USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 779 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 23 THR OG1 : rot -24:sc= 1.07 USER MOD Set 1.2: A 27 LYS NZ :NH3+ 176:sc= 1.23 (180deg=1.13) USER MOD Set 2.1: A 3 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 6 SER OG : rot 180:sc= 0 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 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.104 K(o=-0.1,f=-1.5!) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.0343 USER MOD Single : A 13 MET CE :methyl 172:sc= -0.0405 (180deg=-0.148) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 162:sc= 1.3 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ -118:sc= 1.31 (180deg=-0.206) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 36 CYS SG : rot 180:sc= 0.046 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.517 K(o=-0.52,f=-3.3!) USER MOD Single : A 51 SER OG : rot 180:sc= 0.00879 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -157:sc= -0.0593 (180deg=-1.2) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 173:sc= 0 (180deg=-0.0337) USER MOD Single : A 77 GLN : amide:sc= 0.633 K(o=0.63,f=-0.18) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= -0.0796 X(o=-0.08,f=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 GLN : amide:sc= 0.407 X(o=0.41,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0.111 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 109:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.246 -19.344 -25.672 1.00 0.00 N ATOM 2 CA GLY A 1 6.995 -18.046 -25.048 1.00 0.00 C ATOM 3 C GLY A 1 5.538 -17.971 -24.653 1.00 0.00 C ATOM 4 O GLY A 1 4.704 -17.642 -25.491 1.00 0.00 O ATOM 0 H1 GLY A 1 8.246 -19.408 -25.949 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.024 -20.103 -24.996 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.646 -19.445 -26.516 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.631 -17.919 -24.172 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.241 -17.240 -25.740 1.00 0.00 H new ATOM 8 N SER A 2 5.220 -18.284 -23.402 1.00 0.00 N ATOM 9 CA SER A 2 3.887 -18.244 -22.831 1.00 0.00 C ATOM 10 C SER A 2 4.066 -17.564 -21.472 1.00 0.00 C ATOM 11 O SER A 2 4.268 -18.233 -20.460 1.00 0.00 O ATOM 12 CB SER A 2 3.326 -19.678 -22.824 1.00 0.00 C ATOM 13 OG SER A 2 2.171 -19.852 -22.023 1.00 0.00 O ATOM 0 H SER A 2 5.923 -18.587 -22.728 1.00 0.00 H new ATOM 0 HA SER A 2 3.142 -17.673 -23.385 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.090 -19.967 -23.848 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.103 -20.357 -22.472 1.00 0.00 H new ATOM 0 HG SER A 2 1.876 -20.785 -22.072 1.00 0.00 H new ATOM 19 N SER A 3 4.062 -16.228 -21.502 1.00 0.00 N ATOM 20 CA SER A 3 4.395 -15.299 -20.428 1.00 0.00 C ATOM 21 C SER A 3 5.719 -15.631 -19.724 1.00 0.00 C ATOM 22 O SER A 3 5.802 -16.524 -18.883 1.00 0.00 O ATOM 23 CB SER A 3 3.215 -15.130 -19.465 1.00 0.00 C ATOM 24 OG SER A 3 3.270 -13.835 -18.894 1.00 0.00 O ATOM 0 H SER A 3 3.803 -15.730 -22.354 1.00 0.00 H new ATOM 0 HA SER A 3 4.573 -14.326 -20.887 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.273 -15.268 -19.995 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.255 -15.889 -18.683 1.00 0.00 H new ATOM 0 HG SER A 3 2.517 -13.717 -18.277 1.00 0.00 H new ATOM 30 N GLY A 4 6.772 -14.878 -20.051 1.00 0.00 N ATOM 31 CA GLY A 4 8.076 -15.019 -19.421 1.00 0.00 C ATOM 32 C GLY A 4 8.035 -14.734 -17.920 1.00 0.00 C ATOM 33 O GLY A 4 8.811 -15.314 -17.164 1.00 0.00 O ATOM 0 H GLY A 4 6.738 -14.151 -20.765 1.00 0.00 H new ATOM 0 HA2 GLY A 4 8.448 -16.030 -19.585 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.782 -14.339 -19.898 1.00 0.00 H new ATOM 37 N SER A 5 7.133 -13.856 -17.485 1.00 0.00 N ATOM 38 CA SER A 5 6.761 -13.662 -16.092 1.00 0.00 C ATOM 39 C SER A 5 5.470 -12.850 -16.099 1.00 0.00 C ATOM 40 O SER A 5 5.446 -11.765 -16.693 1.00 0.00 O ATOM 41 CB SER A 5 7.882 -12.982 -15.277 1.00 0.00 C ATOM 42 OG SER A 5 8.832 -12.265 -16.057 1.00 0.00 O ATOM 0 H SER A 5 6.625 -13.240 -18.119 1.00 0.00 H new ATOM 0 HA SER A 5 6.606 -14.620 -15.596 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.428 -12.296 -14.562 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.406 -13.744 -14.700 1.00 0.00 H new ATOM 0 HG SER A 5 9.504 -11.865 -15.467 1.00 0.00 H new ATOM 48 N SER A 6 4.396 -13.362 -15.509 1.00 0.00 N ATOM 49 CA SER A 6 3.177 -12.602 -15.260 1.00 0.00 C ATOM 50 C SER A 6 3.414 -11.528 -14.183 1.00 0.00 C ATOM 51 O SER A 6 4.520 -11.414 -13.640 1.00 0.00 O ATOM 52 CB SER A 6 2.058 -13.555 -14.835 1.00 0.00 C ATOM 53 OG SER A 6 1.931 -14.637 -15.733 1.00 0.00 O ATOM 0 H SER A 6 4.347 -14.328 -15.186 1.00 0.00 H new ATOM 0 HA SER A 6 2.882 -12.094 -16.178 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.262 -13.934 -13.834 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.115 -13.011 -14.784 1.00 0.00 H new ATOM 0 HG SER A 6 1.209 -15.228 -15.433 1.00 0.00 H new ATOM 59 N GLY A 7 2.393 -10.735 -13.842 1.00 0.00 N ATOM 60 CA GLY A 7 2.506 -9.723 -12.798 1.00 0.00 C ATOM 61 C GLY A 7 1.152 -9.179 -12.364 1.00 0.00 C ATOM 62 O GLY A 7 0.744 -8.111 -12.828 1.00 0.00 O ATOM 0 H GLY A 7 1.473 -10.779 -14.281 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.015 -10.151 -11.935 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.125 -8.902 -13.158 1.00 0.00 H new ATOM 66 N GLN A 8 0.471 -9.881 -11.460 1.00 0.00 N ATOM 67 CA GLN A 8 -0.754 -9.447 -10.790 1.00 0.00 C ATOM 68 C GLN A 8 -0.602 -9.711 -9.292 1.00 0.00 C ATOM 69 O GLN A 8 0.299 -10.442 -8.879 1.00 0.00 O ATOM 70 CB GLN A 8 -1.955 -10.229 -11.351 1.00 0.00 C ATOM 71 CG GLN A 8 -2.400 -9.746 -12.745 1.00 0.00 C ATOM 72 CD GLN A 8 -2.897 -10.881 -13.645 1.00 0.00 C ATOM 73 OE1 GLN A 8 -2.477 -12.027 -13.528 1.00 0.00 O ATOM 74 NE2 GLN A 8 -3.742 -10.606 -14.623 1.00 0.00 N ATOM 0 H GLN A 8 0.771 -10.809 -11.161 1.00 0.00 H new ATOM 0 HA GLN A 8 -0.925 -8.384 -10.961 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.697 -11.287 -11.406 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -2.793 -10.140 -10.659 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -3.193 -9.007 -12.631 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -1.565 -9.243 -13.232 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.101 -9.658 -14.735 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.035 -11.342 -15.266 1.00 0.00 H new ATOM 83 N TYR A 9 -1.513 -9.167 -8.479 1.00 0.00 N ATOM 84 CA TYR A 9 -1.494 -9.333 -7.026 1.00 0.00 C ATOM 85 C TYR A 9 -1.467 -10.796 -6.599 1.00 0.00 C ATOM 86 O TYR A 9 -0.864 -11.107 -5.581 1.00 0.00 O ATOM 87 CB TYR A 9 -2.696 -8.642 -6.368 1.00 0.00 C ATOM 88 CG TYR A 9 -4.030 -8.890 -7.046 1.00 0.00 C ATOM 89 CD1 TYR A 9 -4.467 -8.028 -8.070 1.00 0.00 C ATOM 90 CD2 TYR A 9 -4.847 -9.965 -6.646 1.00 0.00 C ATOM 91 CE1 TYR A 9 -5.713 -8.219 -8.686 1.00 0.00 C ATOM 92 CE2 TYR A 9 -6.110 -10.140 -7.235 1.00 0.00 C ATOM 93 CZ TYR A 9 -6.558 -9.260 -8.245 1.00 0.00 C ATOM 94 OH TYR A 9 -7.809 -9.408 -8.756 1.00 0.00 O ATOM 0 H TYR A 9 -2.288 -8.596 -8.815 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.570 -8.863 -6.688 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -2.765 -8.975 -5.332 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -2.511 -7.568 -6.346 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -3.836 -7.210 -8.385 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -4.503 -10.653 -5.888 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.024 -7.573 -9.494 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -6.743 -10.953 -6.913 1.00 0.00 H new ATOM 0 HH TYR A 9 -8.245 -10.178 -8.335 1.00 0.00 H new ATOM 104 N GLU A 10 -2.103 -11.691 -7.351 1.00 0.00 N ATOM 105 CA GLU A 10 -2.152 -13.119 -7.055 1.00 0.00 C ATOM 106 C GLU A 10 -0.774 -13.790 -7.144 1.00 0.00 C ATOM 107 O GLU A 10 -0.531 -14.801 -6.489 1.00 0.00 O ATOM 108 CB GLU A 10 -3.162 -13.798 -7.979 1.00 0.00 C ATOM 109 CG GLU A 10 -2.871 -13.607 -9.472 1.00 0.00 C ATOM 110 CD GLU A 10 -3.882 -14.379 -10.310 1.00 0.00 C ATOM 111 OE1 GLU A 10 -3.853 -15.631 -10.300 1.00 0.00 O ATOM 112 OE2 GLU A 10 -4.730 -13.736 -10.964 1.00 0.00 O ATOM 0 H GLU A 10 -2.609 -11.438 -8.200 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.475 -13.235 -6.020 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.181 -14.865 -7.757 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.157 -13.409 -7.761 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.912 -12.548 -9.725 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.862 -13.950 -9.700 1.00 0.00 H new ATOM 119 N LEU A 11 0.158 -13.225 -7.911 1.00 0.00 N ATOM 120 CA LEU A 11 1.560 -13.634 -7.893 1.00 0.00 C ATOM 121 C LEU A 11 2.129 -13.244 -6.526 1.00 0.00 C ATOM 122 O LEU A 11 2.577 -14.080 -5.736 1.00 0.00 O ATOM 123 CB LEU A 11 2.302 -12.961 -9.068 1.00 0.00 C ATOM 124 CG LEU A 11 3.656 -13.578 -9.469 1.00 0.00 C ATOM 125 CD1 LEU A 11 4.643 -13.785 -8.318 1.00 0.00 C ATOM 126 CD2 LEU A 11 3.445 -14.900 -10.205 1.00 0.00 C ATOM 0 H LEU A 11 -0.040 -12.468 -8.565 1.00 0.00 H new ATOM 0 HA LEU A 11 1.679 -14.709 -8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.648 -12.978 -9.940 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.466 -11.914 -8.813 1.00 0.00 H new ATOM 0 HG LEU A 11 4.115 -12.837 -10.124 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.564 -14.223 -8.703 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.865 -12.825 -7.852 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.204 -14.454 -7.578 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.412 -15.321 -10.481 1.00 0.00 H new ATOM 0 HD22 LEU A 11 2.917 -15.598 -9.555 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.856 -14.725 -11.105 1.00 0.00 H new ATOM 138 N TYR A 12 2.052 -11.947 -6.229 1.00 0.00 N ATOM 139 CA TYR A 12 2.639 -11.326 -5.049 1.00 0.00 C ATOM 140 C TYR A 12 1.951 -11.818 -3.770 1.00 0.00 C ATOM 141 O TYR A 12 2.445 -11.579 -2.675 1.00 0.00 O ATOM 142 CB TYR A 12 2.576 -9.785 -5.157 1.00 0.00 C ATOM 143 CG TYR A 12 2.764 -9.174 -6.545 1.00 0.00 C ATOM 144 CD1 TYR A 12 3.562 -9.806 -7.520 1.00 0.00 C ATOM 145 CD2 TYR A 12 2.092 -7.981 -6.881 1.00 0.00 C ATOM 146 CE1 TYR A 12 3.577 -9.340 -8.843 1.00 0.00 C ATOM 147 CE2 TYR A 12 2.176 -7.451 -8.183 1.00 0.00 C ATOM 148 CZ TYR A 12 2.901 -8.147 -9.176 1.00 0.00 C ATOM 149 OH TYR A 12 2.979 -7.676 -10.447 1.00 0.00 O ATOM 0 H TYR A 12 1.562 -11.280 -6.825 1.00 0.00 H new ATOM 0 HA TYR A 12 3.687 -11.619 -4.995 1.00 0.00 H new ATOM 0 HB2 TYR A 12 1.610 -9.459 -4.772 1.00 0.00 H new ATOM 0 HB3 TYR A 12 3.338 -9.369 -4.499 1.00 0.00 H new ATOM 0 HD1 TYR A 12 4.168 -10.657 -7.246 1.00 0.00 H new ATOM 0 HD2 TYR A 12 1.507 -7.468 -6.132 1.00 0.00 H new ATOM 0 HE1 TYR A 12 4.105 -9.893 -9.605 1.00 0.00 H new ATOM 0 HE2 TYR A 12 1.689 -6.517 -8.421 1.00 0.00 H new ATOM 0 HH TYR A 12 2.461 -6.848 -10.521 1.00 0.00 H new ATOM 159 N MET A 13 0.807 -12.500 -3.861 1.00 0.00 N ATOM 160 CA MET A 13 0.039 -13.011 -2.747 1.00 0.00 C ATOM 161 C MET A 13 0.836 -14.003 -1.908 1.00 0.00 C ATOM 162 O MET A 13 0.572 -14.129 -0.710 1.00 0.00 O ATOM 163 CB MET A 13 -1.214 -13.655 -3.328 1.00 0.00 C ATOM 164 CG MET A 13 -2.291 -13.856 -2.279 1.00 0.00 C ATOM 165 SD MET A 13 -2.933 -12.359 -1.460 1.00 0.00 S ATOM 166 CE MET A 13 -3.424 -11.324 -2.870 1.00 0.00 C ATOM 0 H MET A 13 0.379 -12.716 -4.761 1.00 0.00 H new ATOM 0 HA MET A 13 -0.222 -12.199 -2.069 1.00 0.00 H new ATOM 0 HB2 MET A 13 -1.603 -13.030 -4.131 1.00 0.00 H new ATOM 0 HB3 MET A 13 -0.955 -14.617 -3.770 1.00 0.00 H new ATOM 0 HG2 MET A 13 -3.129 -14.372 -2.747 1.00 0.00 H new ATOM 0 HG3 MET A 13 -1.896 -14.521 -1.510 1.00 0.00 H