 1.00 0.00 O1- ATOM 58 OE2 GLU A 75 -23.653 -5.212 -23.863 1.00 0.00 O ATOM 0 H GLU A 75 -25.169 -2.069 -20.024 1.00 0.00 H new ATOM 0 HA GLU A 75 -24.041 -4.497 -18.753 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -22.900 -2.854 -21.043 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -22.213 -4.318 -20.368 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -23.749 -5.697 -21.402 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -25.016 -4.487 -21.397 1.00 0.00 H new ATOM 65 N ASN A 76 -23.066 -1.344 -18.680 1.00 0.00 N ATOM 66 CA ASN A 76 -22.310 -0.368 -17.904 1.00 0.00 C ATOM 67 C ASN A 76 -22.567 1.047 -18.411 1.00 0.00 C ATOM 68 O ASN A 76 -22.699 1.985 -17.624 1.00 0.00 O ATOM 69 CB ASN A 76 -20.813 -0.684 -17.969 1.00 0.00 C ATOM 70 CG ASN A 76 -20.330 -1.446 -16.751 1.00 0.00 C ATOM 71 OD1 ASN A 76 -20.040 -2.639 -16.826 1.00 0.00 O ATOM 72 ND2 ASN A 76 -20.241 -0.757 -15.619 1.00 0.00 N ATOM 0 H ASN A 76 -23.591 -0.948 -19.460 1.00 0.00 H new ATOM 0 HA ASN A 76 -22.642 -0.428 -16.868 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -20.606 -1.269 -18.865 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -20.252 0.246 -18.059 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -19.922 -1.216 -14.766 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -20.492 0.231 -15.603 1.00 0.00 H new ATOM 79 N GLU A 77 -22.637 1.194 -19.731 1.00 0.00 N ATOM 80 CA GLU A 77 -22.878 2.496 -20.343 1.00 0.00 C ATOM 81 C GLU A 77 -24.209 3.078 -19.879 1.00 0.00 C ATOM 82 O GLU A 77 -25.270 2.708 -20.384 1.00 0.00 O ATOM 83 CB GLU A 77 -22.866 2.374 -21.868 1.00 0.00 C ATOM 84 CG GLU A 77 -21.510 1.986 -22.436 1.00 0.00 C ATOM 85 CD GLU A 77 -21.572 0.737 -23.294 1.00 0.00 C ATOM 86 OE1 GLU A 77 -22.203 0.787 -24.371 1.00 0.00 O1- ATOM 87 OE2 GLU A 77 -20.989 -0.290 -22.890 1.00 0.00 O ATOM 0 H GLU A 77 -22.530 0.428 -20.396 1.00 0.00 H new ATOM 0 HA GLU A 77 -22.080 3.170 -20.032 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -23.604 1.631 -22.171 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -23.174 3.325 -22.303 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -21.120 2.812 -23.031 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -20.810 1.825 -21.616 1.00 0.00 H new ATOM 94 N ARG A 78 -24.146 3.990 -18.915 1.00 0.00 N ATOM 95 CA ARG A 78 -25.349 4.623 -18.384 1.00 0.00 C ATOM 96 C ARG A 78 -25.873 5.685 -19.343 1.00 0.00 C ATOM 97 O ARG A 78 -26.986 5.578 -19.856 1.00 0.00 O ATOM 98 CB ARG A 78 -25.059 5.250 -17.018 1.00 0.00 C ATOM 99 CG ARG A 78 -24.780 4.228 -15.927 1.00 0.00 C ATOM 100 CD ARG A 78 -25.462 4.605 -14.621 1.00 0.00 C ATOM 101 NE ARG A 78 -24.688 4.182 -13.457 1.00 0.00 N ATOM 102 CZ ARG A 78 -25.196 4.062 -12.233 1.00 0.00 C ATOM 103 NH1 ARG A 78 -26.476 4.333 -12.008 1.00 0.00 N1+ ATOM 104 NH2 ARG A 78 -24.422 3.671 -11.230 1.00 0.00 N ATOM 0 H ARG A 78 -23.277 4.307 -18.486 1.00 0.00 H new ATOM 0 HA ARG A 78 -26.114 3.855 -18.269 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -24.201 5.917 -17.108 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -25.910 5.863 -16.721 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -25.127 3.246 -16.250 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -23.705 4.149 -15.767 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -25.607 5.685 -14.587 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -26.451 4.149 -14.584 1.00 0.00 H new ATOM 0 HE ARG A 78 -23.700 3.966 -13.590 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -27.076 4.635 -12.776 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -26.860 4.239 -11.068 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -23.438 3.462 -11.397 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -24.811 3.579 -10.292 1.00 0.00 H new ATOM 118 N GLU A 79 -25.061 6.708 -19.583 1.00 0.00 N ATOM 119 CA GLU A 79 -25.436 7.790 -20.481 1.00 0.00 C ATOM 120 C GLU A 79 -24.229 8.664 -20.796 1.00 0.00 C ATOM 121 O GLU A 79 -24.368 9.847 -21.105 1.00 0.00 O ATOM 122 CB GLU A 79 -26.550 8.636 -19.860 1.00 0.00 C ATOM 123 CG GLU A 79 -27.646 9.016 -20.844 1.00 0.00 C ATOM 124 CD GLU A 79 -27.302 10.254 -21.649 1.00 0.00 C ATOM 125 OE1 GLU A 79 -26.684 10.110 -22.725 1.00 0.00 O ATOM 126 OE2 GLU A 79 -27.650 11.367 -21.203 1.00 0.00 O1- ATOM 0 H GLU A 79 -24.136 6.809 -19.166 1.00 0.00 H new ATOM 0 HA GLU A 79 -25.803 7.354 -21.410 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -26.993 8.086 -19.030 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -26.116 9.545 -19.444 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -27.824 8.183 -21.524 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -28.575 9.187 -20.300 1.00 0.00 H new ATOM 133 N ASP A 80 -23.040 8.071 -20.714 1.00 0.00 N ATOM 134 CA ASP A 80 -21.806 8.792 -20.989 1.00 0.00 C ATOM 135 C ASP A 80 -20.598 7.869 -20.872 1.00 0.00 C ATOM 136 O ASP A 80 -19.758 7.813 -21.770 1.00 0.00 O ATOM 137 CB ASP A 80 -21.654 9.976 -20.031 1.00 0.00 C ATOM 138 CG ASP A 80 -20.427 10.812 -20.335 1.00 0.00 C ATOM 139 OD1 ASP A 80 -20.185 11.100 -21.526 1.00 0.00 O ATOM 140 OD2 ASP A 80 -19.707 11.179 -19.382 1.00 0.00 O1- ATOM 0 H ASP A 80 -22.908 7.092 -20.459 1.00 0.00 H new ATOM 0 HA ASP A 80 -21.856 9.167 -22.011 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -22.542 10.605 -20.091 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -21.594 9.606 -19.007 1.00 0.00 H new ATOM 145 N LEU A 81 -20.517 7.148 -19.759 1.00 0.00 N ATOM 146 CA LEU A 81 -19.411 6.227 -19.523 1.00 0.00 C ATOM 147 C LEU A 81 -19.352 5.156 -20.607 1.00 0.00 C ATOM 148 O LEU A 81 -20.357 4.854 -21.252 1.00 0.00 O ATOM 149 CB LEU A 81 -19.552 5.570 -18.148 1.00 0.00 C ATOM 150 CG LEU A 81 -19.045 6.409 -16.975 1.00 0.00 C ATOM 151 CD1 LEU A 81 -17.569 6.731 -17.148 1.00 0.00 C ATOM 152 CD2 LEU A 81 -19.860 7.686 -16.842 1.00 0.00 C ATOM 0 H LEU A 81 -21.204 7.184 -19.006 1.00 0.00 H new ATOM 0 HA LEU A 81 -18.483 6.799 -19.552 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -20.603 5.336 -17.980 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -19.012 4.623 -18.158 1.00 0.00 H new ATOM 0 HG LEU A 81 -19.164 5.829 -16.060 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -17.226 7.329 -16.304 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -16.997 5.804 -17.193 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -17.425 7.291 -18.072 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -19.485 8.271 -16.002 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -19.773 8.270 -17.758 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -20.906 7.434 -16.670 1.00 0.00 H new ATOM 164 N GLU A 82 -18.169 4.584 -20.802 1.00 0.00 N ATOM 165 CA GLU A 82 -17.977 3.546 -21.808 1.00 0.00 C ATOM 166 C GLU A 82 -16.733 2.718 -21.504 1.00 0.00 C ATOM 167 O GLU A 82 -16.782 1.488 -21.482 1.00 0.00 O ATOM 168 CB GLU A 82 -17.863 4.169 -23.202 1.00 0.00 C ATOM 169 CG GLU A 82 -19.162 4.131 -23.992 1.00 0.00 C ATOM 170 CD GLU A 82 -19.020 4.740 -25.373 1.00 0.00 C ATOM 171 OE1 GLU A 82 -17.979 4.504 -26.022 1.00 0.00 O ATOM 172 OE2 GLU A 82 -19.951 5.451 -25.807 1.00 0.00 O1- ATOM 0 H GLU A 82 -17.328 4.822 -20.276 1.00 0.00 H new ATOM 0 HA GLU A 82 -18.845 2.887 -21.784 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -17.538 5.205 -23.103 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -17.090 3.644 -23.764 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -19.496 3.098 -24.087 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.935 4.666 -23.440 1.00 0.00 H new ATOM 179 N GLN A 83 -15.617 3.401 -21.269 1.00 0.00 N ATOM 180 CA GLN A 83 -14.358 2.729 -20.966 1.00 0.00 C ATOM 181 C GLN A 83 -14.078 2.751 -19.466 1.00 0.00 C ATOM 182 O GLN A 83 -14.480 3.678 -18.763 1.00 0.00 O ATOM 183 CB GLN A 83 -13.207 3.394 -21.721 1.00 0.00 C ATOM 184 CG GLN A 83 -12.126 2.419 -22.163 1.00 0.00 C ATOM 185 CD GLN A 83 -11.758 2.578 -23.625 1.00 0.00 C ATOM 186 OE1 GLN A 83 -10.646 2.987 -23.956 1.00 0.00 O ATOM 187 NE2 GLN A 83 -12.695 2.255 -24.510 1.00 0.00 N ATOM 0 H GLN A 83 -15.559 4.419 -21.283 1.00 0.00 H new ATOM 0 HA GLN A 83 -14.442 1.691 -21.287 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -13.605 3.904 -22.598 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -12.759 4.157 -21.085 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -11.237 2.567 -21.550 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -12.468 1.399 -21.987 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -13.604 1.920 -24.191 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -12.505 2.342 -25.508 1.00 0.00 H new ATOM 196 N GLU A 84 -13.387 1.724 -18.984 1.00 0.00 N ATOM 197 CA GLU A 84 -13.054 1.624 -17.568 1.00 0.00 C ATOM 198 C GLU A 84 -11.876 2.530 -17.221 1.00 0.00 C ATOM 199 O GLU A 84 -11.451 3.351 -18.033 1.00 0.00 O ATOM 200 CB GLU A 84 -12.725 0.176 -17.200 1.00 0.00 C ATOM 201 CG GLU A 84 -13.249 -0.239 -15.835 1.00 0.00 C ATOM 202 CD GLU A 84 -13.748 -1.671 -15.812 1.00 0.00 C ATOM 203 OE1 GLU A 84 -12.917 -2.586 -15.629 1.00 0.00 O1- ATOM 204 OE2 GLU A 84 -14.968 -1.877 -15.977 1.00 0.00 O ATOM 0 H GLU A 84 -13.047 0.949 -19.553 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.921 1.949 -16.993 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -13.144 -0.487 -17.957 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.644 0.041 -17.221 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -12.457 -0.122 -15.095 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.059 0.429 -15.543 1.00 0.00 H new ATOM 211 N TRP A 85 -11.352 2.373 -16.009 1.00 0.00 N ATOM 212 CA TRP A 85 -10.223 3.176 -15.553 1.00 0.00 C ATOM 213 C TRP A 85 -9.016 2.981 -16.460 1.00 0.00 C ATOM 214 O TRP A 85 -8.627 1.853 -16.755 1.00 0.00 O ATOM 215 CB TRP A 85 -9.850 2.801 -14.118 1.00 0.00 C ATOM 216 CG TRP A 85 -8.966 3.810 -13.447 1.00 0.00 C ATOM 217 CD1 TRP A 85 -8.793 5.119 -13.803 1.00 0.00 C ATOM 218 CD2 TRP A 85 -8.132 3.595 -12.301 1.00 0.00 C ATOM 219 NE1 TRP A 85 -7.908 5.727 -12.946 1.00 0.00 N ATOM 220 CE2 TRP A 85 -7.495 4.817 -12.018 1.00 0.00 C ATOM 221 CE3 TRP A 85 -7.862 2.493 -11.481 1.00 0.00 C ATOM 222 CZ2 TRP A 85 -6.614 4.968 -10.959 1.00 0.00 C ATOM 223 CZ3 TRP A 85 -6.981 2.655 -10.427 1.00 0.00 C ATOM 224 CH2 TRP A 85 -6.375 3.878 -10.180 1.00 0.00 C ATOM 0 H TRP A 85 -11.692 1.697 -15.325 1.00 0.00 H new ATOM 0 HA TRP A 85 -10.521 4.224 -15.587 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -10.762 2.683 -13.533 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.346 1.834 -14.123 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -9.281 5.604 -14.636 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -7.608 6.701 -12.996 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -8.331 1.538 -11.667 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -6.135 5.915 -10.759 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -6.761 1.815 -9.785 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -5.694 3.968 -9.346 1.00 0.00 H new ATOM 235 N LYS A 86 -8.422 4.089 -16.895 1.00 0.00 N ATOM 236 CA LYS A 86 -7.262 4.042 -17.758 1.00 0.00 C ATOM 237 C LYS A 86 -6.045 3.545 -16.980 1.00 0.00 C ATOM 238 O LYS A 86 -5.522 4.254 -16.121 1.00 0.00 O ATOM 239 CB LYS A 86 -6.981 5.426 -18.346 1.00 0.00 C ATOM 240 CG LYS A 86 -6.608 6.467 -17.303 1.00 0.00 C ATOM 241 CD LYS A 86 -7.078 7.856 -17.709 1.00 0.00 C ATOM 242 CE LYS A 86 -8.370 8.235 -17.004 1.00 0.00 C ATOM 243 NZ LYS A 86 -8.628 9.700 -17.066 1.00 0.00 N1+ ATOM 0 H LYS A 86 -8.732 5.031 -16.658 1.00 0.00 H new ATOM 0 HA LYS A 86 -7.464 3.349 -18.575 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.172 5.345 -19.072 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.863 5.767 -18.888 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.051 6.198 -16.344 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.527 6.474 -17.164 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.305 8.587 -17.472 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.228 7.890 -18.788 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -9.203 7.700 -17.461 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.321 7.919 -15.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.518 9.917 -16.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -7.846 10.210 -16.