USER MOD reduce.3.24.130724 H: found=0, std=0, add=691, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 687 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 58 ASN : amide:sc= 0.49 K(o=1.2,f=-5.4!) USER MOD Set 1.2: A 77 CYS SG : rot 61:sc= 0.723 USER MOD Set 2.1: A 61 ASN : amide:sc= 1.38 X(o=2.3,f=1.9) USER MOD Set 2.2: A 64 ASN : amide:sc= 0.956 X(o=2.3,f=1.9) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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= 0.0806 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.254 X(o=0.25,f=0) USER MOD Single : A 12 MET CE :methyl -153:sc= -3.96! (180deg=-4.85!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -118:sc= 1.98 (180deg=-0.36) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 47:sc= 1.17 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.036 USER MOD Single : A 34 GLN :FLIP amide:sc= -0.404 F(o=-1.1,f=-0.4) USER MOD Single : A 37 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0198) USER MOD Single : A 38 GLN : amide:sc=-0.00272 K(o=-0.0027,f=-0.91) USER MOD Single : A 43 GLN : amide:sc= -0.032 X(o=-0.032,f=0) USER MOD Single : A 45 CYS SG : rot -155:sc= 0.949 USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= 0.879 K(o=0.88,f=-0.31) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.14 K(o=-1.1,f=-2.9!) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 146:sc= 1.2 (180deg=0.301) USER MOD Single : A 81 SER OG : rot -160:sc=-0.00177 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.721 10.322 5.020 1.00 0.00 N ATOM 2 CA GLY A 1 -15.703 10.118 3.566 1.00 0.00 C ATOM 3 C GLY A 1 -14.337 10.457 3.004 1.00 0.00 C ATOM 4 O GLY A 1 -13.856 11.569 3.228 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.663 10.086 5.392 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.009 9.708 5.465 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.504 11.316 5.234 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.952 9.083 3.334 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.463 10.742 3.095 1.00 0.00 H new ATOM 8 N SER A 2 -13.713 9.517 2.292 1.00 0.00 N ATOM 9 CA SER A 2 -12.354 9.610 1.784 1.00 0.00 C ATOM 10 C SER A 2 -12.386 9.245 0.306 1.00 0.00 C ATOM 11 O SER A 2 -12.802 8.138 -0.050 1.00 0.00 O ATOM 12 CB SER A 2 -11.466 8.657 2.591 1.00 0.00 C ATOM 13 OG SER A 2 -10.101 8.789 2.274 1.00 0.00 O ATOM 0 H SER A 2 -14.164 8.636 2.046 1.00 0.00 H new ATOM 0 HA SER A 2 -11.945 10.615 1.887 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.608 8.847 3.655 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.780 7.630 2.406 1.00 0.00 H new ATOM 0 HG SER A 2 -9.577 8.162 2.816 1.00 0.00 H new ATOM 19 N SER A 3 -11.990 10.182 -0.549 1.00 0.00 N ATOM 20 CA SER A 3 -11.816 10.019 -1.980 1.00 0.00 C ATOM 21 C SER A 3 -11.150 11.320 -2.422 1.00 0.00 C ATOM 22 O SER A 3 -11.814 12.358 -2.503 1.00 0.00 O ATOM 23 CB SER A 3 -13.169 9.762 -2.669 1.00 0.00 C ATOM 24 OG SER A 3 -13.020 9.437 -4.038 1.00 0.00 O ATOM 0 H SER A 3 -11.770 11.129 -0.239 1.00 0.00 H new ATOM 0 HA SER A 3 -11.207 9.156 -2.250 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.686 8.949 -2.159 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.797 10.648 -2.574 1.00 0.00 H new ATOM 0 HG SER A 3 -13.902 9.280 -4.435 1.00 0.00 H new ATOM 30 N GLY A 4 -9.837 11.288 -2.621 1.00 0.00 N ATOM 31 CA GLY A 4 -9.008 12.443 -2.937 1.00 0.00 C ATOM 32 C GLY A 4 -8.542 12.394 -4.387 1.00 0.00 C ATOM 33 O GLY A 4 -9.250 11.882 -5.260 1.00 0.00 O ATOM 0 H GLY A 4 -9.301 10.422 -2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.572 13.360 -2.762 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.144 12.469 -2.273 1.00 0.00 H new ATOM 37 N SER A 5 -7.366 12.964 -4.651 1.00 0.00 N ATOM 38 CA SER A 5 -6.742 13.028 -5.970 1.00 0.00 C ATOM 39 C SER A 5 -6.604 11.618 -6.550 1.00 0.00 C ATOM 40 O SER A 5 -5.880 10.795 -5.983 1.00 0.00 O ATOM 41 CB SER A 5 -5.367 13.716 -5.885 1.00 0.00 C ATOM 42 OG SER A 5 -5.291 14.605 -4.782 1.00 0.00 O ATOM 0 H SER A 5 -6.803 13.409 -3.926 1.00 0.00 H new ATOM 0 HA SER A 5 -7.376 13.619 -6.631 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.587 12.960 -5.797 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.177 14.264 -6.808 1.00 0.00 H new ATOM 0 HG SER A 5 -4.404 15.022 -4.758 1.00 0.00 H new ATOM 48 N SER A 6 -7.298 11.323 -7.646 1.00 0.00 N ATOM 49 CA SER A 6 -7.058 10.107 -8.410 1.00 0.00 C ATOM 50 C SER A 6 -5.741 10.233 -9.180 1.00 0.00 C ATOM 51 O SER A 6 -5.191 11.328 -9.315 1.00 0.00 O ATOM 52 CB SER A 6 -8.229 9.870 -9.368 1.00 0.00 C ATOM 53 OG SER A 6 -9.407 9.595 -8.632 1.00 0.00 O ATOM 0 H SER A 6 -8.036 11.916 -8.025 1.00 0.00 H new ATOM 0 HA SER A 6 -6.981 9.255 -7.735 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.379 10.748 -9.996 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.003 9.037 -10.033 1.00 0.00 H new ATOM 0 HG SER A 6 -10.152 9.446 -9.251 1.00 0.00 H new ATOM 59 N GLY A 7 -5.253 9.127 -9.728 1.00 0.00 N ATOM 60 CA GLY A 7 -4.147 9.073 -10.668 1.00 0.00 C ATOM 61 C GLY A 7 -4.104 7.656 -11.219 1.00 0.00 C ATOM 62 O GLY A 7 -4.296 6.699 -10.460 1.00 0.00 O ATOM 0 H GLY A 7 -5.636 8.205 -9.519 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.288 9.796 -11.472 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.208 9.324 -10.174 1.00 0.00 H new ATOM 66 N GLN A 8 -3.914 7.506 -12.528 1.00 0.00 N ATOM 67 CA GLN A 8 -4.034 6.223 -13.197 1.00 0.00 C ATOM 68 C GLN A 8 -2.754 5.412 -12.982 1.00 0.00 C ATOM 69 O GLN A 8 -1.895 5.329 -13.865 1.00 0.00 O ATOM 70 CB GLN A 8 -4.364 6.441 -14.679 1.00 0.00 C ATOM 71 CG GLN A 8 -4.766 5.117 -15.337 1.00 0.00 C ATOM 72 CD GLN A 8 -4.042 4.889 -16.653 1.00 0.00 C ATOM 73 OE1 GLN A 8 -4.620 5.075 -17.717 1.00 0.00 O ATOM 74 NE2 GLN A 8 -2.782 4.489 -16.598 1.00 0.00 N ATOM 0 H GLN A 8 -3.672 8.276 -13.152 1.00 0.00 H new ATOM 0 HA GLN A 8 -4.854 5.645 -12.772 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.175 7.163 -14.775 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.500 6.862 -15.193 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -4.548 4.294 -14.657 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -5.842 5.111 -15.510 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.332 4.344 -15.694 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -2.261 4.326 -17.459 1.00 0.00 H new ATOM 83 N ALA A 9 -2.615 4.825 -11.798 1.00 0.00 N ATOM 84 CA ALA A 9 -1.540 3.904 -11.475 1.00 0.00 C ATOM 85 C ALA A 9 -1.674 2.633 -12.311 1.00 0.00 C ATOM 86 O ALA A 9 -2.743 2.328 -12.844 1.00 0.00 O ATOM 87 CB ALA A 9 -1.609 3.547 -9.986 1.00 0.00 C ATOM 0 H ALA A 9 -3.260 4.981 -11.024 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.583 4.376 -11.696 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.803 2.855 -9.740 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.504 4.453 -9.389 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.569 3.078 -9.768 1.00 0.00 H new ATOM 93 N GLU A 10 -0.610 1.840 -12.332 1.00 0.00 N ATOM 94 CA GLU A 10 -0.678 0.419 -12.608 1.00 0.00 C ATOM 95 C GLU A 10 -0.519 -0.273 -11.260 1.00 0.00 C ATOM 96 O GLU A 10 0.543 -0.179 -10.634 1.00 0.00 O ATOM 97 CB GLU A 10 0.413 -0.010 -13.593 1.00 0.00 C ATOM 98 CG GLU A 10 0.130 0.502 -15.010 1.00 0.00 C ATOM 99 CD GLU A 10 1.125 -0.116 -15.982 1.00 0.00 C ATOM 100 OE1 GLU A 10 0.883 -1.249 -16.455 1.00 0.00 O ATOM 101 OE2 GLU A 10 2.195 0.485 -16.230 1.00 0.00 O ATOM 0 H GLU A 10 0.337 2.176 -12.154 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.623 0.150 -13.080 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.378 0.368 -13.255 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.484 -1.098 -13.606 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.888 0.246 -15.304 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.206 1.589 -15.037 1.00 0.00 H new ATOM 108 N LEU A 11 -1.588 -0.902 -10.778 1.00 0.00 N ATOM 109 CA LEU A 11 -1.552 -1.846 -9.669 1.00 0.00 C ATOM 110 C LEU A 11 -0.949 -3.155 -10.190 1.00 0.00 C ATOM 111 O LEU A 11 -1.075 -3.447 -11.387 1.00 0.00 O ATOM 112 CB LEU A 11 -2.983 -2.115 -9.178 1.00 0.00 C ATOM 113 CG LEU A 11 -3.743 -0.988 -8.452 1.00 0.00 C ATOM 114 CD1 LEU A 11 -3.128 -0.670 -7.089 1.00 0.00 C ATOM 115 CD2 LEU A 11 -3.904 0.302 -9.259 1.00 0.00 C ATOM 0 H LEU A 11 -2.525 -0.765 -11.158 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.960 -1.445 -8.846 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.578 -2.411 -10.042 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.946 -2.973 -8.507 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.746 -1.394 -8.316 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.694 0.130 -6.612 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.157 -1.560 -6.460 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.094 -0.353 -7.222 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.451 1.036 -8.667 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.921 0.699 -9.511 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.456 0.092 -10.175 1.00 0.00 H new ATOM 127 N MET A 12 -0.359 -3.978 -9.324 1.00 0.00 N ATOM 128 CA MET A 12 0.139 -5.296 -9.712 1.00 0.00 C ATOM 129 C MET A 12 -0.945 -6.336 -9.465 1.00 0.00 C ATOM 130 O MET A 12 -1.274 -6.655 -8.324 1.00 0.00 O ATOM 131 CB MET A 12 1.390 -5.655 -8.906 1.00 0.00 C ATOM 132 CG MET A 12 2.576 -4.777 -9.313 1.00 0.00 C ATOM 133 SD MET A 12 4.232 -5.400 -8.930 1.00 0.00 S ATOM 134 CE MET A 12 3.975 -5.864 -7.213 1.00 0.00 C ATOM 0 H MET A 12 -0.214 -3.752 -8.340 1.00 0.00 H new ATOM 0 HA MET A 12 0.400 -5.279 -10.770 1.00 0.00 H new ATOM 0 HB2 MET A 12 1.189 -5.531 -7.842 1.00 0.00 H new ATOM 0 HB3 MET A 12 1.639 -6.704 -9.063 1.00 0.00 H new ATOM 0 HG2 MET A 12 2.518 -4.608 -10.388 1.00 0.00 H new ATOM 0 HG3 MET A 12 2.460 -3.806 -8.831 1.00 0.00 H new ATOM 0 HE1 MET A 12 4.922 -5.811 -6.676 1.00 0.00 H new ATOM 0 HE2 MET A 12 3.260 -5.181 -6.755 1.00 0.00 H new ATOM 0 HE3 MET A 12 3.587 -6.881 -7.165 1.00 0.00 H new ATOM 144 N THR A 13 -1.444 -6.924 -10.541 1.00 0.00 N ATOM 145 CA THR A 13 -2.329 -8.083 -10.502 1.00 0.00 C ATOM 146 C THR A 13 -1.433 -9.319 -10.363 1.00 0.00 C ATOM 147 O THR A 13 -0.419 -9.429 -11.062 1.00 0.00 O ATOM 148 CB THR A 13 -3.208 -8.096 -11.762 1.00 0.00 C ATOM 149 OG1 THR A 13 -3.842 -6.833 -11.906 1.00 0.00 O ATOM 150 CG2 THR A 13 -4.278 -9.189 -11.712 1.00 0.00 C ATOM 0 H THR A 13 -1.242 -6.603 -11.488 1.00 0.00 H new ATOM 0 HA THR A 13 -3.019 -8.060 -9.659 1.00 0.00 H new ATOM 0 HB THR A 13 -2.559 -8.304 -12.613 1.00 0.00 H new ATOM 0 HG1 THR A 13 -4.402 -6.838 -12.710 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.873 -9.157 -12.625 1.00 0.00 H new ATOM 0 HG22 THR A 13 -3.798 -10.164 -11.625 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.926 -9.025 -10.851 1.00 0.00 H new ATOM 158 N LEU A 14 -1.722 -10.188 -9.393 1.00 0.00 N ATOM 159 CA LEU A 14 -0.921 -11.352 -9.026 1.00 0.00 C ATOM 160 C LEU A 14 -1.881 -12.454 -8.586 1.00 0.00 C ATOM 161 O LEU A 14 -2.836 -12.160 -7.875 1.00 0.00 O ATOM 162 CB LEU A 14 0.012 -10.989 -7.862 1.00 0.00 C ATOM 163 CG LEU A 14 1.070 -9.918 -8.166 1.00 0.00 C ATOM 164 CD1 LEU A 14 1.799 -9.589 -6.875 1.00 0.00 C ATOM 165 CD2 LEU A 14 2.120 -10.364 -9.175 1.00 0.00 C ATOM 0 H LEU A 14 -2.559 -10.093 -8.817 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.316 -11.683 -9.870 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.597 -10.645 -7.026 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.522 -11.894 -7.533 1.00 0.00 H new ATOM 0 HG LEU A 14 0.540 -9.065 -8.591 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.556 -8.829 -7.068 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.087 -9.213 -6.141 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.278 -10.488 -6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.833 -9.556 -9.339 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.645 -11.239 -8.791 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.635 -10.617 -10.118 1.00 0.00 H new ATOM 177 N THR A 15 -1.612 -13.718 -8.904 1.00 0.00 N ATOM 178 CA THR A 15 -2.617 -14.784 -8.776 1.00 0.00 C ATOM 179 C THR A 15 -2.084 -15.929 -7.904 1.00 0.00 C ATOM 180 O THR A 15 -0.922 -16.317 -8.039 1.00 0.00 O ATOM 181 CB THR A 15 -3.038 -15.254 -10.183 1.00 0.00 C ATOM 182 OG1 THR A 15 -3.306 -14.158 -11.034 1.00 0.00 O ATOM 183 CG2 THR A 15 -4.319 -16.089 -10.170 1.00 0.00 C ATOM 0 H THR A 15 -0.707 -14.035 -9.253 1.00 0.00 H new ATOM 0 HA THR A 15 -3.504 -14.402 -8.271 1.00 0.00 H new ATOM 0 HB THR A 15 -2.197 -15.850 -10.538 1.00 0.00 H new ATOM 0 HG1 THR A 15 -3.569 -14.487 -11.919 1.00 0.00 H new ATOM 0 HG21 THR A 15 -4.566 -16.392 -11.188 1.00 0.00 H new ATOM 0 HG22 THR A 15 -4.169 -16.976 -9.554 1.00 0.00 H new ATOM 0 HG23 THR A 15 -5.136 -15.496 -9.759 1.00 0.00 H new ATOM 191 N ILE A 16 -2.928 -16.504 -7.044 1.00 0.00 N ATOM 192 CA ILE A 16 -2.557 -17.503 -6.036 1.00 0.00 C ATOM 193 C ILE A 16 -3.476 -18.726 -6.110 1.00 0.00 C ATOM 194 O ILE A 16 -4.599 -18.596 -6.590 1.00 0.00 O ATOM 195 CB ILE A 16 -2.585 -16.852 -4.636 1.00 0.00 C ATOM 196 CG1 ILE A 16 -3.864 -16.053 -4.305 1.00 0.00 C ATOM 197 CG2 ILE A 16 -1.407 -15.895 -4.461 1.00 0.00 C ATOM 198 CD1 ILE A 16 -3.877 -15.511 -2.875 1.00 0.00 C ATOM 0 H ILE A 16 -3.923 -16.280 -7.029 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.545 -17.856 -6.235 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.539 -17.702 -3.956 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -3.957 -15.222 -5.004 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.734 -16.693 -4.453 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.446 -15.447 -3.468 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.472 -16.444 -4.575 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -1.461 -15.110 -5.215 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -4.801 -14.959 -2.704 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.814 -16.341 -2.171 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.025 -14.846 -2.730 1.00 0.00 H new ATOM 210 N VAL A 17 -3.046 -19.889 -5.602 1.00 0.00 N ATOM 211 CA VAL A 17 -3.809 -21.141 -5.612 1.00 0.00 C ATOM 212 C VAL A 17 -3.845 -21.697 -4.194 1.00 0.00 C ATOM 213 O VAL A 17 -2.825 -22.014 -3.586 1.00 0.00 O ATOM 214 CB VAL A 17 -3.234 -22.150 -6.625 1.00 0.00 C ATOM 215 CG1 VAL A 17 -3.902 -23.537 -6.546 1.00 0.00 C ATOM 216 CG2 VAL A 17 -3.411 -21.637 -8.054 1.00 0.00 C ATOM 0 H VAL A 17 -2.132 -19.986 -5.161 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.830 -20.946 -5.941 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.180 -22.254 -6.366 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.452 -24.200 -7.285 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -3.759 -23.954 -5.549 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.969 -23.439 -6.748 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.999 -22.363 -8.755 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -4.472 -21.495 -8.261 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.889 -20.687 -8.167 1.00 0.00 H new ATOM 226 N LYS A 18 -5.052 -21.778 -3.646 1.00 0.00 N ATOM 227 CA LYS A 18 -5.309 -22.176 -2.271 1.00 0.00 C ATOM 228 C LYS A 18 -5.136 -23.681 -2.126 1.00 0.00 C ATOM 229 O LYS A 18 -5.995 -24.434 -2.580 1.00 0.00 O ATOM 230 CB LYS A 18 -6.727 -21.726 -1.962 1.00 0.00 C ATOM 231 CG LYS A 18 -7.044 -21.674 -0.476 1.00 0.00 C ATOM 232 CD LYS A 18 -8.527 -21.332 -0.317 1.00 0.00 C ATOM 233 CE LYS A 18 -8.829 -21.052 1.143 1.00 0.00 C ATOM 234 NZ LYS A 18 -10.258 -21.241 1.450 1.00 0.00 N ATOM 0 H LYS A 18 -5.904 -21.561 -4.164 1.00 0.00 H new ATOM 0 HA LYS A 18 -4.611 -21.721 -1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.887 -20.738 -2.393 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -7.428 -22.403 -2.450 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.822 -22.632 -0.006 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.426 -20.925 0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -8.777 -20.462 -0.924 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -9.142 -22.158 -0.674 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -8.231 -21.712 1.771 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.537 -20.030 1.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.666 -20.340 1.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.757 -21.563 0.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -10.361 -21.954 2.200 1.00 0.00 H new ATOM 248 N GLY A 19 -4.037 -24.122 -1.527 1.00 0.00 N ATOM 249 CA GLY A 19 -3.653 -25.525 -1.537 1.00 0.00 C ATOM 250 C GLY A 19 -4.578 -26.391 -0.692 1.00 0.00 C ATOM 251 O GLY A 19 -5.274 -27.252 -1.235 1.00 0.00 O ATOM 0 H GLY A 19 -3.389 -23.517 -1.022 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.656 -25.891 -2.564 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.632 -25.621 -1.167 1.00 0.00 H new ATOM 255 N ALA A 20 -4.556 -26.208 0.636 1.00 0.00 N ATOM 256 CA ALA A 20 -5.270 -27.074 1.572 1.00 0.00 C ATOM 257 C ALA A 20 -5.549 -26.351 2.896 1.00 0.00 C ATOM 258 O ALA A 20 -6.699 -26.019 3.191 1.00 0.00 O ATOM 259 CB ALA A 20 -4.461 -28.364 1.784 1.00 0.00 C ATOM 0 H ALA A 20 -4.040 -25.453 1.087 1.00 0.00 H new ATOM 0 HA ALA A 20 -6.241 -27.336 1.152 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -4.989 -29.014 2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -4.339 -28.878 0.830 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -3.481 -28.116 2.190 1.00 0.00 H new ATOM 265 N GLN A 21 -4.521 -26.097 3.708 1.00 0.00 N ATOM 266 CA GLN A 21 -4.593 -25.294 4.924 1.00 0.00 C ATOM 267 C GLN A 21 -4.602 -23.824 4.516 1.00 0.00 C ATOM 268 O GLN A 21 -3.627 -23.087 4.674 1.00 0.00 O ATOM 269 CB GLN A 21 -3.447 -25.642 5.889 1.00 0.00 C ATOM 270 CG GLN A 21 -3.799 -26.882 6.720 1.00 0.00 C ATOM 271 CD GLN A 21 -2.642 -27.367 7.593 1.00 0.00 C ATOM 272 OE1 GLN A 21 -1.746 -26.613 7.980 1.00 0.00 O ATOM 273 NE2 GLN A 21 -2.655 -28.629 7.963 1.00 0.00 N ATOM 0 H GLN A 21 -3.584 -26.459 3.528 1.00 0.00 H new ATOM 0 HA GLN A 21 -5.509 -25.511 5.474 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -2.532 -25.823 5.325 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -3.252 -24.798 6.550 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -4.655 -26.655 7.355 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -4.103 -27.686 6.050 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -3.399 -29.248 7.640 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -1.921 -28.989 8.573 1.00 0.00 H new ATOM 282 N GLY A 22 -5.733 -23.406 3.954 1.00 0.00 N ATOM 283 CA GLY A 22 -5.875 -22.083 3.397 1.00 0.00 C ATOM 284 C GLY A 22 -4.882 -21.904 2.256 1.00 0.00 C ATOM 285 O GLY A 22 -4.530 -22.856 1.556 1.00 0.00 O ATOM 0 H GLY A 22 -6.571 -23.982 3.877 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.892 -21.937 3.034 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -5.700 -21.332 4.167 1.00 0.00 H new ATOM 289 N PHE A 23 -4.449 -20.664 2.073 1.00 0.00 N ATOM 290 CA PHE A 23 -3.320 -20.297 1.234 1.00 0.00 C ATOM 291 C PHE A 23 -1.983 -20.446 1.971 1.00 0.00 C ATOM 292 O PHE A 23 -0.942 -20.053 1.440 1.00 0.00 O ATOM 293 CB PHE A 23 -3.479 -18.832 0.829 1.00 0.00 C ATOM 294 CG PHE A 23 -4.671 -18.522 -0.037 1.00 0.00 C ATOM 295 CD1 PHE A 23 -4.529 -18.617 -1.433 1.00 0.00 C ATOM 296 CD2 PHE A 23 -5.895 -18.116 0.531 1.00 0.00 C ATOM 297 CE1 PHE A 23 -5.604 -18.283 -2.263 1.00 0.00 C ATOM 298 CE2 PHE A 23 -6.999 -17.929 -0.306 1.00 0.00 C ATOM 299 CZ PHE A 23 -6.836 -17.917 -1.694 1.00 0.00 C ATOM 0 H PHE A 23 -4.890 -19.860 2.520 1.00 0.00 H new ATOM 0 HA PHE A 23 -3.310 -20.961 0.370 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -3.543 -18.228 1.734 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.578 -18.520 0.301 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.594 -18.946 -1.862 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -5.979 -17.952 1.595 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.488 -18.306 -3.336 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -7.981 -17.793 0.122 1.00 0.00 H new ATOM 0 HZ PHE A 23 -7.658 -17.626 -2.331 1.00 0.00 H new ATOM 309 N GLY A 24 -1.980 -20.900 3.228 1.00 0.00 N ATOM 310 CA GLY A 24 -0.818 -20.850 4.099 1.00 0.00 C ATOM 311 C GLY A 24 -0.526 -19.425 4.567 1.00 0.00 C ATOM 312 O GLY A 24 -0.571 -19.180 5.767 1.00 0.00 O ATOM 0 H GLY A 24 -2.800 -21.317 3.669 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.984 -21.491 4.965 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.050 -21.245 3.571 1.00 0.00 H new ATOM 316 N PHE A 25 -0.200 -18.495 3.657 1.00 0.00 N ATOM 317 CA PHE A 25 0.229 -17.138 4.004 1.00 0.00 C ATOM 318 C PHE A 25 -0.757 -16.457 4.942 1.00 0.00 C ATOM 319 O PHE A 25 -1.961 -16.742 4.954 1.00 0.00 O ATOM 320 CB PHE A 25 0.503 -16.231 2.781 1.00 0.00 C ATOM 321 CG PHE A 25 -0.703 -15.545 2.149 1.00 0.00 C ATOM 322 CD1 PHE A 25 -1.464 -16.252 1.213 1.00 0.00 C ATOM 323 CD2 PHE A 25 -1.054 -14.209 2.443 1.00 0.00 C