new ATOM 0 HE1 MET A 13 -3.960 -10.446 -2.508 1.00 0.00 H new ATOM 0 HE2 MET A 13 -2.535 -11.007 -3.416 1.00 0.00 H new ATOM 0 HE3 MET A 13 -4.072 -11.897 -3.533 1.00 0.00 H new ATOM 176 N TYR A 14 1.816 -14.667 -2.523 1.00 0.00 N ATOM 177 CA TYR A 14 2.625 -15.695 -1.888 1.00 0.00 C ATOM 178 C TYR A 14 4.103 -15.324 -1.922 1.00 0.00 C ATOM 179 O TYR A 14 4.820 -15.601 -0.963 1.00 0.00 O ATOM 180 CB TYR A 14 2.395 -17.041 -2.583 1.00 0.00 C ATOM 181 CG TYR A 14 0.945 -17.329 -2.922 1.00 0.00 C ATOM 182 CD1 TYR A 14 0.068 -17.857 -1.956 1.00 0.00 C ATOM 183 CD2 TYR A 14 0.470 -17.022 -4.209 1.00 0.00 C ATOM 184 CE1 TYR A 14 -1.288 -18.057 -2.273 1.00 0.00 C ATOM 185 CE2 TYR A 14 -0.883 -17.232 -4.530 1.00 0.00 C ATOM 186 CZ TYR A 14 -1.774 -17.726 -3.556 1.00 0.00 C ATOM 187 OH TYR A 14 -3.096 -17.863 -3.849 1.00 0.00 O ATOM 0 H TYR A 14 2.070 -14.498 -3.496 1.00 0.00 H new ATOM 0 HA TYR A 14 2.324 -15.777 -0.844 1.00 0.00 H new ATOM 0 HB2 TYR A 14 2.983 -17.068 -3.501 1.00 0.00 H new ATOM 0 HB3 TYR A 14 2.771 -17.837 -1.940 1.00 0.00 H new ATOM 0 HD1 TYR A 14 0.436 -18.108 -0.972 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.145 -16.624 -4.952 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -1.959 -18.465 -1.532 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.240 -17.014 -5.526 1.00 0.00 H new ATOM 0 HH TYR A 14 -3.256 -17.589 -4.776 1.00 0.00 H new ATOM 197 N ARG A 15 4.549 -14.726 -3.034 1.00 0.00 N ATOM 198 CA ARG A 15 5.932 -14.331 -3.269 1.00 0.00 C ATOM 199 C ARG A 15 6.294 -13.116 -2.396 1.00 0.00 C ATOM 200 O ARG A 15 5.542 -12.729 -1.501 1.00 0.00 O ATOM 201 CB ARG A 15 6.116 -14.117 -4.792 1.00 0.00 C ATOM 202 CG ARG A 15 7.356 -14.818 -5.378 1.00 0.00 C ATOM 203 CD ARG A 15 8.690 -14.283 -4.848 1.00 0.00 C ATOM 204 NE ARG A 15 9.845 -14.933 -5.482 1.00 0.00 N ATOM 205 CZ ARG A 15 10.753 -15.717 -4.887 1.00 0.00 C ATOM 206 NH1 ARG A 15 10.625 -16.129 -3.632 1.00 0.00 N ATOM 207 NH2 ARG A 15 11.828 -16.092 -5.560 1.00 0.00 N ATOM 0 H ARG A 15 3.934 -14.499 -3.815 1.00 0.00 H new ATOM 0 HA ARG A 15 6.635 -15.107 -2.968 1.00 0.00 H new ATOM 0 HB2 ARG A 15 5.228 -14.480 -5.309 1.00 0.00 H new ATOM 0 HB3 ARG A 15 6.187 -13.048 -4.992 1.00 0.00 H new ATOM 0 HG2 ARG A 15 7.293 -15.884 -5.161 1.00 0.00 H new ATOM 0 HG3 ARG A 15 7.340 -14.712 -6.463 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.742 -13.208 -5.020 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.737 -14.436 -3.770 1.00 0.00 H new ATOM 0 HE ARG A 15 9.968 -14.770 -6.481 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.812 -15.849 -3.084 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.340 -16.726 -3.216 1.00 0.00 H new ATOM 0 HH21 ARG A 15 11.960 -15.784 -6.523 1.00 0.00 H new ATOM 0 HH22 ARG A 15 12.525 -16.689 -5.116 1.00 0.00 H new ATOM 221 N GLU A 16 7.451 -12.509 -2.646 1.00 0.00 N ATOM 222 CA GLU A 16 8.023 -11.391 -1.913 1.00 0.00 C ATOM 223 C GLU A 16 8.396 -10.287 -2.888 1.00 0.00 C ATOM 224 O GLU A 16 8.546 -10.532 -4.085 1.00 0.00 O ATOM 225 CB GLU A 16 9.296 -11.832 -1.180 1.00 0.00 C ATOM 226 CG GLU A 16 9.080 -12.733 0.038 1.00 0.00 C ATOM 227 CD GLU A 16 10.384 -13.436 0.402 1.00 0.00 C ATOM 228 OE1 GLU A 16 11.264 -12.788 1.023 1.00 0.00 O ATOM 229 OE2 GLU A 16 10.548 -14.623 0.047 1.00 0.00 O ATOM 0 H GLU A 16 8.050 -12.807 -3.416 1.00 0.00 H new ATOM 0 HA GLU A 16 7.287 -11.035 -1.192 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.938 -12.356 -1.888 1.00 0.00 H new ATOM 0 HB3 GLU A 16 9.836 -10.941 -0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.729 -12.140 0.882 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.307 -13.471 -0.177 1.00 0.00 H new ATOM 236 N VAL A 17 8.616 -9.101 -2.327 1.00 0.00 N ATOM 237 CA VAL A 17 9.058 -7.888 -2.985 1.00 0.00 C ATOM 238 C VAL A 17 9.953 -7.153 -1.976 1.00 0.00 C ATOM 239 O VAL A 17 9.808 -7.345 -0.761 1.00 0.00 O ATOM 240 CB VAL A 17 7.808 -7.083 -3.417 1.00 0.00 C ATOM 241 CG1 VAL A 17 6.844 -6.848 -2.241 1.00 0.00 C ATOM 242 CG2 VAL A 17 8.147 -5.726 -4.048 1.00 0.00 C ATOM 0 H VAL A 17 8.478 -8.959 -1.326 1.00 0.00 H new ATOM 0 HA VAL A 17 9.636 -8.064 -3.892 1.00 0.00 H new ATOM 0 HB VAL A 17 7.327 -7.702 -4.174 1.00 0.00 H new ATOM 0 HG11 VAL A 17 5.980 -6.280 -2.586 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.512 -7.808 -1.845 1.00 0.00 H new ATOM 0 HG13 VAL A 17 7.356 -6.290 -1.457 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.226 -5.214 -4.328 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.696 -5.118 -3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.760 -5.881 -4.936 1.00 0.00 H new ATOM 252 N ASP A 18 10.870 -6.310 -2.445 1.00 0.00 N ATOM 253 CA ASP A 18 11.644 -5.414 -1.593 1.00 0.00 C ATOM 254 C ASP A 18 10.732 -4.265 -1.185 1.00 0.00 C ATOM 255 O ASP A 18 10.535 -3.334 -1.967 1.00 0.00 O ATOM 256 CB ASP A 18 12.848 -4.833 -2.341 1.00 0.00 C ATOM 257 CG ASP A 18 13.936 -5.852 -2.613 1.00 0.00 C ATOM 258 OD1 ASP A 18 14.696 -6.141 -1.657 1.00 0.00 O ATOM 259 OD2 ASP A 18 14.035 -6.291 -3.776 1.00 0.00 O ATOM 0 H ASP A 18 11.098 -6.230 -3.436 1.00 0.00 H new ATOM 0 HA ASP A 18 12.012 -5.971 -0.731 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.510 -4.412 -3.288 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.267 -4.012 -1.759 1.00 0.00 H new ATOM 264 N THR A 19 10.149 -4.297 0.014 1.00 0.00 N ATOM 265 CA THR A 19 9.291 -3.201 0.444 1.00 0.00 C ATOM 266 C THR A 19 10.065 -1.877 0.522 1.00 0.00 C ATOM 267 O THR A 19 9.471 -0.828 0.275 1.00 0.00 O ATOM 268 CB THR A 19 8.556 -3.551 1.748 1.00 0.00 C ATOM 269 OG1 THR A 19 9.359 -4.269 2.663 1.00 0.00 O ATOM 270 CG2 THR A 19 7.346 -4.433 1.449 1.00 0.00 C ATOM 0 H THR A 19 10.254 -5.054 0.689 1.00 0.00 H new ATOM 0 HA THR A 19 8.521 -3.053 -0.313 1.00 0.00 H new ATOM 0 HB THR A 19 8.273 -2.595 2.190 1.00 0.00 H new ATOM 0 HG1 THR A 19 8.962 -4.217 3.557 1.00 0.00 H new ATOM 0 HG21 THR A 19 6.833 -4.675 2.380 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.663 -3.902 0.786 1.00 0.00 H new ATOM 0 HG23 THR A 19 7.677 -5.353 0.967 1.00 0.00 H new ATOM 278 N LEU A 20 11.376 -1.885 0.794 1.00 0.00 N ATOM 279 CA LEU A 20 12.178 -0.676 0.742 1.00 0.00 C ATOM 280 C LEU A 20 12.189 -0.082 -0.664 1.00 0.00 C ATOM 281 O LEU A 20 11.774 1.065 -0.836 1.00 0.00 O ATOM 282 CB LEU A 20 13.608 -0.947 1.243 1.00 0.00 C ATOM 283 CG LEU A 20 13.889 -0.461 2.674 1.00 0.00 C ATOM 284 CD1 LEU A 20 13.604 1.039 2.855 1.00 0.00 C ATOM 285 CD2 LEU A 20 13.126 -1.279 3.721 1.00 0.00 C ATOM 0 H LEU A 20 11.897 -2.723 1.052 1.00 0.00 H new ATOM 0 HA LEU A 20 11.723 0.059 1.406 1.00 0.00 H new ATOM 0 HB2 LEU A 20 13.799 -2.019 1.194 1.00 0.00 H new ATOM 0 HB3 LEU A 20 14.313 -0.466 0.565 1.00 0.00 H new ATOM 0 HG LEU A 20 14.956 -0.616 2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.819 1.329 3.884 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.235 1.614 2.177 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.556 1.240 2.633 1.00 0.00 H new ATOM 0 HD21 LEU A 20 13.355 -0.900 4.717 1.00 0.00 H new ATOM 0 HD22 LEU A 20 12.055 -1.195 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 20 13.424 -2.325 3.654 1.00 0.00 H new ATOM 297 N GLU A 21 12.676 -0.835 -1.649 1.00 0.00 N ATOM 298 CA GLU A 21 12.853 -0.372 -3.014 1.00 0.00 C ATOM 299 C GLU A 21 11.506 -0.017 -3.641 1.00 0.00 C ATOM 300 O GLU A 21 11.420 0.982 -4.355 1.00 0.00 O ATOM 301 CB GLU A 21 13.618 -1.442 -3.808 1.00 0.00 C ATOM 302 CG GLU A 21 15.093 -1.077 -4.012 1.00 0.00 C ATOM 303 CD GLU A 21 15.783 -0.734 -2.692 1.00 0.00 C ATOM 304 OE1 GLU A 21 16.058 -1.637 -1.872 1.00 0.00 O ATOM 305 OE2 GLU A 21 16.012 0.465 -2.428 1.00 0.00 O ATOM 0 H GLU A 21 12.963 -1.804 -1.512 1.00 0.00 H new ATOM 0 HA GLU A 21 13.444 0.543 -3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.552 -2.396 -3.284 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.143 -1.578 -4.779 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.611 -1.910 -4.487 1.00 0.00 H new ATOM 0 HG3 GLU A 21 15.166 -0.228 -4.691 1.00 0.00 H new ATOM 312 N LEU A 22 10.445 -0.749 -3.289 1.00 0.00 N ATOM 313 CA LEU A 22 9.072 -0.405 -3.627 1.00 0.00 C ATOM 314 C LEU A 22 8.766 1.026 -3.197 1.00 0.00 C ATOM 315 O LEU A 22 8.433 1.852 -4.043 1.00 0.00 O ATOM 316 CB LEU A 22 8.113 -1.413 -2.976 1.00 0.00 C ATOM 317 CG LEU A 22 6.632 -1.006 -3.057 1.00 0.00 C ATOM 318 CD1 LEU A 22 6.156 -0.890 -4.503 1.00 0.00 C ATOM 319 CD2 LEU A 22 5.792 -2.029 -2.294 1.00 0.00 C ATOM 0 H LEU A 22 10.524 -1.612 -2.751 1.00 0.00 H new ATOM 0 HA LEU A 22 8.935 -0.458 -4.707 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.240 -2.383 -3.457 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.389 -1.538 -1.929 1.00 0.00 H new ATOM 0 HG LEU A 22 6.516 -0.022 -2.604 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.105 -0.601 -4.518 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.748 -0.135 -5.021 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.275 -1.851 -5.003 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.740 -1.748 -2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 22 5.927 -3.015 -2.739 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.109 -2.055 -1.251 1.00 0.00 H new ATOM 331 N THR A 23 8.863 1.341 -1.897 1.00 0.00 N ATOM 332 CA THR A 23 8.526 2.691 -1.443 1.00 0.00 C ATOM 333 C THR A 23 9.400 3.719 -2.157 1.00 0.00 C ATOM 334 O THR A 23 8.921 4.795 -2.487 1.00 0.00 O ATOM 335 CB THR A 23 8.656 2.860 0.073 1.00 0.00 C ATOM 336 OG1 THR A 23 9.968 2.646 0.557 1.00 0.00 O ATOM 337 CG2 THR A 23 7.670 1.947 0.788 1.00 0.00 C ATOM 0 H THR A 23 9.163 0.699 -1.164 1.00 0.00 H new ATOM 0 HA THR A 23 7.478 2.855 -1.694 1.00 0.00 H new ATOM 0 HB THR A 23 8.420 3.902 0.289 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.460 2.078 -0.072 1.00 0.00 H new ATOM 0 HG21 THR A 23 7.771 2.075 1.866 1.00 0.00 H new ATOM 0 HG22 THR A 23 6.654 2.201 0.486 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.878 0.910 0.525 1.00 0.00 H new ATOM 345 N ARG A 24 10.681 3.412 -2.374 1.00 0.00 N ATOM 346 CA ARG A 24 11.619 4.288 -3.087 1.00 0.00 C ATOM 347 C ARG A 24 11.109 4.635 -4.486 1.00 0.00 C ATOM 348 O ARG A 24 10.996 5.820 -4.802 1.00 0.00 O ATOM 349 CB ARG A 24 13.037 3.703 -3.058 1.00 0.00 C ATOM 350 CG ARG A 24 13.693 4.164 -1.746 1.00 0.00 C ATOM 351 CD ARG A 24 14.539 3.110 -1.054 1.00 0.00 C ATOM 352 NE ARG A 24 15.900 3.008 -1.595 1.00 0.00 N ATOM 353 CZ ARG A 24 17.040 3.437 -1.045 1.00 0.00 C ATOM 354 NH1 ARG A 24 17.032 4.129 0.087 1.00 0.00 N ATOM 355 NH2 ARG A 24 18.195 3.156 -1.629 1.00 0.00 N ATOM 0 H ARG A 24 11.103 2.539 -2.057 1.00 0.00 H new ATOM 0 HA ARG A 24 11.680 5.243 -2.565 1.00 0.00 H new ATOM 0 HB2 ARG A 24 13.005 2.615 -3.110 1.00 0.00 H new ATOM 0 HB3 ARG A 24 13.613 4.047 -3.917 1.00 0.00 H new ATOM 0 HG2 ARG A 24 14.318 5.033 -1.954 1.00 0.00 H new ATOM 0 HG3 ARG A 24 12.911 4.490 -1.060 1.00 0.00 H new ATOM 0 HD2 ARG A 24 14.595 3.341 0.010 1.00 0.00 H new ATOM 0 HD3 ARG A 24 14.046 2.142 -1.145 1.00 0.00 H new ATOM 0 HE ARG A 24 15.986 2.553 -2.504 1.00 0.00 H new ATOM 0 HH11 ARG A 24 16.148 4.340 0.549 1.00 0.00 H new ATOM 0 HH12 ARG A 24 17.910 4.450 0.495 1.00 0.00 H new ATOM 0 HH21 ARG A 24 18.211 2.615 -2.494 1.00 0.00 H new ATOM 0 HH22 ARG A 24 19.068 3.481 -1.214 1.00 0.00 H new ATOM 369 N GLN A 25 10.751 3.640 -5.298 1.00 0.00 N ATOM 370 CA GLN A 25 10.179 3.875 -6.622 1.00 0.00 C ATOM 371 C GLN A 25 8.879 4.678 -6.527 1.00 0.00 C ATOM 372 O GLN A 25 8.658 5.571 -7.350 1.00 0.00 O ATOM 373 CB GLN A 25 9.947 2.542 -7.348 1.00 0.00 C ATOM 374 CG GLN A 25 11.261 1.833 -7.703 1.00 0.00 C ATOM 375 CD GLN A 25 11.422 1.635 -9.205 1.00 0.00 C ATOM 376 OE1 GLN A 25 11.089 0.589 -9.742 