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.700 9.998 -18.060 1.00 0.00 H new ATOM 257 N PRO A 87 -5.580 2.313 -17.259 1.00 0.00 N ATOM 258 CA PRO A 87 -4.429 1.737 -16.561 1.00 0.00 C ATOM 259 C PRO A 87 -3.117 2.414 -16.947 1.00 0.00 C ATOM 260 O PRO A 87 -2.849 2.635 -18.129 1.00 0.00 O ATOM 261 CB PRO A 87 -4.419 0.266 -17.012 1.00 0.00 C ATOM 262 CG PRO A 87 -5.724 0.047 -17.705 1.00 0.00 C ATOM 263 CD PRO A 87 -6.133 1.383 -18.251 1.00 0.00 C ATOM 0 HA PRO A 87 -4.514 1.863 -15.482 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -3.582 0.067 -17.681 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -4.311 -0.404 -16.159 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.623 -0.687 -18.505 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.473 -0.337 -17.013 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.722 1.558 -19.245 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -7.216 1.474 -18.333 1.00 0.00 H new ATOM 271 N PRO A 88 -2.271 2.747 -15.955 1.00 0.00 N ATOM 272 CA PRO A 88 -0.980 3.390 -16.206 1.00 0.00 C ATOM 273 C PRO A 88 0.026 2.418 -16.812 1.00 0.00 C ATOM 274 O PRO A 88 -0.349 1.354 -17.305 1.00 0.00 O ATOM 275 CB PRO A 88 -0.531 3.830 -14.811 1.00 0.00 C ATOM 276 CG PRO A 88 -1.181 2.859 -13.888 1.00 0.00 C ATOM 277 CD PRO A 88 -2.504 2.516 -14.514 1.00 0.00 C ATOM 0 HA PRO A 88 -1.054 4.211 -16.919 1.00 0.00 H new ATOM 0 HB2 PRO A 88 0.555 3.803 -14.716 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -0.844 4.852 -14.597 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -0.566 1.968 -13.762 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -1.319 3.294 -12.898 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -2.788 1.483 -14.313 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -3.306 3.147 -14.130 1.00 0.00 H new ATOM 285 N ASP A 89 1.304 2.779 -16.765 1.00 0.00 N ATOM 286 CA ASP A 89 2.348 1.938 -17.293 1.00 0.00 C ATOM 287 C ASP A 89 3.078 1.245 -16.158 1.00 0.00 C ATOM 288 O ASP A 89 3.255 1.814 -15.081 1.00 0.00 O ATOM 289 CB ASP A 89 3.329 2.761 -18.129 1.00 0.00 C ATOM 290 CG ASP A 89 2.632 3.599 -19.183 1.00 0.00 C ATOM 291 OD1 ASP A 89 1.693 3.084 -19.825 1.00 0.00 O1- ATOM 292 OD2 ASP A 89 3.024 4.771 -19.364 1.00 0.00 O ATOM 0 H ASP A 89 1.633 3.656 -16.362 1.00 0.00 H new ATOM 0 HA ASP A 89 1.896 1.184 -17.937 1.00 0.00 H new ATOM 0 HB2 ASP A 89 3.903 3.414 -17.472 1.00 0.00 H new ATOM 0 HB3 ASP A 89 4.040 2.091 -18.613 1.00 0.00 H new ATOM 297 N GLU A 90 3.504 0.018 -16.404 1.00 0.00 N ATOM 298 CA GLU A 90 4.217 -0.757 -15.408 1.00 0.00 C ATOM 299 C GLU A 90 5.408 0.022 -14.854 1.00 0.00 C ATOM 300 O GLU A 90 5.913 -0.286 -13.776 1.00 0.00 O ATOM 301 CB GLU A 90 4.692 -2.071 -16.015 1.00 0.00 C ATOM 302 CG GLU A 90 5.261 -1.932 -17.419 1.00 0.00 C ATOM 303 CD GLU A 90 4.289 -2.389 -18.488 1.00 0.00 C ATOM 304 OE1 GLU A 90 3.553 -3.367 -18.243 1.00 0.00 O ATOM 305 OE2 GLU A 90 4.263 -1.767 -19.571 1.00 0.00 O1- ATOM 0 H GLU A 90 3.366 -0.464 -17.292 1.00 0.00 H new ATOM 0 HA GLU A 90 3.534 -0.965 -14.585 1.00 0.00 H new ATOM 0 HB2 GLU A 90 5.453 -2.505 -15.367 1.00 0.00 H new ATOM 0 HB3 GLU A 90 3.857 -2.771 -16.040 1.00 0.00 H new ATOM 0 HG2 GLU A 90 5.529 -0.891 -17.597 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.179 -2.515 -17.495 1.00 0.00 H new ATOM 312 N GLU A 91 5.848 1.040 -15.592 1.00 0.00 N ATOM 313 CA GLU A 91 6.969 1.865 -15.162 1.00 0.00 C ATOM 314 C GLU A 91 6.721 2.404 -13.760 1.00 0.00 C ATOM 315 O GLU A 91 7.586 2.332 -12.886 1.00 0.00 O ATOM 316 CB GLU A 91 7.165 3.032 -16.128 1.00 0.00 C ATOM 317 CG GLU A 91 7.471 2.599 -17.553 1.00 0.00 C ATOM 318 CD GLU A 91 8.957 2.572 -17.848 1.00 0.00 C ATOM 319 OE1 GLU A 91 9.623 1.591 -17.455 1.00 0.00 O1- ATOM 320 OE2 GLU A 91 9.456 3.532 -18.473 1.00 0.00 O ATOM 0 H GLU A 91 5.444 1.311 -16.489 1.00 0.00 H new ATOM 0 HA GLU A 91 7.868 1.248 -15.155 1.00 0.00 H new ATOM 0 HB2 GLU A 91 6.265 3.646 -16.129 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.979 3.660 -15.765 1.00 0.00 H new ATOM 0 HG2 GLU A 91 7.052 1.608 -17.725 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.979 3.278 -18.249 1.00 0.00 H new ATOM 327 N LEU A 92 5.527 2.943 -13.563 1.00 0.00 N ATOM 328 CA LEU A 92 5.139 3.503 -12.280 1.00 0.00 C ATOM 329 C LEU A 92 4.684 2.410 -11.316 1.00 0.00 C ATOM 330 O LEU A 92 4.825 2.549 -10.101 1.00 0.00 O ATOM 331 CB LEU A 92 4.026 4.530 -12.479 1.00 0.00 C ATOM 332 CG LEU A 92 3.730 5.417 -11.267 1.00 0.00 C ATOM 333 CD1 LEU A 92 3.044 4.618 -10.171 1.00 0.00 C ATOM 334 CD2 LEU A 92 5.014 6.050 -10.746 1.00 0.00 C ATOM 0 H LEU A 92 4.806 3.004 -14.282 1.00 0.00 H new ATOM 0 HA LEU A 92 6.008 3.994 -11.843 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.291 5.170 -13.321 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.113 4.003 -12.754 1.00 0.00 H new ATOM 0 HG LEU A 92 3.055 6.213 -11.580 1.00 0.00 H new ATOM 0 HD11 LEU A 92 2.843 5.267 -9.319 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.105 4.214 -10.549 1.00 0.00 H new ATOM 0 HD13 LEU A 92 3.692 3.799 -9.858 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.787 6.678 -9.884 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.712 5.267 -10.450 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.463 6.659 -11.530 1.00 0.00 H new ATOM 346 N ILE A 93 4.141 1.322 -11.858 1.00 0.00 N ATOM 347 CA ILE A 93 3.674 0.218 -11.030 1.00 0.00 C ATOM 348 C ILE A 93 4.847 -0.555 -10.441 1.00 0.00 C ATOM 349 O ILE A 93 4.801 -0.988 -9.290 1.00 0.00 O ATOM 350 CB ILE A 93 2.778 -0.737 -11.840 1.00 0.00 C ATOM 351 CG1 ILE A 93 1.623 0.043 -12.466 1.00 0.00 C ATOM 352 CG2 ILE A 93 2.250 -1.861 -10.957 1.00 0.00 C ATOM 353 CD1 ILE A 93 0.745 -0.795 -13.365 1.00 0.00 C ATOM 0 H ILE A 93 4.015 1.184 -12.861 1.00 0.00 H new ATOM 0 HA ILE A 93 3.088 0.644 -10.215 1.00 0.00 H new ATOM 0 HB ILE A 93 3.373 -1.186 -12.635 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.012 0.471 -11.671 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.027 0.876 -13.041 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.619 -2.524 -11.550 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.087 -2.427 -10.548 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.665 -1.438 -10.140 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.053 -0.176 -13.774 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.343 -1.202 -14.181 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.311 -1.613 -12.790 1.00 0.00 H new ATOM 365 N LYS A 94 5.900 -0.716 -11.233 1.00 0.00 N ATOM 366 CA LYS A 94 7.088 -1.430 -10.781 1.00 0.00 C ATOM 367 C LYS A 94 7.829 -0.609 -9.731 1.00 0.00 C ATOM 368 O LYS A 94 8.431 -1.160 -8.811 1.00 0.00 O ATOM 369 CB LYS A 94 8.011 -1.735 -11.962 1.00 0.00 C ATOM 370 CG LYS A 94 7.905 -3.168 -12.459 1.00 0.00 C ATOM 371 CD LYS A 94 6.567 -3.428 -13.132 1.00 0.00 C ATOM 372 CE LYS A 94 5.557 -4.009 -12.156 1.00 0.00 C ATOM 373 NZ LYS A 94 6.068 -5.242 -11.497 1.00 0.00 N1+ ATOM 0 H LYS A 94 5.956 -0.363 -12.188 1.00 0.00 H new ATOM 0 HA LYS A 94 6.776 -2.373 -10.333 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.776 -1.056 -12.782 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.042 -1.536 -11.669 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.713 -3.371 -13.163 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.032 -3.855 -11.622 1.00 0.00 H new ATOM 0 HD2 LYS A 94 6.180 -2.497 -13.547 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.706 -4.116 -13.966 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.316 -3.265 -11.397 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.631 -4.237 -12.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 5.267 -5.838 -11.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.667 -5.769 -12.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.628 -4.982 -10.660 1.00 0.00 H new ATOM 387 N LYS A 95 7.769 0.713 -9.868 1.00 0.00 N ATOM 388 CA LYS A 95 8.423 1.605 -8.920 1.00 0.00 C ATOM 389 C LYS A 95 7.728 1.523 -7.567 1.00 0.00 C ATOM 390 O LYS A 95 8.373 1.352 -6.532 1.00 0.00 O ATOM 391 CB LYS A 95 8.398 3.046 -9.437 1.00 0.00 C ATOM 392 CG LYS A 95 9.657 3.441 -10.196 1.00 0.00 C ATOM 393 CD LYS A 95 10.441 4.515 -9.457 1.00 0.00 C ATOM 394 CE LYS A 95 11.939 4.286 -9.569 1.00 0.00 C ATOM 395 NZ LYS A 95 12.704 5.560 -9.473 1.00 0.00 N1+ ATOM 0 H LYS A 95 7.275 1.187 -10.624 1.00 0.00 H new ATOM 0 HA LYS A 95 9.462 1.295 -8.807 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.535 3.174 -10.090 1.00 0.00 H new ATOM 0 HB3 LYS A 95 8.264 3.724 -8.594 1.00 0.00 H new ATOM 0 HG2 LYS A 95 10.287 2.563 -10.339 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.386 3.804 -11.187 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.190 5.495 -9.863 1.00 0.00 H new ATOM 0 HD3 LYS A 95 10.150 4.522 -8.407 1.00 0.00 H new ATOM 0 HE2 LYS A 95 12.263 3.608 -8.779 1.00 0.00 H new ATOM 0 HE3 LYS A 95 12.162 3.799 -10.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 13.722 5.361 -9.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 12.414 6.198 -10.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 12.512 6.012 -8.556 1.00 0.00 H new ATOM 409 N LEU A 96 6.404 1.630 -7.591 1.00 0.00 N ATOM 410 CA LEU A 96 5.600 1.552 -6.378 1.00 0.00 C ATOM 411 C LEU A 96 5.887 0.257 -5.629 1.00 0.00 C ATOM 412 O LEU A 96 6.315 0.267 -4.474 1.00 0.00 O ATOM 413 CB LEU A 96 4.115 1.613 -6.738 1.00 0.00 C ATOM 414 CG LEU A 96 3.386 2.854 -6.261 1.00 0.00 C ATOM 415 CD1 LEU A 96 2.244 3.197 -7.205 1.00 0.00 C ATOM 416 CD2 LEU A 96 2.875 2.650 -4.843 1.00 0.00 C ATOM 0 H LEU A 96 5.862 1.772 -8.444 1.00 0.00 H new ATOM 0 HA LEU A 96 5.857 2.395 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.017 1.548 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.620 0.737 -6.320 1.00 0.00 H new ATOM 0 HG LEU A 96 4.084 3.691 -6.258 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.732 4.090 -6.847 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.640 3.381 -8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.540 2.366 -7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.353 3.548 -4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.189 1.803 -4.822 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.716 2.453 -4.178 1.00 0.00 H new ATOM 428 N VAL A 97 5.636 -0.856 -6.306 1.00 0.00 N ATOM 429 CA VAL A 97 5.851 -2.173 -5.728 1.00 0.00 C ATOM 430 C VAL A 97 7.276 -2.324 -5.199 1.00 0.00 C ATOM 431 O VAL A 97 7.519 -3.066 -4.247 1.00 0.00 O ATOM 432 CB VAL A 97 5.558 -3.279 -6.760 1.00 0.00 C ATOM 433 CG1 VAL A 97 6.636 -3.327 -7.833 1.00 0.00 C ATOM 434 CG2 VAL A 97 5.418 -4.622 -6.068 1.00 0.00 C ATOM 0 H VAL A 97 5.281 -0.871 -7.262 1.00 0.00 H new ATOM 0 HA VAL A 97 5.160 -2.276 -4.891 1.00 0.00 H new ATOM 0 HB VAL A 97 4.614 -3.046 -7.253 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.403 -4.117 -8.547 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.676 -2.369 -8.351 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.602 -3.530 -7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.211 -5.394 -6.810 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.344 -4.860 -5.545 1.00 0.00 H new ATOM 0 HG23 VAL A 97 4.598 -4.578 -5.351 1.00 0.00 H new ATOM 444 N ASP A 98 8.213 -1.613 -5.818 1.00 0.00 N ATOM 445 CA ASP A 98 9.609 -1.668 -5.404 1.00 0.00 C ATOM 446 C ASP A 98 9.769 -1.133 -3.985 1.00 0.00 C ATOM 447 O ASP A 98 10.628 -1.590 -3.231 1.00 0.00 O ATOM 448 CB ASP A 98 10.486 -0.864 -6.366 1.00 0.00 C ATOM 449 CG ASP A 98 11.770 -1.588 -6.722 1.00 0.00 C ATOM 450 OD1 ASP A 98 12.400 -2.162 -5.808 1.00 0.00 O1- ATOM 451 OD2 ASP A 98 12.145 -1.581 -7.913 1.00 0.00 O ATOM 0 H ASP A 98 8.031 -0.993 -6.607 1.00 0.00 H new ATOM 0 HA ASP A 98 9.928 -2.710 -5.424 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.925 -0.656 -7.277 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.728 0.098 -5.914 1.00 0.00 H new ATOM 456 N GLN A 99 8.933 -0.163 -3.629 1.00 0.00 N ATOM 457 CA GLN A 99 8.977 0.433 -2.302 1.00 0.00 C ATOM 458 C GLN A 99 8.504 -0.562 -1.249 1.00 0.00 C ATOM 459 O GLN A 99 9.047 -0.619 -0.145 1.00 0.00 O ATOM 460 CB GLN A 99 8.113 1.694 -2.256 1.00 0.00 C ATOM 461 CG GLN A 99 8.882 2.970 -2.563 1.00 0.00 C ATOM 462 CD GLN A 99 9.989 3.237 -1.563 1.00 0.00 C ATOM 463 OE1 GLN A 99 9.779 3.903 -0.550 1.00 0.00 O ATOM 464 NE2 GLN A 99 11.180 2.719 -1.846 1.00 0.00 N ATOM 0 H GLN A 99 8.217 0.226 -4.243 1.00 0.00 H new ATOM 0 HA GLN A 99 10.010 0.704 -2.084 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.296 1.591 -2.970 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.663 1.780 -1.267 1.00 0.00 H new ATOM 0 HG2 GLN A 99 9.310 2.901 -3.563 1.00 0.00 H new ATOM 0 HG3 GLN A 99 8.192 3.813 -2.569 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.309 2.173 -2.698 1.00 0.00 H new ATOM 0 HE22 GLN A 99 11.965 2.868 -1.211 1.00 0.00 H new ATOM 473 N ILE A 100 7.488 -1.346 -1.597 1.00 0.00 N ATOM 474 CA ILE A 100 6.945 -2.338 -0.681 1.00 0.00 C ATOM 475 C ILE A 100 7.985 -3.384 -0.342 1.00 0.00 C ATOM 476 O ILE A 100 8.404 -3.517 0.808 1.00 0.00 O ATOM 477 CB ILE A 100 5.715 -3.051 -1.274 1.00 0.00 C ATOM 478 CG1 ILE A 100 4.845 -2.082 -2.079 1.00 0.00 C ATOM 479 CG2 ILE A 100 4.904 -3.690 -0.164 1.00 0.00 C ATOM 480 CD1 ILE A 100 4.573 -0.781 -1.361 1.00 0.00 C ATOM 0 H ILE A 100 7.026 -1.312 -2.506 1.00 0.00 H new ATOM 0 HA ILE A 100 6.647 -1.800 0.219 1.00 0.00 H new ATOM 0 HB ILE A 100 6.066 -3.827 -1.954 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.335 -1.868 -3.029 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.896 -2.565 -2.312 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.036 -4.192 -0.591 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.520 -4.417 0.365 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.572 -2.921 0.533 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.951 -0.142 -1.988 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.055 -0.984 -0.424 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.516 -0.277 -1.152 1.00 0.00 H new ATOM 492 N GLU A 101 8.413 -4.116 -1.359 1.00 0.00 N ATOM 493 CA GLU A 101 9.429 -5.150 -1.178 1.00 0.00 C ATOM 494 C GLU A 101 10.608 -4.598 -0.383 1.00 0.00 C ATOM 495 O GLU A 101 11.341 -5.343 0.268 1.00 0.00 O ATOM 496 CB GLU A 101 9.908 -5.673 -2.535 1.00 0.00 C ATOM 497 CG GLU A 101 10.643 -7.000 -2.450 1.00 0.00 C ATOM 498 CD GLU A 101 11.440 -7.306 -3.702 1.00 0.00 C ATOM 499 OE1 GLU A 101 12.533 -6.724 -3.868 1.00 0.00 O ATOM 500 OE2 GLU A 101 10.971 -8.128 -4.518 1.00 0.00 O1- ATOM 0 H GLU A 101 8.076 -4.016 -2.317 1.00 0.00 H new ATOM 0 HA GLU A 101 8.986 -5.977 -0.623 1.00 0.00 H new ATOM 0 HB2 GLU A 101 9.048 -5.785 -3.196 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.565 -4.932 -2.989 1.00 0.00 H new ATOM 0 HG2 GLU A 101 11.314 -6.985 -1.591 1.00 0.00 H new ATOM 0 HG3 GLU A 101 9.923 -7.800 -2.278 1.00 0.00 H new ATOM 507 N PHE A 102 10.763 -3.278 -0.426 1.00 0.00 N ATOM 508 CA PHE A 102 11.826 -2.599 0.302 1.00 0.00 C ATOM 509 C PHE A 102 11.378 -2.332 1.731 1.00 0.00 C ATOM 510 O PHE A 102 12.123 -2.535 2.689 1.00 0.00 O ATOM 511 