USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 843 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 40 GLN : amide:sc= 0.534 K(o=1.8,f=-5.3!) USER MOD Set 1.2: A 93 LYS NZ :NH3+ 143:sc= 1.22 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0256 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -16:sc= 0.57 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= -0.0157 (180deg=-0.0157) USER MOD Single : A 26 HIS : no HD1:sc= -3.78! C(o=-3.8!,f=-10!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0036) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -150:sc= 0.166 (180deg=-0.00116) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= -1.51 USER MOD Single : A 60 MET CE :methyl 161:sc= -0.13 (180deg=-0.783) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -6.35! C(o=-6.3!,f=-11!) USER MOD Single : A 95 GLN : amide:sc= -0.0151 X(o=-0.015,f=-0.038) USER MOD Single : A 96 THR OG1 : rot 99:sc= 1.24 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.55) USER MOD Single : A 104 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0672) USER MOD Single : A 106 SER OG : rot -11:sc= 0.824 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.812 -34.302 16.667 1.00 0.00 N ATOM 2 CA GLY A 1 -8.561 -34.285 15.422 1.00 0.00 C ATOM 3 C GLY A 1 -9.751 -33.327 15.511 1.00 0.00 C ATOM 4 O GLY A 1 -9.653 -32.265 16.124 1.00 0.00 O ATOM 0 H1 GLY A 1 -6.793 -34.319 16.459 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.038 -33.451 17.220 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.068 -35.148 17.214 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.907 -33.983 14.604 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.915 -35.290 15.193 1.00 0.00 H new ATOM 8 N SER A 2 -10.848 -33.738 14.891 1.00 0.00 N ATOM 9 CA SER A 2 -12.055 -32.929 14.893 1.00 0.00 C ATOM 10 C SER A 2 -11.811 -31.622 14.137 1.00 0.00 C ATOM 11 O SER A 2 -10.893 -30.872 14.466 1.00 0.00 O ATOM 12 CB SER A 2 -12.521 -32.638 16.321 1.00 0.00 C ATOM 13 OG SER A 2 -13.897 -32.956 16.510 1.00 0.00 O ATOM 0 H SER A 2 -10.926 -34.620 14.384 1.00 0.00 H new ATOM 0 HA SER A 2 -12.843 -33.490 14.390 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.917 -33.212 17.023 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.358 -31.584 16.548 1.00 0.00 H new ATOM 0 HG SER A 2 -14.155 -32.758 17.434 1.00 0.00 H new ATOM 19 N SER A 3 -12.649 -31.388 13.137 1.00 0.00 N ATOM 20 CA SER A 3 -12.535 -30.185 12.332 1.00 0.00 C ATOM 21 C SER A 3 -13.789 -30.010 11.472 1.00 0.00 C ATOM 22 O SER A 3 -14.564 -30.949 11.301 1.00 0.00 O ATOM 23 CB SER A 3 -11.288 -30.229 11.447 1.00 0.00 C ATOM 24 OG SER A 3 -11.381 -31.236 10.443 1.00 0.00 O ATOM 0 H SER A 3 -13.409 -32.012 12.867 1.00 0.00 H new ATOM 0 HA SER A 3 -12.440 -29.332 13.004 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.145 -29.258 10.974 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.410 -30.414 12.066 1.00 0.00 H new ATOM 0 HG SER A 3 -10.567 -31.231 9.898 1.00 0.00 H new ATOM 30 N GLY A 4 -13.950 -28.801 10.955 1.00 0.00 N ATOM 31 CA GLY A 4 -15.096 -28.491 10.118 1.00 0.00 C ATOM 32 C GLY A 4 -16.273 -27.997 10.961 1.00 0.00 C ATOM 33 O GLY A 4 -16.581 -28.574 12.003 1.00 0.00 O ATOM 0 H GLY A 4 -13.305 -28.024 11.100 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.822 -27.729 9.388 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.392 -29.378 9.558 1.00 0.00 H new ATOM 37 N SER A 5 -16.900 -26.933 10.479 1.00 0.00 N ATOM 38 CA SER A 5 -18.036 -26.355 11.176 1.00 0.00 C ATOM 39 C SER A 5 -18.507 -25.093 10.451 1.00 0.00 C ATOM 40 O SER A 5 -17.860 -24.635 9.510 1.00 0.00 O ATOM 41 CB SER A 5 -17.685 -26.032 12.630 1.00 0.00 C ATOM 42 OG SER A 5 -18.589 -26.645 13.545 1.00 0.00 O ATOM 0 H SER A 5 -16.642 -26.457 9.615 1.00 0.00 H new ATOM 0 HA SER A 5 -18.843 -27.087 11.180 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.670 -26.369 12.842 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.699 -24.952 12.775 1.00 0.00 H new ATOM 0 HG SER A 5 -18.331 -26.417 14.462 1.00 0.00 H new ATOM 48 N SER A 6 -19.630 -24.565 10.917 1.00 0.00 N ATOM 49 CA SER A 6 -20.195 -23.365 10.324 1.00 0.00 C ATOM 50 C SER A 6 -20.567 -23.627 8.864 1.00 0.00 C ATOM 51 O SER A 6 -19.969 -24.480 8.210 1.00 0.00 O ATOM 52 CB SER A 6 -19.218 -22.191 10.420 1.00 0.00 C ATOM 53 OG SER A 6 -19.748 -21.006 9.833 1.00 0.00 O ATOM 0 H SER A 6 -20.163 -24.946 11.698 1.00 0.00 H new ATOM 0 HA SER A 6 -21.095 -23.101 10.879 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.980 -22.002 11.467 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.284 -22.455 9.924 1.00 0.00 H new ATOM 0 HG SER A 6 -19.095 -20.280 9.916 1.00 0.00 H new ATOM 59 N GLY A 7 -21.554 -22.878 8.394 1.00 0.00 N ATOM 60 CA GLY A 7 -22.014 -23.019 7.023 1.00 0.00 C ATOM 61 C GLY A 7 -22.505 -21.680 6.469 1.00 0.00 C ATOM 62 O GLY A 7 -23.122 -20.896 7.188 1.00 0.00 O ATOM 0 H GLY A 7 -22.048 -22.171 8.939 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.203 -23.399 6.401 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.820 -23.752 6.979 1.00 0.00 H new ATOM 66 N ALA A 8 -22.214 -21.460 5.196 1.00 0.00 N ATOM 67 CA ALA A 8 -22.618 -20.230 4.537 1.00 0.00 C ATOM 68 C ALA A 8 -22.202 -20.283 3.066 1.00 0.00 C ATOM 69 O ALA A 8 -21.437 -21.160 2.665 1.00 0.00 O ATOM 70 CB ALA A 8 -22.011 -19.034 5.272 1.00 0.00 C ATOM 0 H ALA A 8 -21.703 -22.113 4.603 1.00 0.00 H new ATOM 0 HA ALA A 8 -23.702 -20.116 4.568 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -22.314 -18.111 4.778 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -22.362 -19.025 6.304 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -20.924 -19.112 5.259 1.00 0.00 H new ATOM 76 N PRO A 9 -22.737 -19.310 2.281 1.00 0.00 N ATOM 77 CA PRO A 9 -22.429 -19.238 0.863 1.00 0.00 C ATOM 78 C PRO A 9 -21.017 -18.694 0.636 1.00 0.00 C ATOM 79 O PRO A 9 -20.511 -17.915 1.442 1.00 0.00 O ATOM 80 CB PRO A 9 -23.510 -18.350 0.270 1.00 0.00 C ATOM 81 CG PRO A 9 -24.109 -17.585 1.439 1.00 0.00 C ATOM 82 CD PRO A 9 -23.646 -18.256 2.721 1.00 0.00 C ATOM 0 HA PRO A 9 -22.428 -20.216 0.382 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -23.092 -17.668 -0.470 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -24.269 -18.945 -0.238 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -23.790 -16.543 1.417 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -25.197 -17.587 1.379 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -23.142 -17.548 3.379 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -24.487 -18.666 3.279 1.00 0.00 H new ATOM 90 N ALA A 10 -20.421 -19.125 -0.467 1.00 0.00 N ATOM 91 CA ALA A 10 -19.078 -18.690 -0.810 1.00 0.00 C ATOM 92 C ALA A 10 -19.129 -17.855 -2.091 1.00 0.00 C ATOM 93 O ALA A 10 -20.195 -17.677 -2.679 1.00 0.00 O ATOM 94 CB ALA A 10 -18.165 -19.911 -0.946 1.00 0.00 C ATOM 0 H ALA A 10 -20.844 -19.771 -1.134 1.00 0.00 H new ATOM 0 HA ALA A 10 -18.665 -18.060 -0.022 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -17.157 -19.585 -1.203 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.140 -20.454 -0.001 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.546 -20.565 -1.730 1.00 0.00 H new ATOM 100 N GLU A 11 -17.963 -17.363 -2.486 1.00 0.00 N ATOM 101 CA GLU A 11 -17.862 -16.551 -3.686 1.00 0.00 C ATOM 102 C GLU A 11 -16.461 -16.668 -4.289 1.00 0.00 C ATOM 103 O GLU A 11 -15.464 -16.466 -3.597 1.00 0.00 O ATOM 104 CB GLU A 11 -18.211 -15.091 -3.391 1.00 0.00 C ATOM 105 CG GLU A 11 -19.141 -14.522 -4.465 1.00 0.00 C ATOM 106 CD GLU A 11 -20.427 -13.974 -3.843 1.00 0.00 C ATOM 107 OE1 GLU A 11 -21.244 -14.809 -3.400 1.00 0.00 O ATOM 108 OE2 GLU A 11 -20.564 -12.731 -3.826 1.00 0.00 O ATOM 0 H GLU A 11 -17.081 -17.511 -1.996 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.583 -16.923 -4.414 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -18.690 -15.018 -2.414 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -17.298 -14.497 -3.344 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.630 -13.729 -5.010 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.386 -15.300 -5.188 1.00 0.00 H new ATOM 115 N PRO A 12 -16.428 -17.002 -5.607 1.00 0.00 N ATOM 116 CA PRO A 12 -15.166 -17.148 -6.311 1.00 0.00 C ATOM 117 C PRO A 12 -14.541 -15.783 -6.606 1.00 0.00 C ATOM 118 O PRO A 12 -15.253 -14.793 -6.769 1.00 0.00 O ATOM 119 CB PRO A 12 -15.505 -17.931 -7.569 1.00 0.00 C ATOM 120 CG PRO A 12 -17.008 -17.791 -7.754 1.00 0.00 C ATOM 121 CD PRO A 12 -17.588 -17.248 -6.459 1.00 0.00 C ATOM 0 HA PRO A 12 -14.414 -17.673 -5.722 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -14.967 -17.537 -8.431 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -15.220 -18.978 -7.466 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -17.230 -17.119 -8.583 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -17.454 -18.755 -7.997 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -18.154 -16.332 -6.632 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -18.271 -17.963 -6.001 1.00 0.00 H new ATOM 129 N ALA A 13 -13.218 -15.775 -6.667 1.00 0.00 N ATOM 130 CA ALA A 13 -12.489 -14.547 -6.940 1.00 0.00 C ATOM 131 C ALA A 13 -10.995 -14.859 -7.043 1.00 0.00 C ATOM 132 O ALA A 13 -10.533 -15.880 -6.537 1.00 0.00 O ATOM 133 CB ALA A 13 -12.796 -13.518 -5.850 1.00 0.00 C ATOM 0 H ALA A 13 -12.631 -16.599 -6.532 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.803 -14.117 -7.891 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -12.250 -12.597 -6.054 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -13.866 -13.310 -5.837 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -12.492 -13.913 -4.881 1.00 0.00 H new ATOM 139 N ALA A 14 -10.280 -13.959 -7.704 1.00 0.00 N ATOM 140 CA ALA A 14 -8.847 -14.125 -7.880 1.00 0.00 C ATOM 141 C ALA A 14 -8.339 -13.092 -8.887 1.00 0.00 C ATOM 142 O ALA A 14 -7.426 -12.324 -8.587 1.00 0.00 O ATOM 143 CB ALA A 14 -8.549 -15.561 -8.317 1.00 0.00 C ATOM 0 H ALA A 14 -10.666 -13.113 -8.124 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.322 -13.955 -6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -7.474 -15.686 -8.449 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -8.904 -16.254 -7.554 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.057 -15.767 -9.259 1.00 0.00 H new ATOM 149 N PRO A 15 -8.968 -13.107 -10.093 1.00 0.00 N ATOM 150 CA PRO A 15 -8.589 -12.180 -11.146 1.00 0.00 C ATOM 151 C PRO A 15 -9.110 -10.772 -10.852 1.00 0.00 C ATOM 152 O PRO A 15 -10.273 -10.600 -10.491 1.00 0.00 O ATOM 153 CB PRO A 15 -9.168 -12.774 -12.420 1.00 0.00 C ATOM 154 CG PRO A 15 -10.238 -13.757 -11.973 1.00 0.00 C ATOM 155 CD PRO A 15 -10.053 -14.002 -10.484 1.00 0.00 C ATOM 0 HA PRO A 15 -7.509 -12.061 -11.233 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -9.593 -11.997 -13.055 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -8.396 -13.276 -13.003 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -11.232 -13.357 -12.173 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -10.153 -14.692 -12.527 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -10.966 -13.783 -9.930 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -9.800 -15.043 -10.282 1.00 0.00 H new ATOM 163 N LYS A 16 -8.225 -9.801 -11.018 1.00 0.00 N ATOM 164 CA LYS A 16 -8.581 -8.414 -10.775 1.00 0.00 C ATOM 165 C LYS A 16 -7.470 -7.505 -11.306 1.00 0.00 C ATOM 166 O LYS A 16 -6.334 -7.570 -10.838 1.00 0.00 O ATOM 167 CB LYS A 16 -8.901 -8.194 -9.295 1.00 0.00 C ATOM 168 CG LYS A 16 -10.384 -7.877 -9.096 1.00 0.00 C ATOM 169 CD LYS A 16 -10.639 -7.301 -7.702 1.00 0.00 C ATOM 170 CE LYS A 16 -12.107 -7.460 -7.302 1.00 0.00 C ATOM 171 NZ LYS A 16 -12.922 -6.366 -7.875 1.00 0.00 N ATOM 0 H LYS A 16 -7.261 -9.947 -11.318 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.491 -8.155 -11.316 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -8.636 -9.085 -8.726 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.295 -7.376 -8.906 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -10.712 -7.165 -9.853 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.975 -8.783 -9.233 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.004 -7.806 -6.974 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.366 -6.246 -7.685 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.483 -8.422 -7.650 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.196 -7.457 -6.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.916 -6.489 -7.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.573 -5.452 -7.