1.00 0.00 O ATOM 377 NE2 GLN A 25 11.927 2.619 -9.930 1.00 0.00 N ATOM 0 H GLN A 25 10.849 2.654 -5.057 1.00 0.00 H new ATOM 0 HA GLN A 25 10.890 4.464 -7.201 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.343 1.889 -6.718 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.377 2.722 -8.259 1.00 0.00 H new ATOM 0 HG2 GLN A 25 12.100 2.416 -7.323 1.00 0.00 H new ATOM 0 HG3 GLN A 25 11.295 0.864 -7.205 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.205 3.492 -9.482 1.00 0.00 H new ATOM 0 HE22 GLN A 25 12.039 2.505 -10.937 1.00 0.00 H new ATOM 386 N VAL A 26 8.029 4.371 -5.544 1.00 0.00 N ATOM 387 CA VAL A 26 6.743 5.030 -5.352 1.00 0.00 C ATOM 388 C VAL A 26 6.962 6.510 -5.017 1.00 0.00 C ATOM 389 O VAL A 26 6.372 7.367 -5.671 1.00 0.00 O ATOM 390 CB VAL A 26 5.929 4.286 -4.274 1.00 0.00 C ATOM 391 CG1 VAL A 26 4.656 5.036 -3.863 1.00 0.00 C ATOM 392 CG2 VAL A 26 5.535 2.891 -4.772 1.00 0.00 C ATOM 0 H VAL A 26 8.221 3.647 -4.852 1.00 0.00 H new ATOM 0 HA VAL A 26 6.161 4.994 -6.273 1.00 0.00 H new ATOM 0 HB VAL A 26 6.576 4.215 -3.400 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.126 4.463 -3.102 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.923 6.013 -3.461 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.013 5.165 -4.733 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.961 2.378 -4.000 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.929 2.984 -5.673 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.434 2.318 -4.997 1.00 0.00 H new ATOM 402 N LYS A 27 7.806 6.830 -4.023 1.00 0.00 N ATOM 403 CA LYS A 27 8.143 8.193 -3.626 1.00 0.00 C ATOM 404 C LYS A 27 8.566 9.000 -4.842 1.00 0.00 C ATOM 405 O LYS A 27 8.054 10.107 -5.013 1.00 0.00 O ATOM 406 CB LYS A 27 9.250 8.169 -2.558 1.00 0.00 C ATOM 407 CG LYS A 27 8.685 7.747 -1.194 1.00 0.00 C ATOM 408 CD LYS A 27 9.764 7.541 -0.123 1.00 0.00 C ATOM 409 CE LYS A 27 10.571 6.252 -0.312 1.00 0.00 C ATOM 410 NZ LYS A 27 11.393 5.882 0.862 1.00 0.00 N ATOM 0 H LYS A 27 8.282 6.123 -3.462 1.00 0.00 H new ATOM 0 HA LYS A 27 7.265 8.672 -3.193 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.037 7.478 -2.860 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.705 9.156 -2.478 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.983 8.506 -0.850 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.121 6.822 -1.313 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.445 8.392 -0.135 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.292 7.525 0.859 1.00 0.00 H new ATOM 0 HE2 LYS A 27 9.885 5.435 -0.535 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.223 6.367 -1.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 11.856 4.967 0.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.117 6.612 1.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 10.784 5.807 1.702 1.00 0.00 H new ATOM 424 N GLU A 28 9.427 8.429 -5.685 1.00 0.00 N ATOM 425 CA GLU A 28 9.829 9.015 -6.953 1.00 0.00 C ATOM 426 C GLU A 28 8.609 9.322 -7.822 1.00 0.00 C ATOM 427 O GLU A 28 8.358 10.488 -8.111 1.00 0.00 O ATOM 428 CB GLU A 28 10.831 8.088 -7.669 1.00 0.00 C ATOM 429 CG GLU A 28 12.264 8.622 -7.602 1.00 0.00 C ATOM 430 CD GLU A 28 12.472 9.787 -8.573 1.00 0.00 C ATOM 431 OE1 GLU A 28 11.922 10.888 -8.337 1.00 0.00 O ATOM 432 OE2 GLU A 28 13.237 9.623 -9.548 1.00 0.00 O ATOM 0 H GLU A 28 9.870 7.530 -5.497 1.00 0.00 H new ATOM 0 HA GLU A 28 10.330 9.964 -6.763 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.793 7.097 -7.217 1.00 0.00 H new ATOM 0 HB3 GLU A 28 10.536 7.974 -8.712 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.485 8.949 -6.586 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.964 7.820 -7.838 1.00 0.00 H new ATOM 439 N LYS A 29 7.830 8.313 -8.233 1.00 0.00 N ATOM 440 CA LYS A 29 6.720 8.519 -9.172 1.00 0.00 C ATOM 441 C LYS A 29 5.695 9.518 -8.627 1.00 0.00 C ATOM 442 O LYS A 29 5.125 10.297 -9.392 1.00 0.00 O ATOM 443 CB LYS A 29 6.090 7.178 -9.559 1.00 0.00 C ATOM 444 CG LYS A 29 5.033 7.346 -10.669 1.00 0.00 C ATOM 445 CD LYS A 29 4.781 6.027 -11.411 1.00 0.00 C ATOM 446 CE LYS A 29 5.356 6.073 -12.833 1.00 0.00 C ATOM 447 NZ LYS A 29 5.385 4.749 -13.481 1.00 0.00 N ATOM 0 H LYS A 29 7.948 7.346 -7.930 1.00 0.00 H new ATOM 0 HA LYS A 29 7.118 8.965 -10.083 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.868 6.494 -9.898 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.628 6.726 -8.681 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.100 7.703 -10.233 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.365 8.105 -11.377 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.234 5.204 -10.859 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.710 5.830 -11.455 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.760 6.756 -13.439 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.368 6.477 -12.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.369 4.488 -13.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.970 4.041 -12.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.836 4.783 -14.364 1.00 0.00 H new ATOM 461 N LEU A 30 5.449 9.520 -7.315 1.00 0.00 N ATOM 462 CA LEU A 30 4.583 10.503 -6.678 1.00 0.00 C ATOM 463 C LEU A 30 5.188 11.892 -6.840 1.00 0.00 C ATOM 464 O LEU A 30 4.534 12.760 -7.415 1.00 0.00 O ATOM 465 CB LEU A 30 4.348 10.163 -5.197 1.00 0.00 C ATOM 466 CG LEU A 30 3.500 8.893 -4.987 1.00 0.00 C ATOM 467 CD1 LEU A 30 3.547 8.487 -3.516 1.00 0.00 C ATOM 468 CD2 LEU A 30 2.035 9.088 -5.391 1.00 0.00 C ATOM 0 H LEU A 30 5.846 8.839 -6.668 1.00 0.00 H new ATOM 0 HA LEU A 30 3.608 10.485 -7.166 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.312 10.033 -4.705 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.854 11.005 -4.713 1.00 0.00 H new ATOM 0 HG LEU A 30 3.925 8.118 -5.625 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.947 7.589 -3.367 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.579 8.287 -3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.149 9.295 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.485 8.162 -5.222 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.596 9.886 -4.792 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.981 9.355 -6.446 1.00 0.00 H new ATOM 480 N ALA A 31 6.419 12.098 -6.361 1.00 0.00 N ATOM 481 CA ALA A 31 7.096 13.390 -6.367 1.00 0.00 C ATOM 482 C ALA A 31 7.236 13.946 -7.780 1.00 0.00 C ATOM 483 O ALA A 31 7.039 15.141 -7.976 1.00 0.00 O ATOM 484 CB ALA A 31 8.476 13.265 -5.722 1.00 0.00 C ATOM 0 H ALA A 31 6.981 11.352 -5.950 1.00 0.00 H new ATOM 0 HA ALA A 31 6.485 14.084 -5.791 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.972 14.236 -5.732 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.367 12.924 -4.692 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.075 12.546 -6.281 1.00 0.00 H new ATOM 490 N LYS A 32 7.520 13.091 -8.764 1.00 0.00 N ATOM 491 CA LYS A 32 7.633 13.431 -10.178 1.00 0.00 C ATOM 492 C LYS A 32 6.445 14.281 -10.617 1.00 0.00 C ATOM 493 O LYS A 32 6.625 15.376 -11.148 1.00 0.00 O ATOM 494 CB LYS A 32 7.714 12.122 -10.978 1.00 0.00 C ATOM 495 CG LYS A 32 8.153 12.345 -12.425 1.00 0.00 C ATOM 496 CD LYS A 32 7.794 11.131 -13.290 1.00 0.00 C ATOM 497 CE LYS A 32 8.812 10.877 -14.402 1.00 0.00 C ATOM 498 NZ LYS A 32 8.965 11.998 -15.349 1.00 0.00 N ATOM 0 H LYS A 32 7.684 12.100 -8.586 1.00 0.00 H new ATOM 0 HA LYS A 32 8.532 14.021 -10.358 1.00 0.00 H new ATOM 0 HB2 LYS A 32 8.415 11.445 -10.490 1.00 0.00 H new ATOM 0 HB3 LYS A 32 6.740 11.634 -10.969 1.00 0.00 H new ATOM 0 HG2 LYS A 32 7.671 13.238 -12.824 1.00 0.00 H new ATOM 0 HG3 LYS A 32 9.228 12.520 -12.462 1.00 0.00 H new ATOM 0 HD2 LYS A 32 7.725 10.246 -12.657 1.00 0.00 H new ATOM 0 HD3 LYS A 32 6.809 11.284 -13.732 1.00 0.00 H new ATOM 0 HE2 LYS A 32 9.781 10.663 -13.951 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.514 9.986 -14.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.671 11.749 -16.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 8.052 12.191 -15.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 9.280 12.846 -14.835 1.00 0.00 H new ATOM 512 N ASN A 33 5.233 13.794 -10.347 1.00 0.00 N ATOM 513 CA ASN A 33 3.987 14.469 -10.697 1.00 0.00 C ATOM 514 C ASN A 33 3.457 15.307 -9.529 1.00 0.00 C ATOM 515 O ASN A 33 2.331 15.794 -9.582 1.00 0.00 O ATOM 516 CB ASN A 33 2.962 13.452 -11.225 1.00 0.00 C ATOM 517 CG ASN A 33 3.423 12.829 -12.539 1.00 0.00 C ATOM 518 OD1 ASN A 33 3.829 13.526 -13.463 1.00 0.00 O ATOM 519 ND2 ASN A 33 3.433 11.513 -12.630 1.00 0.00 N ATOM 0 H ASN A 33 5.090 12.904 -9.871 1.00 0.00 H new ATOM 0 HA ASN A 33 4.182 15.176 -11.504 1.00 0.00 H new ATOM 0 HB2 ASN A 33 2.809 12.668 -10.483 1.00 0.00 H new ATOM 0 HB3 ASN A 33 2.001 13.944 -11.371 1.00 0.00 H new ATOM 0 HD21 ASN A 33 3.781 11.063 -13.476 1.00 0.00 H new ATOM 0 HD22 ASN A 33 3.092 10.946 -11.854 1.00 0.00 H new ATOM 526 N GLY A 34 4.257 15.536 -8.483 1.00 0.00 N ATOM 527 CA GLY A 34 3.916 16.392 -7.354 1.00 0.00 C ATOM 528 C GLY A 34 2.757 15.853 -6.521 1.00 0.00 C ATOM 529 O GLY A 34 2.112 16.624 -5.810 1.00 0.00 O ATOM 0 H GLY A 34 5.184 15.117 -8.401 1.00 0.00 H new ATOM 0 HA2 GLY A 34 4.792 16.506 -6.715 1.00 0.00 H new ATOM 0 HA3 GLY A 34 3.659 17.385 -7.723 1.00 0.00 H new ATOM 533 N ILE A 35 2.449 14.558 -6.624 1.00 0.00 N ATOM 534 CA ILE A 35 1.296 13.967 -5.967 1.00 0.00 C ATOM 535 C ILE A 35 1.552 13.988 -4.463 1.00 0.00 C ATOM 536 O ILE A 35 2.536 13.436 -3.957 1.00 0.00 O ATOM 537 CB ILE A 35 0.984 12.552 -6.501 1.00 0.00 C ATOM 538 CG1 ILE A 35 0.754 12.631 -8.025 1.00 0.00 C ATOM 539 CG2 ILE A 35 -0.251 11.968 -5.783 1.00 0.00 C ATOM 540 CD1 ILE A 35 0.267 11.332 -8.672 1.00 0.00 C ATOM 0 H ILE A 35 2.998 13.893 -7.169 1.00 0.00 H new ATOM 0 HA ILE A 35 0.402 14.550 -6.188 1.00 0.00 H new ATOM 0 HB ILE A 35 1.826 11.888 -6.302 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.025 13.416 -8.227 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.686 12.931 -8.503 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -0.459 10.970 -6.170 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.055 11.909 -4.712 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.113 12.612 -5.959 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.134 11.486 -9.743 1.00 0.00 H new ATOM 0 HD12 ILE A 35 1.003 10.545 -8.507 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.684 11.038 -8.227 1.00 0.00 H new ATOM 552 N CYS A 36 0.624 14.614 -3.750 1.00 0.00 N ATOM 553 CA CYS A 36 0.522 14.593 -2.310 1.00 0.00 C ATOM 554 C CYS A 36 0.320 13.139 -1.880 1.00 0.00 C ATOM 555 O CYS A 36 -0.732 12.555 -2.162 1.00 0.00 O ATOM 556 CB CYS A 36 -0.669 15.466 -1.913 1.00 0.00 C ATOM 557 SG CYS A 36 -0.448 17.138 -2.585 1.00 0.00 S ATOM 0 H CYS A 36 -0.108 15.174 -4.187 1.00 0.00 H new ATOM 0 HA CYS A 36 1.417 14.982 -1.824 1.00 0.00 H new ATOM 0 HB2 CYS A 36 -1.594 15.031 -2.291 1.00 0.00 H new ATOM 0 HB3 CYS A 36 -0.756 15.508 -0.827 1.00 0.00 H new ATOM 0 HG CYS A 36 -1.462 17.878 -2.249 1.00 0.00 H new ATOM 563 N GLN A 37 1.332 12.549 -1.234 1.00 0.00 N ATOM 564 CA GLN A 37 1.338 11.153 -0.790 1.00 0.00 C ATOM 565 C GLN A 37 0.035 10.796 -0.065 1.00 0.00 C ATOM 566 O GLN A 37 -0.500 9.714 -0.288 1.00 0.00 O ATOM 567 CB GLN A 37 2.549 10.910 0.125 1.00 0.00 C ATOM 568 CG GLN A 37 3.899 10.863 -0.610 1.00 0.00 C ATOM 569 CD GLN A 37 5.068 11.126 0.339 1.00 0.00 C ATOM 570 OE1 GLN A 37 5.107 10.663 1.477 1.00 0.00 O ATOM 571 NE2 GLN A 37 6.078 11.862 -0.078 1.00 0.00 N ATOM 0 H GLN A 37 2.192 13.044 -1.000 1.00 0.00 H new ATOM 0 HA GLN A 37 1.414 10.509 -1.666 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.585 11.698 0.877 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.405 9.969 