ATOM 324 CE1 PHE A 25 -2.552 -15.654 0.553 1.00 0.00 C ATOM 325 CE2 PHE A 25 -2.157 -13.610 1.794 1.00 0.00 C ATOM 326 CZ PHE A 25 -2.896 -14.329 0.843 1.00 0.00 C ATOM 0 H PHE A 25 -0.228 -18.668 2.652 1.00 0.00 H new ATOM 0 HA PHE A 25 1.182 -17.272 4.517 1.00 0.00 H new ATOM 0 HB2 PHE A 25 1.213 -15.460 3.082 1.00 0.00 H new ATOM 0 HB3 PHE A 25 0.992 -16.833 2.015 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -1.211 -17.278 0.992 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -0.480 -13.645 3.163 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -3.120 -16.215 -0.175 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.433 -12.593 2.031 1.00 0.00 H new ATOM 0 HZ PHE A 25 -3.727 -13.862 0.336 1.00 0.00 H new ATOM 336 N THR A 26 -0.230 -15.498 5.689 1.00 0.00 N ATOM 337 CA THR A 26 -0.972 -14.712 6.650 1.00 0.00 C ATOM 338 C THR A 26 -0.830 -13.248 6.266 1.00 0.00 C ATOM 339 O THR A 26 0.137 -12.850 5.600 1.00 0.00 O ATOM 340 CB THR A 26 -0.457 -14.999 8.072 1.00 0.00 C ATOM 341 OG1 THR A 26 0.930 -14.734 8.189 1.00 0.00 O ATOM 342 CG2 THR A 26 -0.669 -16.460 8.474 1.00 0.00 C ATOM 0 H THR A 26 0.756 -15.242 5.638 1.00 0.00 H new ATOM 0 HA THR A 26 -2.030 -14.974 6.642 1.00 0.00 H new ATOM 0 HB THR A 26 -1.029 -14.341 8.726 1.00 0.00 H new ATOM 0 HG1 THR A 26 1.224 -14.925 9.104 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.291 -16.618 9.484 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.733 -16.695 8.444 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.134 -17.109 7.781 1.00 0.00 H new ATOM 350 N ILE A 27 -1.782 -12.443 6.720 1.00 0.00 N ATOM 351 CA ILE A 27 -1.775 -11.008 6.543 1.00 0.00 C ATOM 352 C ILE A 27 -1.760 -10.335 7.907 1.00 0.00 C ATOM 353 O ILE A 27 -1.845 -10.988 8.954 1.00 0.00 O ATOM 354 CB ILE A 27 -2.942 -10.556 5.639 1.00 0.00 C ATOM 355 CG1 ILE A 27 -4.330 -10.946 6.182 1.00 0.00 C ATOM 356 CG2 ILE A 27 -2.750 -11.144 4.237 1.00 0.00 C ATOM 357 CD1 ILE A 27 -5.392 -9.956 5.694 1.00 0.00 C ATOM 0 H ILE A 27 -2.596 -12.783 7.232 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.870 -10.698 6.020 1.00 0.00 H new ATOM 0 HB ILE A 27 -2.919 -9.467 5.612 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.586 -11.954 5.855 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -4.310 -10.960 7.272 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.572 -10.828 3.594 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.807 -10.791 3.820 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.735 -12.232 4.298 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.367 -10.245 6.086 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -5.143 -8.954 6.043 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.423 -9.963 4.604 1.00 0.00 H new ATOM 369 N ALA A 28 -1.641 -9.018 7.868 1.00 0.00 N ATOM 370 CA ALA A 28 -1.748 -8.113 8.987 1.00 0.00 C ATOM 371 C ALA A 28 -2.917 -7.167 8.704 1.00 0.00 C ATOM 372 O ALA A 28 -3.421 -7.111 7.571 1.00 0.00 O ATOM 373 CB ALA A 28 -0.404 -7.390 9.115 1.00 0.00 C ATOM 0 H ALA A 28 -1.455 -8.527 6.994 1.00 0.00 H new ATOM 0 HA ALA A 28 -1.951 -8.613 9.934 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -0.444 -6.694 9.953 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.387 -8.120 9.287 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -0.197 -6.841 8.196 1.00 0.00 H new ATOM 379 N ASP A 29 -3.390 -6.451 9.718 1.00 0.00 N ATOM 380 CA ASP A 29 -4.015 -5.154 9.486 1.00 0.00 C ATOM 381 C ASP A 29 -2.884 -4.198 9.116 1.00 0.00 C ATOM 382 O ASP A 29 -1.789 -4.280 9.678 1.00 0.00 O ATOM 383 CB ASP A 29 -4.824 -4.677 10.708 1.00 0.00 C ATOM 384 CG ASP A 29 -4.744 -3.155 10.902 1.00 0.00 C ATOM 385 OD1 ASP A 29 -5.415 -2.425 10.134 1.00 0.00 O ATOM 386 OD2 ASP A 29 -3.963 -2.686 11.757 1.00 0.00 O ATOM 0 H ASP A 29 -3.354 -6.741 10.695 1.00 0.00 H new ATOM 0 HA ASP A 29 -4.747 -5.207 8.680 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.867 -4.971 10.588 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -4.453 -5.175 11.604 1.00 0.00 H new ATOM 391 N SER A 30 -3.130 -3.307 8.165 1.00 0.00 N ATOM 392 CA SER A 30 -2.225 -2.233 7.801 1.00 0.00 C ATOM 393 C SER A 30 -3.130 -1.042 7.460 1.00 0.00 C ATOM 394 O SER A 30 -4.293 -1.239 7.089 1.00 0.00 O ATOM 395 CB SER A 30 -1.262 -2.681 6.677 1.00 0.00 C ATOM 396 OG SER A 30 -1.860 -3.629 5.827 1.00 0.00 O ATOM 0 H SER A 30 -3.988 -3.314 7.613 1.00 0.00 H new ATOM 0 HA SER A 30 -1.546 -1.942 8.603 1.00 0.00 H new ATOM 0 HB2 SER A 30 -0.954 -1.813 6.094 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.360 -3.105 7.118 1.00 0.00 H new ATOM 0 HG SER A 30 -2.760 -3.328 5.583 1.00 0.00 H new ATOM 402 N PRO A 31 -2.641 0.198 7.578 1.00 0.00 N ATOM 403 CA PRO A 31 -3.485 1.386 7.689 1.00 0.00 C ATOM 404 C PRO A 31 -4.051 1.878 6.347 1.00 0.00 C ATOM 405 O PRO A 31 -4.441 3.039 6.207 1.00 0.00 O ATOM 406 CB PRO A 31 -2.575 2.418 8.355 1.00 0.00 C ATOM 407 CG PRO A 31 -1.179 2.057 7.863 1.00 0.00 C ATOM 408 CD PRO A 31 -1.242 0.536 7.777 1.00 0.00 C ATOM 0 HA PRO A 31 -4.388 1.181 8.265 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -2.848 3.434 8.069 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -2.641 2.365 9.442 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.960 2.509 6.896 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.406 2.393 8.554 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -0.632 0.167 6.953 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.857 0.078 8.688 1.00 0.00 H new ATOM 416 N THR A 32 -4.002 1.030 5.330 1.00 0.00 N ATOM 417 CA THR A 32 -4.086 1.385 3.923 1.00 0.00 C ATOM 418 C THR A 32 -4.839 0.323 3.102 1.00 0.00 C ATOM 419 O THR A 32 -4.873 0.422 1.873 1.00 0.00 O ATOM 420 CB THR A 32 -2.636 1.590 3.425 1.00 0.00 C ATOM 421 OG1 THR A 32 -1.726 0.646 3.982 1.00 0.00 O ATOM 422 CG2 THR A 32 -2.093 2.970 3.797 1.00 0.00 C ATOM 0 H THR A 32 -3.897 0.025 5.472 1.00 0.00 H new ATOM 0 HA THR A 32 -4.664 2.300 3.794 1.00 0.00 H new ATOM 0 HB THR A 32 -2.700 1.469 2.344 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.825 0.816 3.636 1.00 0.00 H new ATOM 0 HG21 THR A 32 -1.072 3.071 3.428 1.00 0.00 H new ATOM 0 HG22 THR A 32 -2.719 3.741 3.348 1.00 0.00 H new ATOM 0 HG23 THR A 32 -2.100 3.084 4.881 1.00 0.00 H new ATOM 430 N GLY A 33 -5.382 -0.714 3.743 1.00 0.00 N ATOM 431 CA GLY A 33 -5.679 -2.001 3.129 1.00 0.00 C ATOM 432 C GLY A 33 -4.665 -3.012 3.660 1.00 0.00 C ATOM 433 O GLY A 33 -3.706 -2.625 4.340 1.00 0.00 O ATOM 0 H GLY A 33 -5.633 -0.676 4.731 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.695 -2.315 3.370 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.617 -1.931 2.043 1.00 0.00 H new ATOM 437 N GLN A 34 -4.874 -4.305 3.400 1.00 0.00 N ATOM 438 CA GLN A 34 -4.137 -5.366 4.094 1.00 0.00 C ATOM 439 C GLN A 34 -2.727 -5.519 3.556 1.00 0.00 C ATOM 440 O GLN A 34 -2.450 -5.157 2.417 1.00 0.00 O ATOM 441 CB GLN A 34 -4.847 -6.726 3.994 1.00 0.00 C ATOM 442 CG GLN A 34 -6.346 -6.686 4.301 1.00 0.00 C ATOM 443 CD GLN A 34 -6.710 -5.797 5.473 1.00 0.00 C ATOM 444 OE1 GLN A 34 -6.002 -5.907 6.575 1.00 0.00 O flip ATOM 445 NE2 GLN A 34 -7.603 -4.970 5.385 1.00 0.00 N flip ATOM 0 H GLN A 34 -5.548 -4.643 2.713 1.00 0.00 H new ATOM 0 HA GLN A 34 -4.096 -5.059 5.139 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -4.706 -7.122 2.988 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -4.367 -7.423 4.681 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -6.879 -6.339 3.416 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.692 -7.699 4.505 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -8.145 -4.895 4.524 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -7.807 -4.354 6.172 1.00 0.00 H new ATOM 454 N ARG A 35 -1.850 -6.149 4.338 1.00 0.00 N ATOM 455 CA ARG A 35 -0.497 -6.438 3.900 1.00 0.00 C ATOM 456 C ARG A 35 -0.140 -7.865 4.171 1.00 0.00 C ATOM 457 O ARG A 35 -0.512 -8.428 5.204 1.00 0.00 O ATOM 458 CB ARG A 35 0.521 -5.525 4.574 1.00 0.00 C ATOM 459 CG ARG A 35 0.673 -4.218 3.805 1.00 0.00 C ATOM 460 CD ARG A 35 1.926 -3.511 4.296 1.00 0.00 C ATOM 461 NE ARG A 35 1.730 -2.682 5.490 1.00 0.00 N ATOM 462 CZ ARG A 35 1.818 -1.352 5.587 1.00 0.00 C ATOM 463 NH1 ARG A 35 1.935 -0.565 4.520 1.00 0.00 N ATOM 464 NH2 ARG A 35 1.764 -0.808 6.792 1.00 0.00 N ATOM 0 H ARG A 35 -2.061 -6.468 5.284 1.00 0.00 H new ATOM 0 HA ARG A 35 -0.467 -6.257 2.826 1.00 0.00 H new ATOM 0 HB2 ARG A 35 0.207 -5.315 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.485 -6.030 4.634 1.00 0.00 H new ATOM 0 HG2 ARG A 35 0.744 -4.414 2.735 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -0.202 -3.586 3.956 1.00 0.00 H new ATOM 0 HD2 ARG A 35 2.689 -4.259 4.510 1.00 0.00 H new ATOM 0 HD3 ARG A 35 2.312 -2.883 3.493 1.00 0.00 H new ATOM 0 HE ARG A 35 1.499 -3.180 6.349 1.00 0.00 H new ATOM 0 HH11 ARG A 35 1.960 -0.973 3.586 1.00 0.00 H new ATOM 0 HH12 ARG A 35 1.999 0.446 4.637 1.00 0.00 H new ATOM 0 HH21 ARG A 35 1.658 -1.401 7.615 1.00 0.00 H new ATOM 0 HH22 ARG A 35 1.829 0.204 6.898 1.00 0.00 H new ATOM 478 N VAL A 36 0.671 -8.406 3.275 1.00 0.00 N ATOM 479 CA VAL A 36 1.181 -9.763 3.430 1.00 0.00 C ATOM 480 C VAL A 36 2.175 -9.720 4.581 1.00 0.00 C ATOM 481 O VAL A 36 3.048 -8.847 4.618 1.00 0.00 O ATOM 482 CB VAL A 36 1.792 -10.279 2.122 1.00 0.00 C ATOM 483 CG1 VAL A 36 2.393 -11.686 2.302 1.00 0.00 C ATOM 484 CG2 VAL A 36 0.727 -10.360 1.025 1.00 0.00 C ATOM 0 H VAL A 36 0.991 -7.928 2.433 1.00 0.00 H new ATOM 0 HA VAL A 36 0.384 -10.470 3.660 1.00 0.00 H new ATOM 0 HB VAL A 36 2.577 -9.577 1.839 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.818 -12.024 1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.175 -11.653 3.061 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.612 -12.378 2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.180 -10.728 0.105 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.066 -11.040 1.337 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.307 -9.369 0.852 1.00 0.00 H new ATOM 494 N LYS A 37 1.988 -10.599 5.564 1.00 0.00 N ATOM 495 CA LYS A 37 2.752 -10.621 6.804 1.00 0.00 C ATOM 496 C LYS A 37 3.819 -11.701 6.734 1.00 0.00 C ATOM 497 O LYS A 37 4.975 -11.405 7.017 1.00 0.00 O ATOM 498 CB LYS A 37 1.778 -10.805 7.976 1.00 0.00 C ATOM 499 CG LYS A 37 2.469 -11.105 9.312 1.00 0.00 C ATOM 500 CD LYS A 37 1.469 -11.723 10.288 1.00 0.00 C ATOM 501 CE LYS A 37 2.125 -12.128 11.610 1.00 0.00 C ATOM 502 NZ LYS A 37 3.050 -13.274 11.466 1.00 0.00 N ATOM 0 H LYS A 37 1.282 -11.333 5.516 1.00 0.00 H new ATOM 0 HA LYS A 37 3.280 -9.680 6.958 1.00 0.00 H new ATOM 0 HB2 LYS A 37 1.177 -9.902 8.083 1.00 0.00 H new ATOM 0 HB3 LYS A 37 1.091 -11.618 7.742 1.00 0.00 H new ATOM 0 HG2 LYS A 37 3.305 -11.787 9.154 1.00 0.00 H new ATOM 0 HG3 LYS A 37 2.881 -10.188 9.732 1.00 0.00 H new ATOM 0 HD2 LYS A 37 0.669 -11.010 10.485 1.00 0.00 H new ATOM 0 HD3 LYS A 37 1.010 -12.599 9.829 1.00 0.00 H new ATOM 0 HE2 LYS A 37 2.671 -11.276 12.015 1.00 0.00 H new ATOM 0 HE3 LYS A 37 1.349 -12.382 12.