USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1069 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 76 GLN : amide:sc= 0.99 K(o=3.4,f=-5.2!) USER MOD Set 1.2: A 131 LYS NZ :NH3+ 165:sc= 2.37 (180deg=1.2) USER MOD Set 2.1: A 51 SER OG : rot -90:sc= 0 USER MOD Set 2.2: A 126 HIS : no HD1:sc= 0.701 K(o=0.7,f=-2.2!) USER MOD Set 3.1: A 77 TYR OH : rot -3:sc= 1.11 USER MOD Set 3.2: A 120 ASN : amide:sc= 0.946 X(o=2.1,f=2.1) USER MOD Set 4.1: A 59 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.18) USER MOD Set 4.2: A 71 GLN : amide:sc= 0.684 K(o=1.9,f=1.1) USER MOD Set 5.1: A 7 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 44 THR OG1 : rot -154:sc= 0.773 USER MOD Set 6.2: A 63 LYS NZ :NH3+ 142:sc= 0.881 (180deg=0) USER MOD Set 7.1: A 9 SER OG : rot 180:sc= 1.08 USER MOD Set 7.2: A 52 LYS NZ :NH3+ 146:sc= 1.21 (180deg=0) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 175:sc= 0 (180deg=-0.0419) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A -1 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ -102:sc= 0.044 (180deg=0) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.192 USER MOD Single : A 14 LYS NZ :NH3+ 171:sc= 2.46 (180deg=2.38) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 30:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0.00871 USER MOD Single : A 28 ASN : amide:sc= 1.08 K(o=1.1,f=-0.0048) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -170:sc= 1.2 (180deg=1.11) USER MOD Single : A 40 GLN : amide:sc= -0.151 K(o=-0.15,f=-0.77) USER MOD Single : A 50 THR OG1 : rot 37:sc= 0.928 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0.135 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 30:sc= 0.316 USER MOD Single : A 97 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 100 THR OG1 : rot -37:sc= 0.346 USER MOD Single : A 103 SER OG : rot -90:sc= 0.688 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -84:sc= 1.24 USER MOD Single : A 124 GLN : amide:sc= 0.69 K(o=0.69,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 162:sc= 1.22 (180deg=1.11) USER MOD Single : A 132 GLN : amide:sc= 0.906 K(o=0.91,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -9.539 33.171 17.892 1.00 0.00 N ATOM 2 CA GLY A -4 -8.965 32.487 16.712 1.00 0.00 C ATOM 3 C GLY A -4 -7.443 32.522 16.728 1.00 0.00 C ATOM 4 O GLY A -4 -6.846 33.439 17.295 1.00 0.00 O ATOM 0 H1 GLY A -4 -9.848 32.462 18.588 1.00 0.00 H new ATOM 0 H2 GLY A -4 -8.819 33.787 18.321 1.00 0.00 H new ATOM 0 H3 GLY A -4 -10.355 33.745 17.598 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -9.305 31.452 16.690 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -9.331 32.962 15.802 1.00 0.00 H new ATOM 10 N SER A -3 -6.810 31.534 16.086 1.00 0.00 N ATOM 11 CA SER A -3 -5.345 31.352 16.028 1.00 0.00 C ATOM 12 C SER A -3 -4.867 31.058 14.593 1.00 0.00 C ATOM 13 O SER A -3 -5.592 30.398 13.840 1.00 0.00 O ATOM 14 CB SER A -3 -4.911 30.211 16.960 1.00 0.00 C ATOM 15 OG SER A -3 -5.264 30.495 18.306 1.00 0.00 O ATOM 0 H SER A -3 -7.316 30.812 15.573 1.00 0.00 H new ATOM 0 HA SER A -3 -4.886 32.285 16.356 1.00 0.00 H new ATOM 0 HB2 SER A -3 -5.382 29.280 16.645 1.00 0.00 H new ATOM 0 HB3 SER A -3 -3.833 30.065 16.885 1.00 0.00 H new ATOM 0 HG SER A -3 -4.980 29.755 18.882 1.00 