CB PHE A 102 12.171 -1.281 -0.397 1.00 0.00 C ATOM 512 CG PHE A 102 12.921 -0.302 0.465 1.00 0.00 C ATOM 513 CD1 PHE A 102 12.245 0.484 1.386 1.00 0.00 C ATOM 514 CD2 PHE A 102 14.295 -0.169 0.354 1.00 0.00 C ATOM 515 CE1 PHE A 102 12.928 1.386 2.179 1.00 0.00 C ATOM 516 CE2 PHE A 102 14.983 0.730 1.146 1.00 0.00 C ATOM 517 CZ PHE A 102 14.299 1.509 2.060 1.00 0.00 C ATOM 0 H PHE A 102 10.160 -2.655 -0.962 1.00 0.00 H new ATOM 0 HA PHE A 102 12.713 -3.232 0.321 1.00 0.00 H new ATOM 0 HB2 PHE A 102 12.767 -1.498 -1.283 1.00 0.00 H new ATOM 0 HB3 PHE A 102 11.249 -0.813 -0.740 1.00 0.00 H new ATOM 0 HD1 PHE A 102 11.174 0.390 1.484 1.00 0.00 H new ATOM 0 HD2 PHE A 102 14.834 -0.774 -0.359 1.00 0.00 H new ATOM 0 HE1 PHE A 102 12.391 1.994 2.891 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.055 0.824 1.051 1.00 0.00 H new ATOM 0 HZ PHE A 102 14.835 2.212 2.680 1.00 0.00 H new ATOM 527 N TYR A 103 10.145 -1.865 1.849 1.00 0.00 N ATOM 528 CA TYR A 103 9.547 -1.546 3.137 1.00 0.00 C ATOM 529 C TYR A 103 9.591 -2.750 4.077 1.00 0.00 C ATOM 530 O TYR A 103 10.091 -2.664 5.198 1.00 0.00 O ATOM 531 CB TYR A 103 8.096 -1.083 2.929 1.00 0.00 C ATOM 532 CG TYR A 103 7.051 -2.000 3.538 1.00 0.00 C ATOM 533 CD1 TYR A 103 6.779 -1.948 4.895 1.00 0.00 C ATOM 534 CD2 TYR A 103 6.348 -2.919 2.766 1.00 0.00 C ATOM 535 CE1 TYR A 103 5.842 -2.776 5.471 1.00 0.00 C ATOM 536 CE2 TYR A 103 5.405 -3.755 3.335 1.00 0.00 C ATOM 537 CZ TYR A 103 5.156 -3.679 4.688 1.00 0.00 C ATOM 538 OH TYR A 103 4.219 -4.509 5.261 1.00 0.00 O ATOM 0 H TYR A 103 9.529 -1.696 1.054 1.00 0.00 H new ATOM 0 HA TYR A 103 10.121 -0.742 3.598 1.00 0.00 H new ATOM 0 HB2 TYR A 103 7.981 -0.087 3.356 1.00 0.00 H new ATOM 0 HB3 TYR A 103 7.905 -0.995 1.859 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.313 -1.243 5.514 1.00 0.00 H new ATOM 0 HD2 TYR A 103 6.542 -2.981 1.705 1.00 0.00 H new ATOM 0 HE1 TYR A 103 5.646 -2.718 6.531 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.867 -4.463 2.723 1.00 0.00 H new ATOM 0 HH TYR A 103 3.826 -5.084 4.571 1.00 0.00 H new ATOM 548 N PHE A 104 9.034 -3.861 3.611 1.00 0.00 N ATOM 549 CA PHE A 104 8.969 -5.084 4.403 1.00 0.00 C ATOM 550 C PHE A 104 10.331 -5.765 4.559 1.00 0.00 C ATOM 551 O PHE A 104 10.429 -6.814 5.195 1.00 0.00 O ATOM 552 CB PHE A 104 7.955 -6.048 3.774 1.00 0.00 C ATOM 553 CG PHE A 104 7.935 -7.418 4.391 1.00 0.00 C ATOM 554 CD1 PHE A 104 7.913 -7.575 5.768 1.00 0.00 C ATOM 555 CD2 PHE A 104 7.935 -8.550 3.591 1.00 0.00 C ATOM 556 CE1 PHE A 104 7.892 -8.836 6.334 1.00 0.00 C ATOM 557 CE2 PHE A 104 7.914 -9.811 4.151 1.00 0.00 C ATOM 558 CZ PHE A 104 7.892 -9.955 5.525 1.00 0.00 C ATOM 0 H PHE A 104 8.618 -3.941 2.683 1.00 0.00 H new ATOM 0 HA PHE A 104 8.647 -4.807 5.407 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.959 -5.612 3.855 1.00 0.00 H new ATOM 0 HB3 PHE A 104 8.175 -6.145 2.711 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.912 -6.703 6.405 1.00 0.00 H new ATOM 0 HD2 PHE A 104 7.952 -8.444 2.516 1.00 0.00 H new ATOM 0 HE1 PHE A 104 7.876 -8.946 7.408 1.00 0.00 H new ATOM 0 HE2 PHE A 104 7.915 -10.685 3.516 1.00 0.00 H new ATOM 0 HZ PHE A 104 7.875 -10.941 5.965 1.00 0.00 H new ATOM 568 N SER A 105 11.384 -5.171 4.016 1.00 0.00 N ATOM 569 CA SER A 105 12.714 -5.755 4.157 1.00 0.00 C ATOM 570 C SER A 105 13.070 -5.874 5.640 1.00 0.00 C ATOM 571 O SER A 105 12.975 -4.900 6.381 1.00 0.00 O ATOM 572 CB SER A 105 13.757 -4.902 3.432 1.00 0.00 C ATOM 573 OG SER A 105 13.683 -5.087 2.030 1.00 0.00 O ATOM 0 H SER A 105 11.348 -4.302 3.483 1.00 0.00 H new ATOM 0 HA SER A 105 12.711 -6.748 3.707 1.00 0.00 H new ATOM 0 HB2 SER A 105 13.601 -3.850 3.672 1.00 0.00 H new ATOM 0 HB3 SER A 105 14.754 -5.165 3.784 1.00 0.00 H new ATOM 0 HG SER A 105 12.743 -5.119 1.753 1.00 0.00 H new ATOM 579 N ASP A 106 13.463 -7.075 6.069 1.00 0.00 N ATOM 580 CA ASP A 106 13.818 -7.326 7.473 1.00 0.00 C ATOM 581 C ASP A 106 14.584 -6.148 8.083 1.00 0.00 C ATOM 582 O ASP A 106 14.127 -5.510 9.037 1.00 0.00 O ATOM 583 CB ASP A 106 14.678 -8.587 7.573 1.00 0.00 C ATOM 584 CG ASP A 106 14.793 -9.098 8.995 1.00 0.00 C ATOM 585 OD1 ASP A 106 13.915 -8.766 9.819 1.00 0.00 O ATOM 586 OD2 ASP A 106 15.762 -9.830 9.286 1.00 0.00 O1- ATOM 0 H ASP A 106 13.545 -7.893 5.465 1.00 0.00 H new ATOM 0 HA ASP A 106 12.890 -7.457 8.029 1.00 0.00 H new ATOM 0 HB2 ASP A 106 14.249 -9.367 6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.674 -8.376 7.184 1.00 0.00 H new ATOM 591 N GLU A 107 15.752 -5.870 7.519 1.00 0.00 N ATOM 592 CA GLU A 107 16.597 -4.777 7.985 1.00 0.00 C ATOM 593 C GLU A 107 15.878 -3.438 7.883 1.00 0.00 C ATOM 594 O GLU A 107 16.265 -2.462 8.525 1.00 0.00 O ATOM 595 CB GLU A 107 17.873 -4.725 7.155 1.00 0.00 C ATOM 596 CG GLU A 107 18.734 -5.965 7.295 1.00 0.00 C ATOM 597 CD GLU A 107 19.441 -6.037 8.634 1.00 0.00 C ATOM 598 OE1 GLU A 107 18.748 -6.138 9.668 1.00 0.00 O ATOM 599 OE2 GLU A 107 20.690 -5.992 8.650 1.00 0.00 O1- ATOM 0 H GLU A 107 16.139 -6.391 6.732 1.00 0.00 H new ATOM 0 HA GLU A 107 16.837 -4.961 9.032 1.00 0.00 H new ATOM 0 HB2 GLU A 107 17.610 -4.591 6.106 1.00 0.00 H new ATOM 0 HB3 GLU A 107 18.455 -3.852 7.451 1.00 0.00 H new ATOM 0 HG2 GLU A 107 18.112 -6.851 7.169 1.00 0.00 H new ATOM 0 HG3 GLU A 107 19.475 -5.980 6.496 1.00 0.00 H new ATOM 606 N ASN A 108 14.837 -3.404 7.069 1.00 0.00 N ATOM 607 CA ASN A 108 14.061 -2.192 6.870 1.00 0.00 C ATOM 608 C ASN A 108 12.907 -2.126 7.856 1.00 0.00 C ATOM 609 O ASN A 108 12.423 -1.046 8.183 1.00 0.00 O ATOM 610 CB ASN A 108 13.533 -2.124 5.436 1.00 0.00 C ATOM 611 CG ASN A 108 13.100 -0.725 5.046 1.00 0.00 C ATOM 612 OD1 ASN A 108 13.922 0.106 4.660 1.00 0.00 O ATOM 613 ND2 ASN A 108 11.803 -0.456 5.147 1.00 0.00 N ATOM 0 H ASN A 108 14.508 -4.207 6.532 1.00 0.00 H new ATOM 0 HA ASN A 108 14.715 -1.337 7.044 1.00 0.00 H new ATOM 0 HB2 ASN A 108 14.308 -2.466 4.750 1.00 0.00 H new ATOM 0 HB3 ASN A 108 12.689 -2.806 5.330 1.00 0.00 H new ATOM 0 HD21 ASN A 108 11.453 0.470 4.900 1.00 0.00 H new ATOM 0 HD22 ASN A 108 11.157 -1.175 5.472 1.00 0.00 H new ATOM 620 N LEU A 109 12.482 -3.288 8.349 1.00 0.00 N ATOM 621 CA LEU A 109 11.410 -3.359 9.306 1.00 0.00 C ATOM 622 C LEU A 109 11.772 -2.559 10.523 1.00 0.00 C ATOM 623 O LEU A 109 11.016 -1.695 10.968 1.00 0.00 O ATOM 624 CB LEU A 109 11.174 -4.800 9.684 1.00 0.00 C ATOM 625 CG LEU A 109 10.141 -5.518 8.838 1.00 0.00 C ATOM 626 CD1 LEU A 109 8.811 -5.508 9.561 1.00 0.00 C ATOM 627 CD2 LEU A 109 9.999 -4.882 7.466 1.00 0.00 C ATOM 0 H LEU A 109 12.876 -4.193 8.091 1.00 0.00 H new ATOM 0 HA LEU A 109 10.499 -2.949 8.871 1.00 0.00 H new ATOM 0 HB2 LEU A 109 12.119 -5.339 9.614 1.00 0.00 H new ATOM 0 HB3 LEU A 109 10.861 -4.841 10.727 1.00 0.00 H new ATOM 0 HG LEU A 109 10.473 -6.545 8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 109 8.064 -6.023 8.957 1.00 0.00 H new ATOM 0 HD12 LEU A 109 8.914 -6.015 10.520 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.495 -4.478 9.728 1.00 0.00 H new ATOM 0 HD21 LEU A 109 9.250 -5.424 6.889 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.689 -3.843 7.577 1.00 0.00 H new ATOM 0 HD23 LEU A 109 10.956 -4.922 6.946 1.00 0.00 H new ATOM 639 N GLU A 110 12.957 -2.832 11.047 1.00 0.00 N ATOM 640 CA GLU A 110 13.438 -2.117 12.189 1.00 0.00 C ATOM 641 C GLU A 110 13.356 -0.615 11.927 1.00 0.00 C ATOM 642 O GLU A 110 13.317 0.196 12.851 1.00 0.00 O ATOM 643 CB GLU A 110 14.880 -2.509 12.525 1.00 0.00 C ATOM 644 CG GLU A 110 15.299 -3.900 12.073 1.00 0.00 C ATOM 645 CD GLU A 110 16.730 -4.226 12.450 1.00 0.00 C ATOM 646 OE1 GLU A 110 17.528 -3.281 12.626 1.00 0.00 O1- ATOM 647 OE2 GLU A 110 17.055 -5.426 12.571 1.00 0.00 O ATOM 0 H GLU A 110 13.593 -3.545 10.691 1.00 0.00 H new ATOM 0 HA GLU A 110 12.811 -2.376 13.042 1.00 0.00 H new ATOM 0 HB2 GLU A 110 15.552 -1.780 12.072 1.00 0.00 H new ATOM 0 HB3 GLU A 110 15.016 -2.440 13.604 1.00 0.00 H new ATOM 0 HG2 GLU A 110 14.632 -4.639 12.517 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.185 -3.977 10.992 1.00 0.00 H new ATOM 654 N LYS A 111 13.339 -0.268 10.641 1.00 0.00 N ATOM 655 CA LYS A 111 13.272 1.113 10.203 1.00 0.00 C ATOM 656 C LYS A 111 12.005 1.383 9.395 1.00 0.00 C ATOM 657 O LYS A 111 11.953 2.335 8.617 1.00 0.00 O ATOM 658 CB LYS A 111 14.494 1.413 9.345 1.00 0.00 C ATOM 659 CG LYS A 111 15.684 1.918 10.139 1.00 0.00 C ATOM 660 CD LYS A 111 15.379 3.242 10.822 1.00 0.00 C ATOM 661 CE LYS A 111 15.036 3.050 12.291 1.00 0.00 C ATOM 662 NZ LYS A 111 13.775 3.751 12.664 1.00 0.00 N1+ ATOM 0 H LYS A 111 13.372 -0.943 9.877 1.00 0.00 H new ATOM 0 HA LYS A 111 13.251 1.756 11.083 1.00 0.00 H new ATOM 0 HB2 LYS A 111 14.783 0.509 8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 111 14.227 2.157 8.594 1.00 0.00 H new ATOM 0 HG2 LYS A 111 15.963 1.177 10.888 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.540 2.039 9.475 1.00 0.00 H new ATOM 0 HD2 LYS A 111 16.240 3.905 10.733 1.00 0.00 H new ATOM 0 HD3 LYS A 111 14.547 3.730 10.315 1.00 0.00 H new ATOM 0 HE2 LYS A 111 14.936 1.986 12.504 1.00 0.00 H new ATOM 0 HE3 LYS A 111 15.854 3.423 12.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 13.324 3.255 13.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 13.991 4.729 12.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 13.128 3.759 11.850 1.00 0.00 H new ATOM 676 N ASP A 112 10.997 0.529 9.550 1.00 0.00 N ATOM 677 CA ASP A 112 9.760 0.685 8.792 1.00 0.00 C ATOM 678 C ASP A 112 8.523 0.509 9.661 1.00 0.00 C ATOM 679 O ASP A 112 7.559 -0.169 9.284 1.00 0.00 O ATOM 680 CB ASP A 112 9.739 -0.308 7.646 1.00 0.00 C ATOM 681 CG ASP A 112 8.763 0.092 6.570 1.00 0.00 C ATOM 682 OD1 ASP A 112 7.590 0.340 6.906 1.00 0.00 O ATOM 683 OD2 ASP A 112 9.170 0.161 5.391 1.00 0.00 O1- ATOM 0 H ASP A 112 11.011 -0.269 10.186 1.00 0.00 H new ATOM 0 HA ASP A 112 9.735 1.703 8.403 1.00 0.00 H new ATOM 0 HB2 ASP A 112 10.738 -0.388 7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.475 -1.295 8.026 1.00 0.00 H new ATOM 688 N ALA A 113 8.548 1.142 10.813 1.00 0.00 N ATOM 689 CA ALA A 113 7.427 1.085 11.736 1.00 0.00 C ATOM 690 C ALA A 113 6.272 1.965 11.249 1.00 0.00 C ATOM 691 O ALA A 113 5.188 1.956 11.832 1.00 0.00 O ATOM 692 CB ALA A 113 7.872 1.496 13.129 1.00 0.00 C ATOM 0 H ALA A 113 9.334 1.705 11.137 1.00 0.00 H new ATOM 0 HA ALA A 113 7.066 0.057 11.778 1.00 0.00 H new ATOM 0 HB1 ALA A 113 7.023 1.449 13.811 1.00 0.00 H new ATOM 0 HB2 ALA A 113 8.654 0.820 13.476 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.259 2.514 13.102 1.00 0.00 H new ATOM 698 N PHE A 114 6.510 2.722 10.175 1.00 0.00 N ATOM 699 CA PHE A 114 5.489 3.602 9.611 1.00 0.00 C ATOM 700 C PHE A 114 4.436 2.805 8.845 1.00 0.00 C ATOM 701 O PHE A 114 3.262 3.165 8.828 1.00 0.00 O ATOM 702 CB PHE A 114 6.130 4.642 8.685 1.00 0.00 C ATOM 703 CG PHE A 114 7.099 4.057 7.695 1.00 0.00 C ATOM 704 CD1 PHE A 114 6.656 3.245 6.664 1.00 0.00 C ATOM 705 CD2 PHE A 114 8.457 4.314 7.803 1.00 0.00 C ATOM 706 CE1 PHE A 114 7.545 2.703 5.756 1.00 0.00 C ATOM 707 CE2 PHE A 114 9.353 3.775 6.899 1.00 0.00 C ATOM 708 CZ PHE A 114 8.895 2.969 5.874 1.00 0.00 C ATOM 0 H PHE A 114 7.402 2.742 9.680 1.00 0.00 H new ATOM 0 HA PHE A 114 4.998 4.114 10.438 1.00 0.00 H new ATOM 0 HB2 PHE A 114 5.343 5.166 8.143 1.00 0.00 H new ATOM 0 HB3 PHE A 114 6.648 5.385 9.292 1.00 0.00 H new ATOM 0 HD1 PHE A 114 5.601 3.033 6.569 1.00 0.00 H new ATOM 0 HD2 PHE A 114 8.819 4.943 8.603 1.00 0.00 H new ATOM 0 HE1 PHE A 114 7.185 2.073 4.956 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.409 3.983 6.993 1.00 0.00 H new ATOM 0 HZ PHE A 114 9.593 2.547 5.166 1.00 0.00 H new ATOM 718 N LEU A 115 4.862 1.721 8.206 1.00 0.00 N ATOM 719 CA LEU A 115 3.946 0.882 7.444 1.00 0.00 C ATOM 720 C LEU A 115 3.249 -0.119 8.361 1.00 0.00 C ATOM 721 O LEU A 115 2.024 -0.236 8.355 1.00 0.00 O ATOM 722 CB LEU A 115 4.693 0.141 6.326 1.00 0.00 C ATOM 723 CG LEU A 115 4.119 0.321 4.913 1.00 0.00 C ATOM 724 CD1 LEU A 115 5.073 1.127 4.045 1.00 0.00 C ATOM 725 CD2 LEU A 115 3.839 -1.029 4.266 1.00 0.00 C ATOM 0 H LEU A 115 5.831 1.404 8.201 1.00 0.00 H new ATOM 0 HA LEU A 115 3.192 1.526 6.991 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.730 0.476 6.323 1.00 0.00 H new ATOM 0 HB3 LEU A 115 4.702 -0.923 6.563 1.00 0.00 H new ATOM 0 HG LEU A 115 3.179 0.866 5.000 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.648 1.243 3.048 1.00 0.00 H new ATOM 0 HD12 LEU A 115 5.228 2.110 4.490 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.028 0.606 3.974 1.00 0.00 H new ATOM 0 HD21 LEU A 115 3.433 -0.876 3.266 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.766 -1.599 4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 115 3.118 -1.579 4.870 1.00 0.00 H new ATOM 737 N LEU A 116 4.046 -0.853 9.136 1.00 0.00 N ATOM 738 CA LEU A 116 3.506 -1.863 10.047 1.00 0.00 C ATOM 739 C LEU A 116 3.061 -1.276 11.390 1.00 0.00 C ATOM 740 O LEU A 116 1.885 -1.341 11.747 1.00 0.00 O ATOM 741 CB LEU A 116 4.537 -2.972 10.285 1.00 0.00 C ATOM 742 CG LEU A 116 5.998 -2.514 10.346 1.00 0.00 C ATOM 743 CD1 LEU A 116 6.738 -3.227 11.466 1.00 0.00 C ATOM 744 CD2 LEU A 116 6.684 -2.755 9.010 1.00 0.00 C ATOM 0 H LEU A 116 5.062 -0.769 9.152 1.00 0.00 H new ATOM 0 HA LEU A 116 2.620 -2.276 9.564 1.00 0.00 H new ATOM 0 HB2 LEU A 116 4.293 -3.476 11.220 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.439 -3.711 9.490 1.00 0.00 H new ATOM 0 HG LEU A 116 6.016 -1.444 10.555 1.00 0.00 H new ATOM 0 HD11 LEU A 116 7.773 -2.887 11.492 1.00 0.00 H new ATOM 0 HD12 LEU A 116 6.259 -3.003 12.419 1.00 0.00 H new ATOM 0 HD13 LEU A 116 6.713 -4.303 11.291 1.00 0.00 H new ATOM 0 HD21 LEU A 116 7.721 -2.425 9.069 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.655 -3.818 8.773 1.00 0.00 H new ATOM 0 HD23 LEU A 116 6.168 -2.195 8.230 1.00 0.00 H new ATOM 756 N LYS A 117 4.016 -0.742 12.145 1.00 0.00 N ATOM 757 CA LYS A 117 3.741 -0.185 13.469 1.00 0.00 C ATOM 758 C LYS A 117 2.702 0.937 13.441 1.00 0.00 C ATOM 759 O LYS A 117 2.097 1.245 14.469 1.00 0.00 O ATOM 760 CB LYS A 117 5.037 0.328 14.098 1.00 0.00 C ATOM 761 CG LYS A 117 5.229 -0.112 15.540 1.00 0.00 C ATOM 762 CD LYS A 117 6.679 -0.479 15.827 1.00 0.00 C ATOM 763 CE LYS A 117 7.274 0.402 16.913 1.00 0.00 C ATOM 764 NZ LYS A 117 7.326 1.832 16.503 1.00 0.00 N1+ ATOM 0 H LYS A 117 4.994 -0.682 11.862 1.00 0.00 H new ATOM 0 HA LYS A 117 3.323 -0.993 14.070 1.00 0.00 H new ATOM 0 HB2 LYS A 117 5.882 -0.021 13.505 1.00 0.00 H new ATOM 0 HB3 LYS A 117 5.046 1.417 14.055 1.00 0.00 H new ATOM 0 HG2 LYS A 117 4.917 0.689 16.210 1.00 0.00 H new ATOM 0 HG3 LYS A 117 4.588 -0.969 15.748 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.737 -1.524 16.133 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.267 -0.381 14.915 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.681 0.307 17.823 1.00 0.00 H new ATOM 0 HE3 LYS A 117 8.280 0.056 17.