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -12.851 -6.387 -8.912 1.00 0.00 H new ATOM 185 N SER A 17 -7.836 -6.680 -12.276 1.00 0.00 N ATOM 186 CA SER A 17 -6.885 -5.760 -12.875 1.00 0.00 C ATOM 187 C SER A 17 -5.699 -6.536 -13.451 1.00 0.00 C ATOM 188 O SER A 17 -5.583 -7.743 -13.246 1.00 0.00 O ATOM 189 CB SER A 17 -6.399 -4.729 -11.855 1.00 0.00 C ATOM 190 OG SER A 17 -5.975 -3.520 -12.479 1.00 0.00 O ATOM 0 H SER A 17 -8.779 -6.630 -12.662 1.00 0.00 H new ATOM 0 HA SER A 17 -7.387 -5.225 -13.681 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.201 -4.511 -11.150 1.00 0.00 H new ATOM 0 HB3 SER A 17 -5.574 -5.149 -11.280 1.00 0.00 H new ATOM 0 HG SER A 17 -5.674 -2.887 -11.794 1.00 0.00 H new ATOM 196 N GLY A 18 -4.847 -5.811 -14.162 1.00 0.00 N ATOM 197 CA GLY A 18 -3.674 -6.416 -14.769 1.00 0.00 C ATOM 198 C GLY A 18 -2.749 -5.349 -15.358 1.00 0.00 C ATOM 199 O GLY A 18 -1.763 -4.964 -14.733 1.00 0.00 O ATOM 0 H GLY A 18 -4.946 -4.810 -14.331 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.134 -6.999 -14.023 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.982 -7.108 -15.553 1.00 0.00 H new ATOM 203 N GLU A 19 -3.101 -4.901 -16.554 1.00 0.00 N ATOM 204 CA GLU A 19 -2.315 -3.886 -17.234 1.00 0.00 C ATOM 205 C GLU A 19 -0.870 -4.359 -17.403 1.00 0.00 C ATOM 206 O GLU A 19 -0.473 -5.372 -16.829 1.00 0.00 O ATOM 207 CB GLU A 19 -2.373 -2.554 -16.484 1.00 0.00 C ATOM 208 CG GLU A 19 -3.715 -1.855 -16.711 1.00 0.00 C ATOM 209 CD GLU A 19 -3.839 -0.609 -15.832 1.00 0.00 C ATOM 210 OE1 GLU A 19 -3.028 0.319 -16.045 1.00 0.00 O ATOM 211 OE2 GLU A 19 -4.741 -0.611 -14.967 1.00 0.00 O ATOM 0 H GLU A 19 -3.920 -5.222 -17.070 1.00 0.00 H new ATOM 0 HA GLU A 19 -2.742 -3.726 -18.224 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.224 -2.726 -15.418 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.561 -1.908 -16.819 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -3.811 -1.575 -17.760 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -4.530 -2.544 -16.489 1.00 0.00 H new ATOM 218 N ALA A 20 -0.121 -3.602 -18.192 1.00 0.00 N ATOM 219 CA ALA A 20 1.272 -3.931 -18.443 1.00 0.00 C ATOM 220 C ALA A 20 2.137 -2.696 -18.184 1.00 0.00 C ATOM 221 O ALA A 20 3.322 -2.684 -18.512 1.00 0.00 O ATOM 222 CB ALA A 20 1.422 -4.459 -19.871 1.00 0.00 C ATOM 0 H ALA A 20 -0.453 -2.762 -18.666 1.00 0.00 H new ATOM 0 HA ALA A 20 1.609 -4.717 -17.768 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.467 -4.706 -20.060 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.810 -5.352 -19.995 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.096 -3.695 -20.577 1.00 0.00 H new ATOM 228 N GLU A 21 1.511 -1.687 -17.597 1.00 0.00 N ATOM 229 CA GLU A 21 2.209 -0.450 -17.289 1.00 0.00 C ATOM 230 C GLU A 21 1.919 -0.020 -15.850 1.00 0.00 C ATOM 231 O GLU A 21 0.912 -0.423 -15.269 1.00 0.00 O ATOM 232 CB GLU A 21 1.830 0.654 -18.278 1.00 0.00 C ATOM 233 CG GLU A 21 0.332 0.955 -18.216 1.00 0.00 C ATOM 234 CD GLU A 21 0.060 2.441 -18.459 1.00 0.00 C ATOM 235 OE1 GLU A 21 0.550 3.248 -17.640 1.00 0.00 O ATOM 236 OE2 GLU A 21 -0.631 2.736 -19.457 1.00 0.00 O ATOM 0 H GLU A 21 0.528 -1.701 -17.326 1.00 0.00 H new ATOM 0 HA GLU A 21 3.280 -0.627 -17.385 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.396 1.558 -18.053 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.102 0.351 -19.289 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.193 0.359 -18.962 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.061 0.664 -17.242 1.00 0.00 H new ATOM 243 N THR A 22 2.819 0.792 -15.316 1.00 0.00 N ATOM 244 CA THR A 22 2.672 1.281 -13.955 1.00 0.00 C ATOM 245 C THR A 22 3.453 2.583 -13.769 1.00 0.00 C ATOM 246 O THR A 22 4.644 2.559 -13.461 1.00 0.00 O ATOM 247 CB THR A 22 3.111 0.168 -13.003 1.00 0.00 C ATOM 248 OG1 THR A 22 2.089 -0.818 -13.126 1.00 0.00 O ATOM 249 CG2 THR A 22 3.044 0.593 -11.534 1.00 0.00 C ATOM 0 H THR A 22 3.653 1.124 -15.801 1.00 0.00 H new ATOM 0 HA THR A 22 1.634 1.527 -13.733 1.00 0.00 H new ATOM 0 HB THR A 22 4.129 -0.137 -13.247 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.303 -0.423 -13.559 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.366 -0.234 -10.901 1.00 0.00 H new ATOM 0 HG22 THR A 22 3.698 1.450 -11.373 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.020 0.866 -11.281 1.00 0.00 H new ATOM 257 N PRO A 23 2.733 3.720 -13.970 1.00 0.00 N ATOM 258 CA PRO A 23 3.346 5.029 -13.827 1.00 0.00 C ATOM 259 C PRO A 23 3.554 5.380 -12.352 1.00 0.00 C ATOM 260 O PRO A 23 3.074 4.672 -11.469 1.00 0.00 O ATOM 261 CB PRO A 23 2.401 5.985 -14.537 1.00 0.00 C ATOM 262 CG PRO A 23 1.073 5.254 -14.646 1.00 0.00 C ATOM 263 CD PRO A 23 1.321 3.787 -14.336 1.00 0.00 C ATOM 0 HA PRO A 23 4.343 5.076 -14.265 1.00 0.00 H new ATOM 0 HB2 PRO A 23 2.291 6.913 -13.977 1.00 0.00 H new ATOM 0 HB3 PRO A 23 2.782 6.251 -15.523 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.348 5.674 -13.949 1.00 0.00 H new ATOM 0 HG3 PRO A 23 0.656 5.367 -15.647 1.00 0.00 H new ATOM 0 HD2 PRO A 23 0.684 3.441 -13.522 1.00 0.00 H new ATOM 0 HD3 PRO A 23 1.105 3.158 -15.199 1.00 0.00 H new ATOM 271 N PRO A 24 4.289 6.501 -12.126 1.00 0.00 N ATOM 272 CA PRO A 24 4.566 6.955 -10.774 1.00 0.00 C ATOM 273 C PRO A 24 3.328 7.598 -10.147 1.00 0.00 C ATOM 274 O PRO A 24 2.695 8.459 -10.756 1.00 0.00 O ATOM 275 CB PRO A 24 5.731 7.921 -10.914 1.00 0.00 C ATOM 276 CG PRO A 24 5.761 8.329 -12.378 1.00 0.00 C ATOM 277 CD PRO A 24 4.873 7.365 -13.149 1.00 0.00 C ATOM 0 HA PRO A 24 4.823 6.138 -10.100 1.00 0.00 H new ATOM 0 HB2 PRO A 24 5.598 8.790 -10.269 1.00 0.00 H new ATOM 0 HB3 PRO A 24 6.668 7.448 -10.621 1.00 0.00 H new ATOM 0 HG2 PRO A 24 5.406 9.353 -12.496 1.00 0.00 H new ATOM 0 HG3 PRO A 24 6.781 8.299 -12.762 1.00 0.00 H new ATOM 0 HD2 PRO A 24 4.102 7.896 -13.706 1.00 0.00 H new ATOM 0 HD3 PRO A 24 5.449 6.788 -13.873 1.00 0.00 H new ATOM 285 N LYS A 25 3.019 7.155 -8.936 1.00 0.00 N ATOM 286 CA LYS A 25 1.868 7.677 -8.220 1.00 0.00 C ATOM 287 C LYS A 25 2.302 8.124 -6.823 1.00 0.00 C ATOM 288 O LYS A 25 3.379 8.696 -6.656 1.00 0.00 O ATOM 289 CB LYS A 25 0.732 6.652 -8.212 1.00 0.00 C ATOM 290 CG LYS A 25 1.141 5.387 -7.456 1.00 0.00 C ATOM 291 CD LYS A 25 0.312 4.184 -7.912 1.00 0.00 C ATOM 292 CE LYS A 25 0.398 3.042 -6.897 1.00 0.00 C ATOM 293 NZ LYS A 25 0.565 1.745 -7.590 1.00 0.00 N ATOM 0 H LYS A 25 3.546 6.441 -8.434 1.00 0.00 H new ATOM 0 HA LYS A 25 1.470 8.556 -8.727 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -0.153 7.088 -7.747 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.461 6.396 -9.236 1.00 0.00 H new ATOM 0 HG2 LYS A 25 2.200 5.187 -7.620 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.008 5.540 -6.385 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.728 4.483 -8.041 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.668 3.840 -8.883 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.236 3.211 -6.221 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.505 3.021 -6.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.622 0.981 -6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.248 1.579 -8.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.439 1.763 -8.154 1.00 0.00 H new ATOM 307 N HIS A 26 1.442 7.848 -5.854 1.00 0.00 N ATOM 308 CA HIS A 26 1.723 8.214 -4.476 1.00 0.00 C ATOM 309 C HIS A 26 2.520 7.097 -3.800 1.00 0.00 C ATOM 310 O HIS A 26 2.231 5.917 -3.996 1.00 0.00 O ATOM 311 CB HIS A 26 0.432 8.557 -3.731 1.00 0.00 C ATOM 312 CG HIS A 26 0.652 9.255 -2.410 1.00 0.00 C ATOM 313 ND1 HIS A 26 0.996 8.578 -1.252 1.00 0.00 N ATOM 314 CD2 HIS A 26 0.575 10.575 -2.075 1.00 0.00 C ATOM 315 CE1 HIS A 26 1.117 9.461 -0.272 1.00 0.00 C ATOM 316 NE2 HIS A 26 0.855 10.698 -0.783 1.00 0.00 N ATOM 0 H HIS A 26 0.550 7.375 -5.996 1.00 0.00 H new ATOM 0 HA HIS A 26 2.337 9.115 -4.453 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -0.185 9.192 -4.367 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -0.129 7.639 -3.556 1.00 0.00 H new ATOM 0 HD2 HIS A 26 0.328 11.383 -2.747 1.00 0.00 H new ATOM 0 HE1 HIS A 26 1.378 9.240 0.753 1.00 0.00 H new ATOM 0 HE2 HIS A 26 0.871 11.573 -0.259 1.00 0.00 H new ATOM 324 N PRO A 27 3.533 7.518 -2.996 1.00 0.00 N ATOM 325 CA PRO A 27 4.373 6.566 -2.289 1.00 0.00 C ATOM 326 C PRO A 27 3.631 5.961 -1.096 1.00 0.00 C ATOM 327 O PRO A 27 3.806 4.784 -0.784 1.00 0.00 O ATOM 328 CB PRO A 27 5.607 7.355 -1.884 1.00 0.00 C ATOM 329 CG PRO A 27 5.210 8.820 -1.968 1.00 0.00 C ATOM 330 CD PRO A 27 3.904 8.906 -2.740 1.00 0.00 C ATOM 0 HA PRO A 27 4.649 5.710 -2.905 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.924 7.093 -0.874 1.00 0.00 H new ATOM 0 HB3 PRO A 27 6.444 7.138 -2.547 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.092 9.241 -0.970 1.00 0.00 H new ATOM 0 HG3 PRO A 27 5.987 9.398 -2.468 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.136 9.421 -2.163 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.030 9.460 -3.670 1.00 0.00 H new ATOM 338 N GLY A 28 2.819 6.793 -0.461 1.00 0.00 N ATOM 339 CA GLY A 28 2.050 6.355 0.692 1.00 0.00 C ATOM 340 C GLY A 28 1.196 5.132 0.349 1.00 0.00 C ATOM 341 O GLY A 28 0.963 4.275 1.199 1.00 0.00 O ATOM 0 H GLY A 28 2.677 7.768 -0.723 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.725 6.113 1.513 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.408 7.166 1.035 1.00 0.00 H new ATOM 345 N VAL A 29 0.752 5.092 -0.899 1.00 0.00 N ATOM 346 CA VAL A 29 -0.071 3.989 -1.365 1.00 0.00 C ATOM 347 C VAL A 29 0.818 2.773 -1.633 1.00 0.00 C ATOM 348 O VAL A 29 0.600 1.703 -1.067 1.00 0.00 O ATOM 349 CB VAL A 29 -0.879 4.421 -2.591 1.00 0.00 C ATOM 350 CG1 VAL A 29 -1.755 3.275 -3.101 1.00 0.00 C ATOM 351 CG2 VAL A 29 -1.721 5.660 -2.283 1.00 0.00 C ATOM 0 H VAL A 29 0.947 5.806 -1.601 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.793 3.702 -0.601 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.176 4.682 -3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -2.319 3.608 -3.972 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -1.124 2.430 -3.378 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -2.447 2.969 -2.316 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -2.285 5.946 -3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.412 5.437 -1.470 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.067 6.481 -1.989 1.00 0.00 H new ATOM 361 N LEU A 30 1.801 2.977 -2.497 1.00 0.00 N ATOM 362 CA LEU A 30 2.724 1.911 -2.847 1.00 0.00 C ATOM 363 C LEU A 30 3.134 1.160 -1.579 1.00 0.00 C ATOM 364 O LEU A 30 3.321 -0.055 -1.605 1.00 0.00 O ATOM 365 CB LEU A 30 3.907 2.465 -3.644 1.00 0.00 C ATOM 366 CG LEU A 30 3.555 3.237 -4.917 1.00 0.00 C ATOM 367 CD1 LEU A 30 4.559 4.364 -5.170 1.00 0.00 C ATOM 368 CD2 LEU A 30 3.438 2.293 -6.116 1.00 0.00 C ATOM 0 H LEU A 30 1.979 3.865 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 30 2.239 1.188 -3.503 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.483 3.122 -2.992 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.558 1.634 -3.915 1.00 0.00 H new ATOM 0 HG LEU A 30 2.579 3.701 -4.776 1.00 0.00 H new ATOM 0 HD11 LEU A 30 4.286 4.897 -6.081 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.549 5.056 -4.328 1.00 0.00 H new ATOM 0 HD13 LEU A 30 5.558 3.943 -5.282 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.187 2.867 -7.008 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.388 1.780 -6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.656 1.558 -5.926 1.00 0.00 H new ATOM 380 N LYS A 31 3.263 1.916 -0.498 1.00 0.00 N ATOM 381 CA LYS A 31 3.647 1.338 0.778 1.00 0.00 C ATOM 382 C LYS A 31 2.778 0.111 1.060 1.00 0.00 C ATOM 383 O LYS A 31 3.258 -0.882 1.605 1.00 0.00 O ATOM 384 CB LYS A 31 3.595 2.395 1.883 1.00 0.00 C ATOM 385 CG LYS A 31 4.970 2.583 2.527 1.00 0.00 C ATOM 386 CD LYS A 31 5.111 3.986 3.120 1.00 0.00 C ATOM 387 CE LYS A 31 6.360 4.088 3.998 1.00 0.00 C ATOM 388 NZ LYS A 31 6.773 5.501 4.150 1.00 0.00 N ATOM 0 H LYS A 31 3.108 2.924 -0.480 1.00 0.00 H new ATOM 0 HA LYS A 31 4.681 0.996 0.745 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.251 3.343 1.469 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.872 2.097 2.642 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.114 1.838 3.309 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.749 2.419 1.783 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.166 4.720 2.316 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.227 4.226 3.710 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.159 3.654 4.978 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.172 3.511 3.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.622 5.552 4.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.984 5.903 3.