0.00 H new ATOM 21 N PRO A -2 -3.650 31.484 14.193 1.00 0.00 N ATOM 22 CA PRO A -2 -3.143 31.322 12.821 1.00 0.00 C ATOM 23 C PRO A -2 -2.678 29.894 12.482 1.00 0.00 C ATOM 24 O PRO A -2 -2.406 29.597 11.319 1.00 0.00 O ATOM 25 CB PRO A -2 -1.990 32.328 12.713 1.00 0.00 C ATOM 26 CG PRO A -2 -1.437 32.373 14.135 1.00 0.00 C ATOM 27 CD PRO A -2 -2.700 32.256 14.987 1.00 0.00 C ATOM 0 HA PRO A -2 -3.940 31.504 12.100 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -1.236 32.002 11.997 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -2.339 33.307 12.385 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -0.742 31.555 14.326 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -0.900 33.301 14.332 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -2.488 31.759 15.933 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -3.101 33.241 15.227 1.00 0.00 H new ATOM 35 N ASN A -1 -2.587 28.993 13.468 1.00 0.00 N ATOM 36 CA ASN A -1 -2.031 27.641 13.312 1.00 0.00 C ATOM 37 C ASN A -1 -2.785 26.781 12.275 1.00 0.00 C ATOM 38 O ASN A -1 -2.176 25.943 11.606 1.00 0.00 O ATOM 39 CB ASN A -1 -2.026 26.958 14.694 1.00 0.00 C ATOM 40 CG ASN A -1 -1.156 27.669 15.722 1.00 0.00 C ATOM 41 OD1 ASN A -1 -0.113 28.234 15.423 1.00 0.00 O ATOM 42 ND2 ASN A -1 -1.563 27.680 16.972 1.00 0.00 N ATOM 0 H ASN A -1 -2.905 29.187 14.418 1.00 0.00 H new ATOM 0 HA ASN A -1 -1.017 27.736 12.923 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -3.048 26.907 15.069 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -1.676 25.932 14.582 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -1.010 28.157 17.684 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -2.432 27.211 17.230 1.00 0.00 H new ATOM 49 N SER A 0 -4.085 27.030 12.075 1.00 0.00 N ATOM 50 CA SER A 0 -4.916 26.358 11.062 1.00 0.00 C ATOM 51 C SER A 0 -4.472 26.623 9.614 1.00 0.00 C ATOM 52 O SER A 0 -4.779 25.832 8.722 1.00 0.00 O ATOM 53 CB SER A 0 -6.381 26.771 11.239 1.00 0.00 C ATOM 54 OG SER A 0 -6.517 28.180 11.119 1.00 0.00 O ATOM 0 H SER A 0 -4.602 27.718 12.623 1.00 0.00 H new ATOM 0 HA SER A 0 -4.793 25.288 11.227 1.00 0.00 H new ATOM 0 HB2 SER A 0 -6.998 26.275 10.490 1.00 0.00 H new ATOM 0 HB3 SER A 0 -6.741 26.446 12.215 1.00 0.00 H new ATOM 0 HG SER A 0 -7.458 28.429 11.233 1.00 0.00 H new ATOM 60 N MET A 1 -3.689 27.682 9.372 1.00 0.00 N ATOM 61 CA MET A 1 -3.096 28.004 8.064 1.00 0.00 C ATOM 62 C MET A 1 -1.883 27.114 7.708 1.00 0.00 C ATOM 63 O MET A 1 -1.333 27.240 6.612 1.00 0.00 O ATOM 64 CB MET A 1 -2.712 29.496 8.014 1.00 0.00 C ATOM 65 CG MET A 1 -3.894 30.434 8.300 1.00 0.00 C ATOM 66 SD MET A 1 -3.488 32.206 8.320 1.00 0.00 S ATOM 67 CE MET A 1 -3.132 32.495 6.564 1.00 0.00 C ATOM 0 H MET A 1 -3.443 28.356 10.097 1.00 0.00 H new ATOM 0 HA MET A 1 -3.855 27.795 7.310 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.922 29.686 8.740 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.303 29.727 7.030 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.664 30.262 7.548 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.325 30.165 9.264 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.953 33.557 6.399 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.247 31.928 6.274 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.982 