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.577 2.420 17.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.042 1.954 15.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.396 2.123 16.140 1.00 0.00 H new ATOM 778 N HIS A 118 2.503 1.559 12.286 1.00 0.00 N ATOM 779 CA HIS A 118 1.541 2.654 12.182 1.00 0.00 C ATOM 780 C HIS A 118 0.128 2.144 11.915 1.00 0.00 C ATOM 781 O HIS A 118 -0.789 2.399 12.695 1.00 0.00 O ATOM 782 CB HIS A 118 1.959 3.632 11.087 1.00 0.00 C ATOM 783 CG HIS A 118 1.581 5.052 11.378 1.00 0.00 C ATOM 784 ND1 HIS A 118 2.506 6.029 11.682 1.00 0.00 N ATOM 785 CD2 HIS A 118 0.371 5.658 11.409 1.00 0.00 C ATOM 786 CE1 HIS A 118 1.881 7.174 11.889 1.00 0.00 C ATOM 787 NE2 HIS A 118 0.585 6.976 11.728 1.00 0.00 N ATOM 0 H HIS A 118 2.986 1.330 11.418 1.00 0.00 H new ATOM 0 HA HIS A 118 1.534 3.171 13.141 1.00 0.00 H new ATOM 0 HB2 HIS A 118 3.039 3.572 10.951 1.00 0.00 H new ATOM 0 HB3 HIS A 118 1.501 3.328 10.145 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -0.584 5.192 11.218 1.00 0.00 H new ATOM 0 HE1 HIS A 118 2.350 8.112 12.146 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -0.140 7.687 11.825 1.00 0.00 H new ATOM 796 N VAL A 119 -0.047 1.433 10.804 1.00 0.00 N ATOM 797 CA VAL A 119 -1.358 0.902 10.436 1.00 0.00 C ATOM 798 C VAL A 119 -2.042 0.218 11.619 1.00 0.00 C ATOM 799 O VAL A 119 -3.219 0.458 11.887 1.00 0.00 O ATOM 800 CB VAL A 119 -1.254 -0.095 9.265 1.00 0.00 C ATOM 801 CG1 VAL A 119 -0.347 -1.260 9.631 1.00 0.00 C ATOM 802 CG2 VAL A 119 -2.636 -0.588 8.858 1.00 0.00 C ATOM 0 H VAL A 119 0.699 1.211 10.145 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.961 1.755 10.125 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.813 0.420 8.412 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -0.287 -1.952 8.791 1.00 0.00 H new ATOM 0 HG12 VAL A 119 0.650 -0.886 9.865 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -0.753 -1.778 10.500 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.542 -1.291 8.030 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -3.109 -1.086 9.705 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.248 0.259 8.547 1.00 0.00 H new ATOM 812 N ARG A 120 -1.301 -0.629 12.326 1.00 0.00 N ATOM 813 CA ARG A 120 -1.847 -1.339 13.479 1.00 0.00 C ATOM 814 C ARG A 120 -0.795 -2.242 14.117 1.00 0.00 C ATOM 815 O ARG A 120 0.310 -2.390 13.596 1.00 0.00 O ATOM 816 CB ARG A 120 -3.067 -2.167 13.066 1.00 0.00 C ATOM 817 CG ARG A 120 -4.331 -1.814 13.836 1.00 0.00 C ATOM 818 CD ARG A 120 -5.384 -1.185 12.935 1.00 0.00 C ATOM 819 NE ARG A 120 -5.908 0.060 13.493 1.00 0.00 N ATOM 820 CZ ARG A 120 -7.056 0.618 13.112 1.00 0.00 C ATOM 821 NH1 ARG A 120 -7.800 0.045 12.174 1.00 0.00 N1+ ATOM 822 NH2 ARG A 120 -7.458 1.751 13.669 1.00 0.00 N ATOM 0 H ARG A 120 -0.324 -0.841 12.122 1.00 0.00 H new ATOM 0 HA ARG A 120 -2.153 -0.597 14.216 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -3.249 -2.025 12.001 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -2.845 -3.224 13.213 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -4.738 -2.713 14.298 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -4.084 -1.124 14.643 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -4.952 -0.989 11.954 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -6.203 -1.889 12.788 1.00 0.00 H new ATOM 0 HE ARG A 120 -5.363 0.529 14.216 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.493 -0.826 11.742 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.678 0.476 11.886 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.889 2.195 14.389 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -8.337 2.179 13.378 1.00 0.00 H new ATOM 836 N ARG A 121 -1.151 -2.842 15.248 1.00 0.00 N ATOM 837 CA ARG A 121 -0.242 -3.733 15.962 1.00 0.00 C ATOM 838 C ARG A 121 -1.011 -4.868 16.631 1.00 0.00 C ATOM 839 O ARG A 121 -1.260 -4.837 17.836 1.00 0.00 O ATOM 840 CB ARG A 121 0.549 -2.952 17.014 1.00 0.00 C ATOM 841 CG ARG A 121 1.531 -1.954 16.423 1.00 0.00 C ATOM 842 CD ARG A 121 1.937 -0.903 17.442 1.00 0.00 C ATOM 843 NE ARG A 121 2.274 -1.493 18.736 1.00 0.00 N ATOM 844 CZ ARG A 121 2.297 -0.813 19.880 1.00 0.00 C ATOM 845 NH1 ARG A 121 2.008 0.482 19.896 1.00 0.00 N1+ ATOM 846 NH2 ARG A 121 2.611 -1.430 21.010 1.00 0.00 N ATOM 0 H ARG A 121 -2.063 -2.728 15.691 1.00 0.00 H new ATOM 0 HA ARG A 121 0.451 -4.161 15.238 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -0.149 -2.421 17.661 1.00 0.00 H new ATOM 0 HB3 ARG A 121 1.094 -3.656 17.643 1.00 0.00 H new ATOM 0 HG2 ARG A 121 2.417 -2.480 16.069 1.00 0.00 H new ATOM 0 HG3 ARG A 121 1.081 -1.468 15.557 1.00 0.00 H new ATOM 0 HD2 ARG A 121 2.794 -0.345 17.065 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.123 -0.190 17.570 1.00 0.00 H new ATOM 0 HE ARG A 121 2.506 -2.486 18.764 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.767 0.961 19.029 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.027 0.998 20.776 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.835 -2.425 21.003 1.00 0.00 H new ATOM 0 HH22 ARG A 121 2.629 -0.910 21.887 1.00 0.00 H new ATOM 860 N ASN A 122 -1.386 -5.869 15.841 1.00 0.00 N ATOM 861 CA ASN A 122 -2.127 -7.014 16.359 1.00 0.00 C ATOM 862 C ASN A 122 -1.269 -8.275 16.338 1.00 0.00 C ATOM 863 O ASN A 122 -0.861 -8.777 17.385 1.00 0.00 O ATOM 864 CB ASN A 122 -3.401 -7.235 15.540 1.00 0.00 C ATOM 865 CG ASN A 122 -4.254 -8.361 16.092 1.00 0.00 C ATOM 866 OD1 ASN A 122 -5.075 -8.152 16.986 1.00 0.00 O ATOM 867 ND2 ASN A 122 -4.065 -9.563 15.561 1.00 0.00 N ATOM 0 H ASN A 122 -1.189 -5.911 14.841 1.00 0.00 H new ATOM 0 HA ASN A 122 -2.399 -6.801 17.393 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -3.984 -6.314 15.525 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -3.132 -7.459 14.508 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -4.611 -10.358 15.892 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -3.374 -9.691 14.822 1.00 0.00 H new ATOM 874 N LYS A 123 -1.000 -8.783 15.138 1.00 0.00 N ATOM 875 CA LYS A 123 -0.191 -9.986 14.982 1.00 0.00 C ATOM 876 C LYS A 123 0.032 -10.305 13.507 1.00 0.00 C ATOM 877 O LYS A 123 1.137 -10.658 13.098 1.00 0.00 O ATOM 878 CB LYS A 123 -0.863 -11.173 15.676 1.00 0.00 C ATOM 879 CG LYS A 123 -0.015 -12.433 15.685 1.00 0.00 C ATOM 880 CD LYS A 123 -0.593 -13.487 16.615 1.00 0.00 C ATOM 881 CE LYS A 123 0.024 -14.853 16.364 1.00 0.00 C ATOM 882 NZ LYS A 123 1.357 -14.988 17.013 1.00 0.00 N1+ ATOM 0 H LYS A 123 -1.330 -8.380 14.261 1.00 0.00 H new ATOM 0 HA LYS A 123 0.778 -9.803 15.447 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -1.098 -10.896 16.704 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -1.809 -11.386 15.178 1.00 0.00 H new ATOM 0 HG2 LYS A 123 0.051 -12.835 14.674 1.00 0.00 H new ATOM 0 HG3 LYS A 123 1.000 -12.188 15.998 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -0.420 -13.194 17.650 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -1.673 -13.544 16.476 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -0.644 -15.628 16.741 1.00 0.00 H new ATOM 0 HE3 LYS A 123 0.125 -15.014 15.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 1.744 -15.933 16.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 2.002 -14.265 16.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 1.258 -14.860 18.040 1.00 0.00 H new ATOM 896 N LEU A 124 -1.027 -10.177 12.714 1.00 0.00 N ATOM 897 CA LEU A 124 -0.948 -10.451 11.285 1.00 0.00 C ATOM 898 C LEU A 124 -0.204 -9.337 10.555 1.00 0.00 C ATOM 899 O LEU A 124 0.431 -9.571 9.528 1.00 0.00 O ATOM 900 CB LEU A 124 -2.352 -10.611 10.696 1.00 0.00 C ATOM 901 CG LEU A 124 -3.232 -11.649 11.396 1.00 0.00 C ATOM 902 CD1 LEU A 124 -4.042 -10.999 12.507 1.00 0.00 C ATOM 903 CD2 LEU A 124 -4.151 -12.330 10.392 1.00 0.00 C ATOM 0 H LEU A 124 -1.949 -9.885 13.037 1.00 0.00 H new ATOM 0 HA LEU A 124 -0.395 -11.381 11.151 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.857 -9.646 10.731 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.260 -10.884 9.645 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.586 -12.406 11.841 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.662 -11.752 12.994 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -3.366 -10.557 13.239 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.679 -10.222 12.086 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.770 -13.065 10.906 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.790 -11.584 9.920 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.552 -12.829 9.630 1.00 0.00 H new ATOM 915 N GLY A 125 -0.288 -8.124 11.094 1.00 0.00 N ATOM 916 CA GLY A 125 0.382 -6.993 10.478 1.00 0.00 C ATOM 917 C GLY A 125 -0.217 -6.628 9.134 1.00 0.00 C ATOM 918 O GLY A 125 0.336 -6.968 8.088 1.00 0.00 O ATOM 0 H GLY A 125 -0.807 -7.905 11.944 1.00 0.00 H new ATOM 0 HA2 GLY A 125 0.323 -6.133 11.144 1.00 0.00 H new ATOM 0 HA3 GLY A 125 1.439 -7.226 10.350 1.00 0.00 H new ATOM 922 N TYR A 126 -1.352 -5.938 9.163 1.00 0.00 N ATOM 923 CA TYR A 126 -2.029 -5.529 7.937 1.00 0.00 C ATOM 924 C TYR A 126 -1.764 -4.059 7.630 1.00 0.00 C ATOM 925 O TYR A 126 -1.908 -3.198 8.497 1.00 0.00 O ATOM 926 CB TYR A 126 -3.533 -5.777 8.051 1.00 0.00 C ATOM 927 CG TYR A 126 -4.118 -5.389 9.391 1.00 0.00 C ATOM 928 CD1 TYR A 126 -4.601 -4.106 9.615 1.00 0.00 C ATOM 929 CD2 TYR A 126 -4.188 -6.307 10.432 1.00 0.00 C ATOM 930 CE1 TYR A 126 -5.137 -3.748 10.838 1.00 0.00 C ATOM 931 CE2 TYR A 126 -4.722 -5.957 11.658 1.00 0.00 C ATOM 932 CZ TYR A 126 -5.195 -4.677 11.854 1.00 0.00 C ATOM 933 OH TYR A 126 -5.728 -4.324 13.073 1.00 0.00 O ATOM 0 H TYR A 126 -1.822 -5.650 10.021 1.00 0.00 H new ATOM 0 HA TYR A 126 -1.631 -6.128 7.118 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.044 -5.218 7.267 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.732 -6.833 7.871 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -4.557 -3.376 8.820 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.819 -7.311 10.281 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -5.508 -2.746 10.996 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -4.768 -6.682 12.457 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.696 -5.093 13.679 1.00 0.00 H new ATOM 943 N VAL A 127 -1.365 -3.779 6.391 1.00 0.00 N ATOM 944 CA VAL A 127 -1.068 -2.413 5.973 1.00 0.00 C ATOM 945 C VAL A 127 -2.092 -1.895 4.967 1.00 0.00 C ATOM 946 O VAL A 127 -2.314 -2.507 3.924 1.00 0.00 O ATOM 947 CB VAL A 127 0.330 -2.331 5.340 1.00 0.00 C ATOM 948 CG1 VAL A 127 0.677 -0.899 4.970 1.00 0.00 C ATOM 949 CG2 VAL A 127 1.370 -2.926 6.274 1.00 0.00 C ATOM 0 H VAL A 127 -1.240 -4.480 5.661 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.108 -1.793 6.868 1.00 0.00 H new ATOM 0 HB VAL A 127 0.326 -2.916 4.420 1.00 0.00 H new ATOM 0 HG11 VAL A 127 1.671 -0.869 4.524 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.053 -0.521 4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 127 0.662 -0.278 5.866 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.355 -2.860 5.811 1.00 0.00 H new ATOM 0 HG22 VAL A 127 1.373 -2.374 7.214 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.129 -3.971 6.468 1.00 0.00 H new ATOM 959 N SER A 128 -2.703 -0.757 5.278 1.00 0.00 N ATOM 960 CA SER A 128 -3.691 -0.155 4.391 1.00 0.00 C ATOM 961 C SER A 128 -3.008 0.588 3.246 1.00 0.00 C ATOM 962 O SER A 128 -2.195 1.485 3.473 1.00 0.00 O ATOM 963 CB SER A 128 -4.593 0.803 5.172 1.00 0.00 C ATOM 964 OG SER A 128 -5.732 0.131 5.682 1.00 0.00 O ATOM 0 H SER A 128 -2.532 -0.234 6.137 1.00 0.00 H new ATOM 0 HA SER A 128 -4.302 -0.954 3.970 1.00 0.00 H new ATOM 0 HB2 SER A 128 -4.031 1.248 5.994 1.00 0.00 H new ATOM 0 HB3 SER A 128 -4.909 1.620 4.523 1.00 0.00 H new ATOM 0 HG SER A 128 -6.291 0.765 6.178 1.00 0.00 H new ATOM 970 N VAL A 129 -3.341 0.211 2.015 1.00 0.00 N ATOM 971 CA VAL A 129 -2.751 0.844 0.840 1.00 0.00 C ATOM 972 C VAL A 129 -3.014 2.348 0.836 1.00 0.00 C ATOM 973 O VAL A 129 -2.187 3.132 0.370 1.00 0.00 O ATOM 974 CB VAL A 129 -3.283 0.221 -0.471 1.00 0.00 C ATOM 975 CG1 VAL A 129 -4.663 0.764 -0.821 1.00 0.00 C ATOM 976 CG2 VAL A 129 -2.301 0.467 -1.607 1.00 0.00 C ATOM 0 H VAL A 129 -4.014 -0.527 1.806 1.00 0.00 H new ATOM 0 HA VAL A 129 -1.676 0.671 0.893 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.381 -0.854 -0.321 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -5.010 0.307 -1.748 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -5.361 0.529 -0.017 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.607 1.845 -0.949 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -2.687 0.023 -2.525 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.171 1.540 -1.750 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -1.340 0.014 -1.362 1.00 0.00 H new ATOM 986 N LYS A 130 -4.170 2.743 1.360 1.00 0.00 N ATOM 987 CA LYS A 130 -4.543 4.153 1.420 1.00 0.00 C ATOM 988 C LYS A 130 -3.470 4.970 2.133 1.00 0.00 C ATOM 989 O LYS A 130 -3.302 6.160 1.867 1.00 0.00 O ATOM 990 CB LYS A 130 -5.885 4.317 2.136 1.00 0.00 C ATOM 991 CG LYS A 130 -6.363 5.759 2.209 1.00 0.00 C ATOM 992 CD LYS A 130 -7.437 5.936 3.269 1.00 0.00 C ATOM 993 CE LYS A 130 -7.570 7.391 3.691 1.00 0.00 C ATOM 994 NZ LYS A 130 -8.985 7.762 3.970 1.00 0.00 N1+ ATOM 0 H LYS A 130 -4.865 2.107 1.750 1.00 0.00 H new ATOM 0 HA LYS A 130 -4.636 4.522 0.399 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -6.637 3.719 1.622 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.799 3.920 3.147 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.519 6.412 2.432 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -6.754 6.063 1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.392 5.579 2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -7.196 5.325 4.139 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.966 7.567 4.581 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -7.174 8.034 2.