0.656 1.00 0.00 H new ATOM 0 HG2 GLN A 37 4.024 9.887 -1.080 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.905 11.605 -1.409 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.067 12.257 -1.019 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.871 12.037 0.540 1.00 0.00 H new ATOM 580 N ARG A 38 -0.505 11.727 0.728 1.00 0.00 N ATOM 581 CA ARG A 38 -1.765 11.597 1.447 1.00 0.00 C ATOM 582 C ARG A 38 -2.901 11.130 0.557 1.00 0.00 C ATOM 583 O ARG A 38 -3.654 10.244 0.935 1.00 0.00 O ATOM 584 CB ARG A 38 -2.109 12.957 2.070 1.00 0.00 C ATOM 585 CG ARG A 38 -3.346 12.913 2.964 1.00 0.00 C ATOM 586 CD ARG A 38 -4.590 13.516 2.301 1.00 0.00 C ATOM 587 NE ARG A 38 -4.472 14.968 2.054 1.00 0.00 N ATOM 588 CZ ARG A 38 -4.399 15.925 2.990 1.00 0.00 C ATOM 589 NH1 ARG A 38 -4.567 15.621 4.278 1.00 0.00 N ATOM 590 NH2 ARG A 38 -4.166 17.186 2.639 1.00 0.00 N ATOM 0 H ARG A 38 -0.053 12.627 0.889 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.642 10.835 2.217 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -1.258 13.307 2.655 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -2.270 13.684 1.274 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.553 11.878 3.237 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.138 13.451 3.889 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -4.772 13.007 1.355 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.457 13.331 2.935 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.443 15.271 1.080 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.752 14.657 4.555 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -4.510 16.353 4.986 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.042 17.427 1.656 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.111 17.912 3.353 1.00 0.00 H new ATOM 604 N ILE A 39 -3.095 11.768 -0.593 1.00 0.00 N ATOM 605 CA ILE A 39 -4.268 11.488 -1.408 1.00 0.00 C ATOM 606 C ILE A 39 -4.047 10.177 -2.151 1.00 0.00 C ATOM 607 O ILE A 39 -4.993 9.417 -2.322 1.00 0.00 O ATOM 608 CB ILE A 39 -4.512 12.648 -2.384 1.00 0.00 C ATOM 609 CG1 ILE A 39 -4.889 13.925 -1.616 1.00 0.00 C ATOM 610 CG2 ILE A 39 -5.606 12.302 -3.410 1.00 0.00 C ATOM 611 CD1 ILE A 39 -4.726 15.161 -2.491 1.00 0.00 C ATOM 0 H ILE A 39 -2.464 12.472 -0.976 1.00 0.00 H new ATOM 0 HA ILE A 39 -5.153 11.391 -0.779 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.584 12.822 -2.929 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -5.920 13.854 -1.271 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -4.262 14.018 -0.730 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.752 13.146 -4.084 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.303 11.427 -3.984 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.539 12.088 -2.889 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.000 16.049 -1.921 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.688 15.243 -2.815 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.373 15.077 -3.364 1.00 0.00 H new ATOM 623 N PHE A 40 -2.819 9.882 -2.582 1.00 0.00 N ATOM 624 CA PHE A 40 -2.509 8.570 -3.130 1.00 0.00 C ATOM 625 C PHE A 40 -2.889 7.497 -2.111 1.00 0.00 C ATOM 626 O PHE A 40 -3.583 6.534 -2.433 1.00 0.00 O ATOM 627 CB PHE A 40 -1.021 8.502 -3.472 1.00 0.00 C ATOM 628 CG PHE A 40 -0.507 7.096 -3.714 1.00 0.00 C ATOM 629 CD1 PHE A 40 -1.081 6.288 -4.714 1.00 0.00 C ATOM 630 CD2 PHE A 40 0.533 6.586 -2.914 1.00 0.00 C ATOM 631 CE1 PHE A 40 -0.601 4.985 -4.924 1.00 0.00 C ATOM 632 CE2 PHE A 40 1.027 5.291 -3.141 1.00 0.00 C ATOM 633 CZ PHE A 40 0.462 4.494 -4.149 1.00 0.00 C ATOM 0 H PHE A 40 -2.032 10.531 -2.561 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.079 8.398 -4.043 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -0.835 9.104 -4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -0.451 8.951 -2.659 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.890 6.670 -5.319 1.00 0.00 H new ATOM 0 HD2 PHE A 40 0.952 7.192 -2.124 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.050 4.360 -5.682 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.840 4.909 -2.541 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.846 3.501 -4.329 1.00 0.00 H new ATOM 643 N GLY A 41 -2.460 7.702 -0.869 1.00 0.00 N ATOM 644 CA GLY A 41 -2.817 6.865 0.255 1.00 0.00 C ATOM 645 C GLY A 41 -4.326 6.756 0.446 1.00 0.00 C ATOM 646 O GLY A 41 -4.817 5.644 0.605 1.00 0.00 O ATOM 0 H GLY A 41 -1.841 8.473 -0.618 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.400 5.869 0.109 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.367 7.269 1.162 1.00 0.00 H new ATOM 650 N GLU A 42 -5.068 7.863 0.417 1.00 0.00 N ATOM 651 CA GLU A 42 -6.495 7.882 0.681 1.00 0.00 C ATOM 652 C GLU A 42 -7.244 7.136 -0.423 1.00 0.00 C ATOM 653 O GLU A 42 -7.969 6.177 -0.159 1.00 0.00 O ATOM 654 CB GLU A 42 -6.960 9.324 0.956 1.00 0.00 C ATOM 655 CG GLU A 42 -7.557 10.106 -0.195 1.00 0.00 C ATOM 656 CD GLU A 42 -8.071 11.486 0.213 1.00 0.00 C ATOM 657 OE1 GLU A 42 -7.265 12.363 0.594 1.00 0.00 O ATOM 658 OE2 GLU A 42 -9.298 11.711 0.105 1.00 0.00 O ATOM 0 H GLU A 42 -4.682 8.783 0.205 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.735 7.335 1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.699 9.290 1.757 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.105 9.885 1.334 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.804 10.222 -0.975 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -8.378 9.533 -0.627 1.00 0.00 H new ATOM 665 N LYS A 43 -7.036 7.572 -1.664 1.00 0.00 N ATOM 666 CA LYS A 43 -7.678 7.074 -2.875 1.00 0.00 C ATOM 667 C LYS A 43 -7.334 5.607 -3.082 1.00 0.00 C ATOM 668 O LYS A 43 -8.236 4.797 -3.292 1.00 0.00 O ATOM 669 CB LYS A 43 -7.200 7.878 -4.102 1.00 0.00 C ATOM 670 CG LYS A 43 -7.734 9.316 -4.216 1.00 0.00 C ATOM 671 CD LYS A 43 -9.060 9.400 -4.985 1.00 0.00 C ATOM 672 CE LYS A 43 -9.394 10.860 -5.328 1.00 0.00 C ATOM 673 NZ LYS A 43 -10.431 11.433 -4.448 1.00 0.00 N ATOM 0 H LYS A 43 -6.377 8.325 -1.860 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.756 7.187 -2.763 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.111 7.916 -4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.485 7.333 -5.002 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.873 9.727 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -6.990 9.936 -4.716 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.994 8.812 -5.900 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.862 8.969 -4.386 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.488 11.462 -5.254 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.731 10.917 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.616 12.418 -4.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.306 10.879 -4.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -10.103 11.407 -3.462 1.00 0.00 H new ATOM 687 N VAL A 44 -6.045 5.283 -3.148 1.00 0.00 N ATOM 688 CA VAL A 44 -5.597 4.014 -3.694 1.00 0.00 C ATOM 689 C VAL A 44 -5.399 3.024 -2.552 1.00 0.00 C ATOM 690 O VAL A 44 -5.925 1.914 -2.628 1.00 0.00 O ATOM 691 CB VAL A 44 -4.334 4.205 -4.565 1.00 0.00 C ATOM 692 CG1 VAL A 44 -3.947 2.885 -5.239 1.00 0.00 C ATOM 693 CG2 VAL A 44 -4.542 5.263 -5.664 1.00 0.00 C ATOM 0 H VAL A 44 -5.291 5.890 -2.826 1.00 0.00 H new ATOM 0 HA VAL A 44 -6.354 3.601 -4.361 1.00 0.00 H new ATOM 0 HB VAL A 44 -3.542 4.543 -3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.056 3.035 -5.849 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.742 2.133 -4.477 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.767 2.546 -5.872 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.629 5.363 -6.250 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -5.360 4.955 -6.316 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.785 6.221 -5.205 1.00 0.00 H new ATOM 703 N LEU A 45 -4.614 3.380 -1.528 1.00 0.00 N ATOM 704 CA LEU A 45 -4.216 2.407 -0.507 1.00 0.00 C ATOM 705 C LEU A 45 -5.289 2.263 0.588 1.00 0.00 C ATOM 706 O LEU A 45 -5.275 1.275 1.331 1.00 0.00 O ATOM 707 CB LEU A 45 -2.853 2.754 0.124 1.00 0.00 C ATOM 708 CG LEU A 45 -1.660 3.095 -0.802 1.00 0.00 C ATOM 709 CD1 LEU A 45 -0.346 2.847 -0.051 1.00 0.00 C ATOM 710 CD2 LEU A 45 -1.575 2.297 -2.102 1.00 0.00 C ATOM 0 H LEU A 45 -4.247 4.321 -1.386 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.115 1.449 -1.017 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.006 3.604 0.790 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.555 1.911 0.747 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.824 4.137 -1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.495 3.086 -0.701 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.310 3.478 0.837 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.289 1.800 0.246 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.702 2.619 -2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.487 1.235 -1.872 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.475 2.467 -2.693 1.00 0.00 H new ATOM 722 N GLY A 46 -6.203 3.233 0.697 1.00 0.00 N ATOM 723 CA GLY A 46 -7.282 3.274 1.670 1.00 0.00 C ATOM 724 C GLY A 46 -6.847 3.784 3.048 1.00 0.00 C ATOM 725 O GLY A 46 -7.508 3.439 4.031 1.00 0.00 O ATOM 0 H GLY A 46 -6.204 4.044 0.078 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -8.078 3.914 1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.701 2.274 1.778 1.00 0.00 H new ATOM 729 N LEU A 47 -5.751 4.549 3.169 1.00 0.00 N ATOM 730 CA LEU A 47 -5.107 4.863 4.455 1.00 0.00 C ATOM 731 C LEU A 47 -4.978 6.372 4.712 1.00 0.00 C ATOM 732 O LEU A 47 -4.929 7.171 3.773 1.00 0.00 O ATOM 733 CB LEU A 47 -3.707 4.224 4.507 1.00 0.00 C ATOM 734 CG LEU A 47 -3.652 2.694 4.331 1.00 0.00 C ATOM 735 CD1 LEU A 47 -2.203 2.232 4.509 1.00 0.00 C ATOM 736 CD2 LEU A 47 -4.520 1.928 5.334 1.00 0.00 C ATOM 0 H LEU A 47 -5.282 4.972 2.368 1.00 0.00 H new ATOM 0 HA LEU A 47 -5.750 4.453 5.234 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.093 4.681 3.731 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -3.251 4.476 5.464 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.039 2.479 3.335 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.148 1.150 4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.573 2.714 3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.855 2.503 5.506 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.431 0.857 5.149 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.187 2.150 6.348 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.561 2.230 5.220 1.00 0.00 H new ATOM 748 N SER A 48 -4.832 6.749 5.988 1.00 0.00 N ATOM 749 CA SER A 48 -4.565 8.111 6.438 1.00 0.00 C ATOM 750 C SER A 48 -3.148 8.570 6.084 1.00 0.00 C ATOM 751 O SER A 48 -2.280 7.762 5.733 1.00 0.00 O ATOM 752 CB SER A 48 -4.749 8.195 7.956 1.00 0.00 C ATOM 753 OG SER A 48 -6.120 8.175 8.277 1.00 0.00 O ATOM 0 H SER A 48 -4.900 6.086 6.760 1.00 0.00 H new ATOM 0 HA SER A 48 -5.270 8.767 5.927 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.242 7.360 8.439 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.291 9.108 8.336 1.00 0.00 H new ATOM 0 HG SER A 48 -6.229 8.227 9.250 1.00 0.00 H new ATOM 759 N GLN A 49 -2.926 9.885 6.201 1.00 0.00 N ATOM 760 CA GLN A 49 -1.662 10.558 5.910 1.00 0.00 C ATOM 761 C GLN A 49 -0.539 9.871 6.666 1.00 0.00 C ATOM 762 O GLN A 49 0.392 9.393 6.024 1.00 0.00 O ATOM 763 CB GLN A 49 -1.725 12.060 6.259 1.00 0.00 C ATOM 764 CG GLN A 49 -0.590 12.919 5.657 1.00 0.00 C ATOM 765 CD GLN A 49 0.785 12.854 6.337 1.00 0.00 C ATOM 766 OE1 GLN A 49 0.968 12.264 7.395 1.00 0.00 O ATOM 767 NE2 GLN A 49 1.794 13.473 5.744 1.00 0.00 N ATOM 0 H GLN A 49 -3.652 10.530 6.513 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.469 