32.173 5.963 1.00 0.00 H new ATOM 77 N ALA A 2 -1.464 26.218 8.613 1.00 0.00 N ATOM 78 CA ALA A 2 -0.326 25.309 8.441 1.00 0.00 C ATOM 79 C ALA A 2 -0.650 23.861 8.868 1.00 0.00 C ATOM 80 O ALA A 2 -0.227 22.917 8.196 1.00 0.00 O ATOM 81 CB ALA A 2 0.857 25.876 9.237 1.00 0.00 C ATOM 0 H ALA A 2 -1.925 26.104 9.516 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.077 25.249 7.382 1.00 0.00 H new ATOM 0 HB1 ALA A 2 1.719 25.218 9.126 1.00 0.00 H new ATOM 0 HB2 ALA A 2 1.107 26.868 8.860 1.00 0.00 H new ATOM 0 HB3 ALA A 2 0.587 25.946 10.291 1.00 0.00 H new ATOM 87 N THR A 3 -1.430 23.685 9.942 1.00 0.00 N ATOM 88 CA THR A 3 -1.828 22.378 10.494 1.00 0.00 C ATOM 89 C THR A 3 -3.306 22.397 10.888 1.00 0.00 C ATOM 90 O THR A 3 -3.695 23.021 11.875 1.00 0.00 O ATOM 91 CB THR A 3 -0.958 22.004 11.710 1.00 0.00 C ATOM 92 OG1 THR A 3 0.417 22.035 11.376 1.00 0.00 O ATOM 93 CG2 THR A 3 -1.260 20.588 12.204 1.00 0.00 C ATOM 0 H THR A 3 -1.814 24.470 10.468 1.00 0.00 H new ATOM 0 HA THR A 3 -1.677 21.623 9.722 1.00 0.00 H new ATOM 0 HB THR A 3 -1.190 22.734 12.485 1.00 0.00 H new ATOM 0 HG1 THR A 3 0.950 21.796 12.163 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.628 20.359 13.062 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.308 20.521 12.497 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.060 19.874 11.405 1.00 0.00 H new ATOM 101 N GLU A 4 -4.139 21.695 10.117 1.00 0.00 N ATOM 102 CA GLU A 4 -5.593 21.572 10.341 1.00 0.00 C ATOM 103 C GLU A 4 -6.152 20.163 10.032 1.00 0.00 C ATOM 104 O GLU A 4 -7.354 19.982 9.826 1.00 0.00 O ATOM 105 CB GLU A 4 -6.341 22.698 9.596 1.00 0.00 C ATOM 106 CG GLU A 4 -6.105 22.702 8.074 1.00 0.00 C ATOM 107 CD GLU A 4 -6.973 23.727 7.307 1.00 0.00 C ATOM 108 OE1 GLU A 4 -7.990 24.238 7.841 1.00 0.00 O ATOM 109 OE2 GLU A 4 -6.667 23.997 6.119 1.00 0.00 O ATOM 0 H GLU A 4 -3.819 21.180 9.296 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.771 21.697 11.409 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.409 22.600 9.788 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.030 23.660 10.005 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.054 22.914 7.880 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.307 21.705 7.682 1.00 0.00 H new ATOM 116 N LEU A 5 -5.277 19.149 9.993 1.00 0.00 N ATOM 117 CA LEU A 5 -5.617 17.762 9.680 1.00 0.00 C ATOM 118 C LEU A 5 -6.269 17.065 10.893 1.00 0.00 C ATOM 119 O LEU A 5 -5.591 16.576 11.798 1.00 0.00 O ATOM 120 CB LEU A 5 -4.346 17.052 9.158 1.00 0.00 C ATOM 121 CG LEU A 5 -4.644 15.969 8.111 1.00 0.00 C ATOM 122 CD1 LEU A 5 -3.338 15.326 7.643 1.00 0.00 C ATOM 123 CD2 LEU A 5 -5.576 14.862 8.605 1.00 0.00 C ATOM 0 H LEU A 5 -4.284 19.280 10.185 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.369 17.717 8.892 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.676 17.794 8.723 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.819 16.600 9.998 1.00 0.00 H new ATOM 0 HG LEU A 5 -5.156 16.481 7.296 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -3.556 14.559 6.900 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.696 16.087 7.200 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.830 14.873 8.494 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -5.736 