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -9.032 8.761 4.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -9.557 7.618 3.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -9.355 7.166 4.737 1.00 0.00 H new ATOM 1008 N LEU A 131 -2.743 4.320 3.036 1.00 0.00 N ATOM 1009 CA LEU A 131 -1.685 4.978 3.783 1.00 0.00 C ATOM 1010 C LEU A 131 -0.418 5.084 2.939 1.00 0.00 C ATOM 1011 O LEU A 131 0.254 6.116 2.937 1.00 0.00 O ATOM 1012 CB LEU A 131 -1.410 4.208 5.080 1.00 0.00 C ATOM 1013 CG LEU A 131 0.036 4.253 5.564 1.00 0.00 C ATOM 1014 CD1 LEU A 131 0.457 5.685 5.850 1.00 0.00 C ATOM 1015 CD2 LEU A 131 0.220 3.376 6.793 1.00 0.00 C ATOM 0 H LEU A 131 -2.870 3.335 3.266 1.00 0.00 H new ATOM 0 HA LEU A 131 -2.006 5.989 4.036 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -2.052 4.608 5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -1.696 3.166 4.934 1.00 0.00 H new ATOM 0 HG LEU A 131 0.676 3.862 4.773 1.00 0.00 H new ATOM 0 HD11 LEU A 131 1.491 5.698 6.194 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.370 6.279 4.940 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -0.188 6.107 6.621 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.258 3.423 7.121 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.430 3.730 7.593 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -0.036 2.346 6.546 1.00 0.00 H new ATOM 1027 N LEU A 132 -0.097 4.011 2.224 1.00 0.00 N ATOM 1028 CA LEU A 132 1.090 3.985 1.379 1.00 0.00 C ATOM 1029 C LEU A 132 1.070 5.128 0.371 1.00 0.00 C ATOM 1030 O LEU A 132 2.115 5.627 -0.038 1.00 0.00 O ATOM 1031 CB LEU A 132 1.191 2.646 0.645 1.00 0.00 C ATOM 1032 CG LEU A 132 1.929 1.545 1.408 1.00 0.00 C ATOM 1033 CD1 LEU A 132 1.399 1.432 2.828 1.00 0.00 C ATOM 1034 CD2 LEU A 132 1.797 0.215 0.679 1.00 0.00 C ATOM 0 H LEU A 132 -0.642 3.149 2.213 1.00 0.00 H new ATOM 0 HA LEU A 132 1.962 4.108 2.021 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.184 2.297 0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 132 1.696 2.808 -0.308 1.00 0.00 H new ATOM 0 HG LEU A 132 2.986 1.808 1.458 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.936 0.644 3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.544 2.379 3.347 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.336 1.192 2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 132 2.327 -0.559 1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.744 -0.053 0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 132 2.225 0.303 -0.319 1.00 0.00 H new ATOM 1046 N THR A 133 -0.128 5.539 -0.027 1.00 0.00 N ATOM 1047 CA THR A 133 -0.282 6.624 -0.985 1.00 0.00 C ATOM 1048 C THR A 133 0.159 7.946 -0.379 1.00 0.00 C ATOM 1049 O THR A 133 0.788 8.772 -1.040 1.00 0.00 O ATOM 1050 CB THR A 133 -1.736 6.718 -1.438 1.00 0.00 C ATOM 1051 OG1 THR A 133 -2.585 5.998 -0.562 1.00 0.00 O ATOM 1052 CG2 THR A 133 -1.946 6.181 -2.828 1.00 0.00 C ATOM 0 H THR A 133 -1.006 5.136 0.300 1.00 0.00 H new ATOM 0 HA THR A 133 0.350 6.413 -1.848 1.00 0.00 H new ATOM 0 HB THR A 133 -1.981 7.780 -1.428 1.00 0.00 H new ATOM 0 HG1 THR A 133 -2.622 6.453 0.305 1.00 0.00 H new ATOM 0 HG21 THR A 133 -2.998 6.273 -3.098 1.00 0.00 H new ATOM 0 HG22 THR A 133 -1.339 6.749 -3.533 1.00 0.00 H new ATOM 0 HG23 THR A 133 -1.653 5.132 -2.861 1.00 0.00 H new ATOM 1060 N SER A 134 -0.174 8.129 0.888 1.00 0.00 N ATOM 1061 CA SER A 134 0.184 9.344 1.609 1.00 0.00 C ATOM 1062 C SER A 134 1.514 9.171 2.335 1.00 0.00 C ATOM 1063 O SER A 134 1.830 9.920 3.259 1.00 0.00 O ATOM 1064 CB SER A 134 -0.913 9.712 2.609 1.00 0.00 C ATOM 1065 OG SER A 134 -0.585 10.897 3.315 1.00 0.00 O ATOM 0 H SER A 134 -0.694 7.449 1.443 1.00 0.00 H new ATOM 0 HA SER A 134 0.288 10.151 0.883 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.858 9.848 2.083 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.056 8.893 3.314 1.00 0.00 H new ATOM 0 HG SER A 134 0.375 10.907 3.510 1.00 0.00 H new ATOM 1071 N PHE A 135 2.291 8.177 1.911 1.00 0.00 N ATOM 1072 CA PHE A 135 3.587 7.906 2.520 1.00 0.00 C ATOM 1073 C PHE A 135 4.676 8.758 1.871 1.00 0.00 C ATOM 1074 O PHE A 135 4.990 8.588 0.696 1.00 0.00 O ATOM 1075 CB PHE A 135 3.921 6.418 2.400 1.00 0.00 C ATOM 1076 CG PHE A 135 5.253 6.036 2.993 1.00 0.00 C ATOM 1077 CD1 PHE A 135 5.891 6.863 3.906 1.00 0.00 C ATOM 1078 CD2 PHE A 135 5.863 4.842 2.638 1.00 0.00 C ATOM 1079 CE1 PHE A 135 7.110 6.508 4.452 1.00 0.00 C ATOM 1080 CE2 PHE A 135 7.082 4.483 3.182 1.00 0.00 C ATOM 1081 CZ PHE A 135 7.706 5.316 4.089 1.00 0.00 C ATOM 0 H PHE A 135 2.044 7.547 1.148 1.00 0.00 H new ATOM 0 HA PHE A 135 3.539 8.169 3.577 1.00 0.00 H new ATOM 0 HB2 PHE A 135 3.138 5.840 2.891 1.00 0.00 H new ATOM 0 HB3 PHE A 135 3.911 6.138 1.347 1.00 0.00 H new ATOM 0 HD1 PHE A 135 5.429 7.796 4.194 1.00 0.00 H new ATOM 0 HD2 PHE A 135 5.380 4.186 1.929 1.00 0.00 H new ATOM 0 HE1 PHE A 135 7.596 7.162 5.161 1.00 0.00 H new ATOM 0 HE2 PHE A 135 7.546 3.550 2.897 1.00 0.00 H new ATOM 0 HZ PHE A 135 8.659 5.036 4.514 1.00 0.00 H new ATOM 1091 N LYS A 136 5.228 9.687 2.648 1.00 0.00 N ATOM 1092 CA LYS A 136 6.271 10.602 2.172 1.00 0.00 C ATOM 1093 C LYS A 136 7.257 9.936 1.205 1.00 0.00 C ATOM 1094 O LYS A 136 7.801 10.596 0.320 1.00 0.00 O ATOM 1095 CB LYS A 136 7.038 11.181 3.362 1.00 0.00 C ATOM 1096 CG LYS A 136 6.336 12.355 4.024 1.00 0.00 C ATOM 1097 CD LYS A 136 6.703 13.671 3.357 1.00 0.00 C ATOM 1098 CE LYS A 136 6.409 14.856 4.263 1.00 0.00 C ATOM 1099 NZ LYS A 136 6.874 16.139 3.668 1.00 0.00 N1+ ATOM 0 H LYS A 136 4.968 9.829 3.624 1.00 0.00 H new ATOM 0 HA LYS A 136 5.765 11.395 1.621 1.00 0.00 H new ATOM 0 HB2 LYS A 136 7.191 10.396 4.102 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.025 11.500 3.027 1.00 0.00 H new ATOM 0 HG2 LYS A 136 5.257 12.210 3.975 1.00 0.00 H new ATOM 0 HG3 LYS A 136 6.605 12.393 5.080 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.761 13.665 3.096 1.00 0.00 H new ATOM 0 HD3 LYS A 136 6.146 13.776 2.426 1.00 0.00 H new ATOM 0 HE2 LYS A 136 5.337 14.911 4.452 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.895 14.706 5.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 6.655 16.922 4.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.901 16.097 3.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.391 16.296 2.760 1.00 0.00 H new ATOM 1113 N LYS A 137 7.491 8.639 1.375 1.00 0.00 N ATOM 1114 CA LYS A 137 8.417 7.918 0.512 1.00 0.00 C ATOM 1115 C LYS A 137 7.744 7.510 -0.792 1.00 0.00 C ATOM 1116 O LYS A 137 8.360 7.537 -1.858 1.00 0.00 O ATOM 1117 CB LYS A 137 8.956 6.678 1.227 1.00 0.00 C ATOM 1118 CG LYS A 137 10.194 6.950 2.065 1.00 0.00 C ATOM 1119 CD LYS A 137 11.455 6.950 1.214 1.00 0.00 C ATOM 1120 CE LYS A 137 11.975 8.360 0.987 1.00 0.00 C ATOM 1121 NZ LYS A 137 12.975 8.412 -0.115 1.00 0.00 N1+ ATOM 0 H LYS A 137 7.054 8.069 2.099 1.00 0.00 H new ATOM 0 HA LYS A 137 9.246 8.586 0.279 1.00 0.00 H new ATOM 0 HB2 LYS A 137 8.175 6.271 1.869 1.00 0.00 H new ATOM 0 HB3 LYS A 137 9.190 5.914 0.486 1.00 0.00 H new ATOM 0 HG2 LYS A 137 10.092 7.913 2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 137 10.280 6.193 2.845 1.00 0.00 H new ATOM 0 HD2 LYS A 137 12.224 6.352 1.702 1.00 0.00 H new ATOM 0 HD3 LYS A 137 11.247 6.479 0.253 1.00 0.00 H new ATOM 0 HE2 LYS A 137 11.141 9.021 0.752 1.00 0.00 H new ATOM 0 HE3 LYS A 137 12.428 8.732 1.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 13.305 9.390 -0.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 13.783 7.801 0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 12.536 8.081 -0.998 1.00 0.00 H new ATOM 1135 N VAL A 138 6.477 7.127 -0.697 1.00 0.00 N ATOM 1136 CA VAL A 138 5.717 6.707 -1.862 1.00 0.00 C ATOM 1137 C VAL A 138 5.103 7.902 -2.584 1.00 0.00 C ATOM 1138 O VAL A 138 5.114 7.968 -3.811 1.00 0.00 O ATOM 1139 CB VAL A 138 4.606 5.710 -1.468 1.00 0.00 C ATOM 1140 CG1 VAL A 138 3.574 5.567 -2.578 1.00 0.00 C ATOM 1141 CG2 VAL A 138 5.202 4.356 -1.107 1.00 0.00 C ATOM 0 H VAL A 138 5.955 7.099 0.179 1.00 0.00 H new ATOM 0 HA VAL A 138 6.412 6.212 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 138 4.097 6.107 -0.590 1.00 0.00 H new ATOM 0 HG11 VAL A 138 2.805 4.858 -2.271 1.00 0.00 H new ATOM 0 HG12 VAL A 138 3.116 6.536 -2.776 1.00 0.00 H new ATOM 0 HG13 VAL A 138 4.061 5.204 -3.483 1.00 0.00 H new ATOM 0 HG21 VAL A 138 4.402 3.668 -0.832 1.00 0.00 H new ATOM 0 HG22 VAL A 138 5.745 3.957 -1.964 1.00 0.00 H new ATOM 0 HG23 VAL A 138 5.886 4.472 -0.266 1.00 0.00 H new ATOM 1151 N LYS A 139 4.552 8.837 -1.822 1.00 0.00 N ATOM 1152 CA LYS A 139 3.928 10.010 -2.415 1.00 0.00 C ATOM 1153 C LYS A 139 4.923 10.819 -3.236 1.00 0.00 C ATOM 1154 O LYS A 139 4.529 11.630 -4.075 1.00 0.00 O ATOM 1155 CB LYS A 139 3.300 10.900 -1.348 1.00 0.00 C ATOM 1156 CG LYS A 139 4.297 11.475 -0.356 1.00 0.00 C ATOM 1157 CD LYS A 139 3.593 12.148 0.813 1.00 0.00 C ATOM 1158 CE LYS A 139 4.066 13.580 1.002 1.00 0.00 C ATOM 1159 NZ LYS A 139 3.109 14.562 0.421 1.00 0.00 N1+ ATOM 0 H LYS A 139 4.524 8.807 -0.803 1.00 0.00 H new ATOM 0 HA LYS A 139 3.143 9.649 -3.080 1.00 0.00 H new ATOM 0 HB2 LYS A 139 2.775 11.721 -1.837 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.552 10.324 -0.803 1.00 0.00 H new ATOM 0 HG2 LYS A 139 4.943 10.679 0.016 1.00 0.00 H new ATOM 0 HG3 LYS A 139 4.939 12.197 -0.860 1.00 0.00 H new ATOM 0 HD2 LYS A 139 2.516 12.139 0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 139 3.777 11.580 1.725 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.194 13.783 2.065 1.00 0.00 H new ATOM 0 HE3 LYS A 139 5.043 13.704 0.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.468 15.527 0.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 3.006 14.385 -0.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.184 14.461 0.885 1.00 0.00 H new ATOM 1173 N HIS A 140 6.213 10.588 -3.010 1.00 0.00 N ATOM 1174 CA HIS A 140 7.245 11.294 -3.755 1.00 0.00 C ATOM 1175 C HIS A 140 7.240 10.857 -5.219 1.00 0.00 C ATOM 1176 O HIS A 140 7.982 11.397 -6.040 1.00 0.00 O ATOM 1177 CB HIS A 140 8.620 11.033 -3.136 1.00 0.00 C ATOM 1178 CG HIS A 140 9.576 12.174 -3.299 1.00 0.00 C ATOM 1179 ND1 HIS A 140 10.695 12.337 -2.510 1.00 0.00 N ATOM 1180 CD2 HIS A 140 9.576 13.212 -4.169 1.00 0.00 C ATOM 1181 CE1 HIS A 140 11.342 13.427 -2.886 1.00 0.00 C ATOM 1182 NE2 HIS A 140 10.684 13.976 -3.891 1.00 0.00 N ATOM 0 H HIS A 140 6.565 9.922 -2.322 1.00 0.00 H new ATOM 0 HA HIS A 140 7.034 12.362 -3.707 1.00 0.00 H new ATOM 0 HB2 HIS A 140 8.497 10.822 -2.074 1.00 0.00 H new ATOM 0 HB3 HIS A 140 9.051 10.141 -3.591 1.00 0.00 H new ATOM 0 HD2 HIS A 140 8.842 13.404 -4.938 1.00 0.00 H new ATOM 0 HE1 HIS A 140 12.253 13.804 -2.446 1.00 0.00 H new ATOM 0 HE2 HIS A 140 10.954 14.829 -4.381 1.00 0.00 H new ATOM 1191 N LEU A 141 6.399 9.873 -5.537 1.00 0.00 N ATOM 1192 CA LEU A 141 6.298 9.360 -6.896 1.00 0.00 C ATOM 1193 C LEU A 141 5.430 10.262 -7.768 1.00 0.00 C ATOM 1194 O LEU A 141 5.933 10.960 -8.649 1.00 0.00 O ATOM 1195 CB LEU A 141 5.723 7.943 -6.872 1.00 0.00 C ATOM 1196 CG LEU A 141 6.451 6.974 -5.941 1.00 0.00 C ATOM 1197 CD1 LEU A 141 5.523 5.849 -5.513 1.00 0.00 C ATOM 1198 CD2 LEU A 141 7.695 6.421 -6.614 1.00 0.00 C ATOM 0 H LEU A 141 5.778 9.417 -4.868 1.00 0.00 H new ATOM 0 HA LEU A 141 7.299 9.341 -7.327 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.676 7.995 -6.573 1.00 0.00 H new ATOM 0 HB3 LEU A 141 5.746 7.539 -7.884 1.00 0.00 H new ATOM 0 HG LEU A 141 6.761 7.518 -5.049 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.058 5.168 -4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 141 4.664 6.266 -4.988 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.181 5.305 -6.393 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.200 5.733 -5.936 1.00 0.00 H new ATOM 0 HD22 LEU A 141 7.412 5.891 -7.524 1.00 0.00 H new ATOM 0 HD23 LEU A 141 8.367 7.241 -6.866 1.00 0.00 H new ATOM 1210 N THR A 142 4.124 10.243 -7.522 1.00 0.00 N ATOM 1211 CA THR A 142 3.189 11.058 -8.289 1.00 0.00 C ATOM 1212 C THR A 142 1.915 11.319 -7.494 1.00 0.00 C ATOM 1213 O THR A 142 1.620 10.618 -6.526 1.00 0.00 O ATOM 1214 CB THR A 142 2.841 10.367 -9.610 1.00 0.00 C ATOM 1215 OG1 THR A 142 3.832 9.414 -9.954 1.00 0.00 O ATOM 1216 CG2 THR A 142 2.710 11.328 -10.772 1.00 0.00 C ATOM 0 H THR A 142 3.689 9.672 -6.797 1.00 0.00 H new ATOM 0 HA THR A 142 3.670 12.013 -8.499 1.00 