10.488 4.839 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.681 12.457 5.917 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.705 12.167 7.344 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -0.464 12.627 4.614 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.918 13.959 5.659 1.00 0.00 H new ATOM 0 HE21 GLN A 49 1.644 13.965 4.863 1.00 0.00 H new ATOM 0 HE22 GLN A 49 2.722 13.458 6.168 1.00 0.00 H new ATOM 776 N GLY A 50 -0.645 9.829 7.999 1.00 0.00 N ATOM 777 CA GLY A 50 0.406 9.373 8.889 1.00 0.00 C ATOM 778 C GLY A 50 0.828 7.975 8.503 1.00 0.00 C ATOM 779 O GLY A 50 1.996 7.752 8.192 1.00 0.00 O ATOM 0 H GLY A 50 -1.489 10.121 8.492 1.00 0.00 H new ATOM 0 HA2 GLY A 50 1.260 10.049 8.836 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.053 9.385 9.920 1.00 0.00 H new ATOM 783 N SER A 51 -0.145 7.066 8.439 1.00 0.00 N ATOM 784 CA SER A 51 0.070 5.685 8.063 1.00 0.00 C ATOM 785 C SER A 51 0.888 5.586 6.778 1.00 0.00 C ATOM 786 O SER A 51 1.931 4.929 6.786 1.00 0.00 O ATOM 787 CB SER A 51 -1.281 4.974 7.938 1.00 0.00 C ATOM 788 OG SER A 51 -2.092 5.222 9.072 1.00 0.00 O ATOM 0 H SER A 51 -1.119 7.281 8.652 1.00 0.00 H new ATOM 0 HA SER A 51 0.649 5.187 8.840 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.793 5.315 7.038 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.123 3.901 7.827 1.00 0.00 H new ATOM 0 HG SER A 51 -2.950 4.759 8.968 1.00 0.00 H new ATOM 794 N VAL A 52 0.440 6.218 5.690 1.00 0.00 N ATOM 795 CA VAL A 52 1.092 6.100 4.392 1.00 0.00 C ATOM 796 C VAL A 52 2.444 6.822 4.357 1.00 0.00 C ATOM 797 O VAL A 52 3.377 6.333 3.714 1.00 0.00 O ATOM 798 CB VAL A 52 0.105 6.550 3.285 1.00 0.00 C ATOM 799 CG1 VAL A 52 0.542 7.751 2.433 1.00 0.00 C ATOM 800 CG2 VAL A 52 -0.182 5.338 2.396 1.00 0.00 C ATOM 0 H VAL A 52 -0.382 6.822 5.688 1.00 0.00 H new ATOM 0 HA VAL A 52 1.343 5.056 4.202 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.786 6.915 3.797 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.228 7.972 1.694 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.688 8.619 3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.477 7.515 1.924 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -0.876 5.623 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.748 4.984 1.952 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.624 4.543 2.997 1.00 0.00 H new ATOM 810 N SER A 53 2.565 7.964 5.031 1.00 0.00 N ATOM 811 CA SER A 53 3.770 8.768 5.064 1.00 0.00 C ATOM 812 C SER A 53 4.863 7.959 5.754 1.00 0.00 C ATOM 813 O SER A 53 5.980 7.867 5.236 1.00 0.00 O ATOM 814 CB SER A 53 3.468 10.088 5.790 1.00 0.00 C ATOM 815 OG SER A 53 4.406 11.084 5.448 1.00 0.00 O ATOM 0 H SER A 53 1.803 8.360 5.582 1.00 0.00 H new ATOM 0 HA SER A 53 4.116 9.019 4.061 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.464 10.426 5.533 1.00 0.00 H new ATOM 0 HB3 SER A 53 3.483 9.925 6.868 1.00 0.00 H new ATOM 0 HG SER A 53 4.190 11.914 5.922 1.00 0.00 H new ATOM 821 N ASP A 54 4.538 7.330 6.885 1.00 0.00 N ATOM 822 CA ASP A 54 5.450 6.464 7.621 1.00 0.00 C ATOM 823 C ASP A 54 5.711 5.172 6.862 1.00 0.00 C ATOM 824 O ASP A 54 6.800 4.623 6.984 1.00 0.00 O ATOM 825 CB ASP A 54 4.902 6.152 9.019 1.00 0.00 C ATOM 826 CG ASP A 54 5.475 7.149 10.031 1.00 0.00 C ATOM 827 OD1 ASP A 54 5.241 8.372 9.890 1.00 0.00 O ATOM 828 OD2 ASP A 54 6.251 6.713 10.912 1.00 0.00 O ATOM 0 H ASP A 54 3.619 7.412 7.319 1.00 0.00 H new ATOM 0 HA ASP A 54 6.394 6.998 7.729 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.813 6.208 9.015 1.00 0.00 H new ATOM 0 HB3 ASP A 54 5.167 5.134 9.306 1.00 0.00 H new ATOM 833 N MET A 55 4.754 4.695 6.058 1.00 0.00 N ATOM 834 CA MET A 55 4.951 3.552 5.172 1.00 0.00 C ATOM 835 C MET A 55 6.095 3.864 4.230 1.00 0.00 C ATOM 836 O MET A 55 7.073 3.131 4.174 1.00 0.00 O ATOM 837 CB MET A 55 3.673 3.251 4.368 1.00 0.00 C ATOM 838 CG MET A 55 3.402 1.754 4.242 1.00 0.00 C ATOM 839 SD MET A 55 1.657 1.299 4.053 1.00 0.00 S ATOM 840 CE MET A 55 1.095 1.716 5.724 1.00 0.00 C ATOM 0 H MET A 55 3.818 5.096 6.007 1.00 0.00 H new ATOM 0 HA MET A 55 5.184 2.670 5.769 1.00 0.00 H new ATOM 0 HB2 MET A 55 2.822 3.732 4.851 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.763 3.686 3.373 1.00 0.00 H new ATOM 0 HG2 MET A 55 3.956 1.372 3.384 1.00 0.00 H new ATOM 0 HG3 MET A 55 3.798 1.254 5.126 1.00 0.00 H new ATOM 0 HE1 MET A 55 0.189 1.155 5.954 1.00 0.00 H new ATOM 0 HE2 MET A 55 1.873 1.461 6.444 1.00 0.00 H new ATOM 0 HE3 MET A 55 0.884 2.784 5.781 1.00 0.00 H new ATOM 850 N LEU A 56 5.957 4.965 3.498 1.00 0.00 N ATOM 851 CA LEU A 56 6.944 5.394 2.523 1.00 0.00 C ATOM 852 C LEU A 56 8.273 5.761 3.185 1.00 0.00 C ATOM 853 O LEU A 56 9.325 5.491 2.612 1.00 0.00 O ATOM 854 CB LEU A 56 6.394 6.562 1.690 1.00 0.00 C ATOM 855 CG LEU A 56 5.233 6.190 0.750 1.00 0.00 C ATOM 856 CD1 LEU A 56 4.825 7.429 -0.046 1.00 0.00 C ATOM 857 CD2 LEU A 56 5.576 5.064 -0.231 1.00 0.00 C ATOM 0 H LEU A 56 5.151 5.586 3.568 1.00 0.00 H new ATOM 0 HA LEU A 56 7.144 4.556 1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.058 7.347 2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.206 6.980 1.095 1.00 0.00 H new ATOM 0 HG LEU A 56 4.420 5.827 1.379 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.003 7.177 -0.716 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.507 8.214 0.640 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.674 7.781 -0.631 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.712 4.855 -0.862 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.416 5.369 -0.856 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.845 4.166 0.325 1.00 0.00 H new ATOM 869 N SER A 57 8.257 6.375 4.368 1.00 0.00 N ATOM 870 CA SER A 57 9.470 6.744 5.087 1.00 0.00 C ATOM 871 C SER A 57 10.207 5.489 5.578 1.00 0.00 C ATOM 872 O SER A 57 11.430 5.407 5.459 1.00 0.00 O ATOM 873 CB SER A 57 9.089 7.693 6.232 1.00 0.00 C ATOM 874 OG SER A 57 10.195 8.090 7.019 1.00 0.00 O ATOM 0 H SER A 57 7.397 6.630 4.854 1.00 0.00 H new ATOM 0 HA SER A 57 10.163 7.266 4.427 1.00 0.00 H new ATOM 0 HB2 SER A 57 8.610 8.580 5.816 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.354 7.204 6.871 1.00 0.00 H new ATOM 0 HG SER A 57 9.891 8.693 7.729 1.00 0.00 H new ATOM 880 N ARG A 58 9.499 4.513 6.149 1.00 0.00 N ATOM 881 CA ARG A 58 10.088 3.409 6.904 1.00 0.00 C ATOM 882 C ARG A 58 9.159 2.193 6.808 1.00 0.00 C ATOM 883 O ARG A 58 8.441 1.900 7.769 1.00 0.00 O ATOM 884 CB ARG A 58 10.380 3.860 8.358 1.00 0.00 C ATOM 885 CG ARG A 58 9.298 4.750 9.001 1.00 0.00 C ATOM 886 CD ARG A 58 9.617 5.157 10.440 1.00 0.00 C ATOM 887 NE ARG A 58 9.344 4.092 11.417 1.00 0.00 N ATOM 888 CZ ARG A 58 9.911 3.973 12.624 1.00 0.00 C ATOM 889 NH1 ARG A 58 10.807 4.852 13.062 1.00 0.00 N ATOM 890 NH2 ARG A 58 9.587 2.936 13.391 1.00 0.00 N ATOM 0 H ARG A 58 8.481 4.468 6.098 1.00 0.00 H new ATOM 0 HA ARG A 58 11.049 3.112 6.484 1.00 0.00 H new ATOM 0 HB2 ARG A 58 10.512 2.972 8.977 1.00 0.00 H new ATOM 0 HB3 ARG A 58 11.326 4.401 8.370 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.173 5.649 8.397 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.346 4.220 8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 58 10.667 5.441 10.506 1.00 0.00 H new ATOM 0 HD3 ARG A 58 9.031 6.039 10.700 1.00 0.00 H new ATOM 0 HE ARG A 58 8.662 3.381 11.151 1.00 0.00 H new ATOM 0 HH11 ARG A 58 11.078 5.640 12.474 1.00 0.00 H new ATOM 0 HH12 ARG A 58 11.224 4.738 13.986 1.00 0.00 H new ATOM 0 HH21 ARG A 58 8.915 2.245 13.057 1.00 0.00 H new ATOM 0 HH22 ARG A 58 10.011 2.832 14.313 1.00 0.00 H new ATOM 904 N PRO A 59 9.128 1.474 5.673 1.00 0.00 N ATOM 905 CA PRO A 59 8.245 0.326 5.511 1.00 0.00 C ATOM 906 C PRO A 59 8.757 -0.865 6.326 1.00 0.00 C ATOM 907 O PRO A 59 9.960 -0.993 6.565 1.00 0.00 O ATOM 908 CB PRO A 59 8.251 0.018 4.014 1.00 0.00 C ATOM 909 CG PRO A 59 9.601 0.540 3.534 1.00 0.00 C ATOM 910 CD PRO A 59 9.903 1.715 4.463 1.00 0.00 C ATOM 0 HA PRO A 59 7.236 0.531 5.870 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.147 -1.051 3.826 1.00 0.00 H new ATOM 0 HB3 PRO A 59 7.427 0.514 3.501 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.371 -0.228 3.601 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.557 0.858 2.492 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.968 1.773 4.686 1.00 0.00 H new ATOM 0 HD3 PRO A 59 9.622 2.661 4.001 1.00 0.00 H new ATOM 918 N LYS A 60 7.861 -1.781 6.714 1.00 0.00 N ATOM 919 CA LYS A 60 8.271 -3.048 7.319 1.00 0.00 C ATOM 920 C LYS A 60 8.675 -4.040 6.225 1.00 0.00 C ATOM 921 O LYS A 60 8.194 -3.914 5.094 1.00 0.00 O ATOM 922 CB LYS A 60 7.169 -3.628 8.225 1.00 0.00 C ATOM 923 CG LYS A 60 7.354 -3.083 9.646 1.00 0.00 C ATOM 924 CD LYS A 60 6.419 -3.678 10.705 1.00 0.00 C ATOM 925 CE LYS A 60 5.000 -3.107 10.607 1.00 0.00 C ATOM 926 NZ LYS A 60 4.313 -3.122 11.915 1.00 0.00 N ATOM 0 H LYS A 60 6.852 -1.666 6.619 1.00 0.00 H new ATOM 0 HA LYS A 60 9.135 -2.861 7.956 1.00 0.00 H new ATOM 0 HB2 LYS A 60 6.185 -3.356 7.843 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.220 -4.717 8.230 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.384 -3.261 9.954 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.210 -2.003 9.624 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.382 -4.761 10.588 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.822 -3.478 11.698 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.044 -2.085 10.231 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.423 -3.687 9.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.356 -2.728 11.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.249 -4.100 12.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.850 -2.548 12.596 1.00 0.00 H new ATOM 940 N PRO A 61 9.508 -5.042 6.552 1.00 0.00 N ATOM 941 CA PRO A 61 9.899 -6.083 5.611 1.00 0.00 C ATOM 942 C PRO A 61 8.700 -6.970 5.291 1.00 0.00 C ATOM 943 O PRO A 61 7.830 -7.178 6.143 1.00 0.00 O ATOM 944 CB PRO A 61 11.015 -6.867 6.301 1.00 0.00 C ATOM 945 CG PRO A 61 10.777 -6.630 7.781 1.00 0.00 C ATOM 946 CD PRO A 61 10.134 -5.252 7.850 1.00 0.00 C ATOM 0 HA PRO A 61 10.246 -5.677 4.661 1.00 0.00 H new ATOM 0 HB2 PRO A 61 10.967 -7.928 6.055 1.00 0.00 H new ATOM 0 HB3 PRO A 61 11.999 -6.513 5.994 1.00 0.00 H new ATOM 0 HG2 PRO A 61 10.125 -7.394 8.205 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.711 -6.661 8.343 1.00 0.00 H new ATOM 0 HD2 PRO A 61 9.397 -5.204 8.652 1.00 0.00 H new ATOM 0 HD3 PRO A 61 10.879 -4.483 8.054 1.00 0.00 H new ATOM 954 N TRP A 62 8.667 -7.543 4.087 1.00 0.00 N ATOM 955 CA TRP A 62 7.496 -8.256 3.585 1.00 0.00 C ATOM 956 C TRP A 62 7.082 -9.433 4.474 1.00 0.00 C ATOM 957 O TRP A 62 5.885 -9.644 4.680 1.00 0.00 O ATOM 958 CB TRP A 62 7.764 -8.714 2.154 1.00 0.00 C ATOM 959 CG TRP A 62 6.574 -9.246 1.423 1.00 0.00 C ATOM 960 CD1 TRP A 62 6.318 -10.553 1.195 1.00 0.00 C ATOM 961 CD2 TRP A 62 5.501 -8.511 0.760 1.00 0.00 C ATOM 962 NE1 TRP A 62 5.255 -10.667 0.329 1.00 0.00 N ATOM 963 CE2 TRP A 62 4.738 -9.438 0.000 1.00 0.00 C ATOM 964 CE3 TRP A 62 5.111 -7.157 0.680 1.00 0.00 C ATOM 965 CZ2 TRP A 62 3.723 -9.029 -0.866 1.00 0.00 C ATOM 966 CZ3 TRP A 62 4.038 -6.747 -0.135 1.00 0.00 C ATOM 967 CH2 TRP A 62 3.357 -7.682 -0.928 1.00 0.00 C ATOM 0 H TRP A 62 9.451 -7.525 3.435 1.00 0.00 H new ATOM 0 HA TRP A 62 6.653 -7.565 3.601 1.00 0.00 H new ATOM 0 HB2 TRP A 62 8.171 -7.874 1.591 1.00 0.00 H new ATOM 0 HB3 TRP A 62 8.533 -9.486 2.175 1.00 0.00 H new ATOM 0 HD1 TRP A 62 6.863 -11.380 1.626 1.00 0.00 H new ATOM 0 HE1 TRP A 62 4.896 -11.554 -0.025 1.00 0.00 H new ATOM 0 HE3 TRP A 62 5.648 -6.418 1.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 3.220 -9.754 -1.