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 3.412 -13.547 12.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 2.544 -14.078 11.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.845 -13.003 10.852 1.00 0.00 H new ATOM 516 N GLN A 38 3.447 -12.937 6.406 1.00 0.00 N ATOM 517 CA GLN A 38 4.379 -14.050 6.331 1.00 0.00 C ATOM 518 C GLN A 38 3.826 -15.003 5.285 1.00 0.00 C ATOM 519 O GLN A 38 2.630 -15.308 5.326 1.00 0.00 O ATOM 520 CB GLN A 38 4.428 -14.733 7.709 1.00 0.00 C ATOM 521 CG GLN A 38 5.493 -15.833 7.863 1.00 0.00 C ATOM 522 CD GLN A 38 6.903 -15.326 8.171 1.00 0.00 C ATOM 523 OE1 GLN A 38 7.135 -14.134 8.369 1.00 0.00 O ATOM 524 NE2 GLN A 38 7.870 -16.220 8.247 1.00 0.00 N ATOM 0 H GLN A 38 2.484 -13.191 6.184 1.00 0.00 H new ATOM 0 HA GLN A 38 5.387 -13.734 6.063 1.00 0.00 H new ATOM 0 HB2 GLN A 38 4.605 -13.971 8.467 1.00 0.00 H new ATOM 0 HB3 GLN A 38 3.450 -15.167 7.916 1.00 0.00 H new ATOM 0 HG2 GLN A 38 5.184 -16.509 8.660 1.00 0.00 H new ATOM 0 HG3 GLN A 38 5.526 -16.418 6.944 1.00 0.00 H new ATOM 0 HE21 GLN A 38 7.667 -17.206 8.081 1.00 0.00 H new ATOM 0 HE22 GLN A 38 8.820 -15.925 8.472 1.00 0.00 H new ATOM 533 N ILE A 39 4.676 -15.481 4.382 1.00 0.00 N ATOM 534 CA ILE A 39 4.322 -16.518 3.426 1.00 0.00 C ATOM 535 C ILE A 39 4.683 -17.837 4.102 1.00 0.00 C ATOM 536 O ILE A 39 5.787 -17.981 4.624 1.00 0.00 O ATOM 537 CB ILE A 39 5.033 -16.275 2.074 1.00 0.00 C ATOM 538 CG1 ILE A 39 4.584 -14.897 1.528 1.00 0.00 C ATOM 539 CG2 ILE A 39 4.725 -17.417 1.086 1.00 0.00 C ATOM 540 CD1 ILE A 39 5.010 -14.572 0.092 1.00 0.00 C ATOM 0 H ILE A 39 5.638 -15.155 4.294 1.00 0.00 H new ATOM 0 HA ILE A 39 3.262 -16.524 3.171 1.00 0.00 H new ATOM 0 HB ILE A 39 6.114 -16.265 2.210 1.00 0.00 H new ATOM 0 HG12 ILE A 39 3.497 -14.843 1.584 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.976 -14.122 2.186 1.00 0.00 H new ATOM 0 HG21 ILE A 39 5.234 -17.228 0.141 1.00 0.00 H new ATOM 0 HG22 ILE A 39 5.073 -18.362 1.503 1.00 0.00 H new ATOM 0 HG23 ILE A 39 3.650 -17.470 0.915 1.00 0.00 H new ATOM 0 HD11 ILE A 39 4.640 -13.584 -0.182 1.00 0.00 H new ATOM 0 HD12 ILE A 39 6.098 -14.584 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 39 4.595 -15.316 -0.588 1.00 0.00 H new ATOM 552 N LEU A 40 3.741 -18.780 4.132 1.00 0.00 N ATOM 553 CA LEU A 40 3.916 -20.105 4.728 1.00 0.00 C ATOM 554 C LEU A 40 3.749 -21.194 3.670 1.00 0.00 C ATOM 555 O LEU A 40 3.571 -22.356 4.029 1.00 0.00 O ATOM 556 CB LEU A 40 2.895 -20.335 5.861 1.00 0.00 C ATOM 557 CG LEU A 40 2.875 -19.303 6.999 1.00 0.00 C ATOM 558 CD1 LEU A 40 1.842 -19.724 8.044 1.00 0.00 C ATOM 559 CD2 LEU A 40 4.228 -19.191 7.693 1.00 0.00 C ATOM 0 H LEU A 40 2.813 -18.640 3.733 1.00 0.00 H new ATOM 0 HA LEU A 40 4.923 -20.154 5.141 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.900 -20.371 5.418 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.086 -21.316 6.296 1.00 0.00 H new ATOM 0 HG LEU A 40 2.627 -18.337 6.559 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.825 -18.994 8.853 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.857 -19.776 7.581 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.107 -20.703 8.444 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.168 -18.450 8.490 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.501 -20.158 8.116 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.984 -18.885 6.970 1.00 0.00 H new ATOM 571 N ASP A 41 3.671 -20.814 2.390 1.00 0.00 N ATOM 572 CA ASP A 41 3.326 -21.704 1.288 1.00 0.00 C ATOM 573 C ASP A 41 3.717 -21.011 -0.022 1.00 0.00 C ATOM 574 O ASP A 41 2.911 -20.314 -0.640 1.00 0.00 O ATOM 575 CB ASP A 41 1.828 -22.023 1.357 1.00 0.00 C ATOM 576 CG ASP A 41 1.482 -23.338 0.694 1.00 0.00 C ATOM 577 OD1 ASP A 41 1.848 -23.599 -0.467 1.00 0.00 O ATOM 578 OD2 ASP A 41 0.816 -24.171 1.351 1.00 0.00 O ATOM 0 H ASP A 41 3.851 -19.856 2.090 1.00 0.00 H new ATOM 0 HA ASP A 41 3.864 -22.650 1.348 1.00 0.00 H new ATOM 0 HB2 ASP A 41 1.514 -22.053 2.400 1.00 0.00 H new ATOM 0 HB3 ASP A 41 1.267 -21.220 0.878 1.00 0.00 H new ATOM 583 N ILE A 42 5.002 -21.094 -0.375 1.00 0.00 N ATOM 584 CA ILE A 42 5.635 -20.289 -1.418 1.00 0.00 C ATOM 585 C ILE A 42 4.921 -20.539 -2.743 1.00 0.00 C ATOM 586 O ILE A 42 4.378 -19.618 -3.352 1.00 0.00 O ATOM 587 CB ILE A 42 7.144 -20.614 -1.543 1.00 0.00 C ATOM 588 CG1 ILE A 42 7.950 -20.436 -0.243 1.00 0.00 C ATOM 589 CG2 ILE A 42 7.799 -19.730 -2.619 1.00 0.00 C ATOM 590 CD1 ILE A 42 7.748 -21.542 0.798 1.00 0.00 C ATOM 0 H ILE A 42 5.649 -21.744 0.072 1.00 0.00 H new ATOM 0 HA ILE A 42 5.551 -19.236 -1.150 1.00 0.00 H new ATOM 0 HB ILE A 42 7.174 -21.671 -1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 42 9.009 -20.383 -0.494 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.680 -19.480 0.207 1.00 0.00 H new ATOM 0 HG21 ILE A 42 8.859 -19.972 -2.693 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.318 -19.910 -3.580 1.00 0.00 H new ATOM 0 HG23 ILE A 42 7.685 -18.681 -2.347 1.00 0.00 H new ATOM 0 HD11 ILE A 42 8.356 -21.329 1.677 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.697 -21.584 1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 42 8.047 -22.500 0.373 1.00 0.00 H new ATOM 602 N GLN A 43 4.930 -21.791 -3.197 1.00 0.00 N ATOM 603 CA GLN A 43 4.271 -22.198 -4.425 1.00 0.00 C ATOM 604 C GLN A 43 2.746 -22.254 -4.289 1.00 0.00 C ATOM 605 O GLN A 43 2.064 -22.373 -5.304 1.00 0.00 O ATOM 606 CB GLN A 43 4.818 -23.555 -4.871 1.00 0.00 C ATOM 607 CG GLN A 43 6.180 -23.456 -5.565 1.00 0.00 C ATOM 608 CD GLN A 43 6.425 -24.707 -6.400 1.00 0.00 C ATOM 609 OE1 GLN A 43 7.234 -25.565 -6.057 1.00 0.00 O ATOM 610 NE2 GLN A 43 5.698 -24.852 -7.493 1.00 0.00 N ATOM 0 H GLN A 43 5.402 -22.555 -2.713 1.00 0.00 H new ATOM 0 HA GLN A 43 4.487 -21.442 -5.180 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.906 -24.208 -4.002 1.00 0.00 H new ATOM 0 HB3 GLN A 43 4.104 -24.022 -5.550 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.211 -22.571 -6.201 1.00 0.00 H new ATOM 0 HG3 GLN A 43 6.970 -23.343 -4.822 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.031 -24.128 -7.762 1.00 0.00 H new ATOM 0 HE22 GLN A 43 5.803 -25.688 -8.068 1.00 0.00 H new ATOM 619 N GLY A 44 2.174 -22.142 -3.087 1.00 0.00 N ATOM 620 CA GLY A 44 0.752 -21.862 -2.943 1.00 0.00 C ATOM 621 C GLY A 44 0.456 -20.472 -3.495 1.00 0.00 C ATOM 622 O GLY A 44 -0.558 -20.261 -4.160 1.00 0.00 O ATOM 0 H GLY A 44 2.676 -22.241 -2.205 1.00 0.00 H new ATOM 0 HA2 GLY A 44 0.166 -22.610 -3.476 1.00 0.00 H new ATOM 0 HA3 GLY A 44 0.462 -21.919 -1.894 1.00 0.00 H new ATOM 626 N CYS A 45 1.369 -19.524 -3.265 1.00 0.00 N ATOM 627 CA CYS A 45 1.182 -18.131 -3.620 1.00 0.00 C ATOM 628 C CYS A 45 2.299 -17.618 -4.540 1.00 0.00 C ATOM 629 O CYS A 45 3.071 -16.744 -4.130 1.00 0.00 O ATOM 630 CB CYS A 45 1.037 -17.321 -2.330 1.00 0.00 C ATOM 631 SG CYS A 45 -0.382 -17.953 -1.402 1.00 0.00 S ATOM 0 H CYS A 45 2.267 -19.714 -2.821 1.00 0.00 H new ATOM 0 HA CYS A 45 0.270 -18.014 -4.205 1.00 0.00 H new ATOM 0 HB2 CYS A 45 1.945 -17.399 -1.731 1.00 0.00 H new ATOM 0 HB3 CYS A 45 0.897 -16.265 -2.561 1.00 0.00 H new ATOM 0 HG CYS A 45 -0.848 -17.016 -0.630 1.00 0.00 H new ATOM 637 N PRO A 46 2.392 -18.114 -5.788 1.00 0.00 N ATOM 638 CA PRO A 46 3.357 -17.611 -6.752 1.00 0.00 C ATOM 639 C PRO A 46 3.078 -16.133 -7.036 1.00 0.00 C ATOM 640 O PRO A 46 1.927 -15.698 -7.094 1.00 0.00 O ATOM 641 CB PRO A 46 3.231 -18.510 -7.985 1.00 0.00 C ATOM 642 CG PRO A 46 1.800 -19.031 -7.902 1.00 0.00 C ATOM 643 CD PRO A 46 1.537 -19.118 -6.404 1.00 0.00 C ATOM 0 HA PRO A 46 4.384 -17.647 -6.389 1.00 0.00 H new ATOM 0 HB2 PRO A 46 3.403 -17.954 -8.906 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.956 -19.324 -7.964 1.00 0.00 H new ATOM 0 HG2 PRO A 46 1.099 -18.357 -8.394 1.00 0.00 H new ATOM 0 HG3 PRO A 46 1.699 -20.003 -8.384 1.00 0.00 H new ATOM 0 HD2 PRO A 46 0.487 -18.927 -6.180 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.768 -20.113 -6.024 1.00 0.00 H new ATOM 651 N GLY A 47 4.128 -15.335 -7.211 1.00 0.00 N ATOM 652 CA GLY A 47 4.017 -13.900 -7.447 1.00 0.00 C ATOM 653 C GLY A 47 3.909 -13.087 -6.156 1.00 0.00 C ATOM 654 O GLY A 47 4.446 -11.980 -6.124 1.00 0.00 O ATOM 0 H GLY A 47 5.091 -15.671 -7.193 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.887 -13.562 -8.011 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.141 -13.706 -8.066 1.00 0.00 H new ATOM 658 N LEU A 48 3.305 -13.628 -5.093 1.00 0.00 N ATOM 659 CA LEU A 48 3.120 -12.933 -3.817 1.00 0.00 C ATOM 660 C LEU A 48 4.485 -12.624 -3.171 1.00 0.00 C ATOM 661 O LEU A 48 5.424 -13.416 -3.304 1.00 0.00 O ATOM 662 CB LEU A 48 2.262 -13.831 -2.894 1.00 0.00 C ATOM 663 CG LEU A 48 1.572 -13.097 -1.722 1.00 0.00 C ATOM 664 CD1 LEU A 48 0.200 -12.536 -2.123 1.00 0.00 C ATOM 665 CD2 LEU A 48 1.342 -14.031 -0.527 1.00 0.00 C ATOM 0 H LEU A 48 2.926 -14.575 -5.096 1.00 0.00 H new ATOM 0 HA LEU A 48 2.611 -11.983 -3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.497 -14.319 -3.497 1.00 0.00 H new ATOM 0 HB3 LEU A 48 2.897 -14.618 -2.486 1.00 0.00 H new ATOM 0 HG LEU A 48 2.247 -12.285 -1.450 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.249 -12.028 -1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.322 -11.828 -2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.448 -13.353 -2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.855 -13.480 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.708 -14.863 -0.832 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.300 -14.415 -0.176 1.00 0.00 H new ATOM 677 N CYS A 49 4.597 -11.511 -2.443 1.00 0.00 N ATOM 678 CA CYS A 49 5.731 -11.138 -1.600 1.00 0.00 C ATOM 679 C CYS A 49 5.214 -10.568 -0.272 1.00 0.00 C ATOM 680 O CYS A 49 4.024 -10.286 -0.122 1.00 0.00 O ATOM 681 CB CYS A 49 6.586 -10.086 -2.321 1.00 0.00 C ATOM 682 SG CYS A 49 7.834 -10.848 -3.390 1.00 0.00 S ATOM 0 H CYS A 49 3.858 -10.809 -2.426 1.00 0.00 H new ATOM 0 HA CYS A 49 6.342 -12.018 -1.401 1.00 0.00 H new ATOM 0 HB2 CYS A 49 5.941 -9.441 -2.918 1.00 0.00 H new ATOM 0 HB3 CYS A 49 7.078 -9.451 -1.584 1.00 0.00 H new ATOM 0 HG CYS A 49 8.528 -9.919 -3.978 1.00 0.00 H new ATOM 688 N GLU A 50 6.099 -10.383 0.712 1.00 0.00 N ATOM 689 CA GLU A 50 5.730 -9.735 1.963 1.00 0.00 C ATOM 690 C GLU A 50 5.720 -8.216 1.799 1.00 0.00 C ATOM 691 O GLU A 50 6.546 -7.635 1.090 1.00 0.00 O ATOM 692 CB GLU A 50 6.677 -10.126 3.098 1.00 0.00 C ATOM 693 CG GLU A 50 6.313 -11.475 3.718 1.00 0.00 C ATOM 694 CD GLU A 50 7.298 -11.835 4.828 1.00 0.00 C ATOM 695 OE1 GLU A 50 7.714 -10.954 5.611 1.00 0.00 O ATOM 696 OE2 GLU A 50 7.727 -13.012 4.879 1.00 0.00 O ATOM 0 H GLU A 50 7.075 -10.675 0.661 1.00 0.00 H new ATOM 0 HA GLU A 50 4.727 -10.075 2.222 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.698 -10.167 2.719 1.00 0.00 H new ATOM 0 HB3 GLU A 50 6.654 -9.356 3.869 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.301 -11.436 4.120 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.322 -12.249 2.951 1.00 0.00 H new ATOM 703 N GLY A 51 4.800 -7.569 2.521 1.00 0.00 N ATOM 704 CA GLY A 51 4.587 -6.130 2.473 1.00 0.00 C ATOM 705 C GLY A 51 3.725 -5.690 1.291 1.00 0.00 C ATOM 706 O GLY A 51 3.399 -4.506 1.203 1.00 0.00 O ATOM 0 H GLY A 51 4.172 -8.047 3.167 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.113 -5.808 3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.553 -5.628 2.417 1.00 0.00 H new ATOM 710 N ASP A 52 3.321 -6.615 0.414 1.00 0.00 N ATOM 711 CA ASP A 52 2.380 -6.389 -0.683 1.00 0.00 C ATOM 712 C ASP A 52 1.091 -5.816 -0.096 1.00 0.00 C ATOM 713 O ASP A 52 0.455 -6.486 0.720 1.00 0.00 O ATOM 714 CB ASP A 52 2.047 -7.704 -1.419 1.00 0.00 C ATOM 715 CG ASP A 52 3.165 -8.315 -2.261 1.00 0.00 C ATOM 716 OD1 ASP A 52 4.310 -7.815 -2.208 1.00 0.00 O ATOM 717 OD2 ASP A 52 2.878 -9.294 -2.986 1.00 0.00 O ATOM 0 H ASP A 52 3.655 -7.578 0.452 1.00 0.00 H new ATOM 0 HA ASP A 52 2.833 -5.702 -1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.736 -8.441 -0.678 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.190 -7.524 -2.068 1.00 0.00 H new ATOM 722 N LEU A 53 0.739 -4.575 -0.452 1.00 0.00 N ATOM 723 CA LEU A 53 -0.506 -3.922 -0.050 1.00 0.00 C ATOM 724 C LEU A 53 -1.639 -4.521 -0.874 1.00 0.00 C ATOM 725 O LEU A 53 -1.791 -4.139 -2.030 1.00 0.00 O ATOM 726 CB LEU A 53 -0.402 -2.398 -0.278 1.00 0.00 C ATOM 727 CG LEU A 53 -1.464 -1.497 0.386 1.00 0.00 C ATOM 728 CD1 LEU A 53 -2.835 -1.562 -0.277 1.00 0.00 C ATOM 729 CD2 LEU A 53 -1.626 -1.749 1.885 1.00 0.00 C ATOM 0 H LEU A 53 1.327 -3.986 -1.041 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.699 -4.084 1.011 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.578 -2.073 0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -0.434 -2.217 -1.352 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.062 -0.494 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -3.525 -0.901 0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.751 -1.247 -1.317 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.211 -2.584 -0.237 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.388 -1.081 2.286 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.927 -2.784 2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.678 -1.562 2.390 1.00 0.00 H new ATOM 741 N ILE A 54 -2.381 -5.480 -0.330 1.00 0.00 N ATOM 742 CA ILE A 54 -3.532 -6.118 -0.956 1.00 0.00 C ATOM 743 C ILE A 54 -4.645 -5.084 -1.073 1.00 0.00 C ATOM 744 O ILE A 54 -5.108 -4.516 -0.082 1.00 0.00 O ATOM 745 CB ILE A 54 -3.942 -7.399 -0.198 1.00 0.00 C ATOM 746 CG1 ILE A 54 -2.736 -8.371 -0.139 1.00 0.00 C ATOM 747 CG2 ILE A 54 -5.151 -8.062 -0.893 1.00 0.00 C ATOM 748 CD1 ILE A 54 -2.987 -9.642 0.670 1.00 0.00 C ATOM 0 H ILE A 54 -2.187 -5.850 0.601 1.00 0.00 H new ATOM 0 HA ILE A 54 -3.286 -6.460 -1.961 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.236 -7.143 0.820 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -2.461 -8.651 -1.156 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.882 -7.845 0.289 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -5.432 -8.965 -0.351 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.991 -7.368 -0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -4.884 -8.322 -1.917 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.092 -10.264 0.658 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.231 -9.376 1.699 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -3.818 -10.194 0.231 1.00 0.00 H new ATOM 760 N VAL A 55 -5.038 -4.845 -2.318 1.00 0.00 N ATOM 761 CA VAL A 55 -6.012 -3.858 -2.728 1.00 0.00 C ATOM 762 C VAL A 55 -7.338 -4.555 -3.019 1.00 0.00 C ATOM 763 O VAL A 55 -8.371 -4.169 -2.472 1.00 0.00 O ATOM 764 CB VAL A 55 -5.437 -3.101 -3.947 1.00 0.00 C ATOM 765 CG1 VAL A 55 -6.508 -2.343 -4.717 1.00 0.00 C ATOM 766 CG2 VAL A 55 -4.328 -2.140 -3.520 1.00 0.00 C ATOM 0 H VAL A 55 -4.660 -5.368 -3.108 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.211 -3.127 -1.945 1.00 0.00 H new ATOM 0 HB VAL A 55 -5.022 -3.857 -4.613 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.052 -1.829 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.260 -3.044 -5.080 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -6.980 -1.613 -4.060 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.940 -1.620 -4.396 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.729 -1.413 -2.814 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.523 -2.701 -3.045 1.00 0.00 H new ATOM 776 N GLU A 56 -7.305 -5.589 -3.857 1.00 0.00 N ATOM 777 CA GLU A 56 -8.477 -6.238 -4.424 1.00 0.00 C ATOM 778 C GLU A 56 -8.277 -7.761 -4.349 1.00 0.00 C ATOM 779 O GLU A 56 -7.161 -8.251 -4.545 1.00 0.00 O ATOM 780 CB GLU A 56 -8.636 -5.773 -5.886 1.00 0.00 C ATOM 781 CG GLU A 56 -9.741 -4.766 -6.180 1.00 0.00 C ATOM 782 CD GLU A 56 -9.411 -3.279 -6.020 1.00 0.00 C ATOM 783 OE1 GLU A 56 -8.865 -2.680 -6.975 1.00 0.00 O ATOM 784 OE2 GLU A 56 -9.663 -2.714 -4.932 1.00 0.00 O ATOM 0 H GLU A 56 -6.430 -6.010 -4.168 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.379 -5.975 -3.872 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.689 -5.339 -6.207 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.809 -6.654 -6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.077 -4.926 -7.204 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.585 -4.994 -5.528 1.00 0.00 H new ATOM 791 N ILE A 57 -9.346 -8.524 -4.093 1.00 0.00 N ATOM 792 CA ILE A 57 -9.374 -9.983 -4.180 1.00 0.00 C ATOM 793 C ILE A 57 -10.603 -10.372 -4.993 1.00 0.00 C ATOM 794 O ILE A 57 -11.698 -9.882 -4.724 1.00 0.00 O ATOM 795 CB ILE A 57 -9.449 -10.616 -2.781 1.00 0.00 C ATOM 796 CG1 ILE A 57 -8.194 -10.276 -1.954 1.00 0.00 C ATOM 797 CG2 ILE A 57 -9.625 -12.143 -2.887 1.00 0.00 C ATOM 798 CD1 ILE A 57 -8.342 -10.697 -0.498 1.00 0.00 C ATOM 0 H ILE A 57 -10.242 -8.127 -3.811 1.00 0.00 H new ATOM 0 HA ILE A 57 -8.462 -10.344 -4.656 1.00 0.00 H new ATOM 0 HB ILE A 57 -10.317 -10.200 -2.269 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -7.327 -10.773 -2.389 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -8.006 -9.204 -2.004 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -9.676 -12.574 -1.887 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -10.546 -12.367 -3.426 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -8.778 -12.571 -3.423 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -7.435 -10.439 0.049 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -9.193 -10.180 -0.054 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.504 -11.774 -0.445 1.00 0.00 H new ATOM 810 N ASN A 58 -10.435 -11.294 -5.944 1.00 0.00 N ATOM 811 CA ASN A 58 -11.454 -11.798 -6.866 1.00 0.00 C ATOM 812 C ASN A 58 -12.351 -10.657 -7.344 1.00 0.00 C ATOM 813 O ASN A 58 -13.583 -10.750 -7.321 1.00 0.00 O ATOM 814 CB ASN A 58 -12.239 -12.969 -6.248 1.00 0.00 C ATOM 815 CG ASN A 58 -11.473 -14.282 -6.192 1.00 0.00 C ATOM 816 OD1 ASN A 58 -10.422 -14.448 -6.806 1.00 0.00 O ATOM 817 ND2 ASN A 58 -11.999 -15.241 -5.451 1.00 0.00 N ATOM 0 H ASN A 58 -9.529 -11.735 -6.100 1.00 0.00 H new ATOM 0 HA ASN A 58 -10.961 -12.204 -7.749 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -12.540 -12.695 -5.237 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -13.153 -13.120 -6.822 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -11.531 -16.145 -5.379 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -12.873 -15.078 -4.951 1.00 0.00 H new ATOM 824 N GLN A 59 -11.708 -9.563 -7.765 1.00 0.00 N ATOM 825 CA GLN A 59 -12.331 -8.423 -8.429 1.00 0.00 C ATOM 826 C GLN A 59 -13.295 -7.648 -7.507 1.00 0.00 C ATOM 827 O GLN A 59 -14.055 -6.796 -7.969 1.00 0.00 O ATOM 828 CB GLN A 59 -12.919 -8.879 -9.785 1.00 0.00 C ATOM 829 CG GLN A 59 -11.913 -9.745 -10.574 1.00 0.00 C ATOM 830 CD GLN A 59 -12.346 -10.088 -11.992 1.00 0.00 C ATOM 831 OE1 GLN A 59 -13.473 -10.520 -12.248 1.00 0.00 O ATOM 832 NE2 GLN A 59 -11.430 -9.987 -12.935 1.00 0.00 N ATOM 0 H GLN A 59 -10.702 -9.447 -7.646 1.00 0.00 H new ATOM 0 HA GLN A 59 -11.575 -7.672 -8.659 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -13.834 -9.446 -9.614 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -13.192 -8.005 -10.377 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.958 -9.221 -10.617 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.744 -10.672 -10.026 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -10.502 -9.628 -12.709 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.649 -10.268 -13.891 1.00 0.00 H new ATOM 841 N GLN A 60 -13.249 -7.911 -6.194 1.00 0.00 N ATOM 842 CA GLN A 60 -13.870 -7.124 -5.148 1.00 0.00 C ATOM 843 C GLN A 60 -12.792 -6.246 -4.522 1.00 0.00 C ATOM 844 O GLN A 60 -11.741 -6.752 -4.117 1.00 0.00 O ATOM 845 CB GLN A 60 -14.498 -8.062 -4.109 1.00 0.00 C ATOM 846 CG GLN A 60 -14.824 -7.358 -2.786 1.00 0.00 C ATOM 847 CD GLN A 60 -15.952 -8.079 -2.065 1.00 0.00 C ATOM 848 OE1 GLN A 60 -17.063 -7.563 -1.988 1.00 0.00 O ATOM 849 NE2 GLN A 60 -15.738 -9.293 -1.595 1.00 0.00 N ATOM 0 H GLN A 60 -12.750 -8.721 -5.826 1.00 0.00 H new ATOM 0 HA GLN A 60 -14.663 -6.492 -5.547 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -15.411 -8.491 -4.520 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -13.816 -8.890 -3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -13.937 -7.332 -2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -15.109 -6.324 -2.978 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -14.810 -9.711 -1.665 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -16.500 -9.814 -1.162 1.00 0.00 H new ATOM 858 N ASN A 61 -13.084 -4.952 -4.403 1.00 0.00 N ATOM 859 CA ASN A 61 -12.314 -4.014 -3.597 1.00 0.00 C ATOM 860 C ASN A 61 -12.268 -4.471 -2.148 1.00 0.00 C ATOM 861 O ASN A 61 -13.319 -4.654 -1.527 1.00 0.00 O ATOM 862 CB ASN A 61 -12.904 -2.606 -3.711 1.00 0.00 C ATOM 863 CG ASN A 61 -12.228 -1.631 -2.757 1.00 0.00 C ATOM 864 OD1 ASN A 61 -12.867 -1.117 -1.842 1.00 0.00 O ATOM 865 ND2 ASN A 61 -10.958 -1.326 -2.950 1.00 0.00 N ATOM 0 H ASN A 61 -13.879 -4.520 -4.875 1.00 0.00 H new ATOM 0 HA ASN A 61 -11.292 -3.985 -3.974 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.795 -2.248 -4.735 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -13.972 -2.641 -3.498 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.495 -0.656 -2.336 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -10.440 -1.760 -3.714 1.00 0.00 H new ATOM 872 N VAL A 62 -11.057 -4.634 -1.611 1.00 0.00 N ATOM 873 CA VAL A 62 -10.851 -4.991 -0.209 1.00 0.00 C ATOM 874 C VAL A 62 -10.034 -3.949 0.568 1.00 0.00 C ATOM 875 O VAL A 62 -9.924 -4.087 1.781 1.00 0.00 O ATOM 876 CB VAL A 62 -10.311 -6.430 -0.051 1.00 0.00 C ATOM 877 CG1 VAL A 62 -11.227 -7.481 -0.696 1.00 0.00 C ATOM 878 CG2 VAL A 62 -8.903 -6.635 -0.611 1.00 0.00 C ATOM 0 H VAL A 62 -10.191 -4.522 -2.138 1.00 0.00 H new ATOM 0 HA VAL A 62 -11.836 -4.980 0.258 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.281 -6.568 1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.798 -8.473 -0.554 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -12.211 -7.441 -0.230 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -11.322 -7.276 -1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.599 -7.671 -0.460 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.899 -6.407 -1.677 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.207 -5.974 -0.096 1.00 0.00 H new ATOM 888 N GLN A 63 -9.520 -2.879 -0.061 1.00 0.00 N ATOM 889 CA GLN A 63 -8.747 -1.854 0.647 1.00 0.00 C ATOM 890 C GLN A 63 -9.505 -1.272 1.849 1.00 0.00 C ATOM 891 O GLN A 63 -8.890 -0.934 2.855 1.00 0.00 O ATOM 892 CB GLN A 63 -8.386 -0.684 -0.275 1.00 0.00 C ATOM 893 CG GLN A 63 -7.108 -0.895 -1.076 1.00 0.00 C ATOM 894 CD GLN A 63 -6.527 0.433 -1.550 1.00 0.00 C ATOM 895 OE1 GLN A 63 -6.636 0.815 -2.709 1.00 0.00 O ATOM 896 NE2 GLN A 63 -5.887 1.183 -0.669 1.00 0.00 N ATOM 0 H GLN A 63 -9.628 -2.704 -1.060 1.00 0.00 H new ATOM 0 HA GLN A 63 -7.847 -2.362 0.993 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.211 -0.512 -0.966 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -8.280 0.219 0.326 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -6.374 -1.418 -0.463 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -7.316 -1.531 -1.936 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -5.794 0.868 0.297 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -5.486 2.076 -0.955 1.00 0.00 H new ATOM 905 N ASN A 64 -10.824 -1.108 1.709 1.00 0.00 N ATOM 906 CA ASN A 64 -11.673 -0.397 2.665 1.00 0.00 C ATOM 907 C ASN A 64 -12.374 -1.363 3.626 1.00 0.00 C ATOM 908 O ASN A 64 -13.214 -0.932 4.422 1.00 0.00 O ATOM 909 CB ASN A 64 -12.721 0.443 1.913 1.00 0.00 C ATOM 910 CG ASN A 64 -12.105 1.449 0.950 1.00 0.00 C ATOM 911 OD1 ASN A 64 -11.696 2.540 1.334 1.00 0.00 O ATOM 912 ND2 ASN A 64 -12.006 1.107 -0.326 1.00 0.00 N ATOM 0 H ASN A 64 -11.341 -1.475 0.910 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.033 0.258 3.256 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -13.381 -0.224 1.358 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -13.339 0.974 2.637 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -11.588 1.752 -0.996 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -12.348 0.198 -0.638 1.00 0.00 H new ATOM 919 N LEU A 65 -12.098 -2.666 3.508 1.00 0.00 N ATOM 920 CA LEU A 65 -12.647 -3.698 4.372 1.00 0.00 C ATOM 921 C LEU A 65 -11.748 -3.849 5.593 1.00 0.00 C ATOM 922 O LEU A 65 -10.578 -3.471 5.563 1.00 0.00 O ATOM 923 CB LEU A 65 -12.729 -5.025 3.600 1.00 0.00 C ATOM 924 CG LEU A 65 -13.779 -5.072 2.475 1.00 0.00 C ATOM 925 CD1 LEU A 65 -13.861 -6.509 1.949 1.00 0.00 C ATOM 926 CD2 LEU A 65 -15.174 -4.627 2.919 1.00 0.00 C ATOM 0 H LEU A 65 -11.472 -3.033 2.791 1.00 0.00 H new ATOM 0 HA LEU A 65 -13.650 -3.421 4.696 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.750 -5.236 3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.944 -5.825 4.308 1.00 0.00 H new ATOM 0 HG LEU A 65 -13.457 -4.371 1.705 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -14.601 -6.562 1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.888 -6.811 1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -14.153 -7.177 2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -15.861 -4.686 2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -15.526 -5.278 3.719 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -15.130 -3.599 3.280 1.00 0.00 H new ATOM 938 N SER A 66 -12.269 -4.440 6.664 1.00 0.00 N ATOM 939 CA SER A 66 -11.458 -4.770 7.831 1.00 0.00 C ATOM 940 C SER A 66 -10.682 -6.050 7.538 1.00 0.00 C ATOM 941 O SER A 66 -11.201 -6.913 6.832 1.00 0.00 O ATOM 942 CB SER A 66 -12.367 -4.982 9.043 1.00 0.00 C ATOM 943 OG SER A 66 -13.216 -3.870 9.237 1.00 0.00 O ATOM 0 H SER A 66 -13.252 -4.701 6.748 1.00 0.00 H new ATOM 0 HA SER A 66 -10.765 -3.957 8.047 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.966 -5.881 8.900 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.760 -5.141 9.934 1.00 0.00 H new ATOM 0 HG SER A 66 -13.789 -4.028 10.016 1.00 0.00 H new ATOM 949 N HIS A 67 -9.517 -6.232 8.162 1.00 0.00 N ATOM 950 CA HIS A 67 -8.663 -7.413 8.046 1.00 0.00 C ATOM 951 C HIS A 67 -9.480 -8.703 8.044 1.00 0.00 C ATOM 952 O HIS A 67 -9.350 -9.500 7.123 1.00 0.00 O ATOM 953 CB HIS A 67 -7.601 -7.372 9.168 1.00 0.00 C ATOM 954 CG HIS A 67 -6.858 -8.661 9.407 1.00 0.00 C ATOM 955 ND1 HIS A 67 -5.535 -8.868 9.111 1.00 0.00 N ATOM 956 CD2 HIS A 67 -7.320 -9.777 10.063 1.00 0.00 C ATOM 957 CE1 HIS A 67 -5.196 -10.070 9.599 1.00 0.00 C ATOM 958 NE2 HIS A 67 -6.249 -10.667 10.176 1.00 0.00 N ATOM 0 H HIS A 67 -9.127 -5.529 8.789 1.00 0.00 H new ATOM 0 HA HIS A 67 -8.147 -7.400 7.086 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -6.876 -6.594 8.929 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -8.090 -7.078 10.097 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -8.325 -9.936 10.424 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -4.207 -10.500 9.536 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -6.265 -11.589 10.612 1.00 0.00 H new ATOM 966 N THR A 68 -10.348 -8.887 9.035 1.00 0.00 N ATOM 967 CA THR A 68 -11.171 -10.064 9.214 1.00 0.00 C ATOM 968 C THR A 68 -12.048 -10.348 7.993 1.00 0.00 C ATOM 969 O THR A 68 -12.143 -11.500 7.581 1.00 0.00 O ATOM 970 CB THR A 68 -11.992 -9.870 10.496 1.00 0.00 C ATOM 971 OG1 THR A 68 -11.125 -9.610 11.591 1.00 0.00 O ATOM 972 CG2 THR A 68 -12.790 -11.124 10.814 1.00 0.00 C ATOM 0 H THR A 68 -10.498 -8.187 9.762 1.00 0.00 H new ATOM 0 HA THR A 68 -10.539 -10.947 9.315 1.00 0.00 H new ATOM 0 HB THR A 68 -12.669 -9.031 10.338 1.00 0.00 H new ATOM 0 HG1 THR A 68 -11.655 -9.485 12.406 1.00 0.00 H new ATOM 0 HG21 THR A 68 -13.366 -10.967 11.726 1.00 0.00 H new ATOM 0 HG22 THR A 68 -13.469 -11.342 9.990 1.00 0.00 H new ATOM 0 HG23 THR A 68 -12.109 -11.963 10.955 1.00 0.00 H new ATOM 980 N GLU A 69 -12.653 -9.319 7.398 1.00 0.00 N ATOM 981 CA GLU A 69 -13.491 -9.465 6.216 1.00 0.00 C ATOM 982 C GLU A 69 -12.638 -9.962 5.050 1.00 0.00 C ATOM 983 O GLU A 69 -13.092 -10.785 4.259 1.00 0.00 O ATOM 984 CB GLU A 69 -14.125 -8.109 5.868 1.00 0.00 C ATOM 985 CG GLU A 69 -14.960 -7.491 6.992 1.00 0.00 C ATOM 986 CD GLU A 69 -15.976 -8.449 7.607 1.00 0.00 C ATOM 987 OE1 GLU A 69 -16.878 -8.938 6.886 1.00 0.00 O ATOM 988 OE2 GLU A 69 -15.875 -8.686 8.833 1.00 0.00 O ATOM 0 H GLU A 69 -12.572 -8.357 7.728 1.00 0.00 H new ATOM 0 HA GLU A 69 -14.284 -10.187 6.412 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -13.333 -7.411 5.595 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -14.757 -8.233 4.989 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.290 -7.136 7.775 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -15.487 -6.619 6.603 1.00 0.00 H new ATOM 995 N VAL A 70 -11.399 -9.474 4.946 1.00 0.00 N ATOM 996 CA VAL A 70 -10.485 -9.827 3.876 1.00 0.00 C ATOM 997 C VAL A 70 -10.042 -11.280 4.043 1.00 0.00 C ATOM 998 O VAL A 70 -10.202 -12.063 3.114 1.00 0.00 O ATOM 999 CB VAL A 70 -9.329 -8.810 3.798 1.00 0.00 C ATOM 1000 CG1 VAL A 70 -8.508 -9.066 2.537 1.00 0.00 C ATOM 1001 CG2 VAL A 70 -9.858 -7.369 3.719 1.00 0.00 C ATOM 0 H VAL A 70 -11.005 -8.814 5.616 1.00 0.00 H new ATOM 0 HA VAL A 70 -10.983 -9.769 2.908 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.724 -8.930 4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -7.691 -8.347 2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -8.100 -10.076 2.567 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.146 -8.958 1.660 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -9.019 -6.676 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.478 -7.257 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.453 -7.151 4.606 1.00 0.00 H new ATOM 1011 N VAL A 71 -9.562 -11.672 5.224 1.00 0.00 N ATOM 1012 CA VAL A 71 -9.274 -13.059 5.600 1.00 0.00 C ATOM 1013 C VAL A 71 -10.464 -13.948 5.283 1.00 0.00 C ATOM 1014 O VAL A 71 -10.251 -15.086 4.866 1.00 0.00 O ATOM 1015 CB VAL A 71 -8.988 -13.082 7.127 1.00 0.00 C ATOM 1016 CG1 VAL A 71 -8.904 -14.468 7.785 1.00 0.00 C ATOM 1017 CG2 VAL A 71 -7.683 -12.365 7.423 1.00 0.00 C ATOM 0 H VAL A 71 -9.355 -11.010 5.972 1.00 0.00 H new ATOM 0 HA VAL A 71 -8.416 -13.432 5.042 1.00 0.00 H new ATOM 0 HB VAL A 71 -9.859 -12.587 7.556 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.701 -14.354 8.850 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -9.850 -14.993 7.650 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -8.102 -15.042 7.322 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -7.491 -12.386 8.496 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.867 -12.863 6.899 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.752 -11.330 7.087 1.00 0.00 H new ATOM 1027 N ASP A 72 -11.680 -13.446 5.493 1.00 0.00 N ATOM 1028 CA ASP A 72 -12.888 -14.257 5.319 1.00 0.00 C ATOM 1029 C ASP A 72 -13.169 -14.549 3.860 1.00 0.00 C ATOM 1030 O ASP A 72 -13.617 -15.639 3.517 1.00 0.00 O ATOM 1031 CB ASP A 72 -14.128 -13.624 5.935 1.00 0.00 C