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.003 6.042 4.594 1.00 0.00 H new ATOM 402 N VAL A 32 1.515 0.219 0.676 1.00 0.00 N ATOM 403 CA VAL A 32 0.574 -0.869 0.880 1.00 0.00 C ATOM 404 C VAL A 32 0.824 -1.956 -0.167 1.00 0.00 C ATOM 405 O VAL A 32 0.926 -3.135 0.169 1.00 0.00 O ATOM 406 CB VAL A 32 -0.859 -0.334 0.857 1.00 0.00 C ATOM 407 CG1 VAL A 32 -0.912 1.113 1.350 1.00 0.00 C ATOM 408 CG2 VAL A 32 -1.468 -0.459 -0.541 1.00 0.00 C ATOM 0 H VAL A 32 1.121 1.044 0.224 1.00 0.00 H new ATOM 0 HA VAL A 32 0.721 -1.322 1.860 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.455 -0.942 1.538 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.942 1.469 1.324 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.537 1.163 2.372 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.295 1.740 0.706 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -2.487 -0.072 -0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.870 0.113 -1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.482 -1.507 -0.840 1.00 0.00 H new ATOM 418 N GLU A 33 0.914 -1.522 -1.415 1.00 0.00 N ATOM 419 CA GLU A 33 1.150 -2.443 -2.513 1.00 0.00 C ATOM 420 C GLU A 33 2.375 -3.313 -2.223 1.00 0.00 C ATOM 421 O GLU A 33 2.329 -4.531 -2.389 1.00 0.00 O ATOM 422 CB GLU A 33 1.312 -1.690 -3.835 1.00 0.00 C ATOM 423 CG GLU A 33 0.036 -0.926 -4.191 1.00 0.00 C ATOM 424 CD GLU A 33 -0.667 -1.561 -5.393 1.00 0.00 C ATOM 425 OE1 GLU A 33 0.035 -1.805 -6.398 1.00 0.00 O ATOM 426 OE2 GLU A 33 -1.891 -1.790 -5.279 1.00 0.00 O ATOM 0 H GLU A 33 0.828 -0.544 -1.690 1.00 0.00 H new ATOM 0 HA GLU A 33 0.281 -3.094 -2.608 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.148 -0.994 -3.761 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.553 -2.394 -4.631 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.638 -0.917 -3.334 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.280 0.112 -4.415 1.00 0.00 H new ATOM 433 N ALA A 34 3.441 -2.653 -1.795 1.00 0.00 N ATOM 434 CA ALA A 34 4.676 -3.350 -1.481 1.00 0.00 C ATOM 435 C ALA A 34 4.411 -4.376 -0.377 1.00 0.00 C ATOM 436 O ALA A 34 5.070 -5.412 -0.316 1.00 0.00 O ATOM 437 CB ALA A 34 5.750 -2.334 -1.087 1.00 0.00 C ATOM 0 H ALA A 34 3.475 -1.643 -1.658 1.00 0.00 H new ATOM 0 HA ALA A 34 5.043 -3.891 -2.353 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.677 -2.857 -0.851 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.922 -1.647 -1.915 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.418 -1.773 -0.213 1.00 0.00 H new ATOM 443 N ILE A 35 3.444 -4.051 0.469 1.00 0.00 N ATOM 444 CA ILE A 35 3.084 -4.931 1.568 1.00 0.00 C ATOM 445 C ILE A 35 2.170 -6.042 1.046 1.00 0.00 C ATOM 446 O ILE A 35 2.444 -7.223 1.252 1.00 0.00 O ATOM 447 CB ILE A 35 2.479 -4.127 2.721 1.00 0.00 C ATOM 448 CG1 ILE A 35 3.515 -3.182 3.333 1.00 0.00 C ATOM 449 CG2 ILE A 35 1.860 -5.054 3.769 1.00 0.00 C ATOM 450 CD1 ILE A 35 2.845 -2.145 4.237 1.00 0.00 C ATOM 0 H ILE A 35 2.899 -3.191 0.415 1.00 0.00 H new ATOM 0 HA ILE A 35 3.971 -5.414 1.978 1.00 0.00 H new ATOM 0 HB ILE A 35 1.675 -3.509 2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.241 -3.756 3.908 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.065 -2.677 2.539 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.437 -4.458 4.578 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.073 -5.650 3.308 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.629 -5.715 4.169 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.604 -1.486 4.659 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.137 -1.556 3.653 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.316 -2.653 5.044 1.00 0.00 H new ATOM 462 N LEU A 36 1.103 -5.623 0.382 1.00 0.00 N ATOM 463 CA LEU A 36 0.147 -6.568 -0.170 1.00 0.00 C ATOM 464 C LEU A 36 0.840 -7.426 -1.231 1.00 0.00 C ATOM 465 O LEU A 36 0.328 -8.477 -1.615 1.00 0.00 O ATOM 466 CB LEU A 36 -1.094 -5.836 -0.686 1.00 0.00 C ATOM 467 CG LEU A 36 -2.084 -5.363 0.380 1.00 0.00 C ATOM 468 CD1 LEU A 36 -2.723 -6.552 1.101 1.00 0.00 C ATOM 469 CD2 LEU A 36 -1.418 -4.392 1.356 1.00 0.00 C ATOM 0 H LEU A 36 0.879 -4.642 0.214 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.210 -7.245 0.606 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.768 -4.969 -1.261 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.621 -6.496 -1.375 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.886 -4.819 -0.118 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.422 -6.188 1.854 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.256 -7.171 0.380 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.946 -7.145 1.584 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.144 -4.072 2.103 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.583 -4.889 1.851 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.051 -3.523 0.811 1.00 0.00 H new ATOM 481 N GLU A 37 1.992 -6.947 -1.674 1.00 0.00 N ATOM 482 CA GLU A 37 2.760 -7.657 -2.683 1.00 0.00 C ATOM 483 C GLU A 37 3.153 -9.044 -2.172 1.00 0.00 C ATOM 484 O GLU A 37 3.203 -10.002 -2.942 1.00 0.00 O ATOM 485 CB GLU A 37 3.995 -6.855 -3.097 1.00 0.00 C ATOM 486 CG GLU A 37 3.970 -6.543 -4.595 1.00 0.00 C ATOM 487 CD GLU A 37 5.364 -6.162 -5.099 1.00 0.00 C ATOM 488 OE1 GLU A 37 5.699 -4.963 -4.987 1.00 0.00 O ATOM 489 OE2 GLU A 37 6.062 -7.078 -5.585 1.00 0.00 O ATOM 0 H GLU A 37 2.413 -6.075 -1.353 1.00 0.00 H new ATOM 0 HA GLU A 37 2.135 -7.781 -3.567 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.037 -5.926 -2.529 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.896 -7.418 -2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.605 -7.411 -5.145 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.274 -5.727 -4.789 1.00 0.00 H new ATOM 496 N LYS A 38 3.421 -9.108 -0.876 1.00 0.00 N ATOM 497 CA LYS A 38 3.808 -10.363 -0.253 1.00 0.00 C ATOM 498 C LYS A 38 2.579 -11.266 -0.130 1.00 0.00 C ATOM 499 O LYS A 38 2.520 -12.328 -0.748 1.00 0.00 O ATOM 500 CB LYS A 38 4.517 -10.104 1.078 1.00 0.00 C ATOM 501 CG LYS A 38 5.769 -9.249 0.874 1.00 0.00 C ATOM 502 CD LYS A 38 5.692 -7.959 1.694 1.00 0.00 C ATOM 503 CE LYS A 38 6.963 -7.758 2.521 1.00 0.00 C ATOM 504 NZ LYS A 38 8.113 -7.457 1.640 1.00 0.00 N ATOM 0 H LYS A 38 3.378 -8.312 -0.240 1.00 0.00 H new ATOM 0 HA LYS A 38 4.531 -10.891 -0.875 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.836 -9.601 1.765 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.791 -11.053 1.539 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.653 -9.817 1.165 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.880 -9.006 -0.183 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.549 -7.108 1.028 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.826 -7.995 2.355 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.817 -6.943 3.230 1.00 0.00 H new ATOM 0 HE3 LYS A 38 7.170 -8.655 3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 8.960 -7.290 2.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.282 -8.262 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 7.906 -6.607 1.077 1.00 0.00 H new ATOM 518 N VAL A 39 1.628 -10.811 0.674 1.00 0.00 N ATOM 519 CA VAL A 39 0.405 -11.565 0.886 1.00 0.00 C ATOM 520 C VAL A 39 -0.010 -12.236 -0.425 1.00 0.00 C ATOM 521 O VAL A 39 -0.289 -13.434 -0.452 1.00 0.00 O ATOM 522 CB VAL A 39 -0.680 -10.651 1.459 1.00 0.00 C ATOM 523 CG1 VAL A 39 -0.828 -9.381 0.618 1.00 0.00 C ATOM 524 CG2 VAL A 39 -2.015 -11.390 1.575 1.00 0.00 C ATOM 0 H VAL A 39 1.681 -9.930 1.186 1.00 0.00 H new ATOM 0 HA VAL A 39 0.566 -12.356 1.619 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.373 -10.355 2.462 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.606 -8.749 1.047 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.117 -8.838 0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.101 -9.650 -0.402 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.769 -10.718 1.985 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -2.330 -11.730 0.588 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.899 -12.250 2.235 1.00 0.00 H new ATOM 534 N GLN A 40 -0.038 -11.435 -1.480 1.00 0.00 N ATOM 535 CA GLN A 40 -0.414 -11.936 -2.791 1.00 0.00 C ATOM 536 C GLN A 40 0.219 -13.307 -3.036 1.00 0.00 C ATOM 537 O GLN A 40 -0.485 -14.281 -3.301 1.00 0.00 O ATOM 538 CB GLN A 40 -0.021 -10.947 -3.889 1.00 0.00 C ATOM 539 CG GLN A 40 -0.931 -9.717 -3.870 1.00 0.00 C ATOM 540 CD GLN A 40 -1.909 -9.739 -5.047 1.00 0.00 C ATOM 541 OE1 GLN A 40 -2.806 -10.562 -5.126 1.00 0.00 O ATOM 542 NE2 GLN A 40 -1.686 -8.792 -5.954 1.00 0.00 N ATOM 0 H GLN A 40 0.194 -10.442 -1.453 1.00 0.00 H new ATOM 0 HA GLN A 40 -1.498 -12.047 -2.819 1.00 0.00 H new ATOM 0 HB2 GLN A 40 1.016 -10.639 -3.752 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -0.083 -11.435 -4.862 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -1.486 -9.685 -2.932 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -0.325 -8.812 -3.913 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -0.917 -8.134 -5.826 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -2.284 -8.723 -6.777 1.00 0.00 H new ATOM 551 N GLY A 41 1.540 -13.340 -2.940 1.00 0.00 N ATOM 552 CA GLY A 41 2.275 -14.576 -3.148 1.00 0.00 C ATOM 553 C GLY A 41 1.755 -15.685 -2.231 1.00 0.00 C ATOM 554 O GLY A 41 1.736 -16.854 -2.614 1.00 0.00 O ATOM 0 H GLY A 41 2.120 -12.530 -2.721 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.183 -14.887 -4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.335 -14.409 -2.958 1.00 0.00 H new ATOM 558 N LEU A 42 1.345 -15.279 -1.038 1.00 0.00 N ATOM 559 CA LEU A 42 0.825 -16.224 -0.064 1.00 0.00 C ATOM 560 C LEU A 42 -0.642 -16.520 -0.380 1.00 0.00 C ATOM 561 O LEU A 42 -1.187 -17.527 0.071 1.00 0.00 O ATOM 562 CB LEU A 42 1.056 -15.708 1.358 1.00 0.00 C ATOM 563 CG LEU A 42 2.394 -15.010 1.609 1.00 0.00 C ATOM 564 CD1 LEU A 42 2.241 -13.883 2.633 1.00 0.00 C ATOM 565 CD2 LEU A 42 3.470 -16.017 2.022 1.00 0.00 C ATOM 0 H LEU A 42 1.362 -14.309 -0.724 1.00 0.00 H new ATOM 0 HA LEU A 42 1.362 -17.171 -0.127 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.254 -15.013 1.606 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.973 -16.549 2.046 1.00 0.00 H new ATOM 0 HG LEU A 42 2.721 -14.554 0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.207 -13.403 2.793 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.528 -13.148 2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.879 -14.294 3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.411 -15.494 2.194 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.163 -16.523 2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.604 -16.753 1.229 1.00 0.00 H new ATOM 577 N GLU A 43 -1.241 -15.625 -1.152 1.00 0.00 N ATOM 578 CA GLU A 43 -2.634 -15.779 -1.533 1.00 0.00 C ATOM 579 C GLU A 43 -2.762 -16.774 -2.688 1.00 0.00 C ATOM 580 O GLU A 43 -3.770 -17.471 -2.803 1.00 0.00 O ATOM 581 CB GLU A 43 -3.253 -14.429 -1.902 1.00 0.00 C ATOM 582 CG GLU A 43 -4.570 -14.618 -2.658 1.00 0.00 C ATOM 583 CD GLU A 43 -5.099 -13.280 -3.180 1.00 0.00 C ATOM 584 OE1 GLU A 43 -4.303 -12.570 -3.832 1.00 0.00 O ATOM 585 OE2 GLU A 43 -6.288 -12.998 -2.916 1.00 0.00 O ATOM 0 H GLU A 43 -0.787 -14.791 -1.524 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.183 -16.173 -0.678 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -3.429 -13.846 -0.998 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -2.555 -13.861 -2.517 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -4.420 -15.304 -3.492 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.309 -15.074 -1.999 1.00 0.00 H new ATOM 592 N GLN A 44 -1.727 -16.810 -3.514 1.00 0.00 N ATOM 593 CA GLN A 44 -1.711 -17.708 -4.656 1.00 0.00 C ATOM 594 C GLN A 44 -1.571 -19.158 -4.188 1.00 0.00 C ATOM 595 O GLN A 44 -2.089 -20.073 -4.827 1.00 0.00 O ATOM 596 CB GLN A 44 -0.593 -17.336 -5.631 1.00 0.00 C ATOM 597 CG GLN A 44 -0.869 -15.985 -6.292 1.00 0.00 C ATOM 598 CD GLN A 44 -0.864 -16.109 -7.817 1.00 0.00 C ATOM 599 OE1 GLN A 44 -1.894 -16.249 -8.458 1.00 0.00 O ATOM 600 NE2 GLN A 44 0.348 -16.051 -8.361 1.00 0.00 N ATOM 0 H GLN A 44 -0.893 -16.231 -3.415 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.658 -17.607 -5.186 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.359 -17.298 -5.101 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.501 -18.107 -6.396 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.834 -15.603 -5.958 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -0.115 -15.263 -5.980 1.00 0.00 H new ATOM 0 HE21 GLN A 44 1.169 -15.933 -7.767 1.00 0.00 H new ATOM 0 HE22 GLN A 44 0.457 -16.125 -9.372 1.00 0.00 H new ATOM 609 N ALA A 45 -0.869 -19.323 -3.077 1.00 0.00 N ATOM 610 CA ALA A 45 -0.654 -20.646 -2.516 1.00 0.00 C ATOM 611 C ALA A 45 -1.968 -21.167 -1.932 1.00 0.00 C ATOM 612 O ALA A 45 -2.192 -22.375 -1.879 1.00 0.00 O ATOM 613 CB ALA A 45 0.463 -20.583 -1.472 1.00 0.00 C ATOM 0 H ALA A 45 -0.441 -18.562 -2.550 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.337 -21.344 -3.291 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.624 -21.576 -1.051 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.382 -20.235 -1.943 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.179 -19.894 -0.677 1.00 0.00 H new ATOM 619 N VAL A 46 -2.804 -20.230 -1.509 1.00 0.00 N ATOM 620 CA VAL A 46 -4.091 -20.580 -0.932 1.00 0.00 C ATOM 621 C VAL A 46 -4.944 -21.286 -1.987 1.00 0.00 C ATOM 622 O VAL A 46 -5.443 -22.385 -1.753 