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 3.739 -5.709 -0.149 1.00 0.00 H new ATOM 0 HH2 TRP A 62 2.557 -7.364 -1.580 1.00 0.00 H new ATOM 978 N SER A 63 8.039 -10.165 5.056 1.00 0.00 N ATOM 979 CA SER A 63 7.758 -11.277 5.964 1.00 0.00 C ATOM 980 C SER A 63 6.946 -10.822 7.182 1.00 0.00 C ATOM 981 O SER A 63 6.060 -11.541 7.657 1.00 0.00 O ATOM 982 CB SER A 63 9.083 -11.895 6.426 1.00 0.00 C ATOM 983 OG SER A 63 8.838 -13.022 7.237 1.00 0.00 O ATOM 0 H SER A 63 9.035 -10.000 4.908 1.00 0.00 H new ATOM 0 HA SER A 63 7.163 -12.016 5.427 1.00 0.00 H new ATOM 0 HB2 SER A 63 9.679 -12.183 5.560 1.00 0.00 H new ATOM 0 HB3 SER A 63 9.663 -11.157 6.981 1.00 0.00 H new ATOM 0 HG SER A 63 9.691 -13.409 7.525 1.00 0.00 H new ATOM 989 N LYS A 64 7.255 -9.634 7.715 1.00 0.00 N ATOM 990 CA LYS A 64 6.632 -9.091 8.918 1.00 0.00 C ATOM 991 C LYS A 64 5.208 -8.634 8.621 1.00 0.00 C ATOM 992 O LYS A 64 4.375 -8.661 9.528 1.00 0.00 O ATOM 993 CB LYS A 64 7.489 -7.930 9.456 1.00 0.00 C ATOM 994 CG LYS A 64 8.745 -8.341 10.248 1.00 0.00 C ATOM 995 CD LYS A 64 9.480 -9.611 9.793 1.00 0.00 C ATOM 996 CE LYS A 64 10.704 -9.866 10.678 1.00 0.00 C ATOM 997 NZ LYS A 64 11.253 -11.224 10.495 1.00 0.00 N ATOM 0 H LYS A 64 7.958 -9.015 7.312 1.00 0.00 H new ATOM 0 HA LYS A 64 6.576 -9.867 9.681 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.799 -7.310 8.614 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.865 -7.308 10.097 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.452 -7.512 10.214 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.458 -8.473 11.291 1.00 0.00 H new ATOM 0 HD2 LYS A 64 8.805 -10.466 9.840 1.00 0.00 H new ATOM 0 HD3 LYS A 64 9.790 -9.506 8.753 1.00 0.00 H new ATOM 0 HE2 LYS A 64 11.475 -9.131 10.449 1.00 0.00 H new ATOM 0 HE3 LYS A 64 10.430 -9.725 11.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.079 -11.351 11.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.527 -11.928 10.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.540 -11.352 9.504 1.00 0.00 H new ATOM 1011 N LEU A 65 4.912 -8.258 7.376 1.00 0.00 N ATOM 1012 CA LEU A 65 3.549 -8.015 6.926 1.00 0.00 C ATOM 1013 C LEU A 65 2.851 -9.362 6.728 1.00 0.00 C ATOM 1014 O LEU A 65 3.503 -10.373 6.470 1.00 0.00 O ATOM 1015 CB LEU A 65 3.541 -7.254 5.592 1.00 0.00 C ATOM 1016 CG LEU A 65 4.395 -5.979 5.512 1.00 0.00 C ATOM 1017 CD1 LEU A 65 4.363 -5.465 4.072 1.00 0.00 C ATOM 1018 CD2 LEU A 65 3.882 -4.897 6.463 1.00 0.00 C ATOM 0 H LEU A 65 5.616 -8.114 6.652 1.00 0.00 H new ATOM 0 HA LEU A 65 3.033 -7.415 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.876 -7.936 4.811 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.510 -6.986 5.361 1.00 0.00 H new ATOM 0 HG LEU A 65 5.415 -6.218 5.811 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.964 -4.559 3.996 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.767 -6.226 3.405 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.334 -5.243 3.788 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.511 -4.011 6.379 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.855 -4.640 6.202 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.914 -5.268 7.487 1.00 0.00 H new ATOM 1030 N THR A 66 1.522 -9.373 6.778 1.00 0.00 N ATOM 1031 CA THR A 66 0.686 -10.478 6.305 1.00 0.00 C ATOM 1032 C THR A 66 -0.136 -9.997 5.108 1.00 0.00 C ATOM 1033 O THR A 66 -0.097 -8.804 4.815 1.00 0.00 O ATOM 1034 CB THR A 66 -0.195 -10.973 7.456 1.00 0.00 C ATOM 1035 OG1 THR A 66 -1.083 -9.957 7.896 1.00 0.00 O ATOM 1036 CG2 THR A 66 0.641 -11.431 8.646 1.00 0.00 C ATOM 0 H THR A 66 0.981 -8.596 7.157 1.00 0.00 H new ATOM 0 HA THR A 66 1.296 -11.319 5.976 1.00 0.00 H new ATOM 0 HB THR A 66 -0.764 -11.818 7.068 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.635 -10.300 8.630 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.018 -11.775 9.443 1.00 0.00 H new ATOM 0 HG22 THR A 66 1.295 -12.247 8.339 1.00 0.00 H new ATOM 0 HG23 THR A 66 1.245 -10.599 9.008 1.00 0.00 H new ATOM 1044 N GLN A 67 -0.943 -10.854 4.471 1.00 0.00 N ATOM 1045 CA GLN A 67 -1.886 -10.459 3.415 1.00 0.00 C ATOM 1046 C GLN A 67 -2.627 -9.150 3.745 1.00 0.00 C ATOM 1047 O GLN A 67 -2.593 -8.211 2.948 1.00 0.00 O ATOM 1048 CB GLN A 67 -2.891 -11.591 3.130 1.00 0.00 C ATOM 1049 CG GLN A 67 -2.322 -12.685 2.213 1.00 0.00 C ATOM 1050 CD GLN A 67 -3.335 -13.785 1.898 1.00 0.00 C ATOM 1051 OE1 GLN A 67 -4.532 -13.525 1.778 1.00 0.00 O ATOM 1052 NE2 GLN A 67 -2.906 -15.032 1.772 1.00 0.00 N ATOM 0 H GLN A 67 -0.961 -11.853 4.676 1.00 0.00 H new ATOM 0 HA GLN A 67 -1.295 -10.275 2.518 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -3.200 -12.041 4.074 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.785 -11.168 2.670 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -1.985 -12.231 1.281 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -1.446 -13.129 2.686 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.913 -15.242 1.872 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.569 -15.782 1.575 1.00 0.00 H new ATOM 1061 N LYS A 68 -3.257 -9.043 4.923 1.00 0.00 N ATOM 1062 CA LYS A 68 -4.019 -7.838 5.280 1.00 0.00 C ATOM 1063 C LYS A 68 -3.113 -6.615 5.426 1.00 0.00 C ATOM 1064 O LYS A 68 -3.526 -5.498 5.124 1.00 0.00 O ATOM 1065 CB LYS A 68 -4.824 -8.060 6.575 1.00 0.00 C ATOM 1066 CG LYS A 68 -6.339 -7.939 6.376 1.00 0.00 C ATOM 1067 CD LYS A 68 -6.814 -6.503 6.111 1.00 0.00 C ATOM 1068 CE LYS A 68 -6.756 -5.641 7.375 1.00 0.00 C ATOM 1069 NZ LYS A 68 -7.335 -4.298 7.174 1.00 0.00 N ATOM 0 H LYS A 68 -3.255 -9.769 5.639 1.00 0.00 H new ATOM 0 HA LYS A 68 -4.713 -7.644 4.462 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -4.595 -9.049 6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.504 -7.334 7.323 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -6.638 -8.571 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.845 -8.322 7.262 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.194 -6.053 5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.836 -6.523 5.731 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.290 -6.146 8.180 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.719 -5.541 7.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.271 -3.756 8.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.810 -3.802 6.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -8.333 -4.388 6.895 1.00 0.00 H new ATOM 1083 N GLY A 69 -1.878 -6.813 5.882 1.00 0.00 N ATOM 1084 CA GLY A 69 -0.874 -5.762 5.974 1.00 0.00 C ATOM 1085 C GLY A 69 -0.272 -5.397 4.618 1.00 0.00 C ATOM 1086 O GLY A 69 0.289 -4.308 4.479 1.00 0.00 O ATOM 0 H GLY A 69 -1.544 -7.722 6.202 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.324 -4.874 6.417 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.078 -6.084 6.645 1.00 0.00 H new ATOM 1090 N ARG A 70 -0.358 -6.287 3.625 1.00 0.00 N ATOM 1091 CA ARG A 70 0.248 -6.130 2.308 1.00 0.00 C ATOM 1092 C ARG A 70 -0.689 -5.446 1.330 1.00 0.00 C ATOM 1093 O ARG A 70 -0.165 -4.846 0.406 1.00 0.00 O ATOM 1094 CB ARG A 70 0.682 -7.490 1.741 1.00 0.00 C ATOM 1095 CG ARG A 70 1.897 -8.070 2.473 1.00 0.00 C ATOM 1096 CD ARG A 70 2.000 -9.574 2.240 1.00 0.00 C ATOM 1097 NE ARG A 70 3.094 -10.177 3.023 1.00 0.00 N ATOM 1098 CZ ARG A 70 3.317 -11.488 3.173 1.00 0.00 C ATOM 1099 NH1 ARG A 70 2.534 -12.395 2.609 1.00 0.00 N ATOM 1100 NH2 ARG A 70 4.332 -11.890 3.913 1.00 0.00 N ATOM 0 H ARG A 70 -0.869 -7.164 3.723 1.00 0.00 H new ATOM 0 HA ARG A 70 1.125 -5.496 2.437 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.149 -8.191 1.811 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.918 -7.380 0.682 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.806 -7.580 2.124 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.815 -7.867 3.541 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.056 -10.049 2.509 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.163 -9.767 1.180 1.00 0.00 H new ATOM 0 HE ARG A 70 3.737 -9.539 3.491 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.738 -12.101 2.044 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.727 -13.388 2.740 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.937 -11.204 4.364 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.511 -12.887 4.034 1.00 0.00 H new ATOM 1114 N GLU A 71 -2.007 -5.443 1.545 1.00 0.00 N ATOM 1115 CA GLU A 71 -2.989 -4.707 0.743 1.00 0.00 C ATOM 1116 C GLU A 71 -2.476 -3.343 0.244 1.00 0.00 C ATOM 1117 O GLU A 71 -2.433 -3.138 -0.972 1.00 0.00 O ATOM 1118 CB GLU A 71 -4.282 -4.524 1.548 1.00 0.00 C ATOM 1119 CG GLU A 71 -5.273 -5.677 1.413 1.00 0.00 C ATOM 1120 CD GLU A 71 -6.633 -5.226 1.942 1.00 0.00 C ATOM 1121 OE1 GLU A 71 -6.882 -5.293 3.168 1.00 0.00 O ATOM 1122 OE2 GLU A 71 -7.468 -4.714 1.165 1.00 0.00 O ATOM 0 H GLU A 71 -2.434 -5.970 2.307 1.00 0.00 H new ATOM 0 HA GLU A 71 -3.180 -5.306 -0.148 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.027 -4.401 2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -4.768 -3.603 1.228 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.357 -5.982 0.370 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.920 -6.544 1.971 1.00 0.00 H new ATOM 1129 N PRO A 72 -2.048 -2.414 1.124 1.00 0.00 N ATOM 1130 CA PRO A 72 -1.596 -1.103 0.679 1.00 0.00 C ATOM 1131 C PRO A 72 -0.348 -1.235 -0.199 1.00 0.00 C ATOM 1132 O PRO A 72 -0.272 -0.629 -1.264 1.00 0.00 O ATOM 1133 CB PRO A 72 -1.363 -0.295 1.962 1.00 0.00 C ATOM 1134 CG PRO A 72 -1.093 -1.350 3.031 1.00 0.00 C ATOM 1135 CD PRO A 72 -1.966 -2.515 2.578 1.00 0.00 C ATOM 0 HA PRO A 72 -2.324 -0.593 0.048 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.519 0.387 1.855 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.233 0.312 2.213 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -0.039 -1.625 3.072 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.369 -0.999 4.025 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.532 -3.468 2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -2.956 -2.459 3.030 1.00 0.00 H new ATOM 1143 N PHE A 73 0.613 -2.067 0.203 1.00 0.00 N ATOM 1144 CA PHE A 73 1.838 -2.298 -0.545 1.00 0.00 C ATOM 1145 C PHE A 73 1.591 -2.935 -1.912 1.00 0.00 C ATOM 1146 O PHE A 73 2.328 -2.634 -2.843 1.00 0.00 O ATOM 1147 CB PHE A 73 2.791 -3.168 0.273 1.00 0.00 C ATOM 1148 CG PHE A 73 3.404 -2.457 1.464 1.00 0.00 C ATOM 1149 CD1 PHE A 73 4.472 -1.565 1.258 1.00 0.00 C ATOM 1150 CD2 PHE A 73 2.935 -2.687 2.771 1.00 0.00 C ATOM 1151 CE1 PHE A 73 5.114 -0.958 2.347 1.00 0.00 C ATOM 1152 CE2 PHE A 73 3.572 -2.074 3.866 1.00 0.00 C ATOM 1153 CZ PHE A 73 4.676 -1.228 3.655 1.00 0.00 C ATOM 0 H PHE A 73 0.557 -2.604 1.069 1.00 0.00 H new ATOM 0 HA PHE A 73 2.287 -1.322 -0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.252 -4.048 0.625 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.591 -3.523 -0.377 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.800 -1.346 0.253 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.086 -3.334 2.934 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.942 -0.285 2.181 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.213 -2.253 4.869 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.187 -0.786 4.498 1.00 0.00 H new ATOM 1163 N ILE A 74 0.611 -3.824 -2.050 1.00 0.00 N ATOM 1164 CA ILE A 74 0.270 -4.491 -3.303 1.00 0.00 C ATOM 1165 C ILE A 74 -0.252 -3.444 -4.272 1.00 0.00 C ATOM 1166 O ILE A 74 0.187 -3.388 -5.418 1.00 0.00 O ATOM 1167 CB ILE A 74 -0.789 -5.577 -3.026 1.00 0.00 C ATOM 1168 CG1 ILE A 74 -0.152 -6.749 -2.258 1.00 0.00 C ATOM 1169 CG2 ILE A 74 -1.471 -6.098 -4.299 1.00 0.00 C ATOM 1170 CD1 ILE A 74 -1.211 -7.567 -1.523 1.00 0.00 C ATOM 0 H ILE A 74 0.016 -4.108 -1.272 1.00 0.00 