ATOM 1032 CG ASP A 72 -15.273 -14.640 6.040 1.00 0.00 C ATOM 1033 OD1 ASP A 72 -15.019 -15.864 6.122 1.00 0.00 O ATOM 1034 OD2 ASP A 72 -16.445 -14.219 6.143 1.00 0.00 O ATOM 0 H ASP A 72 -11.857 -12.484 5.783 1.00 0.00 H new ATOM 0 HA ASP A 72 -12.677 -15.187 5.846 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -13.889 -13.237 6.926 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -14.445 -12.775 5.330 1.00 0.00 H new ATOM 1039 N ILE A 73 -12.851 -13.593 2.991 1.00 0.00 N ATOM 1040 CA ILE A 73 -12.856 -13.808 1.547 1.00 0.00 C ATOM 1041 C ILE A 73 -11.971 -15.011 1.259 1.00 0.00 C ATOM 1042 O ILE A 73 -12.473 -16.015 0.761 1.00 0.00 O ATOM 1043 CB ILE A 73 -12.474 -12.530 0.774 1.00 0.00 C ATOM 1044 CG1 ILE A 73 -13.594 -11.503 1.000 1.00 0.00 C ATOM 1045 CG2 ILE A 73 -12.314 -12.777 -0.736 1.00 0.00 C ATOM 1046 CD1 ILE A 73 -13.188 -10.055 0.757 1.00 0.00 C ATOM 0 H ILE A 73 -12.583 -12.649 3.268 1.00 0.00 H new ATOM 0 HA ILE A 73 -13.860 -14.031 1.187 1.00 0.00 H new ATOM 0 HB ILE A 73 -11.511 -12.176 1.141 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -14.430 -11.747 0.344 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -13.954 -11.598 2.024 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -12.045 -11.844 -1.231 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -11.530 -13.515 -0.903 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -13.254 -13.147 -1.146 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -14.041 -9.402 0.941 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -12.374 -9.787 1.431 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -12.857 -9.938 -0.275 1.00 0.00 H new ATOM 1058 N LEU A 74 -10.678 -14.987 1.600 1.00 0.00 N ATOM 1059 CA LEU A 74 -9.846 -16.150 1.451 1.00 0.00 C ATOM 1060 C LEU A 74 -10.338 -17.397 2.174 1.00 0.00 C ATOM 1061 O LEU A 74 -10.073 -18.486 1.678 1.00 0.00 O ATOM 1062 CB LEU A 74 -8.478 -15.734 1.953 1.00 0.00 C ATOM 1063 CG LEU A 74 -7.937 -14.501 1.224 1.00 0.00 C ATOM 1064 CD1 LEU A 74 -8.283 -14.366 -0.261 1.00 0.00 C ATOM 1065 CD2 LEU A 74 -7.736 -13.277 2.091 1.00 0.00 C ATOM 0 H LEU A 74 -10.201 -14.169 1.979 1.00 0.00 H new ATOM 0 HA LEU A 74 -9.847 -16.455 0.404 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -8.534 -15.525 3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -7.781 -16.562 1.827 1.00 0.00 H new ATOM 0 HG LEU A 74 -6.885 -14.717 1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.840 -13.452 -0.656 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.890 -15.225 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -9.366 -14.325 -0.380 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -7.351 -12.459 1.482 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.688 -12.983 2.532 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -7.024 -13.506 2.884 1.00 0.00 H new ATOM 1077 N LYS A 75 -11.021 -17.307 3.317 1.00 0.00 N ATOM 1078 CA LYS A 75 -11.608 -18.487 3.951 1.00 0.00 C ATOM 1079 C LYS A 75 -12.660 -19.073 3.016 1.00 0.00 C ATOM 1080 O LYS A 75 -12.564 -20.256 2.693 1.00 0.00 O ATOM 1081 CB LYS A 75 -12.186 -18.164 5.336 1.00 0.00 C ATOM 1082 CG LYS A 75 -11.092 -17.967 6.390 1.00 0.00 C ATOM 1083 CD LYS A 75 -11.598 -17.251 7.647 1.00 0.00 C ATOM 1084 CE LYS A 75 -12.742 -17.982 8.353 1.00 0.00 C ATOM 1085 NZ LYS A 75 -14.066 -17.370 8.126 1.00 0.00 N ATOM 0 H LYS A 75 -11.180 -16.434 3.820 1.00 0.00 H new ATOM 0 HA LYS A 75 -10.828 -19.229 4.121 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.793 -17.261 5.272 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.848 -18.972 5.649 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -10.685 -18.939 6.670 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -10.274 -17.392 5.955 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.769 -17.132 8.345 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -11.932 -16.250 7.375 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -12.766 -19.017 8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.541 -18.005 9.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.792 -18.114 8.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.280 -16.709 8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -14.060 -16.854 7.223 1.00 0.00 H new ATOM 1099 N ASP A 76 -13.590 -18.266 2.523 1.00 0.00 N ATOM 1100 CA ASP A 76 -14.635 -18.690 1.597 1.00 0.00 C ATOM 1101 C ASP A 76 -14.043 -19.234 0.297 1.00 0.00 C ATOM 1102 O ASP A 76 -14.597 -20.175 -0.265 1.00 0.00 O ATOM 1103 CB ASP A 76 -15.580 -17.519 1.269 1.00 0.00 C ATOM 1104 CG ASP A 76 -16.663 -17.249 2.311 1.00 0.00 C ATOM 1105 OD1 ASP A 76 -16.874 -18.066 3.233 1.00 0.00 O ATOM 1106 OD2 ASP A 76 -17.384 -16.229 2.178 1.00 0.00 O ATOM 0 H ASP A 76 -13.641 -17.275 2.760 1.00 0.00 H new ATOM 0 HA ASP A 76 -15.196 -19.485 2.088 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -14.984 -16.615 1.145 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -16.061 -17.718 0.311 1.00 0.00 H new ATOM 1111 N CYS A 77 -12.927 -18.676 -0.185 1.00 0.00 N ATOM 1112 CA CYS A 77 -12.397 -18.952 -1.515 1.00 0.00 C ATOM 1113 C CYS A 77 -12.135 -20.455 -1.752 1.00 0.00 C ATOM 1114 O CYS A 77 -11.694 -21.172 -0.847 1.00 0.00 O ATOM 1115 CB CYS A 77 -11.119 -18.147 -1.745 1.00 0.00 C ATOM 1116 SG CYS A 77 -11.468 -16.400 -2.095 1.00 0.00 S ATOM 0 H CYS A 77 -12.364 -18.013 0.348 1.00 0.00 H new ATOM 0 HA CYS A 77 -13.157 -18.648 -2.234 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -10.481 -18.220 -0.864 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -10.563 -18.579 -2.577 1.00 0.00 H new ATOM 0 HG CYS A 77 -12.091 -15.871 -1.084 1.00 0.00 H new ATOM 1122 N PRO A 78 -12.367 -20.928 -2.984 1.00 0.00 N ATOM 1123 CA PRO A 78 -12.320 -22.334 -3.347 1.00 0.00 C ATOM 1124 C PRO A 78 -10.904 -22.894 -3.309 1.00 0.00 C ATOM 1125 O PRO A 78 -9.995 -22.408 -3.989 1.00 0.00 O ATOM 1126 CB PRO A 78 -12.929 -22.428 -4.743 1.00 0.00 C ATOM 1127 CG PRO A 78 -12.903 -21.003 -5.290 1.00 0.00 C ATOM 1128 CD PRO A 78 -12.812 -20.103 -4.088 1.00 0.00 C ATOM 0 HA PRO A 78 -12.878 -22.937 -2.630 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -12.356 -23.104 -5.378 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -13.947 -22.816 -4.703 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -12.052 -20.855 -5.954 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -13.801 -20.791 -5.870 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -12.112 -19.287 -4.268 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -13.779 -19.651 -3.868 1.00 0.00 H new ATOM 1136 N ILE A 79 -10.733 -23.948 -2.518 1.00 0.00 N ATOM 1137 CA ILE A 79 -9.517 -24.741 -2.443 1.00 0.00 C ATOM 1138 C ILE A 79 -9.256 -25.303 -3.847 1.00 0.00 C ATOM 1139 O ILE A 79 -10.175 -25.828 -4.480 1.00 0.00 O ATOM 1140 CB ILE A 79 -9.711 -25.812 -1.345 1.00 0.00 C ATOM 1141 CG1 ILE A 79 -9.772 -25.154 0.058 1.00 0.00 C ATOM 1142 CG2 ILE A 79 -8.630 -26.905 -1.382 1.00 0.00 C ATOM 1143 CD1 ILE A 79 -8.402 -24.877 0.675 1.00 0.00 C ATOM 0 H ILE A 79 -11.464 -24.283 -1.891 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.634 -24.169 -2.157 1.00 0.00 H new ATOM 0 HB ILE A 79 -10.663 -26.302 -1.551 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -10.322 -24.216 -0.016 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -10.336 -25.803 0.728 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.817 -27.629 -0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.656 -27.410 -2.348 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.649 -26.452 -1.236 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -8.531 -24.417 1.655 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -7.855 -25.814 0.783 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -7.841 -24.202 0.028 1.00 0.00 H new ATOM 1155 N GLY A 80 -8.025 -25.170 -4.342 1.00 0.00 N ATOM 1156 CA GLY A 80 -7.605 -25.654 -5.656 1.00 0.00 C ATOM 1157 C GLY A 80 -8.283 -24.916 -6.808 1.00 0.00 C ATOM 1158 O GLY A 80 -8.455 -25.487 -7.888 1.00 0.00 O ATOM 0 H GLY A 80 -7.274 -24.711 -3.827 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.524 -25.546 -5.749 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.827 -26.718 -5.733 1.00 0.00 H new ATOM 1162 N SER A 81 -8.692 -23.668 -6.582 1.00 0.00 N ATOM 1163 CA SER A 81 -8.835 -22.687 -7.639 1.00 0.00 C ATOM 1164 C SER A 81 -7.660 -21.730 -7.565 1.00 0.00 C ATOM 1165 O SER A 81 -7.104 -21.486 -6.486 1.00 0.00 O ATOM 1166 CB SER A 81 -10.097 -21.855 -7.427 1.00 0.00 C ATOM 1167 OG SER A 81 -11.284 -22.564 -7.679 1.00 0.00 O ATOM 0 H SER A 81 -8.932 -23.315 -5.656 1.00 0.00 H new ATOM 0 HA SER A 81 -8.883 -23.207 -8.596 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.113 -21.488 -6.401 1.00 0.00 H new ATOM 0 HB3 SER A 81 -10.060 -20.981 -8.077 1.00 0.00 H new ATOM 0 HG SER A 81 -12.015 -21.931 -7.839 1.00 0.00 H new ATOM 1173 N GLU A 82 -7.396 -21.094 -8.701 1.00 0.00 N ATOM 1174 CA GLU A 82 -6.768 -19.795 -8.749 1.00 0.00 C ATOM 1175 C GLU A 82 -7.664 -18.776 -8.039 1.00 0.00 C ATOM 1176 O GLU A 82 -8.885 -18.920 -7.947 1.00 0.00 O ATOM 1177 CB GLU A 82 -6.507 -19.362 -10.204 1.00 0.00 C ATOM 1178 CG GLU A 82 -5.037 -19.502 -10.628 1.00 0.00 C ATOM 1179 CD GLU A 82 -4.552 -20.911 -10.969 1.00 0.00 C ATOM 1180 OE1 GLU A 82 -5.353 -21.875 -10.944 1.00 0.00 O ATOM 1181 OE2 GLU A 82 -3.336 -21.003 -11.269 1.00 0.00 O ATOM 0 H GLU A 82 -7.618 -21.477 -9.620 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.805 -19.848 -8.242 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.128 -19.961 -10.870 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.816 -18.324 -10.327 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.872 -18.866 -11.497 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.412 -19.112 -9.824 1.00 0.00 H new ATOM 1188 N THR A 83 -7.059 -17.730 -7.503 1.00 0.00 N ATOM 1189 CA THR A 83 -7.709 -16.616 -6.847 1.00 0.00 C ATOM 1190 C THR A 83 -6.940 -15.384 -7.299 1.00 0.00 C ATOM 1191 O THR A 83 -5.705 -15.358 -7.244 1.00 0.00 O ATOM 1192 CB THR A 83 -7.700 -16.871 -5.338 1.00 0.00 C ATOM 1193 OG1 THR A 83 -8.452 -18.054 -5.123 1.00 0.00 O ATOM 1194 CG2 THR A 83 -8.319 -15.726 -4.531 1.00 0.00 C ATOM 0 H THR A 83 -6.044 -17.633 -7.516 1.00 0.00 H new ATOM 0 HA THR A 83 -8.759 -16.478 -7.104 1.00 0.00 H new ATOM 0 HB THR A 83 -6.667 -16.959 -5.000 1.00 0.00 H new ATOM 0 HG1 THR A 83 -8.473 -18.259 -4.165 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.282 -15.968 -3.469 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.760 -14.808 -4.714 1.00 0.00 H new ATOM 0 HG23 THR A 83 -9.356 -15.586 -4.835 1.00 0.00 H new ATOM 1202 N SER A 84 -7.678 -14.426 -7.842 1.00 0.00 N ATOM 1203 CA SER A 84 -7.181 -13.293 -8.582 1.00 0.00 C ATOM 1204 C SER A 84 -6.950 -12.236 -7.525 1.00 0.00 C ATOM 1205 O SER A 84 -7.891 -11.907 -6.797 1.00 0.00 O ATOM 1206 CB SER A 84 -8.238 -12.841 -9.606 1.00 0.00 C ATOM 1207 OG SER A 84 -8.945 -13.948 -10.158 1.00 0.00 O ATOM 0 H SER A 84 -8.695 -14.426 -7.769 1.00 0.00 H new ATOM 0 HA SER A 84 -6.274 -13.506 -9.147 1.00 0.00 H new ATOM 0 HB2 SER A 84 -8.943 -12.162 -9.126 1.00 0.00 H new ATOM 0 HB3 SER A 84 -7.753 -12.283 -10.407 1.00 0.00 H new ATOM 0 HG SER A 84 -9.609 -13.624 -10.802 1.00 0.00 H new ATOM 1213 N LEU A 85 -5.724 -11.763 -7.358 1.00 0.00 N ATOM 1214 CA LEU A 85 -5.416 -10.775 -6.344 1.00 0.00 C ATOM 1215 C LEU A 85 -4.837 -9.558 -7.047 1.00 0.00 C ATOM 1216 O LEU A 85 -4.233 -9.677 -8.112 1.00 0.00 O ATOM 1217 CB LEU A 85 -4.416 -11.346 -5.322 1.00 0.00 C ATOM 1218 CG LEU A 85 -5.001 -11.540 -3.920 1.00 0.00 C ATOM 1219 CD1 LEU A 85 -5.939 -12.760 -3.861 1.00 0.00 C ATOM 1220 CD2 LEU A 85 -3.837 -11.693 -2.934 1.00 0.00 C ATOM 0 H LEU A 85 -4.923 -12.053 -7.919 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.316 -10.498 -5.795 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.047 -12.305 -5.687 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.557 -10.678 -5.257 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.605 -10.672 -3.655 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -6.335 -12.866 -2.851 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -6.763 -12.620 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.384 -13.659 -4.129 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -4.229 -11.833 -1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.236 -12.558 -3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.217 -10.797 -2.961 1.00 0.00 H new ATOM 1232 N ILE A 86 -4.957 -8.389 -6.431 1.00 0.00 N ATOM 1233 CA ILE A 86 -4.305 -7.181 -6.908 1.00 0.00 C ATOM 1234 C ILE A 86 -3.677 -6.537 -5.680 1.00 0.00 C ATOM 1235 O ILE A 86 -4.347 -6.383 -4.650 1.00 0.00 O ATOM 1236 CB ILE A 86 -5.271 -6.258 -7.664 1.00 0.00 C ATOM 1237 CG1 ILE A 86 -6.097 -7.070 -8.682 1.00 0.00 C ATOM 1238 CG2 ILE A 86 -4.459 -5.147 -8.342 1.00 0.00 C ATOM 1239 CD1 ILE A 86 -6.863 -6.233 -9.688 1.00 0.00 C ATOM 0 H ILE A 86 -5.511 -8.254 -5.585 1.00 0.00 H new ATOM 0 HA ILE A 86 -3.537 -7.404 -7.649 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.978 -5.800 -6.972 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -5.427 -7.739 -9.222 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.804 -7.697 -8.138 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.133 -4.483 -8.884 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.919 -4.578 -7.586 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.748 -5.590 -9.039 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -7.414 -6.889 -10.362 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -7.562 -5.582 -9.163 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -6.164 -5.625 -10.263 1.00 0.00 H new ATOM 1251 N ILE A 87 -2.397 -6.188 -5.771 1.00 0.00 N ATOM 1252 CA ILE A 87 -1.671 -5.448 -4.753 1.00 0.00 C ATOM 1253 C ILE A 87 -1.173 -4.138 -5.379 1.00 0.00 C ATOM 1254 O ILE A 87 -1.279 -3.956 -6.592 1.00 0.00 O ATOM 1255 CB ILE A 87 -0.613 -6.355 -4.062 1.00 0.00 C ATOM 1256 CG1 ILE A 87 0.703 -6.570 -4.845 1.00 0.00 C ATOM 1257 CG2 ILE A 87 -1.241 -7.731 -3.746 1.00 0.00 C ATOM 1258 CD1 ILE A 87 1.786 -5.504 -4.602 1.00 0.00 C ATOM 0 H ILE A 87 -1.822 -6.421 -6.581 1.00 0.00 H new ATOM 0 HA ILE A 87 -2.305 -5.148 -3.919 1.00 0.00 H new ATOM 0 HB ILE A 87 -0.328 -5.815 -3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.110 -7.546 -4.581 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.474 -6.597 -5.910 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -0.500 -8.367 -3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -2.094 -7.597 -3.081 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -1.573 -8.201 -4.672 1.00 0.00 H new ATOM 0 HD11 ILE A 87 2.670 -5.742 -5.194 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.405 -4.525 -4.895 1.00 0.00 H new ATOM 0 HD13 ILE A 87 2.051 -5.489 -3.545 1.00 0.00 H new ATOM 1270 N HIS A 88 -0.706 -3.194 -4.559 1.00 0.00 N ATOM 1271 CA HIS A 88 -0.332 -1.851 -5.005 1.00 0.00 C ATOM 1272 C HIS A 88 1.020 -1.874 -5.751 1.00 0.00 C ATOM 1273 O HIS A 88 1.205 -2.598 -6.731 1.00 0.00 O ATOM 1274 CB HIS A 88 -0.431 -0.901 -3.790 1.00 0.00 C ATOM 1275 CG HIS A 88 -0.581 0.563 -4.127 1.00 0.00 C ATOM 1276 ND1 HIS A 88 0.373 1.546 -3.964 1.00 0.00 N ATOM 1277 CD2 HIS A 88 -1.727 1.167 -4.571 1.00 0.00 C ATOM 1278 CE1 HIS A 88 -0.183 2.714 -4.333 1.00 0.00 C ATOM 1279 NE2 HIS A 88 -1.466 2.536 -4.696 1.00 0.00 N ATOM 0 H HIS A 88 -0.576 -3.342 -3.558 1.00 0.00 H new ATOM 0 HA HIS A 88 -1.018 -1.459 -5.755 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -1.281 -1.206 -3.180 1.00 0.00 H new ATOM 0 HB3 HIS A 88 0.462 -1.026 -3.178 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -2.664 0.675 -4.786 1.00 0.00 H new ATOM 0 HE1 HIS A 88 0.330 3.664 -4.337 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -2.120 3.257 -5.002 1.00 0.00 H new ATOM 1287 N ARG A 89 2.005 -1.135 -5.245 1.00 0.00 N ATOM 1288 CA ARG A 89 3.381 -1.074 -5.728 1.00 0.00 C ATOM 1289 C ARG A 89 3.425 -0.610 -7.187 1.00 0.00 C ATOM 1290 O ARG A 89 3.169 0.569 -7.425 1.00 0.00 O ATOM 1291 CB ARG A 89 4.078 -2.413 -5.418 1.00 0.00 C ATOM 1292 CG ARG A 89 5.607 -2.316 -5.455 1.00 0.00 C ATOM 1293 CD ARG A 89 6.263 -3.240 -4.421 1.00 0.00 C ATOM 1294 NE ARG A 89 6.201 -4.668 -4.770 1.00 0.00 N ATOM 1295 CZ ARG A 89 5.814 -5.658 -3.956 1.00 0.00 C ATOM 1296 NH1 ARG A 89 5.522 -5.443 -2.681 1.00 0.00 N ATOM 1297 NH2 ARG A 89 5.700 -6.885 -4.434 1.00 0.00 N ATOM 0 H ARG A 89 1.854 -0.527 -4.440 1.00 0.00 H new ATOM 0 HA ARG A 89 3.959 -0.314 -5.202 1.00 0.00 H new ATOM 0 HB2 ARG A 89 3.765 -2.759 -4.433 1.00 0.00 H new ATOM 0 HB3 ARG A 89 3.750 -3.162 -6.138 1.00 0.00 H new ATOM 0 HG2 ARG A 89 5.963 -2.576 -6.452 1.00 0.00 H new ATOM 0 HG3 ARG A 89 5.910 -1.286 -5.266 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.307 -2.951 -4.301 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.778 -3.091 -3.456 1.00 0.00 H new ATOM 0 HE ARG A 89 6.478 -4.927 -5.717 1.00 0.00 H new ATOM 0 HH11 ARG A 89 5.589 -4.502 -2.294 1.00 0.00 H new ATOM 0 HH12 ARG A 89 5.230 -6.219 -2.087 1.00 0.00 H new ATOM 0 HH21 ARG A 89 5.906 -7.071 -5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.406 -7.646 -3.821 1.00 0.00 H new ATOM 1311 N GLY A 90 3.717 -1.502 -8.138 1.00 0.00 N ATOM 1312 CA GLY A 90 3.760 -1.213 -9.564 1.00 0.00 C ATOM 1313 C GLY A 90 4.771 -0.119 -9.896 1.00 0.00 C ATOM 1314 O GLY A 90 4.384 0.926 -10.417 1.00 0.00 O ATOM 0 H GLY A 90 3.936 -2.475 -7.924 1.00 0.00 H new ATOM 0 HA2 GLY A 90 4.016 -2.121 -10.110 1.00 0.00 H new ATOM 0 HA3 GLY A 90 2.770 -0.906 -9.902 1.00 0.00 H new ATOM 1318 N SER A 91 6.051 -0.353 -9.590 1.00 0.00 N ATOM 1319 CA SER A 91 7.105 0.662 -9.700 1.00 0.00 C ATOM 1320 C SER A 91 8.407 0.125 -10.311 1.00 0.00 C ATOM 1321 O SER A 91 9.194 0.898 -10.864 1.00 0.00 O ATOM 1322 CB SER A 91 7.414 1.207 -8.297 1.00 0.00 C ATOM 1323 OG SER A 91 6.247 1.511 -7.554 1.00 0.00 O ATOM 0 H SER A 91 6.387 -1.257 -9.257 1.00 0.00 H new ATOM 0 HA SER A 91 6.731 1.439 -10.367 1.00 0.00 H new ATOM 0 HB2 SER A 91 8.006 0.473 -7.750 1.00 0.00 H new ATOM 0 HB3 SER A 91 8.025 2.105 -8.388 1.00 0.00 H new ATOM 0 HG SER A 91 6.501 1.852 -6.671 1.00 0.00 H new ATOM 1329 N GLY A 92 8.668 -1.179 -10.186 1.00 0.00 N ATOM 1330 CA GLY A 92 9.952 -1.810 -10.472 1.00 0.00 C ATOM 1331 C GLY A 92 11.120 -1.222 -9.664 1.00 0.00 C ATOM 1332 O GLY A 92 10.956 -0.258 -8.908 1.00 0.00 O ATOM 0 H GLY A 92 7.963 -1.845 -9.871 1.00 0.00 H new ATOM 0 HA2 GLY A 92 9.877 -2.877 -10.263 1.00 0.00 H new ATOM 0 HA3 GLY A 92 10.169 -1.708 -11.535 1.00 0.00 H new ATOM 1336 N PRO A 93 12.317 -1.816 -9.772 1.00 0.00 N ATOM 1337 CA PRO A 93 13.560 -1.217 -9.306 1.00 0.00 C ATOM 1338 C PRO A 93 14.119 -0.279 -10.390 1.00 0.00 C ATOM 1339 O PRO A 93 13.552 -0.182 -11.482 1.00 0.00 O ATOM 1340 CB PRO A 93 14.470 -2.419 -9.071 1.00 0.00 C ATOM 1341 CG PRO A 93 14.091 -3.343 -10.226 1.00 0.00 C ATOM 1342 CD PRO A 93 12.595 -3.085 -10.428 1.00 0.00 C ATOM 0 HA PRO A 93 13.450 -0.609 -8.408 1.00 0.00 H new ATOM 0 HB2 PRO A 93 15.524 -2.143 -9.100 1.00 0.00 H new ATOM 0 HB3 PRO A 93 14.288 -2.884 -8.102 1.00 0.00 H new ATOM 0 HG2 PRO A 93 14.661 -3.112 -11.126 1.00 0.00 H new ATOM 0 HG3 PRO A 93 14.287 -4.387 -9.983 1.00 0.00 H new ATOM 0 HD2 PRO A 93 12.346 -3.039 -11.488 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.998 -3.888 -9.995 1.00 0.00 H new ATOM 1350 N SER A 94 15.270 0.343 -10.126 1.00 0.00 N ATOM 1351 CA SER A 94 15.899 1.348 -10.972 1.00 0.00 C ATOM 1352 C SER A 94 14.913 2.458 -11.344 1.00 0.00 C ATOM 1353 O SER A 94 14.545 2.629 -12.512 1.00 0.00 O ATOM 1354 CB SER A 94 16.563 0.690 -12.185 1.00 0.00 C ATOM 1355 OG SER A 94 17.612 -0.185 -11.787 1.00 0.00 O ATOM 0 H SER A 94 15.808 0.149 -9.281 1.00 0.00 H new ATOM 0 HA SER A 94 16.695 1.836 -10.409 1.00 0.00 H new ATOM 0 HB2 SER A 94 15.818 0.133 -12.753 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.960 1.459 -12.847 1.00 0.00 H new ATOM 0 HG SER A 94 18.017 -0.593 -12.581 1.00 0.00 H new ATOM 1361 N SER A 95 14.510 3.228 -10.334 1.00 0.00 N ATOM 1362 CA SER A 95 14.106 4.619 -10.498 1.00 0.00 C ATOM 1363 C SER A 95 15.372 5.488 -10.637 1.00 0.00 C ATOM 1364 O SER A 95 16.501 4.982 -10.597 1.00 0.00 O ATOM 1365 CB SER A 95 13.243 5.001 -9.291 1.00 0.00 C ATOM 1366 OG SER A 95 12.518 6.201 -9.476 1.00 0.00 O ATOM 0 H SER A 95 14.455 2.898 -9.370 1.00 0.00 H new ATOM 0 HA SER A 95 13.512 4.776 -11.398 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.544 4.191 -9.083 1.00 0.00 H new ATOM 0 HB3 SER A 95 13.883 5.103 -8.414 1.00 0.00 H new ATOM 0 HG SER A 95 11.987 6.389 -8.674 1.00 0.00 H new ATOM 1372 N GLY A 96 15.199 6.792 -10.840 1.00 0.00 N ATOM 1373 CA GLY A 96 16.248 7.769 -11.101 1.00 0.00 C ATOM 1374 C GLY A 96 15.720 8.803 -12.073 1.00 0.00 C ATOM 1375 O GLY A 96 16.404 9.811 -12.328 1.00 0.00 O ATOM 0 H GLY A 96 14.272 7.216 -10.826 1.00 0.00 H new ATOM 0 HA2 GLY A 96 16.558 8.248 -10.172 1.00 0.00 H new ATOM 0 HA3 GLY A 96 17.128 7.277 -11.515 1.00 0.00 H new TER 1379 GLY A 96