0.00 H new ATOM 0 HB THR A 142 1.875 9.891 -9.440 1.00 0.00 H new ATOM 0 HG1 THR A 142 3.591 8.982 -10.800 1.00 0.00 H new ATOM 0 HG21 THR A 142 2.463 10.773 -11.677 1.00 0.00 H new ATOM 0 HG22 THR A 142 1.920 12.049 -10.561 1.00 0.00 H new ATOM 0 HG23 THR A 142 3.653 11.855 -10.916 1.00 0.00 H new ATOM 1224 N ARG A 143 1.158 12.327 -7.914 1.00 0.00 N ATOM 1225 CA ARG A 143 -0.090 12.671 -7.246 1.00 0.00 C ATOM 1226 C ARG A 143 -1.167 11.629 -7.544 1.00 0.00 C ATOM 1227 O ARG A 143 -2.225 11.617 -6.913 1.00 0.00 O ATOM 1228 CB ARG A 143 -0.563 14.060 -7.686 1.00 0.00 C ATOM 1229 CG ARG A 143 -0.656 15.059 -6.544 1.00 0.00 C ATOM 1230 CD ARG A 143 0.091 16.345 -6.862 1.00 0.00 C ATOM 1231 NE ARG A 143 -0.802 17.392 -7.352 1.00 0.00 N ATOM 1232 CZ ARG A 143 -0.386 18.477 -8.001 1.00 0.00 C ATOM 1233 NH1 ARG A 143 0.906 18.661 -8.240 1.00 0.00 N1+ ATOM 1234 NH2 ARG A 143 -1.265 19.381 -8.413 1.00 0.00 N ATOM 0 H ARG A 143 1.387 12.919 -8.713 1.00 0.00 H new ATOM 0 HA ARG A 143 0.089 12.684 -6.171 1.00 0.00 H new ATOM 0 HB2 ARG A 143 0.122 14.446 -8.441 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -1.541 13.969 -8.159 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -1.703 15.286 -6.343 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -0.246 14.615 -5.637 1.00 0.00 H new ATOM 0 HD2 ARG A 143 0.604 16.696 -5.967 1.00 0.00 H new ATOM 0 HD3 ARG A 143 0.857 16.143 -7.610 1.00 0.00 H new ATOM 0 HE ARG A 143 -1.803 17.285 -7.187 1.00 0.00 H new ATOM 0 HH11 ARG A 143 1.586 17.969 -7.926 1.00 0.00 H new ATOM 0 HH12 ARG A 143 1.219 19.494 -8.738 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -2.260 19.245 -8.232 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -0.946 20.213 -8.910 1.00 0.00 H new ATOM 1248 N ASP A 144 -0.890 10.755 -8.509 1.00 0.00 N ATOM 1249 CA ASP A 144 -1.826 9.707 -8.893 1.00 0.00 C ATOM 1250 C ASP A 144 -1.887 8.618 -7.824 1.00 0.00 C ATOM 1251 O ASP A 144 -1.522 7.467 -8.067 1.00 0.00 O ATOM 1252 CB ASP A 144 -1.419 9.114 -10.244 1.00 0.00 C ATOM 1253 CG ASP A 144 -2.502 9.270 -11.293 1.00 0.00 C ATOM 1254 OD1 ASP A 144 -3.683 9.031 -10.968 1.00 0.00 O1- ATOM 1255 OD2 ASP A 144 -2.168 9.631 -12.443 1.00 0.00 O ATOM 0 H ASP A 144 -0.019 10.754 -9.040 1.00 0.00 H new ATOM 0 HA ASP A 144 -2.821 10.143 -8.986 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -0.508 9.600 -10.592 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -1.188 8.056 -10.119 1.00 0.00 H new ATOM 1260 N TRP A 145 -2.351 8.994 -6.637 1.00 0.00 N ATOM 1261 CA TRP A 145 -2.463 8.062 -5.526 1.00 0.00 C ATOM 1262 C TRP A 145 -3.483 6.969 -5.825 1.00 0.00 C ATOM 1263 O TRP A 145 -3.488 5.919 -5.183 1.00 0.00 O ATOM 1264 CB TRP A 145 -2.835 8.818 -4.250 1.00 0.00 C ATOM 1265 CG TRP A 145 -1.666 9.529 -3.637 1.00 0.00 C ATOM 1266 CD1 TRP A 145 -0.353 9.394 -3.990 1.00 0.00 C ATOM 1267 CD2 TRP A 145 -1.698 10.483 -2.570 1.00 0.00 C ATOM 1268 NE1 TRP A 145 0.433 10.206 -3.211 1.00 0.00 N ATOM 1269 CE2 TRP A 145 -0.369 10.884 -2.329 1.00 0.00 C ATOM 1270 CE3 TRP A 145 -2.720 11.037 -1.794 1.00 0.00 C ATOM 1271 CZ2 TRP A 145 -0.038 11.815 -1.347 1.00 0.00 C ATOM 1272 CZ3 TRP A 145 -2.390 11.961 -0.819 1.00 0.00 C ATOM 1273 CH2 TRP A 145 -1.060 12.341 -0.604 1.00 0.00 C ATOM 0 H TRP A 145 -2.656 9.943 -6.421 1.00 0.00 H new ATOM 0 HA TRP A 145 -1.497 7.578 -5.381 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -3.617 9.542 -4.477 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -3.250 8.117 -3.525 1.00 0.00 H new ATOM 0 HD1 TRP A 145 0.013 8.742 -4.769 1.00 0.00 H new ATOM 0 HE1 TRP A 145 1.447 10.291 -3.277 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -3.749 10.749 -1.953 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 0.987 12.111 -1.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -3.171 12.396 -0.214 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -0.835 13.065 0.165 1.00 0.00 H new ATOM 1284 N ARG A 146 -4.339 7.210 -6.814 1.00 0.00 N ATOM 1285 CA ARG A 146 -5.342 6.232 -7.201 1.00 0.00 C ATOM 1286 C ARG A 146 -4.684 5.064 -7.919 1.00 0.00 C ATOM 1287 O ARG A 146 -4.700 3.934 -7.428 1.00 0.00 O ATOM 1288 CB ARG A 146 -6.393 6.877 -8.107 1.00 0.00 C ATOM 1289 CG ARG A 146 -7.496 7.584 -7.341 1.00 0.00 C ATOM 1290 CD ARG A 146 -6.977 8.824 -6.631 1.00 0.00 C ATOM 1291 NE ARG A 146 -7.975 9.398 -5.732 1.00 0.00 N ATOM 1292 CZ ARG A 146 -7.685 10.246 -4.747 1.00 0.00 C ATOM 1293 NH1 ARG A 146 -6.430 10.621 -4.533 1.00 0.00 N1+ ATOM 1294 NH2 ARG A 146 -8.653 10.721 -3.975 1.00 0.00 N ATOM 0 H ARG A 146 -4.356 8.072 -7.358 1.00 0.00 H new ATOM 0 HA ARG A 146 -5.834 5.864 -6.301 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -5.903 7.593 -8.767 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -6.836 6.109 -8.741 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -8.295 7.865 -8.028 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -7.929 6.900 -6.611 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -6.082 8.569 -6.064 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -6.684 9.569 -7.371 1.00 0.00 H new ATOM 0 HE ARG A 146 -8.951 9.134 -5.867 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -5.682 10.259 -5.124 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -6.214 11.271 -3.777 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -9.619 10.437 -4.136 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -8.431 11.371 -3.220 1.00 0.00 H new ATOM 1308 N THR A 147 -4.088 5.344 -9.079 1.00 0.00 N ATOM 1309 CA THR A 147 -3.405 4.311 -9.858 1.00 0.00 C ATOM 1310 C THR A 147 -2.339 3.664 -9.000 1.00 0.00 C ATOM 1311 O THR A 147 -1.934 2.527 -9.240 1.00 0.00 O ATOM 1312 CB THR A 147 -2.800 4.879 -11.153 1.00 0.00 C ATOM 1313 OG1 THR A 147 -1.395 4.704 -11.187 1.00 0.00 O ATOM 1314 CG2 THR A 147 -3.080 6.347 -11.360 1.00 0.00 C ATOM 0 H THR A 147 -4.064 6.274 -9.498 1.00 0.00 H new ATOM 0 HA THR A 147 -4.136 3.560 -10.156 1.00 0.00 H new ATOM 0 HB THR A 147 -3.284 4.316 -11.951 1.00 0.00 H new ATOM 0 HG1 THR A 147 -1.028 5.157 -11.975 1.00 0.00 H new ATOM 0 HG21 THR A 147 -2.622 6.677 -12.293 1.00 0.00 H new ATOM 0 HG22 THR A 147 -4.157 6.509 -11.407 1.00 0.00 H new ATOM 0 HG23 THR A 147 -2.663 6.917 -10.530 1.00 0.00 H new ATOM 1322 N THR A 148 -1.910 4.389 -7.974 1.00 0.00 N ATOM 1323 CA THR A 148 -0.919 3.872 -7.065 1.00 0.00 C ATOM 1324 C THR A 148 -1.460 2.616 -6.384 1.00 0.00 C ATOM 1325 O THR A 148 -0.713 1.687 -6.071 1.00 0.00 O ATOM 1326 CB THR A 148 -0.543 4.930 -6.024 1.00 0.00 C ATOM 1327 OG1 THR A 148 0.031 6.065 -6.649 1.00 0.00 O ATOM 1328 CG2 THR A 148 0.441 4.433 -4.988 1.00 0.00 C ATOM 0 H THR A 148 -2.237 5.331 -7.759 1.00 0.00 H new ATOM 0 HA THR A 148 -0.019 3.615 -7.624 1.00 0.00 H new ATOM 0 HB THR A 148 -1.477 5.182 -5.521 1.00 0.00 H new ATOM 0 HG1 THR A 148 -0.506 6.315 -7.430 1.00 0.00 H new ATOM 0 HG21 THR A 148 0.663 5.234 -4.283 1.00 0.00 H new ATOM 0 HG22 THR A 148 0.010 3.587 -4.453 1.00 0.00 H new ATOM 0 HG23 THR A 148 1.361 4.119 -5.481 1.00 0.00 H new ATOM 1336 N ALA A 149 -2.777 2.597 -6.177 1.00 0.00 N ATOM 1337 CA ALA A 149 -3.444 1.463 -5.552 1.00 0.00 C ATOM 1338 C ALA A 149 -3.543 0.295 -6.525 1.00 0.00 C ATOM 1339 O ALA A 149 -3.028 -0.791 -6.258 1.00 0.00 O ATOM 1340 CB ALA A 149 -4.825 1.870 -5.060 1.00 0.00 C ATOM 0 H ALA A 149 -3.402 3.360 -6.436 1.00 0.00 H new ATOM 0 HA ALA A 149 -2.852 1.142 -4.695 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.313 1.013 -4.595 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -4.729 2.673 -4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.424 2.215 -5.902 1.00 0.00 H new ATOM 1346 N HIS A 150 -4.197 0.523 -7.665 1.00 0.00 N ATOM 1347 CA HIS A 150 -4.341 -0.517 -8.679 1.00 0.00 C ATOM 1348 C HIS A 150 -2.976 -1.069 -9.054 1.00 0.00 C ATOM 1349 O HIS A 150 -2.813 -2.267 -9.278 1.00 0.00 O ATOM 1350 CB HIS A 150 -5.039 0.028 -9.925 1.00 0.00 C ATOM 1351 CG HIS A 150 -6.414 -0.531 -10.132 1.00 0.00 C ATOM 1352 ND1 HIS A 150 -7.442 -0.353 -9.229 1.00 0.00 N ATOM 1353 CD2 HIS A 150 -6.927 -1.269 -11.144 1.00 0.00 C ATOM 1354 CE1 HIS A 150 -8.528 -0.958 -9.678 1.00 0.00 C ATOM 1355 NE2 HIS A 150 -8.242 -1.519 -10.838 1.00 0.00 N ATOM 0 H HIS A 150 -4.632 1.413 -7.906 1.00 0.00 H new ATOM 0 HA HIS A 150 -4.953 -1.317 -8.263 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -5.104 1.113 -9.850 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -4.429 -0.195 -10.800 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -6.400 -1.599 -12.027 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.486 -0.988 -9.180 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -8.893 -2.052 -11.414 1.00 0.00 H new ATOM 1364 N ALA A 151 -1.988 -0.183 -9.104 1.00 0.00 N ATOM 1365 CA ALA A 151 -0.628 -0.590 -9.433 1.00 0.00 C ATOM 1366 C ALA A 151 -0.212 -1.763 -8.556 1.00 0.00 C ATOM 1367 O ALA A 151 0.275 -2.782 -9.044 1.00 0.00 O ATOM 1368 CB ALA A 151 0.336 0.571 -9.258 1.00 0.00 C ATOM 0 H ALA A 151 -2.102 0.814 -8.922 1.00 0.00 H new ATOM 0 HA ALA A 151 -0.599 -0.901 -10.477 1.00 0.00 H new ATOM 0 HB1 ALA A 151 1.346 0.246 -9.509 1.00 0.00 H new ATOM 0 HB2 ALA A 151 0.044 1.389 -9.917 1.00 0.00 H new ATOM 0 HB3 ALA A 151 0.311 0.912 -8.223 1.00 0.00 H new ATOM 1374 N LEU A 152 -0.434 -1.614 -7.254 1.00 0.00 N ATOM 1375 CA LEU A 152 -0.114 -2.660 -6.298 1.00 0.00 C ATOM 1376 C LEU A 152 -0.979 -3.878 -6.545 1.00 0.00 C ATOM 1377 O LEU A 152 -0.553 -5.012 -6.347 1.00 0.00 O ATOM 1378 CB LEU A 152 -0.320 -2.134 -4.889 1.00 0.00 C ATOM 1379 CG LEU A 152 0.940 -1.604 -4.222 1.00 0.00 C ATOM 1380 CD1 LEU A 152 1.903 -1.022 -5.255 1.00 0.00 C ATOM 1381 CD2 LEU A 152 0.587 -0.564 -3.175 1.00 0.00 C ATOM 0 H LEU A 152 -0.836 -0.774 -6.839 1.00 0.00 H new ATOM 0 HA LEU A 152 0.928 -2.955 -6.418 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -1.063 -1.337 -4.917 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -0.733 -2.933 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 152 1.440 -2.438 -3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 152 2.795 -0.650 -4.752 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.185 -1.797 -5.967 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.417 -0.202 -5.784 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.499 -0.195 -2.707 1.00 0.00 H new ATOM 0 HD22 LEU A 152 0.061 0.265 -3.648 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -0.053 -1.014 -2.416 1.00 0.00 H new ATOM 1393 N LYS A 153 -2.192 -3.627 -7.002 1.00 0.00 N ATOM 1394 CA LYS A 153 -3.127 -4.700 -7.322 1.00 0.00 C ATOM 1395 C LYS A 153 -2.446 -5.722 -8.234 1.00 0.00 C ATOM 1396 O LYS A 153 -2.813 -6.897 -8.258 1.00 0.00 O ATOM 1397 CB LYS A 153 -4.374 -4.133 -8.010 1.00 0.00 C ATOM 1398 CG LYS A 153 -5.557 -5.087 -8.028 1.00 0.00 C ATOM 1399 CD LYS A 153 -6.801 -4.421 -8.591 1.00 0.00 C ATOM 1400 CE LYS A 153 -7.860 -5.444 -8.971 1.00 0.00 C ATOM 1401 NZ LYS A 153 -8.931 -5.545 -7.942 1.00 0.00 N1+ ATOM 0 H LYS A 153 -2.557 -2.688 -7.162 1.00 0.00 H new ATOM 0 HA LYS A 153 -3.432 -5.190 -6.397 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -4.669 -3.214 -7.504 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -4.121 -3.865 -9.036 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -5.310 -5.964 -8.627 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -5.758 -5.439 -7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -7.210 -3.730 -7.854 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -6.533 -3.831 -9.467 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -8.302 -5.170 -9.929 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -7.391 -6.419 -9.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -9.633 -6.253 -8.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -8.514 -5.832 -7.