H new ATOM 0 HA ILE A 74 1.143 -4.975 -3.741 1.00 0.00 H new ATOM 0 HB ILE A 74 -1.566 -5.108 -2.423 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.390 -7.391 -2.953 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.576 -6.366 -1.543 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -2.204 -6.859 -4.033 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -1.971 -5.274 -4.807 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.722 -6.531 -4.962 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.731 -8.388 -0.990 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -1.735 -6.929 -0.811 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.924 -7.969 -2.243 1.00 0.00 H new ATOM 1182 N ARG A 75 -1.186 -2.605 -3.820 1.00 0.00 N ATOM 1183 CA ARG A 75 -1.712 -1.547 -4.645 1.00 0.00 C ATOM 1184 C ARG A 75 -0.599 -0.570 -4.996 1.00 0.00 C ATOM 1185 O ARG A 75 -0.564 -0.123 -6.134 1.00 0.00 O ATOM 1186 CB ARG A 75 -2.885 -0.909 -3.906 1.00 0.00 C ATOM 1187 CG ARG A 75 -4.110 -1.833 -3.942 1.00 0.00 C ATOM 1188 CD ARG A 75 -5.338 -1.133 -3.355 1.00 0.00 C ATOM 1189 NE ARG A 75 -6.511 -2.018 -3.400 1.00 0.00 N ATOM 1190 CZ ARG A 75 -7.288 -2.274 -4.456 1.00 0.00 C ATOM 1191 NH1 ARG A 75 -7.216 -1.539 -5.559 1.00 0.00 N ATOM 1192 NH2 ARG A 75 -8.142 -3.286 -4.418 1.00 0.00 N ATOM 0 H ARG A 75 -1.586 -2.648 -2.883 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.089 -1.922 -5.596 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.605 -0.707 -2.872 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.132 0.050 -4.362 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -4.314 -2.133 -4.970 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -3.901 -2.743 -3.379 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.137 -0.839 -2.325 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -5.544 -0.220 -3.913 1.00 0.00 H new ATOM 0 HE ARG A 75 -6.759 -2.488 -2.529 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.558 -0.761 -5.612 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -7.819 -1.752 -6.354 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -8.206 -3.869 -3.583 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -8.736 -3.483 -5.224 1.00 0.00 H new ATOM 1206 N MET A 76 0.350 -0.312 -4.091 1.00 0.00 N ATOM 1207 CA MET A 76 1.573 0.420 -4.382 1.00 0.00 C ATOM 1208 C MET A 76 2.357 -0.197 -5.555 1.00 0.00 C ATOM 1209 O MET A 76 2.747 0.532 -6.465 1.00 0.00 O ATOM 1210 CB MET A 76 2.427 0.487 -3.102 1.00 0.00 C ATOM 1211 CG MET A 76 2.807 1.905 -2.705 1.00 0.00 C ATOM 1212 SD MET A 76 4.177 1.971 -1.513 1.00 0.00 S ATOM 1213 CE MET A 76 3.275 1.769 0.029 1.00 0.00 C ATOM 0 H MET A 76 0.282 -0.614 -3.119 1.00 0.00 H new ATOM 0 HA MET A 76 1.311 1.430 -4.698 1.00 0.00 H new ATOM 0 HB2 MET A 76 1.878 0.023 -2.283 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.335 -0.097 -3.249 1.00 0.00 H new ATOM 0 HG2 MET A 76 3.084 2.464 -3.599 1.00 0.00 H new ATOM 0 HG3 MET A 76 1.936 2.401 -2.276 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.981 1.663 0.852 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.647 2.643 0.200 1.00 0.00 H new ATOM 0 HE3 MET A 76 2.649 0.879 -0.030 1.00 0.00 H new ATOM 1223 N GLN A 77 2.602 -1.515 -5.533 1.00 0.00 N ATOM 1224 CA GLN A 77 3.360 -2.227 -6.568 1.00 0.00 C ATOM 1225 C GLN A 77 2.665 -2.107 -7.911 1.00 0.00 C ATOM 1226 O GLN A 77 3.305 -1.822 -8.920 1.00 0.00 O ATOM 1227 CB GLN A 77 3.484 -3.725 -6.248 1.00 0.00 C ATOM 1228 CG GLN A 77 4.367 -4.011 -5.039 1.00 0.00 C ATOM 1229 CD GLN A 77 3.999 -5.304 -4.324 1.00 0.00 C ATOM 1230 OE1 GLN A 77 3.996 -6.387 -4.885 1.00 0.00 O ATOM 1231 NE2 GLN A 77 3.684 -5.216 -3.045 1.00 0.00 N ATOM 0 H GLN A 77 2.273 -2.124 -4.784 1.00 0.00 H new ATOM 0 HA GLN A 77 4.350 -1.773 -6.599 1.00 0.00 H new ATOM 0 HB2 GLN A 77 2.490 -4.135 -6.069 1.00 0.00 H new ATOM 0 HB3 GLN A 77 3.890 -4.243 -7.117 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.407 -4.064 -5.360 1.00 0.00 H new ATOM 0 HG3 GLN A 77 4.292 -3.180 -4.337 1.00 0.00 H new ATOM 0 HE21 GLN A 77 3.688 -4.308 -2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 77 3.437 -6.056 -2.522 1.00 0.00 H new ATOM 1240 N LEU A 78 1.358 -2.359 -7.927 1.00 0.00 N ATOM 1241 CA LEU A 78 0.585 -2.318 -9.150 1.00 0.00 C ATOM 1242 C LEU A 78 0.587 -0.903 -9.674 1.00 0.00 C ATOM 1243 O LEU A 78 1.064 -0.700 -10.783 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.831 -2.863 -8.909 1.00 0.00 C ATOM 1245 CG LEU A 78 -0.841 -4.392 -8.710 1.00 0.00 C ATOM 1246 CD1 LEU A 78 -2.161 -4.839 -8.083 1.00 0.00 C ATOM 1247 CD2 LEU A 78 -0.621 -5.145 -10.029 1.00 0.00 C ATOM 0 H LEU A 78 0.816 -2.595 -7.096 1.00 0.00 H new ATOM 0 HA LEU A 78 1.033 -2.961 -9.908 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.259 -2.381 -8.030 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.467 -2.604 -9.756 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.015 -4.633 -8.041 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.152 -5.921 -7.949 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.286 -4.354 -7.115 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.987 -4.561 -8.737 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.636 -6.219 -9.842 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.414 -4.888 -10.731 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.343 -4.864 -10.452 1.00 0.00 H new ATOM 1259 N TRP A 79 0.145 0.066 -8.874 1.00 0.00 N ATOM 1260 CA TRP A 79 0.027 1.469 -9.243 1.00 0.00 C ATOM 1261 C TRP A 79 1.272 2.007 -9.949 1.00 0.00 C ATOM 1262 O TRP A 79 1.135 2.817 -10.864 1.00 0.00 O ATOM 1263 CB TRP A 79 -0.262 2.283 -7.976 1.00 0.00 C ATOM 1264 CG TRP A 79 -0.236 3.762 -8.162 1.00 0.00 C ATOM 1265 CD1 TRP A 79 -1.264 4.536 -8.577 1.00 0.00 C ATOM 1266 CD2 TRP A 79 0.912 4.647 -8.002 1.00 0.00 C ATOM 1267 NE1 TRP A 79 -0.826 5.839 -8.690 1.00 0.00 N ATOM 1268 CE2 TRP A 79 0.504 5.967 -8.350 1.00 0.00 C ATOM 1269 CE3 TRP A 79 2.262 4.459 -7.624 1.00 0.00 C ATOM 1270 CZ2 TRP A 79 1.387 7.055 -8.318 1.00 0.00 C ATOM 1271 CZ3 TRP A 79 3.152 5.547 -7.578 1.00 0.00 C ATOM 1272 CH2 TRP A 79 2.716 6.839 -7.923 1.00 0.00 C ATOM 0 H TRP A 79 -0.151 -0.115 -7.915 1.00 0.00 H new ATOM 0 HA TRP A 79 -0.791 1.563 -9.958 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -1.241 1.997 -7.593 1.00 0.00 H new ATOM 0 HB3 TRP A 79 0.469 2.014 -7.214 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -2.266 4.190 -8.786 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.416 6.615 -8.989 1.00 0.00 H new ATOM 0 HE3 TRP A 79 2.613 3.470 -7.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 1.050 8.044 -8.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 4.177 5.389 -7.276 1.00 0.00 H new ATOM 0 HH2 TRP A 79 3.407 7.668 -7.884 1.00 0.00 H new ATOM 1283 N LEU A 80 2.464 1.537 -9.568 1.00 0.00 N ATOM 1284 CA LEU A 80 3.715 1.937 -10.203 1.00 0.00 C ATOM 1285 C LEU A 80 3.635 1.748 -11.721 1.00 0.00 C ATOM 1286 O LEU A 80 4.038 2.650 -12.454 1.00 0.00 O ATOM 1287 CB LEU A 80 4.891 1.141 -9.606 1.00 0.00 C ATOM 1288 CG LEU A 80 5.633 1.867 -8.475 1.00 0.00 C ATOM 1289 CD1 LEU A 80 6.406 0.839 -7.653 1.00 0.00 C ATOM 1290 CD2 LEU A 80 6.641 2.895 -8.995 1.00 0.00 C ATOM 0 H LEU A 80 2.584 0.867 -8.808 1.00 0.00 H new ATOM 0 HA LEU A 80 3.884 2.996 -10.008 1.00 0.00 H new ATOM 0 HB2 LEU A 80 4.516 0.190 -9.228 1.00 0.00 H new ATOM 0 HB3 LEU A 80 5.600 0.911 -10.401 1.00 0.00 H new ATOM 0 HG LEU A 80 4.882 2.390 -7.883 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.937 1.344 -6.846 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.711 0.113 -7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.123 0.325 -8.294 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.136 3.378 -8.152 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.385 2.394 -9.614 1.00 0.00 H new ATOM 0 HD23 LEU A 80 6.121 3.646 -9.589 1.00 0.00 H new ATOM 1302 N SER A 81 3.153 0.598 -12.197 1.00 0.00 N ATOM 1303 CA SER A 81 3.001 0.320 -13.623 1.00 0.00 C ATOM 1304 C SER A 81 1.580 0.607 -14.138 1.00 0.00 C ATOM 1305 O SER A 81 1.387 1.112 -15.245 1.00 0.00 O ATOM 1306 CB SER A 81 3.418 -1.137 -13.851 1.00 0.00 C ATOM 1307 OG SER A 81 3.849 -1.316 -15.184 1.00 0.00 O ATOM 0 H SER A 81 2.855 -0.171 -11.597 1.00 0.00 H new ATOM 0 HA SER A 81 3.640 0.990 -14.198 1.00 0.00 H new ATOM 0 HB2 SER A 81 4.219 -1.406 -13.162 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.580 -1.801 -13.640 1.00 0.00 H new ATOM 0 HG SER A 81 4.115 -2.249 -15.319 1.00 0.00 H new ATOM 1313 N ASP A 82 0.584 0.209 -13.351 1.00 0.00 N ATOM 1314 CA ASP A 82 -0.839 0.090 -13.668 1.00 0.00 C ATOM 1315 C ASP A 82 -1.558 1.437 -13.602 1.00 0.00 C ATOM 1316 O ASP A 82 -2.568 1.633 -14.277 1.00 0.00 O ATOM 1317 CB ASP A 82 -1.424 -0.839 -12.591 1.00 0.00 C ATOM 1318 CG ASP A 82 -2.925 -1.095 -12.656 1.00 0.00 C ATOM 1319 OD1 ASP A 82 -3.478 -1.455 -13.716 1.00 0.00 O ATOM 1320 OD2 ASP A 82 -3.551 -0.978 -11.583 1.00 0.00 O ATOM 0 H ASP A 82 0.768 -0.064 -12.386 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.968 -0.289 -14.682 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -0.911 -1.799 -12.653 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.192 -0.416 -11.613 1.00 0.00 H new ATOM 1325 N GLN A 83 -1.062 2.340 -12.746 1.00 0.00 N ATOM 1326 CA GLN A 83 -1.681 3.580 -12.269 1.00 0.00 C ATOM 1327 C GLN A 83 -3.136 3.443 -11.780 1.00 0.00 C ATOM 1328 O GLN A 83 -3.719 4.452 -11.381 1.00 0.00 O ATOM 1329 CB GLN A 83 -1.490 4.722 -13.285 1.00 0.00 C ATOM 1330 CG GLN A 83 -0.008 5.071 -13.485 1.00 0.00 C ATOM 1331 CD GLN A 83 0.168 6.429 -14.162 1.00 0.00 C ATOM 1332 OE1 GLN A 83 0.013 7.480 -13.536 1.00 0.00 O ATOM 1333 NE2 GLN A 83 0.536 6.461 -15.429 1.00 0.00 N ATOM 0 H GLN A 83 -0.138 2.209 -12.335 1.00 0.00 H new ATOM 0 HA GLN A 83 -1.140 3.843 -11.360 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -1.927 4.434 -14.241 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -2.028 5.606 -12.942 1.00 0.00 H new ATOM 0 HG2 GLN A 83 0.497 5.078 -12.519 1.00 0.00 H new ATOM 0 HG3 GLN A 83 0.469 4.299 -14.089 1.00 0.00 H new ATOM 0 HE21 GLN A 83 0.664 5.591 -15.945 1.00 0.00 H new ATOM 0 HE22 GLN A 83 0.693 7.356 -15.892 1.00 0.00 H new ATOM 1342 N LEU A 84 -3.692 2.225 -11.702 1.00 0.00 N ATOM 1343 CA LEU A 84 -5.085 1.868 -11.555 1.00 0.00 C ATOM 1344 C LEU A 84 -5.911 2.415 -12.702 1.00 0.00 C ATOM 1345 O LEU A 84 -5.728 3.534 -13.184 1.00 0.00 O ATOM 1346 CB LEU A 84 -5.623 2.213 -10.172 1.00 0.00 C ATOM 1347 CG LEU A 84 -5.012 1.260 -9.127 1.00 0.00 C ATOM 1348 CD1 LEU A 84 -3.744 1.814 -8.484 1.00 0.00 C ATOM 1349 CD2 LEU A 84 -6.034 0.961 -8.053 1.00 0.00 C ATOM 0 H LEU A 84 -3.106 1.391 -11.746 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.170 0.783 -11.619 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.379 3.246 -9.923 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.710 2.131 -10.163 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.731 0.348 -9.654 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.361 1.097 -7.757 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.992 1.987 -9.253 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.972 2.754 -7.981 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.600 0.287 -7.315 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.332 1.889 -7.566 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.908 0.491 -8.503 1.00 0.00 H new ATOM 1361 N GLY A 85 -6.898 1.625 -13.095 1.00 0.00 N ATOM 1362 CA GLY A 85 -7.937 2.010 -14.037 1.00 0.00 C ATOM 1363 C GLY A 85 -8.937 2.984 -13.408 1.00 0.00 C ATOM 1364 O GLY A 85 -10.127 2.911 -13.709 1.00 0.00 O ATOM 0 H GLY A 85 -7.001 0.668 -12.756 