1.00 0.00 O ATOM 623 CB VAL A 46 -4.763 -19.331 -0.357 1.00 0.00 C ATOM 624 CG1 VAL A 46 -6.280 -19.512 -0.280 1.00 0.00 C ATOM 625 CG2 VAL A 46 -4.183 -18.978 1.014 1.00 0.00 C ATOM 0 H VAL A 46 -2.615 -19.229 -1.554 1.00 0.00 H new ATOM 0 HA VAL A 46 -3.961 -21.275 -0.102 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.558 -18.500 -1.031 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.734 -18.610 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.676 -19.693 -1.279 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.513 -20.361 0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -4.678 -18.087 1.400 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -4.343 -19.809 1.702 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.114 -18.787 0.919 1.00 0.00 H new ATOM 635 N ASP A 47 -5.085 -20.625 -3.127 1.00 0.00 N ATOM 636 CA ASP A 47 -5.869 -21.175 -4.219 1.00 0.00 C ATOM 637 C ASP A 47 -5.295 -22.536 -4.619 1.00 0.00 C ATOM 638 O ASP A 47 -5.977 -23.340 -5.252 1.00 0.00 O ATOM 639 CB ASP A 47 -5.821 -20.263 -5.446 1.00 0.00 C ATOM 640 CG ASP A 47 -7.061 -20.315 -6.341 1.00 0.00 C ATOM 641 OD1 ASP A 47 -8.081 -20.860 -5.865 1.00 0.00 O ATOM 642 OD2 ASP A 47 -6.962 -19.809 -7.479 1.00 0.00 O ATOM 0 H ASP A 47 -4.669 -19.713 -3.318 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.900 -21.268 -3.879 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.676 -19.236 -5.111 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.949 -20.529 -6.044 1.00 0.00 H new ATOM 647 N SER A 48 -4.046 -22.752 -4.231 1.00 0.00 N ATOM 648 CA SER A 48 -3.372 -24.001 -4.541 1.00 0.00 C ATOM 649 C SER A 48 -2.860 -24.653 -3.255 1.00 0.00 C ATOM 650 O SER A 48 -1.839 -25.339 -3.266 1.00 0.00 O ATOM 651 CB SER A 48 -2.217 -23.777 -5.519 1.00 0.00 C ATOM 652 OG SER A 48 -2.198 -24.753 -6.557 1.00 0.00 O ATOM 0 H SER A 48 -3.484 -22.083 -3.705 1.00 0.00 H new ATOM 0 HA SER A 48 -4.091 -24.668 -5.017 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.302 -22.783 -5.958 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.272 -23.807 -4.977 1.00 0.00 H new ATOM 0 HG SER A 48 -1.447 -24.574 -7.161 1.00 0.00 H new ATOM 658 N PHE A 49 -3.593 -24.415 -2.177 1.00 0.00 N ATOM 659 CA PHE A 49 -3.226 -24.970 -0.885 1.00 0.00 C ATOM 660 C PHE A 49 -4.126 -26.152 -0.521 1.00 0.00 C ATOM 661 O PHE A 49 -5.155 -26.373 -1.157 1.00 0.00 O ATOM 662 CB PHE A 49 -3.418 -23.860 0.150 1.00 0.00 C ATOM 663 CG PHE A 49 -3.665 -24.370 1.571 1.00 0.00 C ATOM 664 CD1 PHE A 49 -4.919 -24.731 1.956 1.00 0.00 C ATOM 665 CD2 PHE A 49 -2.631 -24.462 2.449 1.00 0.00 C ATOM 666 CE1 PHE A 49 -5.148 -25.204 3.275 1.00 0.00 C ATOM 667 CE2 PHE A 49 -2.860 -24.935 3.768 1.00 0.00 C ATOM 668 CZ PHE A 49 -4.114 -25.296 4.153 1.00 0.00 C ATOM 0 H PHE A 49 -4.439 -23.845 -2.172 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.196 -25.327 -0.912 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.534 -23.223 0.152 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.259 -23.237 -0.153 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -5.740 -24.658 1.258 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -1.636 -24.175 2.143 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.143 -25.491 3.581 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.039 -25.008 4.466 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.288 -25.656 5.156 1.00 0.00 H new ATOM 678 N GLU A 50 -3.705 -26.881 0.503 1.00 0.00 N ATOM 679 CA GLU A 50 -4.460 -28.036 0.960 1.00 0.00 C ATOM 680 C GLU A 50 -4.120 -28.349 2.418 1.00 0.00 C ATOM 681 O GLU A 50 -2.955 -28.300 2.812 1.00 0.00 O ATOM 682 CB GLU A 50 -4.204 -29.249 0.064 1.00 0.00 C ATOM 683 CG GLU A 50 -5.303 -29.394 -0.990 1.00 0.00 C ATOM 684 CD GLU A 50 -5.089 -30.651 -1.837 1.00 0.00 C ATOM 685 OE1 GLU A 50 -4.059 -30.689 -2.544 1.00 0.00 O ATOM 686 OE2 GLU A 50 -5.959 -31.544 -1.756 1.00 0.00 O ATOM 0 H GLU A 50 -2.851 -26.694 1.029 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.522 -27.799 0.898 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.236 -29.145 -0.427 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.158 -30.152 0.673 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.276 -29.442 -0.501 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.312 -28.515 -1.634 1.00 0.00 H new ATOM 693 N GLY A 51 -5.157 -28.665 3.180 1.00 0.00 N ATOM 694 CA GLY A 51 -4.982 -28.987 4.586 1.00 0.00 C ATOM 695 C GLY A 51 -6.183 -28.518 5.409 1.00 0.00 C ATOM 696 O GLY A 51 -7.315 -28.533 4.927 1.00 0.00 O ATOM 0 H GLY A 51 -6.121 -28.705 2.850 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.854 -30.063 4.703 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.073 -28.515 4.960 1.00 0.00 H new ATOM 700 N LYS A 52 -5.896 -28.113 6.638 1.00 0.00 N ATOM 701 CA LYS A 52 -6.939 -27.640 7.533 1.00 0.00 C ATOM 702 C LYS A 52 -6.417 -26.444 8.331 1.00 0.00 C ATOM 703 O LYS A 52 -5.350 -25.911 8.031 1.00 0.00 O ATOM 704 CB LYS A 52 -7.454 -28.786 8.407 1.00 0.00 C ATOM 705 CG LYS A 52 -6.295 -29.545 9.054 1.00 0.00 C ATOM 706 CD LYS A 52 -6.402 -31.047 8.780 1.00 0.00 C ATOM 707 CE LYS A 52 -5.026 -31.714 8.833 1.00 0.00 C ATOM 708 NZ LYS A 52 -4.821 -32.572 7.644 1.00 0.00 N ATOM 0 H LYS A 52 -4.956 -28.103 7.035 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.801 -27.291 6.964 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -8.112 -28.391 9.181 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -8.049 -29.470 7.802 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -5.348 -29.168 8.668 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -6.294 -29.367 10.129 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -7.062 -31.508 9.515 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -6.852 -31.210 7.801 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -4.247 -30.952 8.878 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -4.940 -32.312 9.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -4.196 -33.365 7.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -5.738 -32.942 7.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.386 -32.013 6.883 1.00 0.00 H new ATOM 722 N LYS A 53 -7.193 -26.058 9.333 1.00 0.00 N ATOM 723 CA LYS A 53 -6.822 -24.934 10.176 1.00 0.00 C ATOM 724 C LYS A 53 -5.844 -25.411 11.252 1.00 0.00 C ATOM 725 O LYS A 53 -5.492 -24.654 12.156 1.00 0.00 O ATOM 726 CB LYS A 53 -8.070 -24.252 10.739 1.00 0.00 C ATOM 727 CG LYS A 53 -8.908 -23.631 9.619 1.00 0.00 C ATOM 728 CD LYS A 53 -9.960 -22.676 10.186 1.00 0.00 C ATOM 729 CE LYS A 53 -11.370 -23.111 9.783 1.00 0.00 C ATOM 730 NZ LYS A 53 -12.084 -23.695 10.941 1.00 0.00 N ATOM 0 H LYS A 53 -8.077 -26.503 9.580 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.307 -24.172 9.591 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -8.670 -24.979 11.287 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -7.777 -23.480 11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.258 -23.093 8.929 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -9.398 -24.419 9.047 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -9.881 -22.647 11.273 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -9.771 -21.665 9.825 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -11.925 -22.255 9.400 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -11.315 -23.842 8.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -13.039 -23.985 10.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -11.562 -24.524 11.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -12.153 -22.987 11.699 1.00 0.00 H new ATOM 744 N THR A 54 -5.432 -26.663 11.119 1.00 0.00 N ATOM 745 CA THR A 54 -4.502 -27.250 12.068 1.00 0.00 C ATOM 746 C THR A 54 -3.150 -27.508 11.400 1.00 0.00 C ATOM 747 O THR A 54 -2.104 -27.361 12.030 1.00 0.00 O ATOM 748 CB THR A 54 -5.146 -28.513 12.643 1.00 0.00 C ATOM 749 OG1 THR A 54 -5.091 -28.320 14.054 1.00 0.00 O ATOM 750 CG2 THR A 54 -4.298 -29.764 12.405 1.00 0.00 C ATOM 0 H THR A 54 -5.725 -27.287 10.368 1.00 0.00 H new ATOM 0 HA THR A 54 -4.297 -26.568 12.893 1.00 0.00 H new ATOM 0 HB THR A 54 -6.131 -28.652 12.197 1.00 0.00 H new ATOM 0 HG1 THR A 54 -5.490 -29.093 14.506 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.801 -30.631 12.833 1.00 0.00 H new ATOM 0 HG22 THR A 54 -4.164 -29.914 11.334 1.00 0.00 H new ATOM 0 HG23 THR A 54 -3.324 -29.639 12.879 1.00 0.00 H new ATOM 758 N ASP A 55 -3.216 -27.889 10.133 1.00 0.00 N ATOM 759 CA ASP A 55 -2.010 -28.169 9.372 1.00 0.00 C ATOM 760 C ASP A 55 -1.006 -27.033 9.580 1.00 0.00 C ATOM 761 O ASP A 55 -1.331 -25.865 9.371 1.00 0.00 O ATOM 762 CB ASP A 55 -2.312 -28.264 7.875 1.00 0.00 C ATOM 763 CG ASP A 55 -2.570 -29.680 7.357 1.00 0.00 C ATOM 764 OD1 ASP A 55 -1.601 -30.470 7.357 1.00 0.00 O ATOM 765 OD2 ASP A 55 -3.730 -29.941 6.972 1.00 0.00 O ATOM 0 H ASP A 55 -4.086 -28.010 9.614 1.00 0.00 H new ATOM 0 HA ASP A 55 -1.606 -29.120 9.719 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.184 -27.648 7.656 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.474 -27.838 7.323 1.00 0.00 H new ATOM 770 N LYS A 56 0.195 -27.415 9.989 1.00 0.00 N ATOM 771 CA LYS A 56 1.249 -26.443 10.228 1.00 0.00 C ATOM 772 C LYS A 56 1.442 -25.588 8.974 1.00 0.00 C ATOM 773 O LYS A 56 1.905 -24.452 9.058 1.00 0.00 O ATOM 774 CB LYS A 56 2.526 -27.142 10.698 1.00 0.00 C ATOM 775 CG LYS A 56 3.703 -26.165 10.738 1.00 0.00 C ATOM 776 CD LYS A 56 3.537 -25.154 11.874 1.00 0.00 C ATOM 777 CE LYS A 56 4.527 -23.997 11.727 1.00 0.00 C ATOM 778 NZ LYS A 56 4.996 -23.543 13.055 1.00 0.00 N ATOM 0 H LYS A 56 0.462 -28.384 10.161 1.00 0.00 H new ATOM 0 HA LYS A 56 0.968 -25.767 11.035 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.368 -27.568 11.689 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.759 -27.970 10.029 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.634 -26.716 10.870 1.00 0.00 H new ATOM 0 HG3 LYS A 56 3.776 -25.639 9.786 1.00 0.00 H new ATOM 0 HD2 LYS A 56 2.518 -24.767 11.876 1.00 0.00 H new ATOM 0 HD3 LYS A 56 3.691 -25.650 12.832 1.00 0.00 H new ATOM 0 HE2 LYS A 56 5.378 -24.313 11.123 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.052 -23.169 11.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.667 -22.757 12.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.183 -23.222 13.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.468 -24.330 13.544 1.00 0.00 H new ATOM 792 N LYS A 57 1.076 -26.168 7.839 1.00 0.00 N ATOM 793 CA LYS A 57 1.204 -25.473 6.569 1.00 0.00 C ATOM 794 C LYS A 57 0.279 -24.255 6.565 1.00 0.00 C ATOM 795 O LYS A 57 0.695 -23.156 6.200 1.00 0.00 O ATOM 796 CB LYS A 57 0.959 -26.436 5.406 1.00 0.00 C ATOM 797 CG LYS A 57 0.756 -25.672 4.095 1.00 0.00 C ATOM 798 CD LYS A 57 0.461 -26.632 2.941 1.00 0.00 C ATOM 799 CE LYS A 57 1.718 -26.891 2.108 1.00 0.00 C ATOM 800 NZ LYS A 57 1.382 -26.952 0.668 1.00 0.00 N ATOM 0 H LYS A 57 0.691 -27.110 7.773 1.00 0.00 H new ATOM 0 HA LYS A 57 2.220 -25.102 6.437 1.00 0.00 H new ATOM 0 HB2 LYS A 57 1.805 -27.116 5.308 1.00 0.00 H new ATOM 0 HB3 LYS A 57 0.081 -27.048 5.614 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -0.067 -24.966 4.205 1.00 0.00 H new ATOM 0 HG3 LYS A 57 1.648 -25.088 3.868 1.00 0.00 H new ATOM 0 HD2 LYS A 57 0.081 -27.575 3.335 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -0.320 -26.214 2.306 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.447 -26.100 2.284 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.181 -27.827 2.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 2.246 -27.128 0.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.703 -27.722 0.