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -9.396 -4.621 -7.833 1.00 0.00 H new ATOM 1415 N TYR A 154 -1.439 -5.256 -8.979 1.00 0.00 N ATOM 1416 CA TYR A 154 -0.683 -6.111 -9.890 1.00 0.00 C ATOM 1417 C TYR A 154 0.589 -6.638 -9.221 1.00 0.00 C ATOM 1418 O TYR A 154 1.456 -7.214 -9.877 1.00 0.00 O ATOM 1419 CB TYR A 154 -0.316 -5.333 -11.157 1.00 0.00 C ATOM 1420 CG TYR A 154 -1.511 -4.933 -11.991 1.00 0.00 C ATOM 1421 CD1 TYR A 154 -2.144 -5.852 -12.820 1.00 0.00 C ATOM 1422 CD2 TYR A 154 -2.006 -3.635 -11.952 1.00 0.00 C ATOM 1423 CE1 TYR A 154 -3.237 -5.488 -13.585 1.00 0.00 C ATOM 1424 CE2 TYR A 154 -3.097 -3.264 -12.713 1.00 0.00 C ATOM 1425 CZ TYR A 154 -3.709 -4.193 -13.528 1.00 0.00 C ATOM 1426 OH TYR A 154 -4.796 -3.828 -14.288 1.00 0.00 O ATOM 0 H TYR A 154 -1.129 -4.284 -8.966 1.00 0.00 H new ATOM 0 HA TYR A 154 -1.311 -6.962 -10.155 1.00 0.00 H new ATOM 0 HB2 TYR A 154 0.236 -4.436 -10.875 1.00 0.00 H new ATOM 0 HB3 TYR A 154 0.353 -5.941 -11.765 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -1.776 -6.866 -12.867 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -1.529 -2.904 -11.316 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -3.719 -6.214 -14.224 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.469 -2.251 -12.670 1.00 0.00 H new ATOM 0 HH TYR A 154 -5.002 -2.883 -14.132 1.00 0.00 H new ATOM 1436 N SER A 155 0.687 -6.435 -7.910 1.00 0.00 N ATOM 1437 CA SER A 155 1.832 -6.881 -7.135 1.00 0.00 C ATOM 1438 C SER A 155 1.438 -8.066 -6.275 1.00 0.00 C ATOM 1439 O SER A 155 0.822 -7.907 -5.221 1.00 0.00 O ATOM 1440 CB SER A 155 2.340 -5.749 -6.248 1.00 0.00 C ATOM 1441 OG SER A 155 3.367 -6.203 -5.382 1.00 0.00 O ATOM 0 H SER A 155 -0.026 -5.957 -7.359 1.00 0.00 H new ATOM 0 HA SER A 155 2.627 -7.179 -7.819 1.00 0.00 H new ATOM 0 HB2 SER A 155 2.716 -4.936 -6.869 1.00 0.00 H new ATOM 0 HB3 SER A 155 1.516 -5.345 -5.660 1.00 0.00 H new ATOM 0 HG SER A 155 3.226 -5.833 -4.485 1.00 0.00 H new ATOM 1447 N VAL A 156 1.778 -9.253 -6.739 1.00 0.00 N ATOM 1448 CA VAL A 156 1.442 -10.466 -6.023 1.00 0.00 C ATOM 1449 C VAL A 156 2.618 -10.985 -5.197 1.00 0.00 C ATOM 1450 O VAL A 156 2.537 -12.054 -4.592 1.00 0.00 O ATOM 1451 CB VAL A 156 0.954 -11.543 -7.002 1.00 0.00 C ATOM 1452 CG1 VAL A 156 2.096 -12.034 -7.881 1.00 0.00 C ATOM 1453 CG2 VAL A 156 0.302 -12.696 -6.257 1.00 0.00 C ATOM 0 H VAL A 156 2.287 -9.402 -7.610 1.00 0.00 H new ATOM 0 HA VAL A 156 0.638 -10.227 -5.327 1.00 0.00 H new ATOM 0 HB VAL A 156 0.201 -11.096 -7.651 1.00 0.00 H new ATOM 0 HG11 VAL A 156 1.726 -12.797 -8.566 1.00 0.00 H new ATOM 0 HG12 VAL A 156 2.501 -11.198 -8.452 1.00 0.00 H new ATOM 0 HG13 VAL A 156 2.880 -12.459 -7.255 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -0.036 -13.446 -6.972 1.00 0.00 H new ATOM 0 HG22 VAL A 156 1.025 -13.144 -5.575 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -0.552 -12.326 -5.689 1.00 0.00 H new ATOM 1463 N VAL A 157 3.705 -10.214 -5.158 1.00 0.00 N ATOM 1464 CA VAL A 157 4.879 -10.595 -4.385 1.00 0.00 C ATOM 1465 C VAL A 157 4.569 -10.524 -2.895 1.00 0.00 C ATOM 1466 O VAL A 157 4.987 -11.381 -2.117 1.00 0.00 O ATOM 1467 CB VAL A 157 6.082 -9.684 -4.697 1.00 0.00 C ATOM 1468 CG1 VAL A 157 7.323 -10.160 -3.955 1.00 0.00 C ATOM 1469 CG2 VAL A 157 6.336 -9.630 -6.195 1.00 0.00 C ATOM 0 H VAL A 157 3.793 -9.326 -5.652 1.00 0.00 H new ATOM 0 HA VAL A 157 5.139 -11.616 -4.663 1.00 0.00 H new ATOM 0 HB VAL A 157 5.848 -8.676 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 157 8.161 -9.503 -4.189 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.135 -10.140 -2.882 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.563 -11.178 -4.263 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.189 -8.982 -6.396 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.547 -10.633 -6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 157 5.454 -9.236 -6.700 1.00 0.00 H new ATOM 1479 N LEU A 158 3.812 -9.500 -2.514 1.00 0.00 N ATOM 1480 CA LEU A 158 3.413 -9.307 -1.127 1.00 0.00 C ATOM 1481 C LEU A 158 1.962 -9.738 -0.962 1.00 0.00 C ATOM 1482 O LEU A 158 1.280 -10.014 -1.948 1.00 0.00 O ATOM 1483 CB LEU A 158 3.560 -7.833 -0.721 1.00 0.00 C ATOM 1484 CG LEU A 158 4.984 -7.261 -0.749 1.00 0.00 C ATOM 1485 CD1 LEU A 158 5.795 -7.767 0.433 1.00 0.00 C ATOM 1486 CD2 LEU A 158 5.681 -7.598 -2.060 1.00 0.00 C ATOM 0 H LEU A 158 3.461 -8.787 -3.153 1.00 0.00 H new ATOM 0 HA LEU A 158 4.058 -9.908 -0.486 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.936 -7.232 -1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.163 -7.714 0.287 1.00 0.00 H new ATOM 0 HG LEU A 158 4.910 -6.176 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.800 -7.348 0.391 1.00 0.00 H new ATOM 0 HD12 LEU A 158 5.313 -7.462 1.362 1.00 0.00 H new ATOM 0 HD13 LEU A 158 5.854 -8.855 0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 158 6.688 -7.181 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 158 5.737 -8.681 -2.175 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.118 -7.174 -2.891 1.00 0.00 H new ATOM 1498 N GLU A 159 1.481 -9.779 0.273 1.00 0.00 N ATOM 1499 CA GLU A 159 0.101 -10.157 0.517 1.00 0.00 C ATOM 1500 C GLU A 159 -0.743 -8.898 0.681 1.00 0.00 C ATOM 1501 O GLU A 159 -0.604 -8.169 1.654 1.00 0.00 O ATOM 1502 CB GLU A 159 0.006 -11.054 1.757 1.00 0.00 C ATOM 1503 CG GLU A 159 -1.386 -11.128 2.361 1.00 0.00 C ATOM 1504 CD GLU A 159 -2.380 -11.827 1.454 1.00 0.00 C ATOM 1505 OE1 GLU A 159 -1.962 -12.729 0.699 1.00 0.00 O1- ATOM 1506 OE2 GLU A 159 -3.577 -11.473 1.500 1.00 0.00 O ATOM 0 H GLU A 159 2.020 -9.558 1.110 1.00 0.00 H new ATOM 0 HA GLU A 159 -0.279 -10.726 -0.332 1.00 0.00 H new ATOM 0 HB2 GLU A 159 0.329 -12.060 1.490 1.00 0.00 H new ATOM 0 HB3 GLU A 159 0.700 -10.686 2.513 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -1.337 -11.655 3.314 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -1.740 -10.119 2.572 1.00 0.00 H new ATOM 1513 N LEU A 160 -1.602 -8.646 -0.294 1.00 0.00 N ATOM 1514 CA LEU A 160 -2.461 -7.469 -0.289 1.00 0.00 C ATOM 1515 C LEU A 160 -3.852 -7.817 0.223 1.00 0.00 C ATOM 1516 O LEU A 160 -4.310 -8.945 0.035 1.00 0.00 O ATOM 1517 CB LEU A 160 -2.595 -6.950 -1.725 1.00 0.00 C ATOM 1518 CG LEU A 160 -1.515 -5.994 -2.225 1.00 0.00 C ATOM 1519 CD1 LEU A 160 -2.072 -4.586 -2.398 1.00 0.00 C ATOM 1520 CD2 LEU A 160 -0.306 -6.014 -1.305 1.00 0.00 C ATOM 0 H LEU A 160 -1.724 -9.248 -1.108 1.00 0.00 H new ATOM 0 HA LEU A 160 -2.017 -6.716 0.363 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -2.621 -7.810 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -3.558 -6.448 -1.814 1.00 0.00 H new ATOM 0 HG LEU A 160 -1.183 -6.334 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -1.283 -3.924 -2.755 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -2.886 -4.603 -3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -2.445 -4.222 -1.441 1.00 0.00 H new ATOM 0 HD21 LEU A 160 0.450 -5.325 -1.682 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -0.607 -5.710 -0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 160 0.107 -7.022 -1.269 1.00 0.00 H new ATOM 1532 N ASN A 161 -4.564 -6.849 0.816 1.00 0.00 N ATOM 1533 CA ASN A 161 -5.928 -7.144 1.250 1.00 0.00 C ATOM 1534 C ASN A 161 -6.700 -7.427 -0.006 1.00 0.00 C ATOM 1535 O ASN A 161 -6.285 -6.925 -1.047 1.00 0.00 O ATOM 1536 CB ASN A 161 -6.580 -5.984 2.005 1.00 0.00 C ATOM 1537 CG ASN A 161 -8.084 -6.140 2.139 1.00 0.00 C ATOM 1538 OD1 ASN A 161 -8.585 -7.230 2.418 1.00 0.00 O ATOM 1539 ND2 ASN A 161 -8.812 -5.048 1.939 1.00 0.00 N ATOM 0 H ASN A 161 -4.236 -5.901 0.998 1.00 0.00 H new ATOM 0 HA ASN A 161 -5.920 -7.983 1.946 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -6.137 -5.909 2.998 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -6.361 -5.050 1.487 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -9.828 -5.092 2.015 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -8.355 -4.165 1.710 1.00 0.00 H new ATOM 1546 N GLU A 162 -7.784 -8.212 0.140 1.00 0.00 N ATOM 1547 CA GLU A 162 -8.658 -8.694 -0.943 1.00 0.00 C ATOM 1548 C GLU A 162 -8.881 -7.740 -2.103 1.00 0.00 C ATOM 1549 O GLU A 162 -8.658 -8.114 -3.255 1.00 0.00 O ATOM 1550 CB GLU A 162 -10.012 -9.059 -0.346 1.00 0.00 C ATOM 1551 CG GLU A 162 -10.853 -9.906 -1.272 1.00 0.00 C ATOM 1552 CD GLU A 162 -12.279 -9.405 -1.396 1.00 0.00 C ATOM 1553 OE1 GLU A 162 -12.465 -8.242 -1.811 1.00 0.00 O ATOM 1554 OE2 GLU A 162 -13.209 -10.176 -1.079 1.00 0.00 O1- ATOM 0 H GLU A 162 -8.087 -8.541 1.057 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.132 -9.546 -1.375 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.858 -9.596 0.590 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -10.555 -8.145 -0.104 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -10.392 -9.924 -2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.864 -10.933 -0.907 1.00 0.00 H new ATOM 1561 N ASP A 163 -9.286 -6.523 -1.833 1.00 0.00 N ATOM 1562 CA ASP A 163 -9.486 -5.565 -2.910 1.00 0.00 C ATOM 1563 C ASP A 163 -8.149 -4.924 -3.196 1.00 0.00 C ATOM 1564 O ASP A 163 -8.058 -3.753 -3.566 1.00 0.00 O ATOM 1565 CB ASP A 163 -10.522 -4.510 -2.516 1.00 0.00 C ATOM 1566 CG ASP A 163 -10.932 -3.635 -3.684 1.00 0.00 C ATOM 1567 OD1 ASP A 163 -10.243 -2.626 -3.943 1.00 0.00 O ATOM 1568 OD2 ASP A 163 -11.943 -3.959 -4.342 1.00 0.00 O1- ATOM 0 H ASP A 163 -9.483 -6.170 -0.896 1.00 0.00 H new ATOM 0 HA ASP A 163 -9.867 -6.067 -3.800 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -11.404 -5.005 -2.110 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -10.114 -3.884 -1.722 1.00 0.00 H new ATOM 1573 N HIS A 164 -7.101 -5.711 -2.935 1.00 0.00 N ATOM 1574 CA HIS A 164 -5.733 -5.274 -3.059 1.00 0.00 C ATOM 1575 C HIS A 164 -5.607 -3.872 -2.530 1.00 0.00 C ATOM 1576 O HIS A 164 -4.794 -3.068 -2.983 1.00 0.00 O ATOM 1577 CB HIS A 164 -5.208 -5.440 -4.475 1.00 0.00 C ATOM 1578 CG HIS A 164 -5.036 -6.888 -4.818 1.00 0.00 C ATOM 1579 ND1 HIS A 164 -4.604 -7.346 -6.045 1.00 0.00 N ATOM 1580 CD2 HIS A 164 -5.243 -7.995 -4.056 1.00 0.00 C ATOM 1581 CE1 HIS A 164 -4.556 -8.667 -6.026 1.00 0.00 C ATOM 1582 NE2 HIS A 164 -4.936 -9.084 -4.833 1.00 0.00 N ATOM 0 H HIS A 164 -7.194 -6.679 -2.629 1.00 0.00 H new ATOM 0 HA HIS A 164 -5.093 -5.914 -2.451 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -5.898 -4.975 -5.179 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -4.254 -4.923 -4.576 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -5.585 -8.014 -3.032 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -4.256 -9.299 -6.849 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -4.992 -10.058 -4.536 1.00 0.00 H new ATOM 1591 N ARG A 165 -6.434 -3.618 -1.523 1.00 0.00 N ATOM 1592 CA ARG A 165 -6.462 -2.360 -0.853 1.00 0.00 C ATOM 1593 C ARG A 165 -5.479 -2.384 0.285 1.00 0.00 C ATOM 1594 O ARG A 165 -5.163 -1.333 0.844 1.00 0.00 O ATOM 1595 CB ARG A 165 -7.868 -2.049 -0.337 1.00 0.00 C ATOM 1596 CG ARG A 165 -8.817 -1.550 -1.415 1.00 0.00 C ATOM 1597 CD ARG A 165 -8.236 -0.366 -2.169 1.00 0.00 C ATOM 1598 NE ARG A 165 -9.148 0.774 -2.189 1.00 0.00 N ATOM 1599 CZ ARG A 165 -9.001 1.828 -2.988 1.00 0.00 C ATOM 1600 NH1 ARG A 165 -7.980 1.891 -3.834 1.00 0.00 N1+ ATOM 1601 NH2 ARG A 165 -9.877 2.822 -2.941 1.00 0.00 N ATOM 0 H ARG A 165 -7.103 -4.297 -1.159 1.00 0.00 H new ATOM 0 HA ARG A 165 -6.184 -1.576 -1.557 1.00 0.00 H new ATOM 0 HB2 ARG A 165 -8.287 -2.948 0.116 1.00 0.00 H new ATOM 0 HB3 ARG A 165 -7.799 -1.298 0.450 1.00 0.00 H new ATOM 0 HG2 ARG A 165 -9.031 -2.358 -2.115 1.00 0.00 H new ATOM 0 HG3 ARG A 165 -9.765 -1.263 -0.961 1.00 0.00 H new ATOM 0 HD2 ARG A 165 -7.295 -0.069 -1.706 1.00 0.00 H new ATOM 0 HD3 ARG A 165 -8.008 -0.665 -3.192 1.00 0.00 H new ATOM 0 HE ARG A 165 -9.945 0.762 -1.553 1.00 0.00 H new ATOM 0 HH11 ARG A 165 -7.303 1.129 -3.874 1.00 0.00 H new ATOM 0 HH12 ARG A 165 -7.872 2.701 -4.444 1.00 0.00 H new ATOM 0 HH21 ARG A 165 -10.663 2.779 -2.293 1.00 0.00 H new ATOM 0 HH22 ARG A 165 -9.765 3.630 -3.553 1.00 0.00 H new ATOM 1615 N LYS A 166 -4.960 -3.573 0.642 1.00 0.00 N ATOM 1616 CA LYS A 166 -3.983 -3.579 1.740 1.00 0.00 C ATOM 1617 C LYS A 166 -2.726 -4.340 1.377 1.00 0.00 C ATOM 1618 O LYS A 166 -2.598 -4.845 0.267 1.00 0.00 O ATOM 1619 CB LYS A 166 -4.588 -4.113 3.037 1.00 0.00 C ATOM 1620 CG LYS A 166 -5.911 -3.443 3.401 1.00 0.00 C ATOM 1621 CD LYS A 166 -6.624 -4.132 4.562 1.00 0.00 C ATOM 1622 CE LYS A 166 -5.648 -4.680 5.592 1.00 0.00 C ATOM 1623 NZ LYS A 166 -6.340 -5.106 6.841 1.00 0.00 N1+ ATOM 0 H LYS A 166 -5.179 -4.477 0.223 1.00 0.00 H new ATOM 0 HA LYS A 166 -3.701 -2.540 1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -4.746 -5.187 2.942 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -3.877 -3.966 3.850 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -5.726 -2.401 3.662 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -6.564 -3.442 2.529 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -7.298 -3.424 5.044 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -7.238 -4.946 4.177 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -5.110 -5.528 5.168 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -4.905 -3.918 5.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -5.892 -4.647 7.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -7.342 -4.830 6.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -6.270 -6.139 6.942 1.00 0.00 H new ATOM 1637 N VAL A 167 -1.796 -4.405 2.318 1.00 0.00 N ATOM 1638 CA VAL A 167 -0.547 -5.100 2.097 1.00 0.00 C ATOM 1639 C VAL A 167 0.013 -5.623 3.405 1.00 0.00 C ATOM 1640 O VAL A 167 0.764 -4.947 4.106 1.00 0.00 O ATOM 1641 CB VAL A 167 0.482 -4.208 1.369 1.00 0.00 C ATOM 1642 CG1 VAL A 167 0.541 -2.815 1.985 1.00 0.00 C ATOM 1643 CG2 VAL A 167 1.862 -4.852 1.356 1.00 0.00 C ATOM 0 H VAL A 167 -1.888 -3.983 3.242 1.00 0.00 H new ATOM 0 HA VAL A 167 -0.753 -5.951 1.448 1.00 0.00 H new ATOM 0 HB VAL A 167 0.150 -4.105 0.336 1.00 0.00 H new ATOM 0 HG11 VAL A 167 1.274 -2.211 1.450 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -0.439 -2.343 1.913 1.00 0.00 H new ATOM 0 HG13 VAL A 167 0.830 -2.893 3.033 1.00 0.00 H new ATOM 0 HG21 VAL A 167 2.563 -4.199 0.836 1.00 0.00 H new ATOM 0 HG22 VAL A 167 2.201 -5.007 2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 167 1.811 -5.812 0.842 1.00 0.00 H new ATOM 1653 N ARG A 168 -0.374 -6.847 3.714 1.00 0.00 N ATOM 1654 CA ARG A 168 0.069 -7.509 4.934 1.00 0.00 C ATOM 1655 C ARG A 168 1.146 -8.544 4.620 1.00 0.00 C ATOM 1656 O ARG A 168 1.367 -8.887 3.460 1.00 0.00 O ATOM 1657 CB ARG A 168 -1.115 -8.175 5.641 1.00 0.00 C ATOM 1658 CG ARG A 168 -1.690 -9.367 4.892 1.00 0.00 C ATOM 1659 CD ARG A 168 -2.549 -10.234 5.798 1.00 0.00 C ATOM 1660 NE ARG A 168 -1.829 -11.413 6.273 1.00 0.00 N ATOM 1661 CZ ARG A 168 -2.423 -12.494 6.772 1.00 0.00 C ATOM 1662 NH1 ARG A 168 -3.746 -12.549 6.866 1.00 0.00 N1+ ATOM 1663 NH2 ARG A 168 -1.693 -13.523 7.180 1.00 0.00 N ATOM 0 H ARG A 168 -0.998 -7.408 3.135 1.00 0.00 H new ATOM 0 HA ARG A 168 0.494 -6.756 5.598 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -0.798 -8.500 6.632 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -1.902 -7.435 5.785 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -2.287 -9.015 4.051 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -0.877 -9.965 4.479 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -2.883 -9.645 6.652 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -3.442 -10.548 5.258 1.00 0.00 H new ATOM 0 HE ARG A 168 -0.810 -11.407 6.219 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -4.313 -11.760 6.555 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -4.196 -13.380 7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -0.676 -13.486 7.111 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -2.148 -14.352 7.563 1.00 0.00 H new ATOM 1677 N ARG A 169 1.815 -9.032 5.658 1.00 0.00 N ATOM 1678 CA ARG A 169 2.871 -10.024 5.485 1.00 0.00 C ATOM 1679 C ARG A 169 2.414 -11.398 5.959 1.00 0.00 C ATOM 1680 O ARG A 169 1.514 -11.513 6.791 1.00 0.00 O ATOM 1681 CB ARG A 169 4.128 -9.604 6.248 1.00 0.00 C ATOM 1682 CG ARG A 169 4.474 -8.133 6.086 1.00 0.00 C ATOM 1683 CD ARG A 169 3.936 -7.297 7.237 1.00 0.00 C ATOM 1684 NE ARG A 169 4.776 -7.401 8.430 1.00 0.00 N ATOM 1685 CZ ARG A 169 4.519 -8.207 9.459 1.00 0.00 C ATOM 1686 NH1 ARG A 169 3.449 -8.997 9.449 1.00 0.00 N1+ ATOM 1687 NH2 ARG A 169 5.335 -8.226 10.503 1.00 0.00 N ATOM 0 H ARG A 169 1.646 -8.758 6.626 1.00 0.00 H new ATOM 0 HA ARG A 169 3.102 -10.084 4.421 1.00 0.00 H new ATOM 0 HB2 ARG A 169 3.990 -9.822 7.307 1.00 0.00 H new ATOM 0 HB3 ARG A 169 4.969 -10.207 5.906 1.00 0.00 H new ATOM 0 HG2 ARG A 169 5.556 -8.018 6.028 1.00 0.00 H new ATOM 0 HG3 ARG A 169 4.064 -7.764 5.146 1.00 0.00 H new ATOM 0 HD2 ARG A 169 3.872 -6.254 6.928 1.00 0.00 H new ATOM 0 HD3 ARG A 169 2.923 -7.620 7.477 1.00 0.00 H new ATOM 0 HE ARG A 169 5.612 -6.819 8.477 1.00 0.00 H new ATOM 0 HH11 ARG A 169 2.817 -8.989 8.649 1.00 0.00 H new ATOM 0 HH12 ARG A 169 3.261 -9.611 10.242 1.00 0.00 H new ATOM 0 HH21 ARG A 169 6.158 -7.624 10.518 1.00 0.00 H new ATOM 0 HH22 ARG A 169 5.140 -8.843 11.292 1.00 0.00 H new ATOM 1701 N THR A 170 3.044 -12.439 5.426 1.00 0.00 N ATOM 1702 CA THR A 170 2.709 -13.807 5.793 1.00 0.00 C ATOM 1703 C THR A 170 3.869 -14.482 6.526 1.00 0.00 C ATOM 1704 O THR A 170 3.704 -15.554 7.107 1.00 0.00 O ATOM 1705 CB THR A 170 2.350 -14.608 4.543 1.00 0.00 C ATOM 1706 OG1 THR A 170 3.489 -14.796 3.723 1.00 0.00 O ATOM 1707 CG2 THR A 170 1.279 -13.952 3.699 1.00 0.00 C ATOM 0 H THR A 170 3.791 -12.359 4.736 1.00 0.00 H new ATOM 0 HA THR A 170 1.852 -13.778 6.465 1.00 0.00 H new ATOM 0 HB THR A 170 1.967 -15.560 4.910 1.00 0.00 H new ATOM 0 HG1 THR A 170 3.239 -15.313 2.929 1.00 0.00 H new ATOM 0 HG21 THR A 170 1.072 -14.573 2.827 1.00 0.00 H new ATOM 0 HG22 THR A 170 0.369 -13.839 4.289 1.00 0.00 H new ATOM 0 HG23 THR A 170 1.623 -12.971 3.372 1.00 0.00 H new ATOM 1715 N THR A 171 5.043 -13.854 6.490 1.00 0.00 N ATOM 1716 CA THR A 171 6.223 -14.405 7.147 1.00 0.00 C ATOM 1717 C THR A 171 7.253 -13.312 7.433 1.00 0.00 C ATOM 1718 O THR A 171 8.322 -13.281 6.821 1.00 0.00 O ATOM 1719 CB THR A 171 6.848 -15.490 6.270 1.00 0.00 C ATOM 1720 OG1 THR A 171 8.121 -15.864 6.766 1.00 0.00 O ATOM 1721 CG2 THR A 171 7.022 -15.057 4.831 1.00 0.00 C ATOM 0 H THR A 171 5.201 -12.966 6.014 1.00 0.00 H new ATOM 0 HA THR A 171 5.912 -14.840 8.097 1.00 0.00 H new ATOM 0 HB THR A 171 6.154 -16.330 6.301 1.00 0.00 H new ATOM 0 HG1 THR A 171 8.737 -15.106 6.690 1.00 0.00 H new ATOM 0 HG21 THR A 171 7.470 -15.869 4.258 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.050 -14.807 4.406 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.672 -14.183 4.790 1.00 0.00 H new ATOM 1729 N PRO A 172 6.946 -12.397 8.367 1.00 0.00 N ATOM 1730 CA PRO A 172 7.851 -11.304 8.725 1.00 0.00 C ATOM 1731 C PRO A 172 8.991 -11.760 9.628 1.00 0.00 C ATOM 1732 O PRO A 172 8.813 -12.633 10.477 1.00 0.00 O ATOM 1733 CB PRO A 172 6.942 -10.331 9.466 1.00 0.00 C ATOM 1734 CG PRO A 172 5.898 -11.194 10.087 1.00 0.00 C ATOM 1735 CD PRO A 172 5.692 -12.353 9.146 1.00 0.00 C ATOM 0 HA PRO A 172 8.341 -10.877 7.850 1.00 0.00 H new ATOM 0 HB2 PRO A 172 7.493 -9.769 10.220 1.00 0.00 H new ATOM 0 HB3 PRO A 172 6.501 -9.603 8.785 1.00 0.00 H new ATOM 0 HG2 PRO A 172 6.216 -11.543 11.070 1.00 0.00 H new ATOM 0 HG3 PRO A 172 4.970 -10.640 10.230 1.00 0.00 H new ATOM 0 HD2 PRO A 172 5.524 -13.284 9.688 1.00 0.00 H new ATOM 0 HD3 PRO A 172 4.826 -12.198 8.503 1.00 0.00 H new ATOM 1743 N VAL A 173 10.161 -11.160 9.439 1.00 0.00 N ATOM 1744 CA VAL A 173 11.330 -11.492 10.224 1.00 0.00 C ATOM 1745 C VAL A 173 11.558 -10.451 11.316 1.00 0.00 C ATOM 1746 O VAL A 173 11.216 -9.281 11.147 1.00 0.00 O ATOM 1747 CB VAL A 173 12.584 -11.602 9.338 1.00 0.00 C ATOM 1748 CG1 VAL A 173 12.806 -13.044 8.932 1.00 0.00 C ATOM 1749 CG2 VAL A 173 12.478 -10.717 8.103 1.00 0.00 C ATOM 0 H VAL A 173 10.319 -10.434 8.740 1.00 0.00 H new ATOM 0 HA VAL A 173 11.150 -12.462 10.688 1.00 0.00 H new ATOM 0 HB VAL A 173 13.438 -11.255 9.921 1.00 0.00 H new ATOM 0 HG11 VAL A 173 13.695 -13.113 8.305 1.00 0.00 H new ATOM 0 HG12 VAL A 173 12.942 -13.656 9.824 1.00 0.00 H new ATOM 0 HG13 VAL A 173 11.941 -13.402 8.374 1.00 0.00 H new ATOM 0 HG21 VAL A 173 13.381 -10.821 7.502 1.00 0.00 H new ATOM 0 HG22 VAL A 173 11.613 -11.018 7.513 1.00 0.00 H new ATOM 0 HG23 VAL A 173 12.364 -9.677 8.409 1.00 0.00 H new ATOM 1759 N PRO A 174 12.130 -10.863 12.460 1.00 0.00 N ATOM 1760 CA PRO A 174 12.386 -9.957 13.584 1.00 0.00 C ATOM 1761 C PRO A 174 13.233 -8.756 13.179 1.00 0.00 C ATOM 1762 O PRO A 174 14.220 -8.890 12.457 1.00 0.00 O ATOM 1763 CB PRO A 174 13.140 -10.829 14.600 1.00 0.00 C ATOM 1764 CG PRO A 174 13.579 -12.036 13.839 1.00 0.00 C ATOM 1765 CD PRO A 174 12.560 -12.236 12.756 1.00 0.00 C ATOM 0 HA PRO A 174 11.461 -9.535 13.978 1.00 0.00 H new ATOM 0 HB2 PRO A 174 13.994 -10.296 15.018 1.00 0.00 H new ATOM 0 HB3 PRO A 174 12.496 -11.104 15.436 1.00 0.00 H new ATOM 0 HG2 PRO A 174 14.573 -11.891 13.417 1.00 0.00 H new ATOM 0 HG3 PRO A 174 13.633 -12.909 14.490 1.00 0.00 H new ATOM 0 HD2 PRO A 174 12.990 -12.723 11.881 1.00 0.00 H new ATOM 0 HD3 PRO A 174 11.729 -12.857 13.091 1.00 0.00 H new ATOM 1773 N LEU A 175 12.828 -7.580 13.648 1.00 0.00 N ATOM 1774 CA LEU A 175 13.513 -6.350 13.351 1.00 0.00 C ATOM 1775 C LEU A 175 14.220 -5.815 14.590 1.00 0.00 C ATOM 1776 O LEU A 175 15.349 -5.328 14.525 1.00 0.00 O ATOM 1777 CB LEU A 175 12.524 -5.285 12.866 1.00 0.00 C ATOM 1778 CG LEU A 175 11.031 -5.608 12.958 1.00 0.00 C ATOM 1779 CD1 LEU A 175 10.711 -6.771 12.056 1.00 0.00 C ATOM 1780 CD2 LEU A 175 10.569 -5.874 14.391 1.00 0.00 C ATOM 0 H LEU A 175 12.010 -7.465 14.247 1.00 0.00 H new ATOM 0 HA LEU A 175 14.243 -6.563 12.570 1.00 0.00 H new ATOM 0 HB2 LEU A 175 12.706 -4.374 13.436 1.00 0.00 H new ATOM 0 HB3 LEU A 175 12.755 -5.061 11.825 1.00 0.00 H new ATOM 0 HG LEU A 175 10.480 -4.729 12.625 1.00 0.00 H new ATOM 0 HD11 LEU A 175 9.648 -7.001 12.122 1.00 0.00 H new ATOM 0 HD12 LEU A 175 10.964 -6.514 11.027 1.00 0.00 H new ATOM 0 HD13 LEU A 175 11.290 -7.641 12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 175 9.502 -6.097 14.394 1.00 0.00 H new ATOM 0 HD22 LEU A 175 11.118 -6.722 14.799 1.00 0.00 H new ATOM 0 HD23 LEU A 175 10.757 -4.992 15.003 1.00 0.00 H new ATOM 1792 N PHE A 176 13.531 -5.915 15.714 1.00 0.00 N ATOM 1793 CA PHE A 176 14.045 -5.453 16.988 1.00 0.00 C ATOM 1794 C PHE A 176 13.545 -6.363 18.095 1.00 0.00 C ATOM 1795 O PHE A 176 12.387 -6.288 18.506 1.00 0.00 O ATOM 1796 CB PHE A 176 13.569 -4.021 17.242 1.00 0.00 C ATOM 1797 CG PHE A 176 12.271 -3.680 16.563 1.00 0.00 C ATOM 1798 CD1 PHE A 176 12.249 -3.285 15.236 1.00 0.00 C ATOM 1799 CD2 PHE A 176 11.070 -3.784 17.246 1.00 0.00 C ATOM 1800 CE1 PHE A 176 11.052 -2.998 14.602 1.00 0.00 C ATOM 1801 CE2 PHE A 176 9.872 -3.494 16.620 1.00 0.00 C ATOM 1802 CZ PHE A 176 9.863 -3.102 15.296 1.00 0.00 C ATOM 0 H PHE A 176 12.597 -6.321 15.767 1.00 0.00 H new ATOM 0 HA PHE A 176 15.135 -5.472 16.970 1.00 0.00 H new ATOM 0 HB2 PHE A 176 13.456 -3.871 18.316 1.00 0.00 H new ATOM 0 HB3 PHE A 176 14.338 -3.327 16.903 1.00 0.00 H new ATOM 0 HD1 PHE A 176 13.176 -3.200 14.689 1.00 0.00 H new ATOM 0 HD2 PHE A 176 11.070 -4.095 18.280 1.00 0.00 H new ATOM 0 HE1 PHE A 176 11.048 -2.693 13.566 1.00 0.00 H new ATOM 0 HE2 PHE A 176 8.944 -3.574 17.166 1.00 0.00 H new ATOM 0 HZ PHE A 176 8.928 -2.877 14.804 1.00 0.00 H new ATOM 1812 N PRO A 177 14.417 -7.238 18.585 1.00 0.00 N ATOM 1813 CA PRO A 177 14.103 -8.193 19.649 1.00 0.00 C ATOM 1814 C PRO A 177 14.018 -7.539 21.023 1.00 0.00 C ATOM 1815 O PRO A 177 13.410 -8.085 21.943 1.00 0.00 O ATOM 1816 CB PRO A 177 15.268 -9.196 19.557 1.00 0.00 C ATOM 1817 CG PRO A 177 15.895 -8.889 18.236 1.00 0.00 C ATOM 1818 CD PRO A 177 15.795 -7.414 18.134 1.00 0.00 C ATOM 0 HA PRO A 177 13.123 -8.654 19.526 1.00 0.00 H new ATOM 0 HB2 PRO A 177 15.975 -9.065 20.376 1.00 0.00 H new ATOM 0 HB3 PRO A 177 14.914 -10.226 19.603 1.00 0.00 H new ATOM 0 HG2 PRO A 177 16.932 -9.224 18.197 1.00 0.00 H new ATOM 0 HG3 PRO A 177 15.370 -9.383 17.419 1.00 0.00 H new ATOM 0 HD2 PRO A 177 16.514 -6.900 18.772 1.00 0.00 H new ATOM 0 HD3 PRO A 177 15.954 -7.052 17.118 1.00 0.00 H new ATOM 1826 N ASN A 178 14.645 -6.372 21.161 1.00 0.00 N ATOM 1827 CA ASN A 178 14.650 -5.657 22.429 1.00 0.00 C ATOM 1828 C ASN A 178 13.622 -4.541 22.427 1.00 0.00 C ATOM 1829 O ASN A 178 13.114 -4.148 23.477 1.00 0.00 O ATOM 1830 CB ASN A 178 16.040 -5.087 22.712 1.00 0.00 C ATOM 1831 CG ASN A 178 16.372 -5.080 24.192 1.00 0.00 C ATOM 1832 OD1 ASN A 178 15.499 -4.877 25.035 1.00 0.00 O ATOM 1833 ND2 ASN A 178 17.641 -5.303 24.515 1.00 0.00 N ATOM 0 H ASN A 178 15.154 -5.905 20.410 1.00 0.00 H new ATOM 0 HA ASN A 178 14.388 -6.364 23.216 1.00 0.00 H new ATOM 0 HB2 ASN A 178 16.786 -5.675 22.178 1.00 0.00 H new ATOM 0 HB3 ASN A 178 16.098 -4.070 22.325 1.00 0.00 H new ATOM 0 HD21 ASN A 178 17.924 -5.311 25.495 1.00 0.00 H new ATOM 0 HD22 ASN A 178 18.332 -5.467 23.783 1.00 0.00 H new ATOM 1840 N GLU A 179 13.328 -4.021 21.244 1.00 0.00 N ATOM 1841 CA GLU A 179 12.367 -2.937 21.114 1.00 0.00 C ATOM 1842 C GLU A 179 10.936 -3.458 21.096 1.00 0.00 C ATOM 1843 O GLU A 179 9.989 -2.719 21.365 1.00 0.00 O ATOM 1844 CB GLU A 179 12.657 -2.155 19.845 1.00 0.00 C ATOM 1845 CG GLU A 179 11.722 -0.977 19.618 1.00 0.00 C ATOM 1846 CD GLU A 179 12.019 0.187 20.541 1.00 0.00 C ATOM 1847 OE1 GLU A 179 12.983 0.932 20.267 1.00 0.00 O1- ATOM 1848 OE2 GLU A 179 11.286 0.355 21.539 1.00 0.00 O ATOM 0 H GLU A 179 13.740 -4.331 20.364 1.00 0.00 H new ATOM 0 HA GLU A 179 12.467 -2.283 21.980 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.683 -1.789 19.882 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.589 -2.829 18.991 1.00 0.00 H new ATOM 0 HG2 GLU A 179 11.805 -0.646 18.583 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.692 -1.301 19.767 1.00 0.00 H new ATOM 1855 N ASN A 180 10.791 -4.732 20.778 1.00 0.00 N ATOM 1856 CA ASN A 180 9.478 -5.364 20.722 1.00 0.00 C ATOM 1857 C ASN A 180 9.448 -6.642 21.554 1.00 0.00 C ATOM 1858 O ASN A 180 10.287 -7.527 21.381 1.00 0.00 O ATOM 1859 CB ASN A 180 9.100 -5.678 19.273 1.00 0.00 C ATOM 1860 CG ASN A 180 7.646 -6.084 19.131 1.00 0.00 C ATOM 1861 OD1 ASN A 180 6.825 -5.816 20.008 1.00 0.00 O ATOM 1862 ND2 ASN A 180 7.320 -6.738 18.022 1.00 0.00 N ATOM 0 H ASN A 180 11.567 -5.354 20.553 1.00 0.00 H new ATOM 0 HA ASN A 180 8.752 -4.665 21.138 1.00 0.00 H new ATOM 0 HB2 ASN A 180 9.293 -4.803 18.652 1.00 0.00 H new ATOM 0 HB3 ASN A 180 9.737 -6.480 18.900 1.00 0.00 H new ATOM 0 HD21 ASN A 180 6.357 -7.039 17.872 1.00 0.00 H new ATOM 0 HD22 ASN A 180 8.033 -6.939 17.321 1.00 0.00 H new ATOM 1869 N LEU A 181 8.477 -6.731 22.456 1.00 0.00 N ATOM 1870 CA LEU A 181 8.334 -7.900 23.315 1.00 0.00 C ATOM 1871 C LEU A 181 6.871 -8.324 23.413 1.00 0.00 C ATOM 1872 O LEU A 181 6.194 -8.028 24.397 1.00 0.00 O ATOM 1873 CB LEU A 181 8.886 -7.604 24.710 1.00 0.00 C ATOM 1874 CG LEU A 181 9.336 -8.832 25.503 1.00 0.00 C ATOM 1875 CD1 LEU A 181 8.190 -9.821 25.650 1.00 0.00 C ATOM 1876 CD2 LEU A 181 10.529 -9.492 24.829 1.00 0.00 C ATOM 0 H LEU A 181 7.776 -6.006 22.611 1.00 0.00 H new ATOM 0 HA LEU A 181 8.903 -8.718 22.874 1.00 0.00 H new ATOM 0 HB2 LEU A 181 9.732 -6.924 24.612 1.00 0.00 H new ATOM 0 HB3 LEU A 181 8.121 -7.081 25.283 1.00 0.00 H new ATOM 0 HG LEU A 181 9.639 -8.508 26.499 1.00 0.00 H new ATOM 0 HD11 LEU A 181 8.528 -10.688 26.217 1.00 0.00 H new ATOM 0 HD12 LEU A 181 7.363 -9.344 26.176 1.00 0.00 H new ATOM 0 HD13 LEU A 181 7.856 -10.140 24.663 1.00 0.00 H new ATOM 0 HD21 LEU A 181 10.836 -10.364 25.406 1.00 0.00 H new ATOM 0 HD22 LEU A 181 10.252 -9.803 23.822 1.00 0.00 H new ATOM 0 HD23 LEU A 181 11.355 -8.783 24.775 1.00 0.00 H new ATOM 1888 N PRO A 182 6.361 -9.026 22.386 1.00 0.00 N ATOM 1889 CA PRO A 182 4.970 -9.490 22.360 1.00 0.00 C ATOM 1890 C PRO A 182 4.686 -10.528 23.440 1.00 0.00 C ATOM 1891 O PRO A 182 5.553 -11.328 23.790 1.00 0.00 O ATOM 1892 CB PRO A 182 4.822 -10.114 20.968 1.00 0.00 C ATOM 1893 CG PRO A 182 6.210 -10.464 20.555 1.00 0.00 C ATOM 1894 CD PRO A 182 7.098 -9.421 21.172 1.00 0.00 C ATOM 0 HA PRO A 182 4.269 -8.678 22.552 1.00 0.00 H new ATOM 0 HB2 PRO A 182 4.184 -10.997 20.997 1.00 0.00 H new ATOM 0 HB3 PRO A 182 4.366 -9.414 20.268 1.00 0.00 H new ATOM 0 HG2 PRO A 182 6.481 -11.462 20.901 1.00 0.00 H new ATOM 0 HG3 PRO A 182 6.306 -10.466 19.469 1.00 0.00 H new ATOM 0 HD2 PRO A 182 8.083 -9.821 21.411 1.00 0.00 H new ATOM 0 HD3 PRO A 182 7.252 -8.576 20.502 1.00 0.00 H new ATOM 1902 N SER A 183 3.464 -10.509 23.965 1.00 0.00 N ATOM 1903 CA SER A 183 3.065 -11.448 25.006 1.00 0.00 C ATOM 1904 C SER A 183 3.934 -11.285 26.249 1.00 0.00 C ATOM 1905 O SER A 183 3.555 -10.491 27.135 1.00 0.00 O ATOM 1906 CB SER A 183 3.157 -12.885 24.489 1.00 0.00 C ATOM 1907 OG SER A 183 2.788 -13.814 25.494 1.00 0.00 O ATOM 1908 OXT SER A 183 4.987 -11.954 26.325 1.00 0.00 O ATOM 0 H SER A 183 2.734 -9.853 23.686 1.00 0.00 H new ATOM 0 HA SER A 183 2.031 -11.233 25.277 1.00 0.00 H new ATOM 0 HB2 SER A 183 2.507 -13.005 23.622 1.00 0.00 H new ATOM 0 HB3 SER A 183 4.174 -13.090 24.156 1.00 0.00 H new ATOM 0 HG SER A 183 2.854 -14.725 25.138 1.00 0.00 H new TER 1914 SER A 183