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.481 2.471 -14.913 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -8.463 1.120 -14.382 1.00 0.00 H new ATOM 1368 N GLN A 86 -8.484 3.858 -12.503 1.00 0.00 N ATOM 1369 CA GLN A 86 -9.307 4.723 -11.674 1.00 0.00 C ATOM 1370 C GLN A 86 -10.227 5.562 -12.562 1.00 0.00 C ATOM 1371 O GLN A 86 -11.455 5.458 -12.468 1.00 0.00 O ATOM 1372 CB GLN A 86 -8.389 5.581 -10.771 1.00 0.00 C ATOM 1373 CG GLN A 86 -8.918 5.815 -9.349 1.00 0.00 C ATOM 1374 CD GLN A 86 -8.474 4.785 -8.308 1.00 0.00 C ATOM 1375 OE1 GLN A 86 -8.012 5.161 -7.233 1.00 0.00 O ATOM 1376 NE2 GLN A 86 -8.626 3.491 -8.548 1.00 0.00 N ATOM 0 H GLN A 86 -7.487 3.982 -12.326 1.00 0.00 H new ATOM 0 HA GLN A 86 -9.951 4.136 -11.019 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.414 5.098 -10.706 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -8.234 6.548 -11.249 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -8.598 6.803 -9.018 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -10.007 5.827 -9.382 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -9.009 3.179 -9.440 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -8.360 2.806 -7.840 1.00 0.00 H new ATOM 1385 N ALA A 87 -9.630 6.382 -13.426 1.00 0.00 N ATOM 1386 CA ALA A 87 -10.298 7.338 -14.284 1.00 0.00 C ATOM 1387 C ALA A 87 -9.304 7.769 -15.357 1.00 0.00 C ATOM 1388 O ALA A 87 -8.289 8.384 -15.026 1.00 0.00 O ATOM 1389 CB ALA A 87 -10.715 8.534 -13.424 1.00 0.00 C ATOM 0 H ALA A 87 -8.617 6.392 -13.546 1.00 0.00 H new ATOM 0 HA ALA A 87 -11.183 6.913 -14.758 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -11.222 9.271 -14.047 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -11.390 8.198 -12.637 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -9.830 8.985 -12.975 1.00 0.00 H new ATOM 1395 N VAL A 88 -9.578 7.436 -16.616 1.00 0.00 N ATOM 1396 CA VAL A 88 -8.762 7.814 -17.761 1.00 0.00 C ATOM 1397 C VAL A 88 -9.698 8.358 -18.843 1.00 0.00 C ATOM 1398 O VAL A 88 -10.543 7.631 -19.383 1.00 0.00 O ATOM 1399 CB VAL A 88 -7.904 6.625 -18.235 1.00 0.00 C ATOM 1400 CG1 VAL A 88 -7.006 7.046 -19.404 1.00 0.00 C ATOM 1401 CG2 VAL A 88 -7.005 6.082 -17.111 1.00 0.00 C ATOM 0 H VAL A 88 -10.395 6.882 -16.872 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.050 8.596 -17.497 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.596 5.843 -18.546 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.406 6.195 -19.727 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -7.625 7.389 -20.233 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.347 7.853 -19.084 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -6.417 5.245 -17.488 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -6.335 6.870 -16.768 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.625 5.745 -16.280 1.00 0.00 H new ATOM 1411 N GLY A 89 -9.569 9.651 -19.134 1.00 0.00 N ATOM 1412 CA GLY A 89 -10.331 10.342 -20.157 1.00 0.00 C ATOM 1413 C GLY A 89 -9.463 10.510 -21.392 1.00 0.00 C ATOM 1414 O GLY A 89 -8.747 11.504 -21.505 1.00 0.00 O ATOM 0 H GLY A 89 -8.911 10.259 -18.647 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -11.230 9.777 -20.403 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.657 11.316 -19.791 1.00 0.00 H new ATOM 1418 N GLN A 90 -9.469 9.513 -22.278 1.00 0.00 N ATOM 1419 CA GLN A 90 -8.846 9.575 -23.598 1.00 0.00 C ATOM 1420 C GLN A 90 -9.746 8.794 -24.567 1.00 0.00 C ATOM 1421 O GLN A 90 -9.300 7.882 -25.262 1.00 0.00 O ATOM 1422 CB GLN A 90 -7.389 9.071 -23.516 1.00 0.00 C ATOM 1423 CG GLN A 90 -6.466 9.660 -24.599 1.00 0.00 C ATOM 1424 CD GLN A 90 -6.405 8.856 -25.899 1.00 0.00 C ATOM 1425 OE1 GLN A 90 -5.649 7.888 -26.007 1.00 0.00 O ATOM 1426 NE2 GLN A 90 -7.155 9.246 -26.921 1.00 0.00 N ATOM 0 H GLN A 90 -9.920 8.617 -22.091 1.00 0.00 H new ATOM 0 HA GLN A 90 -8.766 10.594 -23.976 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.984 9.316 -22.534 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.385 7.984 -23.600 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -6.800 10.672 -24.830 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.458 9.742 -24.192 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -7.777 10.048 -26.820 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -7.110 8.744 -27.808 1.00 0.00 H new ATOM 1435 N GLN A 91 -11.044 9.105 -24.547 1.00 0.00 N ATOM 1436 CA GLN A 91 -12.102 8.335 -25.193 1.00 0.00 C ATOM 1437 C GLN A 91 -13.179 9.273 -25.765 1.00 0.00 C ATOM 1438 O GLN A 91 -13.307 10.406 -25.289 1.00 0.00 O ATOM 1439 CB GLN A 91 -12.670 7.295 -24.204 1.00 0.00 C ATOM 1440 CG GLN A 91 -12.967 7.815 -22.786 1.00 0.00 C ATOM 1441 CD GLN A 91 -13.570 6.724 -21.898 1.00 0.00 C ATOM 1442 OE1 GLN A 91 -14.590 6.123 -22.223 1.00 0.00 O ATOM 1443 NE2 GLN A 91 -12.972 6.429 -20.753 1.00 0.00 N ATOM 0 H GLN A 91 -11.397 9.930 -24.062 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.694 7.783 -26.040 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -13.591 6.888 -24.622 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.963 6.469 -24.128 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -12.047 8.185 -22.334 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.655 8.658 -22.844 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -12.124 6.925 -20.478 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -13.359 5.706 -20.147 1.00 0.00 H new ATOM 1452 N PRO A 92 -13.951 8.840 -26.782 1.00 0.00 N ATOM 1453 CA PRO A 92 -14.946 9.654 -27.481 1.00 0.00 C ATOM 1454 C PRO A 92 -16.253 9.789 -26.675 1.00 0.00 C ATOM 1455 O PRO A 92 -17.317 9.311 -27.089 1.00 0.00 O ATOM 1456 CB PRO A 92 -15.127 8.959 -28.839 1.00 0.00 C ATOM 1457 CG PRO A 92 -14.911 7.493 -28.501 1.00 0.00 C ATOM 1458 CD PRO A 92 -13.779 7.573 -27.483 1.00 0.00 C ATOM 0 HA PRO A 92 -14.625 10.688 -27.612 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -16.119 9.136 -29.254 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -14.405 9.315 -29.574 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -15.806 7.033 -28.082 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -14.633 6.908 -29.377 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -13.821 6.735 -26.788 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -12.808 7.530 -27.976 1.00 0.00 H new ATOM 1466 N GLY A 93 -16.187 10.475 -25.535 1.00 0.00 N ATOM 1467 CA GLY A 93 -17.326 10.831 -24.698 1.00 0.00 C ATOM 1468 C GLY A 93 -18.012 12.098 -25.199 1.00 0.00 C ATOM 1469 O GLY A 93 -17.819 12.511 -26.346 1.00 0.00 O ATOM 0 H GLY A 93 -15.301 10.810 -25.156 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.041 10.009 -24.686 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -16.992 10.978 -23.671 1.00 0.00 H new ATOM 1473 N ALA A 94 -18.802 12.740 -24.340 1.00 0.00 N ATOM 1474 CA ALA A 94 -19.271 14.113 -24.505 1.00 0.00 C ATOM 1475 C ALA A 94 -19.044 14.844 -23.180 1.00 0.00 C ATOM 1476 O ALA A 94 -18.834 14.195 -22.153 1.00 0.00 O ATOM 1477 CB ALA A 94 -20.751 14.119 -24.906 1.00 0.00 C ATOM 0 H ALA A 94 -19.144 12.304 -23.483 1.00 0.00 H new ATOM 0 HA ALA A 94 -18.723 14.620 -25.299 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -21.091 15.148 -25.027 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -20.875 13.583 -25.847 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -21.340 13.631 -24.130 1.00 0.00 H new ATOM 1483 N SER A 95 -19.043 16.174 -23.180 1.00 0.00 N ATOM 1484 CA SER A 95 -18.982 16.949 -21.947 1.00 0.00 C ATOM 1485 C SER A 95 -20.341 16.881 -21.254 1.00 0.00 C ATOM 1486 O SER A 95 -21.341 17.289 -21.848 1.00 0.00 O ATOM 1487 CB SER A 95 -18.563 18.399 -22.233 1.00 0.00 C ATOM 1488 OG SER A 95 -18.930 18.819 -23.543 1.00 0.00 O ATOM 0 H SER A 95 -19.084 16.740 -24.028 1.00 0.00 H new ATOM 0 HA SER A 95 -18.226 16.527 -21.284 1.00 0.00 H new ATOM 0 HB2 SER A 95 -19.025 19.060 -21.499 1.00 0.00 H new ATOM 0 HB3 SER A 95 -17.484 18.494 -22.113 1.00 0.00 H new ATOM 0 HG SER A 95 -18.646 19.747 -23.681 1.00 0.00 H new ATOM 1494 N SER A 96 -20.376 16.393 -20.012 1.00 0.00 N ATOM 1495 CA SER A 96 -21.497 16.666 -19.123 1.00 0.00 C ATOM 1496 C SER A 96 -21.552 18.180 -18.878 1.00 0.00 C ATOM 1497 O SER A 96 -20.530 18.867 -18.962 1.00 0.00 O ATOM 1498 CB SER A 96 -21.313 15.877 -17.817 1.00 0.00 C ATOM 1499 OG SER A 96 -22.446 15.983 -16.970 1.00 0.00 O ATOM 0 H SER A 96 -19.644 15.811 -19.605 1.00 0.00 H new ATOM 0 HA SER A 96 -22.442 16.350 -19.565 1.00 0.00 H new ATOM 0 HB2 SER A 96 -21.131 14.828 -18.050 1.00 0.00 H new ATOM 0 HB3 SER A 96 -20.432 16.245 -17.292 1.00 0.00 H new ATOM 0 HG SER A 96 -22.292 15.467 -16.151 1.00 0.00 H new ATOM 1505 N GLY A 97 -22.729 18.698 -18.523 1.00 0.00 N ATOM 1506 CA GLY A 97 -22.852 20.087 -18.107 1.00 0.00 C ATOM 1507 C GLY A 97 -22.253 20.276 -16.707 1.00 0.00 C ATOM 1508 O GLY A 97 -22.332 19.343 -15.895 1.00 0.00 O ATOM 0 H GLY A 97 -23.605 18.175 -18.517 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -22.341 20.734 -18.820 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -23.901 20.382 -18.104 1.00 0.00 H new ATOM 1512 N PRO A 98 -21.682 21.455 -16.402 1.00 0.00 N ATOM 1513 CA PRO A 98 -21.374 21.891 -15.044 1.00 0.00 C ATOM 1514 C PRO A 98 -22.633 22.454 -14.356 1.00 0.00 C ATOM 1515 O PRO A 98 -23.699 22.544 -14.969 1.00 0.00 O ATOM 1516 CB PRO A 98 -20.309 22.977 -15.236 1.00 0.00 C ATOM 1517 CG PRO A 98 -20.756 23.659 -16.528 1.00 0.00 C ATOM 1518 CD PRO A 98 -21.320 22.501 -17.353 1.00 0.00 C ATOM 0 HA PRO A 98 -21.025 21.079 -14.406 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -20.285 23.673 -14.398 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -19.309 22.552 -15.327 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -21.509 24.425 -16.340 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -19.924 24.148 -17.035 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -22.189 22.821 -17.928 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -20.582 22.137 -18.068 1.00 0.00 H new ATOM 1526 N SER A 99 -22.496 22.901 -13.107 1.00 0.00 N ATOM 1527 CA SER A 99 -23.431 23.786 -12.427 1.00 0.00 C ATOM 1528 C SER A 99 -22.645 24.881 -11.696 1.00 0.00 C ATOM 1529 O SER A 99 -21.423 24.775 -11.525 1.00 0.00 O ATOM 1530 CB SER A 99 -24.327 22.974 -11.478 1.00 0.00 C ATOM 1531 OG SER A 99 -23.572 22.227 -10.537 1.00 0.00 O ATOM 0 H SER A 99 -21.700 22.645 -12.523 1.00 0.00 H new ATOM 0 HA SER A 99 -24.089 24.271 -13.148 1.00 0.00 H new ATOM 0 HB2 SER A 99 -24.999 23.650 -10.948 1.00 0.00 H new ATOM 0 HB3 SER A 99 -24.951 22.296 -12.061 1.00 0.00 H new ATOM 0 HG SER A 99 -24.180 21.727 -9.953 1.00 0.00 H new ATOM 1537 N SER A 100 -23.338 25.922 -11.246 1.00 0.00 N ATOM 1538 CA SER A 100 -22.803 27.041 -10.488 1.00 0.00 C ATOM 1539 C SER A 100 -23.918 27.556 -9.564 1.00 0.00 C ATOM 1540 O SER A 100 -24.914 26.855 -9.352 1.00 0.00 O ATOM 1541 CB SER A 100 -22.263 28.094 -11.475 1.00 0.00 C ATOM 1542 OG SER A 100 -23.260 28.555 -12.364 1.00 0.00 O ATOM 0 H SER A 100 -24.341 26.010 -11.411 1.00 0.00 H new ATOM 0 HA SER A 100 -21.962 26.760 -9.854 1.00 0.00 H new ATOM 0 HB2 SER A 100 -21.858 28.938 -10.917 1.00 0.00 H new ATOM 0 HB3 SER A 100 -21.440 27.665 -12.046 1.00 0.00 H new ATOM 0 HG SER A 100 -23.494 29.480 -12.141 1.00 0.00 H new ATOM 1548 N GLY A 101 -23.745 28.752 -9.005 1.00 0.00 N ATOM 1549 CA GLY A 101 -24.860 29.649 -8.750 1.00 0.00 C ATOM 1550 C GLY A 101 -24.791 30.743 -9.804 1.00 0.00 C ATOM 1551 O GLY A 101 -24.194 30.469 -10.874 1.00 0.00 O ATOM 0 H GLY A 101 -22.837 29.120 -8.720 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -25.808 29.114 -8.809 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -24.795 30.073 -7.748 1.00 0.00 H new TER 1555 GLY A 101