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.961 -26.049 0.371 1.00 0.00 H new ATOM 814 N TYR A 58 -0.959 -24.490 6.974 1.00 0.00 N ATOM 815 CA TYR A 58 -1.947 -23.425 7.021 1.00 0.00 C ATOM 816 C TYR A 58 -1.449 -22.253 7.870 1.00 0.00 C ATOM 817 O TYR A 58 -1.532 -21.099 7.451 1.00 0.00 O ATOM 818 CB TYR A 58 -3.186 -24.028 7.684 1.00 0.00 C ATOM 819 CG TYR A 58 -4.288 -23.011 7.986 1.00 0.00 C ATOM 820 CD1 TYR A 58 -4.977 -22.411 6.951 1.00 0.00 C ATOM 821 CD2 TYR A 58 -4.594 -22.692 9.294 1.00 0.00 C ATOM 822 CE1 TYR A 58 -6.014 -21.454 7.236 1.00 0.00 C ATOM 823 CE2 TYR A 58 -5.631 -21.734 9.579 1.00 0.00 C ATOM 824 CZ TYR A 58 -6.289 -21.162 8.535 1.00 0.00 C ATOM 825 OH TYR A 58 -7.269 -20.258 8.804 1.00 0.00 O ATOM 0 H TYR A 58 -1.301 -25.402 7.276 1.00 0.00 H new ATOM 0 HA TYR A 58 -2.151 -23.046 6.019 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -3.591 -24.805 7.035 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.888 -24.512 8.614 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -4.738 -22.660 5.928 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -4.055 -23.161 10.104 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.561 -20.979 6.436 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -5.880 -21.476 10.598 1.00 0.00 H new ATOM 0 HH TYR A 58 -7.356 -20.149 9.774 1.00 0.00 H new ATOM 835 N LEU A 59 -0.943 -22.589 9.047 1.00 0.00 N ATOM 836 CA LEU A 59 -0.431 -21.579 9.958 1.00 0.00 C ATOM 837 C LEU A 59 0.567 -20.688 9.216 1.00 0.00 C ATOM 838 O LEU A 59 0.460 -19.464 9.257 1.00 0.00 O ATOM 839 CB LEU A 59 0.144 -22.234 11.215 1.00 0.00 C ATOM 840 CG LEU A 59 -0.875 -22.835 12.185 1.00 0.00 C ATOM 841 CD1 LEU A 59 -1.582 -24.040 11.561 1.00 0.00 C ATOM 842 CD2 LEU A 59 -0.219 -23.185 13.523 1.00 0.00 C ATOM 0 H LEU A 59 -0.876 -23.547 9.391 1.00 0.00 H new ATOM 0 HA LEU A 59 -1.238 -20.933 10.304 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.832 -23.022 10.908 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.732 -21.489 11.752 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.638 -22.083 12.387 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.301 -24.448 12.271 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.103 -23.728 10.656 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.846 -24.804 11.310 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.965 -23.610 14.194 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.577 -23.911 13.359 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.199 -22.283 13.970 1.00 0.00 H new ATOM 854 N MET A 60 1.515 -21.338 8.557 1.00 0.00 N ATOM 855 CA MET A 60 2.531 -20.620 7.807 1.00 0.00 C ATOM 856 C MET A 60 1.903 -19.530 6.936 1.00 0.00 C ATOM 857 O MET A 60 2.323 -18.374 6.982 1.00 0.00 O ATOM 858 CB MET A 60 3.301 -21.601 6.921 1.00 0.00 C ATOM 859 CG MET A 60 4.649 -21.964 7.547 1.00 0.00 C ATOM 860 SD MET A 60 5.373 -23.346 6.680 1.00 0.00 S ATOM 861 CE MET A 60 5.532 -22.639 5.048 1.00 0.00 C ATOM 0 H MET A 60 1.601 -22.354 8.527 1.00 0.00 H new ATOM 0 HA MET A 60 3.211 -20.146 8.515 1.00 0.00 H new ATOM 0 HB2 MET A 60 2.709 -22.505 6.774 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.460 -21.160 5.937 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.321 -21.107 7.506 1.00 0.00 H new ATOM 0 HG3 MET A 60 4.515 -22.214 8.599 1.00 0.00 H new ATOM 0 HE1 MET A 60 6.255 -23.215 4.471 1.00 0.00 H new ATOM 0 HE2 MET A 60 4.565 -22.662 4.546 1.00 0.00 H new ATOM 0 HE3 MET A 60 5.873 -21.607 5.130 1.00 0.00 H new ATOM 871 N ILE A 61 0.907 -19.936 6.163 1.00 0.00 N ATOM 872 CA ILE A 61 0.217 -19.009 5.283 1.00 0.00 C ATOM 873 C ILE A 61 -0.558 -17.993 6.125 1.00 0.00 C ATOM 874 O ILE A 61 -0.456 -16.788 5.901 1.00 0.00 O ATOM 875 CB ILE A 61 -0.655 -19.769 4.281 1.00 0.00 C ATOM 876 CG1 ILE A 61 0.197 -20.673 3.388 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.518 -18.805 3.464 1.00 0.00 C ATOM 878 CD1 ILE A 61 -0.650 -21.786 2.767 1.00 0.00 C ATOM 0 H ILE A 61 0.561 -20.895 6.128 1.00 0.00 H new ATOM 0 HA ILE A 61 0.934 -18.447 4.685 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.333 -20.415 4.839 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.659 -20.080 2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.006 -21.110 3.973 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.128 -19.371 2.760 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.167 -18.240 4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.875 -18.116 2.916 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.020 -22.414 2.137 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.091 -22.392 3.558 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.443 -21.346 2.163 1.00 0.00 H new ATOM 890 N GLU A 62 -1.314 -18.517 7.078 1.00 0.00 N ATOM 891 CA GLU A 62 -2.106 -17.671 7.956 1.00 0.00 C ATOM 892 C GLU A 62 -1.279 -16.473 8.425 1.00 0.00 C ATOM 893 O GLU A 62 -1.585 -15.331 8.084 1.00 0.00 O ATOM 894 CB GLU A 62 -2.642 -18.467 9.147 1.00 0.00 C ATOM 895 CG GLU A 62 -3.324 -17.545 10.160 1.00 0.00 C ATOM 896 CD GLU A 62 -2.411 -17.275 11.358 1.00 0.00 C ATOM 897 OE1 GLU A 62 -2.078 -18.260 12.051 1.00 0.00 O ATOM 898 OE2 GLU A 62 -2.067 -16.089 11.553 1.00 0.00 O ATOM 0 H GLU A 62 -1.395 -19.517 7.262 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.963 -17.299 7.395 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.351 -19.218 8.798 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -1.824 -19.002 9.630 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.588 -16.603 9.680 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.254 -17.999 10.502 1.00 0.00 H new ATOM 905 N GLU A 63 -0.247 -16.773 9.200 1.00 0.00 N ATOM 906 CA GLU A 63 0.627 -15.734 9.719 1.00 0.00 C ATOM 907 C GLU A 63 1.197 -14.897 8.572 1.00 0.00 C ATOM 908 O GLU A 63 1.213 -13.670 8.643 1.00 0.00 O ATOM 909 CB GLU A 63 1.748 -16.335 10.569 1.00 0.00 C ATOM 910 CG GLU A 63 2.992 -16.608 9.722 1.00 0.00 C ATOM 911 CD GLU A 63 4.111 -17.215 10.570 1.00 0.00 C ATOM 912 OE1 GLU A 63 4.321 -16.696 11.688 1.00 0.00 O ATOM 913 OE2 GLU A 63 4.732 -18.184 10.082 1.00 0.00 O ATOM 0 H GLU A 63 0.004 -17.721 9.481 1.00 0.00 H new ATOM 0 HA GLU A 63 0.039 -15.080 10.362 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.999 -15.653 11.381 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.405 -17.263 11.027 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.740 -17.287 8.907 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.338 -15.679 9.268 1.00 0.00 H new ATOM 920 N TYR A 64 1.650 -15.595 7.541 1.00 0.00 N ATOM 921 CA TYR A 64 2.219 -14.932 6.380 1.00 0.00 C ATOM 922 C TYR A 64 1.273 -13.856 5.845 1.00 0.00 C ATOM 923 O TYR A 64 1.718 -12.802 5.392 1.00 0.00 O ATOM 924 CB TYR A 64 2.391 -16.018 5.316 1.00 0.00 C ATOM 925 CG TYR A 64 3.812 -16.578 5.223 1.00 0.00 C ATOM 926 CD1 TYR A 64 4.896 -15.729 5.312 1.00 0.00 C ATOM 927 CD2 TYR A 64 4.009 -17.933 5.051 1.00 0.00 C ATOM 928 CE1 TYR A 64 6.233 -16.256 5.225 1.00 0.00 C ATOM 929 CE2 TYR A 64 5.347 -18.461 4.963 1.00 0.00 C ATOM 930 CZ TYR A 64 6.392 -17.596 5.055 1.00 0.00 C ATOM 931 OH TYR A 64 7.655 -18.094 4.972 1.00 0.00 O ATOM 0 H TYR A 64 1.635 -16.613 7.486 1.00 0.00 H new ATOM 0 HA TYR A 64 3.160 -14.447 6.638 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.703 -16.835 5.531 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.108 -15.610 4.346 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.741 -14.669 5.447 1.00 0.00 H new ATOM 0 HD2 TYR A 64 3.161 -18.598 4.982 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.090 -15.602 5.293 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.516 -19.519 4.827 1.00 0.00 H new ATOM 0 HH TYR A 64 7.616 -19.066 4.852 1.00 0.00 H new ATOM 941 N LEU A 65 -0.015 -14.158 5.915 1.00 0.00 N ATOM 942 CA LEU A 65 -1.028 -13.229 5.443 1.00 0.00 C ATOM 943 C LEU A 65 -1.099 -12.032 6.393 1.00 0.00 C ATOM 944 O LEU A 65 -0.638 -10.942 6.059 1.00 0.00 O ATOM 945 CB LEU A 65 -2.367 -13.946 5.257 1.00 0.00 C ATOM 946 CG LEU A 65 -2.383 -15.083 4.233 1.00 0.00 C ATOM 947 CD1 LEU A 65 -3.516 -16.068 4.525 1.00 0.00 C ATOM 948 CD2 LEU A 65 -2.453 -14.534 2.806 1.00 0.00 C ATOM 0 H LEU A 65 -0.381 -15.033 6.291 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.760 -12.841 4.460 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.678 -14.348 6.221 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.114 -13.208 4.963 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.447 -15.635 4.320 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.505 -16.866 3.783 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.380 -16.495 5.519 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.472 -15.546 4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.463 -15.362 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -3.362 -13.944 2.687 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.584 -13.904 2.615 1.00 0.00 H new ATOM 960 N THR A 66 -1.680 -12.275 7.559 1.00 0.00 N ATOM 961 CA THR A 66 -1.816 -11.231 8.559 1.00 0.00 C ATOM 962 C THR A 66 -0.567 -10.347 8.582 1.00 0.00 C ATOM 963 O THR A 66 -0.660 -9.140 8.799 1.00 0.00 O ATOM 964 CB THR A 66 -2.113 -11.899 9.903 1.00 0.00 C ATOM 965 OG1 THR A 66 -3.517 -12.138 9.870 1.00 0.00 O ATOM 966 CG2 THR A 66 -1.925 -10.946 11.085 1.00 0.00 C ATOM 0 H THR A 66 -2.062 -13.180 7.833 1.00 0.00 H new ATOM 0 HA THR A 66 -2.644 -10.563 8.322 1.00 0.00 H new ATOM 0 HB THR A 66 -1.464 -12.765 10.028 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.795 -12.571 10.704 1.00 0.00 H new ATOM 0 HG21 THR A 66 -2.149 -11.470 12.014 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.894 -10.592 11.107 1.00 0.00 H new ATOM 0 HG23 THR A 66 -2.598 -10.095 10.977 1.00 0.00 H new ATOM 974 N LYS A 67 0.573 -10.984 8.357 1.00 0.00 N ATOM 975 CA LYS A 67 1.839 -10.271 8.349 1.00 0.00 C ATOM 976 C LYS A 67 1.650 -8.912 7.672 1.00 0.00 C ATOM 977 O LYS A 67 2.105 -7.891 8.185 1.00 0.00 O ATOM 978 CB LYS A 67 2.933 -11.130 7.710 1.00 0.00 C ATOM 979 CG LYS A 67 4.005 -11.503 8.735 1.00 0.00 C ATOM 980 CD LYS A 67 4.339 -12.994 8.662 1.00 0.00 C ATOM 981 CE LYS A 67 5.570 -13.323 9.509 1.00 0.00 C ATOM 982 NZ LYS A 67 6.466 -14.250 8.782 1.00 0.00 N ATOM 0 H LYS A 67 0.646 -11.986 8.179 1.00 0.00 H new ATOM 0 HA LYS A 67 2.173 -10.076 9.368 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.492 -12.036 7.293 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.389 -10.587 6.882 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.905 -10.916 8.555 1.00 0.00 H new ATOM 0 HG3 LYS A 67 3.657 -11.253 9.737 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.487 -13.578 9.010 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.520 -13.279 7.626 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.106 -12.406 9.753 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.260 -13.772 10.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.296 -14.463 9.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.956 -15.131 8.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.776 -13.808 7.893 1.00 0.00 H new ATOM 996 N GLU A 68 0.978 -8.944 6.530 1.00 0.00 N ATOM 997 CA GLU A 68 0.724 -7.727 5.778 1.00 0.00 C ATOM 998 C GLU A 68 -0.225 -6.811 6.555 1.00 0.00 C ATOM 999 O GLU A 68 -0.028 -5.598 6.595 1.00 0.00 O ATOM 1000 CB GLU A 68 0.164 -8.047 4.391 1.00 0.00 C ATOM 1001 CG GLU A 68 1.140 -8.913 3.592 1.00 0.00 C ATOM 1002 CD GLU A 68 2.590 -8.539 3.908 1.00 0.00 C ATOM 1003 OE1 GLU A 68 2.971 -7.400 3.562 1.00 0.00 O ATOM 1004 OE2 GLU A 68 3.284 -9.400 4.489 1.00 0.00 O ATOM 0 H GLU A 68 0.602 -9.793 6.108 1.00 0.00 H new ATOM 0 HA GLU A 68 1.670 -7.204 5.640 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.790 -8.565 4.491 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -0.031 -7.120 3.851 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.973 -9.965 3.825 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.953 -8.789 2.525 1.00 0.00 H new ATOM 1011 N LEU A 69 -1.234 -7.428 7.152 1.00 0.00 N ATOM 1012 CA LEU A 69 -2.214 -6.684 7.925 1.00 0.00 C ATOM 1013 C LEU A 69 -1.490 -5.697 8.843 1.00 0.00 C ATOM 1014 O LEU A 69 -1.774 -4.500 8.820 1.00 0.00 O ATOM 1015 CB LEU A 69 -3.149 -7.641 8.667 1.00 0.00 C ATOM 1016 CG LEU A 69 -4.623 -7.589 8.259 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -5.012 -8.826 7.449 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -5.524 -7.398 9.481 1.00 0.00 C ATOM 0 H LEU A 69 -1.394 -8.435 7.116 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.853 -6.097 7.266 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.787 -8.659 8.519 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.080 -7.430 9.734 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.768 -6.723 7.613 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.064 -8.763 7.172 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.402 -8.877 6.547 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.847 -9.721 8.050 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.566 -7.364 9.163 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.382 -8.229 10.171 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.267 -6.464 9.980 1.00 0.00 H new ATOM 1030 N LEU A 70 -0.568 -6.235 9.628 1.00 0.00 N ATOM 1031 CA LEU A 70 0.198 -5.416 10.552 1.00 0.00 C ATOM 1032 C LEU A 70 0.945 -4.334 9.769 1.00 0.00 C ATOM 1033 O LEU A 70 1.056 -3.197 10.225 1.00 0.00 O ATOM 1034 CB LEU A 70 1.110 -6.291 11.414 1.00 0.00 C ATOM 1035 CG LEU A 70 0.415 -7.125 12.493 1.00 0.00 C ATOM 1036 CD1 LEU A 70 -0.025 -6.247 13.666 1.00 0.00 C ATOM 1037 CD2 LEU A 70 -0.752 -7.921 11.903 1.00 0.00 C ATOM 0 H LEU A 70 -0.334 -7.228 9.643 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.466 -4.905 11.249 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.659 -6.967 10.758 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.846 -5.649 11.897 1.00 0.00 H new ATOM 0 HG LEU A 70 1.133 -7.847 12.883 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.516 -6.864 14.418 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.847 -5.764 14.106 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -0.720 -5.487 13.311 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.229 -8.505 12.690 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -1.479 -7.234 11.470 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.380 -8.592 11.128 1.00 0.00 H new ATOM 1049 N ALA A 71 1.438 -4.727 8.603 1.00 0.00 N ATOM 1050 CA ALA A 71 2.172 -3.806 7.752 1.00 0.00 C ATOM 1051 C ALA A 71 1.205 -2.768 7.178 1.00 0.00 C ATOM 1052 O ALA A 71 1.629 -1.725 6.684 1.00 0.00 O ATOM 1053 CB ALA A 71 2.901 -4.590 6.660 1.00 0.00 C ATOM 0 H ALA A 71 1.343 -5.671 8.228 1.00 0.00 H new ATOM 0 HA ALA A 71 2.927 -3.271 8.328 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.452 -3.899 6.022 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.597 -5.292 7.119 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.175 -5.138 6.060 1.00 0.00 H new ATOM 1059 N LEU A 72 -0.078 -3.091 7.263 1.00 0.00 N ATOM 1060 CA LEU A 72 -1.108 -2.200 6.759 1.00 0.00 C ATOM 1061 C LEU A 72 -1.512 -1.219 7.860 1.00 0.00 C ATOM 1062 O LEU A 72 -2.031 -0.140 7.576 1.00 0.00 O ATOM 1063 CB LEU A 72 -2.280 -3.004 6.191 1.00 0.00 C ATOM 1064 CG LEU A 72 -2.112 -3.515 4.759 1.00 0.00 C ATOM 1065 CD1 LEU A 72 -3.000 -4.734 4.504 1.00 0.00 C ATOM 1066 CD2 LEU A 72 -2.368 -2.398 3.745 1.00 0.00 C ATOM 0 H LEU A 72 -0.427 -3.957 7.673 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.725 -1.607 5.929 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.457 -3.860 6.842 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.174 -2.382 6.231 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.079 -3.837 4.630 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.861 -5.077 3.479 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.728 -5.533 5.194 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.044 -4.462 4.657 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.242 -2.788 2.735 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.384 -2.023 3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.660 -1.586 3.912 1.00 0.00 H new ATOM 1078 N ASP A 73 -1.259 -1.627 9.095 1.00 0.00 N ATOM 1079 CA ASP A 73 -1.590 -0.797 10.241 1.00 0.00 C ATOM 1080 C ASP A 73 -0.430 0.159 10.524 1.00 0.00 C ATOM 1081 O ASP A 73 -0.647 1.329 10.838 1.00 0.00 O ATOM 1082 CB ASP A 73 -1.816 -1.649 11.491 1.00 0.00 C ATOM 1083 CG ASP A 73 -2.518 -0.931 12.645 1.00 0.00 C ATOM 1084 OD1 ASP A 73 -2.330 0.301 12.745 1.00 0.00 O ATOM 1085 OD2 ASP A 73 -3.227 -1.630 13.401 1.00 0.00 O ATOM 0 H ASP A 73 -0.828 -2.522 9.327 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.503 -0.249 10.008 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.405 -2.523 11.215 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -0.851 -2.014 11.843 1.00 0.00 H new ATOM 1090 N SER A 74 0.778 -0.373 10.403 1.00 0.00 N ATOM 1091 CA SER A 74 1.972 0.419 10.641 1.00 0.00 C ATOM 1092 C SER A 74 1.951 1.675 9.768 1.00 0.00 C ATOM 1093 O SER A 74 2.517 2.702 10.138 1.00 0.00 O ATOM 1094 CB SER A 74 3.237 -0.397 10.368 1.00 0.00 C ATOM 1095 OG SER A 74 3.899 0.027 9.179 1.00 0.00 O ATOM 0 H SER A 74 0.955 -1.343 10.143 1.00 0.00 H new ATOM 0 HA SER A 74 1.982 0.715 11.690 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.918 -0.305 11.214 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.976 -1.452 10.282 1.00 0.00 H new ATOM 0 HG SER A 74 4.702 -0.517 9.040 1.00 0.00 H new ATOM 1101 N VAL A 75 1.293 1.550 8.625 1.00 0.00 N ATOM 1102 CA VAL A 75 1.190 2.662 7.695 1.00 0.00 C ATOM 1103 C VAL A 75 0.170 3.672 8.225 1.00 0.00 C ATOM 1104 O VAL A 75 -1.019 3.370 8.313 1.00 0.00 O ATOM 1105 CB VAL A 75 0.849 2.146 6.296 1.00 0.00 C ATOM 1106 CG1 VAL A 75 0.581 3.304 5.334 1.00 0.00 C ATOM 1107 CG2 VAL A 75 1.957 1.235 5.763 1.00 0.00 C ATOM 0 H VAL A 75 0.826 0.696 8.322 1.00 0.00 H new ATOM 0 HA VAL A 75 2.146 3.179 7.611 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.064 1.555 6.370 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.341 2.909 4.347 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.257 3.896 5.702 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.468 3.934 5.267 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.690 0.882 4.767 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.893 1.792 5.712 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.079 0.382 6.430 1.00 0.00 H new ATOM 1117 N ASP A 76 0.672 4.850 8.564 1.00 0.00 N ATOM 1118 CA ASP A 76 -0.181 5.906 9.083 1.00 0.00 C ATOM 1119 C ASP A 76 -0.412 6.952 7.990 1.00 0.00 C ATOM 1120 O ASP A 76 0.517 7.652 7.590 1.00 0.00 O ATOM 1121 CB ASP A 76 0.472 6.605 10.276 1.00 0.00 C ATOM 1122 CG ASP A 76 -0.385 7.683 10.943 1.00 0.00 C ATOM 1123 OD1 ASP A 76 -1.493 7.931 10.420 1.00 0.00 O ATOM 1124 OD2 ASP A 76 0.086 8.234 11.961 1.00 0.00 O ATOM 0 H ASP A 76 1.659 5.097 8.489 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.121 5.455 9.400 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.729 5.853 11.022 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.407 7.058 9.945 1.00 0.00 H new ATOM 1129 N PRO A 77 -1.689 7.027 7.527 1.00 0.00 N ATOM 1130 CA PRO A 77 -2.054 7.976 6.489 1.00 0.00 C ATOM 1131 C PRO A 77 -2.136 9.397 7.049 1.00 0.00 C ATOM 1132 O PRO A 77 -2.013 10.369 6.306 1.00 0.00 O ATOM 1133 CB PRO A 77 -3.381 7.473 5.946 1.00 0.00 C ATOM 1134 CG PRO A 77 -3.937 6.535 7.005 1.00 0.00 C ATOM 1135 CD PRO A 77 -2.814 6.214 7.978 1.00 0.00 C ATOM 0 HA PRO A 77 -1.311 8.037 5.694 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -4.065 8.301 5.759 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -3.243 6.953 4.998 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.773 7.001 7.527 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.317 5.622 6.546 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.095 6.460 9.002 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -2.567 5.152 7.962 1.00 0.00 H new ATOM 1143 N GLU A 78 -2.345 9.472 8.356 1.00 0.00 N ATOM 1144 CA GLU A 78 -2.446 10.759 9.024 1.00 0.00 C ATOM 1145 C GLU A 78 -3.727 11.479 8.599 1.00 0.00 C ATOM 1146 O GLU A 78 -4.581 11.778 9.432 1.00 0.00 O ATOM 1147 CB GLU A 78 -1.213 11.620 8.744 1.00 0.00 C ATOM 1148 CG GLU A 78 -0.192 11.501 9.877 1.00 0.00 C ATOM 1149 CD GLU A 78 0.310 12.880 10.311 1.00 0.00 C ATOM 1150 OE1 GLU A 78 -0.540 13.674 10.769 1.00 0.00 O ATOM 1151 OE2 GLU A 78 1.531 13.109 10.175 1.00 0.00 O ATOM 0 H GLU A 78 -2.447 8.663 8.969 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.491 10.586 10.099 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.756 11.312 7.804 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.512 12.662 8.627 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.645 10.991 10.727 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.650 10.890 9.550 1.00 0.00 H new ATOM 1158 N GLY A 79 -3.820 11.737 7.302 1.00 0.00 N ATOM 1159 CA GLY A 79 -4.982 12.417 6.756 1.00 0.00 C ATOM 1160 C GLY A 79 -4.955 12.406 5.226 1.00 0.00 C ATOM 1161 O GLY A 79 -5.380 13.367 4.587 1.00 0.00 O ATOM 0 H GLY A 79 -3.110 11.487 6.614 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.892 11.932 7.111 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.008 13.446 7.115 1.00 0.00 H new ATOM 1165 N ARG A 80 -4.451 11.307 4.683 1.00 0.00 N ATOM 1166 CA ARG A 80 -4.363 11.158 3.241 1.00 0.00 C ATOM 1167 C ARG A 80 -5.331 10.076 2.759 1.00 0.00 C ATOM 1168 O ARG A 80 -5.251 8.928 3.196 1.00 0.00 O ATOM 1169 CB ARG A 80 -2.941 10.790 2.811 1.00 0.00 C ATOM 1170 CG ARG A 80 -2.020 12.010 2.861 1.00 0.00 C ATOM 1171 CD ARG A 80 -0.905 11.813 3.890 1.00 0.00 C ATOM 1172 NE ARG A 80 0.412 11.811 3.215 1.00 0.00 N ATOM 1173 CZ ARG A 80 1.061 10.702 2.836 1.00 0.00 C ATOM 1174 NH1 ARG A 80 0.518 9.498 3.064 1.00 0.00 N ATOM 1175 NH2 ARG A 80 2.252 10.796 2.230 1.00 0.00 N ATOM 0 H ARG A 80 -4.100 10.512 5.216 1.00 0.00 H new ATOM 0 HA ARG A 80 -4.630 12.115 2.792 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -2.551 10.008 3.463 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -2.957 10.383 1.800 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -1.585 12.182 1.877 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -2.600 12.898 3.113 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.940 12.609 4.634 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.052 10.873 4.422 1.00 0.00 H new ATOM 0 HE ARG A 80 0.854 12.711 3.026 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.389 9.427 3.526 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.011 8.653 2.776 1.00 0.00 H new ATOM 0 HH21 ARG A 80 2.665 11.712 2.057 1.00 0.00 H new ATOM 0 HH22 ARG A 80 2.746 9.951 1.942 1.00 0.00 H new ATOM 1189 N ALA A 81 -6.222 10.479 1.865 1.00 0.00 N ATOM 1190 CA ALA A 81 -7.204 9.557 1.319 1.00 0.00 C ATOM 1191 C ALA A 81 -6.493 8.518 0.450 1.00 0.00 C ATOM 1192 O ALA A 81 -6.625 7.317 0.679 1.00 0.00 O ATOM 1193 CB ALA A 81 -8.264 10.341 0.543 1.00 0.00 C ATOM 0 H ALA A 81 -6.285 11.431 1.505 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.716 9.022 2.119 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.001 9.650 0.133 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -8.759 11.044 1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -7.788 10.889 -0.271 1.00 0.00 H new ATOM 1199 N ASP A 82 -5.756 9.018 -0.531 1.00 0.00 N ATOM 1200 CA ASP A 82 -5.025 8.149 -1.436 1.00 0.00 C ATOM 1201 C ASP A 82 -4.457 6.964 -0.651 1.00 0.00 C ATOM 1202 O ASP A 82 -4.588 5.816 -1.071 1.00 0.00 O ATOM 1203 CB ASP A 82 -3.855 8.889 -2.087 1.00 0.00 C ATOM 1204 CG ASP A 82 -4.246 9.872 -3.192 1.00 0.00 C ATOM 1205 OD1 ASP A 82 -4.583 9.384 -4.293 1.00 0.00 O ATOM 1206 OD2 ASP A 82 -4.200 11.089 -2.912 1.00 0.00 O ATOM 0 H ASP A 82 -5.650 10.015 -0.719 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.714 7.813 -2.211 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -3.313 9.432 -1.313 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -3.166 8.154 -2.503 1.00 0.00 H new ATOM 1211 N VAL A 83 -3.837 7.285 0.475 1.00 0.00 N ATOM 1212 CA VAL A 83 -3.248 6.262 1.322 1.00 0.00 C ATOM 1213 C VAL A 83 -4.363 5.469 2.006 1.00 0.00 C ATOM 1214 O VAL A 83 -4.473 4.258 1.819 1.00 0.00 O ATOM 1215 CB VAL A 83 -2.274 6.901 2.315 1.00 0.00 C ATOM 1216 CG1 VAL A 83 -1.407 5.839 2.993 1.00 0.00 C ATOM 1217 CG2 VAL A 83 -1.408 7.959 1.628 1.00 0.00 C ATOM 0 H VAL A 83 -3.730 8.239 0.820 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.668 5.559 0.724 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.861 7.398 3.088 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.724 6.320 3.693 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.045 5.138 3.531 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.833 5.301 2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.725 8.398 2.355 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.835 7.495 0.825 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.047 8.739 1.214 1.00 0.00 H new ATOM 1227 N ARG A 84 -5.162 6.183 2.785 1.00 0.00 N ATOM 1228 CA ARG A 84 -6.265 5.561 3.498 1.00 0.00 C ATOM 1229 C ARG A 84 -6.979 4.553 2.595 1.00 0.00 C ATOM 1230 O ARG A 84 -7.453 3.520 3.066 1.00 0.00 O ATOM 1231 CB ARG A 84 -7.272 6.608 3.978 1.00 0.00 C ATOM 1232 CG ARG A 84 -6.858 7.187 5.332 1.00 0.00 C ATOM 1233 CD ARG A 84 -7.841 8.266 5.791 1.00 0.00 C ATOM 1234 NE ARG A 84 -7.336 8.922 7.018 1.00 0.00 N ATOM 1235 CZ ARG A 84 -8.064 9.746 7.783 1.00 0.00 C ATOM 1236 NH1 ARG A 84 -9.333 10.021 7.452 1.00 0.00 N ATOM 1237 NH2 ARG A 84 -7.524 10.295 8.879 1.00 0.00 N ATOM 0 H ARG A 84 -5.068 7.187 2.938 1.00 0.00 H new ATOM 0 HA ARG A 84 -5.851 5.048 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.347 7.410 3.243 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -8.261 6.157 4.059 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -6.815 6.390 6.074 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.856 7.610 5.260 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -7.976 9.006 5.002 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -8.818 7.822 5.982 1.00 0.00 H new ATOM 0 HE ARG A 84 -6.373 8.735 7.299 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -9.744 9.603 6.618 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -9.887 10.648 8.034 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.558 10.086 9.131 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.079 10.922 9.461 1.00 0.00 H new ATOM 1251 N GLN A 85 -7.033 4.888 1.315 1.00 0.00 N ATOM 1252 CA GLN A 85 -7.681 4.025 0.342 1.00 0.00 C ATOM 1253 C GLN A 85 -6.931 2.696 0.229 1.00 0.00 C ATOM 1254 O GLN A 85 -7.421 1.662 0.682 1.00 0.00 O ATOM 1255 CB GLN A 85 -7.784 4.714 -1.020 1.00 0.00 C ATOM 1256 CG GLN A 85 -7.697 3.695 -2.158 1.00 0.00 C ATOM 1257 CD GLN A 85 -6.325 3.743 -2.834 1.00 0.00 C ATOM 1258 OE1 GLN A 85 -5.607 2.759 -2.908 1.00 0.00 O ATOM 1259 NE2 GLN A 85 -6.003 4.937 -3.321 1.00 0.00 N ATOM 0 H GLN A 85 -6.639 5.746 0.929 1.00 0.00 H new ATOM 0 HA GLN A 85 -8.695 3.820 0.686 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -8.726 5.258 -1.086 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -6.984 5.447 -1.122 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -7.880 2.693 -1.769 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -8.476 3.898 -2.893 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -6.651 5.719 -3.225 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -5.108 5.072 -3.791 1.00 0.00 H new ATOM 1268 N ALA A 86 -5.756 2.766 -0.379 1.00 0.00 N ATOM 1269 CA ALA A 86 -4.934 1.581 -0.557 1.00 0.00 C ATOM 1270 C ALA A 86 -4.966 0.746 0.724 1.00 0.00 C ATOM 1271 O ALA A 86 -5.313 -0.434 0.692 1.00 0.00 O ATOM 1272 CB ALA A 86 -3.514 1.998 -0.946 1.00 0.00 C ATOM 0 H ALA A 86 -5.354 3.625 -0.755 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.324 0.961 -1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.897 1.109 -1.079 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.543 2.563 -1.878 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.089 2.620 -0.158 1.00 0.00 H new ATOM 1278 N ARG A 87 -4.600 1.390 1.822 1.00 0.00 N ATOM 1279 CA ARG A 87 -4.582 0.722 3.112 1.00 0.00 C ATOM 1280 C ARG A 87 -5.890 -0.040 3.333 1.00 0.00 C ATOM 1281 O ARG A 87 -5.875 -1.222 3.674 1.00 0.00 O ATOM 1282 CB ARG A 87 -4.385 1.725 4.250 1.00 0.00 C ATOM 1283 CG ARG A 87 -3.410 1.183 5.297 1.00 0.00 C ATOM 1284 CD ARG A 87 -2.972 2.286 6.262 1.00 0.00 C ATOM 1285 NE ARG A 87 -3.546 2.042 7.604 1.00 0.00 N ATOM 1286 CZ ARG A 87 -4.769 2.437 7.982 1.00 0.00 C ATOM 1287 NH1 ARG A 87 -5.555 3.099 7.121 1.00 0.00 N ATOM 1288 NH2 ARG A 87 -5.207 2.172 9.220 1.00 0.00 N ATOM 0 H ARG A 87 -4.313 2.369 1.845 1.00 0.00 H new ATOM 0 HA ARG A 87 -3.746 0.023 3.111 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -4.007 2.666 3.849 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -5.345 1.941 4.719 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -3.882 0.374 5.854 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -2.536 0.761 4.801 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.884 2.316 6.323 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.298 3.257 5.889 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.974 1.541 8.284 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.222 3.302 6.179 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -6.486 3.400 7.408 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.609 1.669 9.876 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -6.138 2.473 9.507 1.00 0.00 H new ATOM 1302 N ARG A 88 -6.992 0.668 3.130 1.00 0.00 N ATOM 1303 CA ARG A 88 -8.306 0.074 3.303 1.00 0.00 C ATOM 1304 C ARG A 88 -8.468 -1.134 2.378 1.00 0.00 C ATOM 1305 O ARG A 88 -8.913 -2.196 2.810 1.00 0.00 O ATOM 1306 CB ARG A 88 -9.413 1.088 3.004 1.00 0.00 C ATOM 1307 CG ARG A 88 -10.747 0.384 2.751 1.00 0.00 C ATOM 1308 CD ARG A 88 -11.923 1.331 3.003 1.00 0.00 C ATOM 1309 NE ARG A 88 -13.041 0.593 3.631 1.00 0.00 N ATOM 1310 CZ ARG A 88 -13.810 -0.296 2.987 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -13.586 -0.562 1.694 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -14.803 -0.917 3.638 1.00 0.00 N ATOM 0 H ARG A 88 -7.001 1.648 2.847 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.392 -0.245 4.342 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -9.515 1.778 3.842 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.141 1.683 2.132 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -10.782 0.021 1.724 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -10.831 -0.487 3.400 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -11.609 2.150 3.649 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -12.252 1.774 2.063 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.239 0.772 4.615 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -12.830 -0.088 1.199 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -14.171 -1.239 1.204 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.973 -0.713 4.623 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.389 -1.594 3.149 1.00 0.00 H new ATOM 1326 N ASP A 89 -8.099 -0.931 1.122 1.00 0.00 N ATOM 1327 CA ASP A 89 -8.198 -1.991 0.132 1.00 0.00 C ATOM 1328 C ASP A 89 -7.303 -3.159 0.551 1.00 0.00 C ATOM 1329 O ASP A 89 -7.751 -4.303 0.596 1.00 0.00 O ATOM 1330 CB ASP A 89 -7.730 -1.506 -1.242 1.00 0.00 C ATOM 1331 CG ASP A 89 -8.577 -1.991 -2.421 1.00 0.00 C ATOM 1332 OD1 ASP A 89 -9.797 -2.162 -2.211 1.00 0.00 O ATOM 1333 OD2 ASP A 89 -7.985 -2.179 -3.505 1.00 0.00 O ATOM 0 H ASP A 89 -7.731 -0.049 0.767 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.242 -2.299 0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -7.723 -0.416 -1.243 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -6.701 -1.832 -1.395 1.00 0.00 H new ATOM 1338 N GLY A 90 -6.054 -2.830 0.847 1.00 0.00 N ATOM 1339 CA GLY A 90 -5.092 -3.837 1.260 1.00 0.00 C ATOM 1340 C GLY A 90 -5.620 -4.643 2.449 1.00 0.00 C ATOM 1341 O GLY A 90 -5.605 -5.873 2.426 1.00 0.00 O ATOM 0 H GLY A 90 -5.686 -1.879 0.809 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -4.881 -4.507 0.427 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.151 -3.358 1.530 1.00 0.00 H new ATOM 1345 N VAL A 91 -6.074 -3.917 3.460 1.00 0.00 N ATOM 1346 CA VAL A 91 -6.605 -4.549 4.656 1.00 0.00 C ATOM 1347 C VAL A 91 -7.732 -5.507 4.264 1.00 0.00 C ATOM 1348 O VAL A 91 -7.848 -6.596 4.824 1.00 0.00 O ATOM 1349 CB VAL A 91 -7.049 -3.482 5.659 1.00 0.00 C ATOM 1350 CG1 VAL A 91 -8.015 -4.067 6.691 1.00 0.00 C ATOM 1351 CG2 VAL A 91 -5.842 -2.836 6.342 1.00 0.00 C ATOM 0 H VAL A 91 -6.085 -2.897 3.476 1.00 0.00 H new ATOM 0 HA VAL A 91 -5.834 -5.139 5.150 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.578 -2.704 5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.315 -3.288 7.392 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.897 -4.457 6.183 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.522 -4.873 7.234 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.185 -2.081 7.050 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.273 -3.599 6.873 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.207 -2.367 5.591 1.00 0.00 H new ATOM 1361 N ARG A 92 -8.533 -5.066 3.306 1.00 0.00 N ATOM 1362 CA ARG A 92 -9.647 -5.870 2.832 1.00 0.00 C ATOM 1363 C ARG A 92 -9.136 -7.036 1.983 1.00 0.00 C ATOM 1364 O ARG A 92 -9.760 -8.095 1.937 1.00 0.00 O ATOM 1365 CB ARG A 92 -10.618 -5.031 2.001 1.00 0.00 C ATOM 1366 CG ARG A 92 -11.508 -5.922 1.132 1.00 0.00 C ATOM 1367 CD ARG A 92 -12.754 -5.165 0.667 1.00 0.00 C ATOM 1368 NE ARG A 92 -13.715 -6.105 0.047 1.00 0.00 N ATOM 1369 CZ ARG A 92 -15.017 -5.842 -0.128 1.00 0.00 C ATOM 1370 NH1 ARG A 92 -15.522 -4.666 0.270 1.00 0.00 N ATOM 1371 NH2 ARG A 92 -15.814 -6.754 -0.700 1.00 0.00 N ATOM 0 H ARG A 92 -8.433 -4.162 2.845 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.173 -6.255 3.706 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -11.238 -4.425 2.662 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.059 -4.342 1.368 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.945 -6.270 0.266 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.805 -6.806 1.696 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.220 -4.661 1.513 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.474 -4.393 -0.049 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.364 -7.010 -0.267 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -14.915 -3.972 0.706 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -16.513 -4.465 0.137 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.430 -7.649 -1.003 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.805 -6.553 -0.833 1.00 0.00 H new ATOM 1385 N LYS A 93 -8.006 -6.802 1.332 1.00 0.00 N ATOM 1386 CA LYS A 93 -7.405 -7.820 0.487 1.00 0.00 C ATOM 1387 C LYS A 93 -6.974 -9.006 1.353 1.00 0.00 C ATOM 1388 O LYS A 93 -7.521 -10.101 1.227 1.00 0.00 O ATOM 1389 CB LYS A 93 -6.269 -7.222 -0.346 1.00 0.00 C ATOM 1390 CG LYS A 93 -5.275 -8.304 -0.774 1.00 0.00 C ATOM 1391 CD LYS A 93 -4.780 -8.059 -2.201 1.00 0.00 C ATOM 1392 CE LYS A 93 -4.603 -9.380 -2.954 1.00 0.00 C ATOM 1393 NZ LYS A 93 -5.006 -9.227 -4.370 1.00 0.00 N ATOM 0 H LYS A 93 -7.491 -5.923 1.373 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.132 -8.197 -0.232 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.680 -6.731 -1.228 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.752 -6.457 0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.428 -8.317 -0.088 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.749 -9.284 -0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.490 -7.426 -2.732 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.832 -7.522 -2.174 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.563 -9.701 -2.898 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.202 -10.158 -2.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.372 -9.789 -4.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.984 -9.560 -4.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.945 -8.225 -4.642 1.00 0.00 H new ATOM 1407 N VAL A 94 -5.999 -8.748 2.211 1.00 0.00 N ATOM 1408 CA VAL A 94 -5.489 -9.780 3.097 1.00 0.00 C ATOM 1409 C VAL A 94 -6.663 -10.496 3.768 1.00 0.00 C ATOM 1410 O VAL A 94 -6.844 -11.700 3.590 1.00 0.00 O ATOM 1411 CB VAL A 94 -4.508 -9.171 4.101 1.00 0.00 C ATOM 1412 CG1 VAL A 94 -3.742 -10.263 4.851 1.00 0.00 C ATOM 1413 CG2 VAL A 94 -3.546 -8.203 3.409 1.00 0.00 C ATOM 0 H VAL A 94 -5.548 -7.839 2.312 1.00 0.00 H new ATOM 0 HA VAL A 94 -4.932 -10.527 2.531 1.00 0.00 H new ATOM 0 HB VAL A 94 -5.085 -8.605 4.832 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.052 -9.803 5.558 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.446 -10.896 5.391 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.182 -10.869 4.139 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.859 -7.784 4.145 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.979 -8.737 2.646 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.113 -7.398 2.942 1.00 0.00 H new ATOM 1423 N GLN A 95 -7.430 -9.726 4.525 1.00 0.00 N ATOM 1424 CA GLN A 95 -8.582 -10.271 5.223 1.00 0.00 C ATOM 1425 C GLN A 95 -9.293 -11.305 4.347 1.00 0.00 C ATOM 1426 O GLN A 95 -9.424 -12.466 4.732 1.00 0.00 O ATOM 1427 CB GLN A 95 -9.542 -9.159 5.649 1.00 0.00 C ATOM 1428 CG GLN A 95 -8.920 -8.286 6.740 1.00 0.00 C ATOM 1429 CD GLN A 95 -9.512 -8.618 8.112 1.00 0.00 C ATOM 1430 OE1 GLN A 95 -9.574 -9.762 8.529 1.00 0.00 O ATOM 1431 NE2 GLN A 95 -9.942 -7.555 8.787 1.00 0.00 N ATOM 0 H GLN A 95 -7.276 -8.728 4.671 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.232 -10.769 6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.796 -8.543 4.786 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.471 -9.596 6.014 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -7.841 -8.436 6.760 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -9.091 -7.234 6.511 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -9.860 -6.624 8.379 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -10.354 -7.671 9.713 1.00 0.00 H new ATOM 1440 N THR A 96 -9.734 -10.845 3.185 1.00 0.00 N ATOM 1441 CA THR A 96 -10.429 -11.715 2.251 1.00 0.00 C ATOM 1442 C THR A 96 -9.699 -13.054 2.126 1.00 0.00 C ATOM 1443 O THR A 96 -10.295 -14.111 2.329 1.00 0.00 O ATOM 1444 CB THR A 96 -10.563 -10.970 0.922 1.00 0.00 C ATOM 1445 OG1 THR A 96 -11.484 -9.920 1.204 1.00 0.00 O ATOM 1446 CG2 THR A 96 -11.269 -11.806 -0.149 1.00 0.00 C ATOM 0 H THR A 96 -9.624 -9.881 2.869 1.00 0.00 H new ATOM 0 HA THR A 96 -11.430 -11.958 2.606 1.00 0.00 H new ATOM 0 HB THR A 96 -9.574 -10.683 0.566 1.00 0.00 H new ATOM 0 HG1 THR A 96 -10.992 -9.088 1.366 1.00 0.00 H new ATOM 0 HG21 THR A 96 -11.338 -11.231 -1.072 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.701 -12.718 -0.331 1.00 0.00 H new ATOM 0 HG23 THR A 96 -12.271 -12.065 0.193 1.00 0.00 H new ATOM 1454 N ILE A 97 -8.420 -12.966 1.793 1.00 0.00 N ATOM 1455 CA ILE A 97 -7.603 -14.157 1.639 1.00 0.00 C ATOM 1456 C ILE A 97 -7.757 -15.041 2.879 1.00 0.00 C ATOM 1457 O ILE A 97 -8.061 -16.227 2.766 1.00 0.00 O ATOM 1458 CB ILE A 97 -6.153 -13.777 1.331 1.00 0.00 C ATOM 1459 CG1 ILE A 97 -6.065 -12.944 0.051 1.00 0.00 C ATOM 1460 CG2 ILE A 97 -5.262 -15.019 1.270 1.00 0.00 C ATOM 1461 CD1 ILE A 97 -4.765 -12.139 0.010 1.00 0.00 C ATOM 0 H ILE A 97 -7.929 -12.088 1.625 1.00 0.00 H new ATOM 0 HA ILE A 97 -7.943 -14.743 0.785 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.782 -13.155 2.146 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -6.119 -13.599 -0.818 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.918 -12.268 -0.007 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.237 -14.721 1.050 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -5.292 -15.535 2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -5.622 -15.687 0.487 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -4.727 -11.556 -0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.726 -11.467 0.868 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.914 -12.820 0.043 1.00 0.00 H new ATOM 1473 N LEU A 98 -7.540 -14.428 4.033 1.00 0.00 N ATOM 1474 CA LEU A 98 -7.651 -15.143 5.293 1.00 0.00 C ATOM 1475 C LEU A 98 -8.957 -15.941 5.308 1.00 0.00 C ATOM 1476 O LEU A 98 -8.992 -17.073 5.787 1.00 0.00 O ATOM 1477 CB LEU A 98 -7.506 -14.179 6.472 1.00 0.00 C ATOM 1478 CG LEU A 98 -6.098 -14.039 7.054 1.00 0.00 C ATOM 1479 CD1 LEU A 98 -5.499 -15.410 7.374 1.00 0.00 C ATOM 1480 CD2 LEU A 98 -5.199 -13.222 6.125 1.00 0.00 C ATOM 0 H LEU A 98 -7.288 -13.444 4.122 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.837 -15.860 5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.846 -13.193 6.154 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.176 -14.506 7.267 1.00 0.00 H new ATOM 0 HG LEU A 98 -6.169 -13.492 7.994 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.498 -15.282 7.786 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.129 -15.921 8.102 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.443 -16.004 6.462 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.204 -13.138 6.563 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.129 -13.719 5.157 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.622 -12.226 5.992 1.00 0.00 H new ATOM 1492 N GLU A 99 -10.000 -15.318 4.778 1.00 0.00 N ATOM 1493 CA GLU A 99 -11.304 -15.955 4.725 1.00 0.00 C ATOM 1494 C GLU A 99 -11.318 -17.047 3.653 1.00 0.00 C ATOM 1495 O GLU A 99 -12.058 -18.023 3.766 1.00 0.00 O ATOM 1496 CB GLU A 99 -12.408 -14.926 4.473 1.00 0.00 C ATOM 1497 CG GLU A 99 -13.443 -14.945 5.599 1.00 0.00 C ATOM 1498 CD GLU A 99 -14.594 -13.981 5.303 1.00 0.00 C ATOM 1499 OE1 GLU A 99 -14.335 -12.759 5.346 1.00 0.00 O ATOM 1500 OE2 GLU A 99 -15.706 -14.488 5.040 1.00 0.00 O ATOM 0 H GLU A 99 -9.968 -14.379 4.382 1.00 0.00 H new ATOM 0 HA GLU A 99 -11.499 -16.419 5.692 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -11.971 -13.931 4.393 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.896 -15.137 3.522 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -13.833 -15.955 5.722 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.967 -14.670 6.540 1.00 0.00 H new ATOM 1507 N LYS A 100 -10.491 -16.846 2.638 1.00 0.00 N ATOM 1508 CA LYS A 100 -10.399 -17.801 1.547 1.00 0.00 C ATOM 1509 C LYS A 100 -9.538 -18.988 1.985 1.00 0.00 C ATOM 1510 O LYS A 100 -9.838 -20.133 1.652 1.00 0.00 O ATOM 1511 CB LYS A 100 -9.898 -17.114 0.275 1.00 0.00 C ATOM 1512 CG LYS A 100 -8.452 -17.512 -0.030 1.00 0.00 C ATOM 1513 CD LYS A 100 -7.882 -16.671 -1.174 1.00 0.00 C ATOM 1514 CE LYS A 100 -8.533 -17.046 -2.507 1.00 0.00 C ATOM 1515 NZ LYS A 100 -8.115 -16.106 -3.571 1.00 0.00 N ATOM 0 H LYS A 100 -9.878 -16.036 2.548 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.385 -18.195 1.302 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -10.538 -17.384 -0.565 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -9.964 -16.032 0.391 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -7.839 -17.382 0.862 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -8.410 -18.569 -0.294 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -8.047 -15.613 -0.970 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -6.804 -16.819 -1.237 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -8.253 -18.063 -2.782 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -9.618 -17.030 -2.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -8.566 -16.375 -4.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -8.404 -15.140 -3.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -7.081 -16.141 -3.679 1.00 0.00 H new ATOM 1529 N LEU A 101 -8.485 -18.672 2.725 1.00 0.00 N ATOM 1530 CA LEU A 101 -7.579 -19.698 3.212 1.00 0.00 C ATOM 1531 C LEU A 101 -8.358 -20.694 4.072 1.00 0.00 C ATOM 1532 O LEU A 101 -8.435 -21.877 3.744 1.00 0.00 O ATOM 1533 CB LEU A 101 -6.388 -19.063 3.932 1.00 0.00 C ATOM 1534 CG LEU A 101 -5.160 -19.958 4.117 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -4.512 -19.724 5.483 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -5.517 -21.429 3.895 1.00 0.00 C ATOM 0 H LEU A 101 -8.239 -17.721 2.999 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.156 -20.259 2.379 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.085 -18.175 3.377 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.720 -18.728 4.915 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.422 -19.688 3.361 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -3.642 -20.372 5.589 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -4.201 -18.683 5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.231 -19.950 6.270 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.628 -22.044 4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.281 -21.730 4.612 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.898 -21.562 2.882 1.00 0.00 H new ATOM 1548 N GLU A 102 -8.917 -20.179 5.158 1.00 0.00 N ATOM 1549 CA GLU A 102 -9.688 -21.009 6.068 1.00 0.00 C ATOM 1550 C GLU A 102 -10.498 -22.045 5.286 1.00 0.00 C ATOM 1551 O GLU A 102 -10.200 -23.237 5.336 1.00 0.00 O ATOM 1552 CB GLU A 102 -10.599 -20.154 6.951 1.00 0.00 C ATOM 1553 CG GLU A 102 -9.778 -19.283 7.905 1.00 0.00 C ATOM 1554 CD GLU A 102 -10.593 -18.082 8.389 1.00 0.00 C ATOM 1555 OE1 GLU A 102 -11.424 -17.600 7.589 1.00 0.00 O ATOM 1556 OE2 GLU A 102 -10.366 -17.672 9.548 1.00 0.00 O ATOM 0 H GLU A 102 -8.851 -19.198 5.428 1.00 0.00 H new ATOM 0 HA GLU A 102 -8.994 -21.538 6.722 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.228 -19.521 6.325 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -11.265 -20.799 7.524 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.457 -19.877 8.760 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.876 -18.936 7.401 1.00 0.00 H new ATOM 1563 N GLN A 103 -11.506 -21.552 4.582 1.00 0.00 N ATOM 1564 CA GLN A 103 -12.361 -22.420 3.790 1.00 0.00 C ATOM 1565 C GLN A 103 -11.533 -23.529 3.137 1.00 0.00 C ATOM 1566 O GLN A 103 -11.858 -24.708 3.265 1.00 0.00 O ATOM 1567 CB GLN A 103 -13.131 -21.620 2.738 1.00 0.00 C ATOM 1568 CG GLN A 103 -14.431 -21.060 3.319 1.00 0.00 C ATOM 1569 CD GLN A 103 -15.440 -22.179 3.584 1.00 0.00 C ATOM 1570 OE1 GLN A 103 -15.636 -23.076 2.780 1.00 0.00 O ATOM 1571 NE2 GLN A 103 -16.068 -22.077 4.752 1.00 0.00 N ATOM 0 H GLN A 103 -11.750 -20.562 4.543 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.091 -22.882 4.454 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.510 -20.802 2.371 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -13.355 -22.258 1.883 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.220 -20.529 4.247 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.860 -20.335 2.627 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -15.856 -21.301 5.379 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -16.761 -22.775 5.021 1.00 0.00 H new ATOM 1580 N LYS A 104 -10.478 -23.111 2.453 1.00 0.00 N ATOM 1581 CA LYS A 104 -9.601 -24.054 1.780 1.00 0.00 C ATOM 1582 C LYS A 104 -9.223 -25.174 2.751 1.00 0.00 C ATOM 1583 O LYS A 104 -9.339 -26.353 2.419 1.00 0.00 O ATOM 1584 CB LYS A 104 -8.396 -23.329 1.178 1.00 0.00 C ATOM 1585 CG LYS A 104 -8.843 -22.171 0.283 1.00 0.00 C ATOM 1586 CD LYS A 104 -8.595 -22.491 -1.192 1.00 0.00 C ATOM 1587 CE LYS A 104 -9.503 -23.627 -1.667 1.00 0.00 C ATOM 1588 NZ LYS A 104 -9.505 -23.706 -3.145 1.00 0.00 N ATOM 0 H LYS A 104 -10.211 -22.132 2.350 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.115 -24.520 0.940 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.759 -22.950 1.977 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.797 -24.031 0.598 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.903 -21.972 0.442 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.303 -21.265 0.558 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -8.774 -21.601 -1.796 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.551 -22.770 -1.337 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -9.162 -24.573 -1.247 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -10.518 -23.465 -1.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -10.015 -24.561 -3.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -9.976 -22.866 -3.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -8.525 -23.747 -3.492 1.00 0.00 H new ATOM 1602 N ALA A 105 -8.779 -24.767 3.930 1.00 0.00 N ATOM 1603 CA ALA A 105 -8.383 -25.721 4.952 1.00 0.00 C ATOM 1604 C ALA A 105 -9.607 -26.527 5.392 1.00 0.00 C ATOM 1605 O ALA A 105 -9.507 -27.726 5.647 1.00 0.00 O ATOM 1606 CB ALA A 105 -7.724 -24.980 6.116 1.00 0.00 C ATOM 0 H ALA A 105 -8.684 -23.788 4.201 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.649 -26.424 4.557 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.427 -25.696 6.882 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.843 -24.448 5.757 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -8.431 -24.267 6.540 1.00 0.00 H new ATOM 1612 N SER A 106 -10.735 -25.835 5.468 1.00 0.00 N ATOM 1613 CA SER A 106 -11.977 -26.472 5.874 1.00 0.00 C ATOM 1614 C SER A 106 -12.523 -27.330 4.730 1.00 0.00 C ATOM 1615 O SER A 106 -13.566 -27.966 4.871 1.00 0.00 O ATOM 1616 CB SER A 106 -13.015 -25.432 6.299 1.00 0.00 C ATOM 1617 OG SER A 106 -14.288 -26.020 6.552 1.00 0.00 O ATOM 0 H SER A 106 -10.815 -24.841 5.256 1.00 0.00 H new ATOM 0 HA SER A 106 -11.770 -27.111 6.732 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.668 -24.919 7.196 1.00 0.00 H new ATOM 0 HB3 SER A 106 -13.113 -24.678 5.518 1.00 0.00 H new ATOM 0 HG SER A 106 -14.288 -26.948 6.238 1.00 0.00 H new ATOM 1623 N GLY A 107 -11.793 -27.319 3.625 1.00 0.00 N ATOM 1624 CA GLY A 107 -12.191 -28.088 2.458 1.00 0.00 C ATOM 1625 C GLY A 107 -11.719 -27.413 1.169 1.00 0.00 C ATOM 1626 O GLY A 107 -11.986 -26.233 0.948 1.00 0.00 O ATOM 0 H GLY A 107 -10.928 -26.790 3.513 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.773 -29.093 2.520 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.276 -28.194 2.441 1.00 0.00 H new ATOM 1630 N PRO A 108 -11.005 -28.211 0.330 1.00 0.00 N ATOM 1631 CA PRO A 108 -10.493 -27.703 -0.932 1.00 0.00 C ATOM 1632 C PRO A 108 -11.616 -27.564 -1.962 1.00 0.00 C ATOM 1633 O PRO A 108 -12.756 -27.944 -1.700 1.00 0.00 O ATOM 1634 CB PRO A 108 -9.422 -28.697 -1.350 1.00 0.00 C ATOM 1635 CG PRO A 108 -9.694 -29.963 -0.554 1.00 0.00 C ATOM 1636 CD PRO A 108 -10.669 -29.613 0.559 1.00 0.00 C ATOM 0 HA PRO A 108 -10.074 -26.701 -0.844 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -9.467 -28.892 -2.421 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -8.425 -28.309 -1.138 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -10.112 -30.737 -1.198 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -8.767 -30.360 -0.139 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -11.557 -30.244 0.521 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -10.218 -29.757 1.541 1.00 0.00 H new ATOM 1644 N SER A 109 -11.253 -27.018 -3.114 1.00 0.00 N ATOM 1645 CA SER A 109 -12.215 -26.823 -4.185 1.00 0.00 C ATOM 1646 C SER A 109 -11.525 -26.977 -5.542 1.00 0.00 C ATOM 1647 O SER A 109 -10.602 -26.229 -5.862 1.00 0.00 O ATOM 1648 CB SER A 109 -12.884 -25.451 -4.082 1.00 0.00 C ATOM 1649 OG SER A 109 -13.762 -25.367 -2.963 1.00 0.00 O ATOM 0 H SER A 109 -10.306 -26.705 -3.329 1.00 0.00 H new ATOM 0 HA SER A 109 -12.991 -27.583 -4.091 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.118 -24.680 -4.000 1.00 0.00 H new ATOM 0 HB3 SER A 109 -13.442 -25.250 -4.996 1.00 0.00 H new ATOM 0 HG SER A 109 -14.168 -24.475 -2.932 1.00 0.00 H new ATOM 1655 N SER A 110 -12.000 -27.952 -6.304 1.00 0.00 N ATOM 1656 CA SER A 110 -11.440 -28.213 -7.619 1.00 0.00 C ATOM 1657 C SER A 110 -11.297 -26.903 -8.397 1.00 0.00 C ATOM 1658 O SER A 110 -12.285 -26.217 -8.652 1.00 0.00 O ATOM 1659 CB SER A 110 -12.308 -29.202 -8.401 1.00 0.00 C ATOM 1660 OG SER A 110 -11.618 -30.419 -8.672 1.00 0.00 O ATOM 0 H SER A 110 -12.766 -28.570 -6.036 1.00 0.00 H new ATOM 0 HA SER A 110 -10.455 -28.660 -7.488 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.213 -29.417 -7.834 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.621 -28.746 -9.340 1.00 0.00 H new ATOM 0 HG SER A 110 -12.206 -31.024 -9.171 1.00 0.00 H new ATOM 1666 N GLY A 111 -10.058 -26.596 -8.752 1.00 0.00 N ATOM 1667 CA GLY A 111 -9.772 -25.380 -9.496 1.00 0.00 C ATOM 1668 C GLY A 111 -8.303 -25.328 -9.918 1.00 0.00 C ATOM 1669 O GLY A 111 -7.946 -25.802 -10.996 1.00 0.00 O ATOM 0 H GLY A 111 -9.241 -27.168 -8.539 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -10.410 -25.331 -10.379 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -10.009 -24.510 -8.883 1.00 0.00 H new TER 1673 GLY A 111