14.138 7.806 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -5.125 14.363 9.463 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -6.532 15.295 8.899 1.00 0.00 H new ATOM 135 N GLU A 6 -7.603 17.035 10.909 1.00 0.00 N ATOM 136 CA GLU A 6 -8.433 16.438 11.970 1.00 0.00 C ATOM 137 C GLU A 6 -9.597 15.628 11.357 1.00 0.00 C ATOM 138 O GLU A 6 -10.773 15.809 11.683 1.00 0.00 O ATOM 139 CB GLU A 6 -8.869 17.544 12.954 1.00 0.00 C ATOM 140 CG GLU A 6 -9.327 16.987 14.311 1.00 0.00 C ATOM 141 CD GLU A 6 -9.696 18.128 15.279 1.00 0.00 C ATOM 142 OE1 GLU A 6 -8.815 18.587 16.048 1.00 0.00 O ATOM 143 OE2 GLU A 6 -10.872 18.569 15.291 1.00 0.00 O ATOM 0 H GLU A 6 -8.161 17.440 10.157 1.00 0.00 H new ATOM 0 HA GLU A 6 -7.861 15.714 12.550 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.039 18.233 13.111 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.681 18.120 12.510 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -10.188 16.333 14.168 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.533 16.379 14.745 1.00 0.00 H new ATOM 150 N TYR A 7 -9.263 14.768 10.389 1.00 0.00 N ATOM 151 CA TYR A 7 -10.187 13.998 9.556 1.00 0.00 C ATOM 152 C TYR A 7 -9.510 12.718 9.054 1.00 0.00 C ATOM 153 O TYR A 7 -8.294 12.697 8.870 1.00 0.00 O ATOM 154 CB TYR A 7 -10.633 14.857 8.360 1.00 0.00 C ATOM 155 CG TYR A 7 -9.520 15.327 7.429 1.00 0.00 C ATOM 156 CD1 TYR A 7 -9.061 16.658 7.492 1.00 0.00 C ATOM 157 CD2 TYR A 7 -8.979 14.451 6.463 1.00 0.00 C ATOM 158 CE1 TYR A 7 -8.079 17.114 6.589 1.00 0.00 C ATOM 159 CE2 TYR A 7 -8.021 14.908 5.543 1.00 0.00 C ATOM 160 CZ TYR A 7 -7.562 16.242 5.606 1.00 0.00 C ATOM 161 OH TYR A 7 -6.638 16.685 4.709 1.00 0.00 O ATOM 0 H TYR A 7 -8.288 14.582 10.155 1.00 0.00 H new ATOM 0 HA TYR A 7 -11.057 13.721 10.151 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -11.353 14.285 7.775 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -11.156 15.734 8.742 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.463 17.331 8.235 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -9.304 13.422 6.431 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.722 18.131 6.649 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -7.636 14.239 4.788 1.00 0.00 H new ATOM 0 HH TYR A 7 -6.391 15.953 4.106 1.00 0.00 H new ATOM 171 N GLU A 8 -10.296 11.666 8.804 1.00 0.00 N ATOM 172 CA GLU A 8 -9.909 10.472 8.043 1.00 0.00 C ATOM 173 C GLU A 8 -11.119 9.525 7.982 1.00 0.00 C ATOM 174 O GLU A 8 -11.614 9.075 9.019 1.00 0.00 O ATOM 175 CB GLU A 8 -8.733 9.741 8.739 1.00 0.00 C ATOM 176 CG GLU A 8 -7.436 9.769 7.921 1.00 0.00 C ATOM 177 CD GLU A 8 -6.250 9.270 8.765 1.00 0.00 C ATOM 178 OE1 GLU A 8 -5.200 9.955 8.806 1.00 0.00 O ATOM 179 OE2 GLU A 8 -6.360 8.193 9.398 1.00 0.00 O ATOM 0 H GLU A 8 -11.258 11.620 9.139 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.594 10.768 7.042 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.552 10.200 9.711 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -9.016 8.705 8.924 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -7.546 9.145 7.034 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -7.241 10.784 7.574 1.00 0.00 H new ATOM 186 N SER A 9 -11.594 9.201 6.778 1.00 0.00 N ATOM 187 CA SER A 9 -12.606 8.158 6.570 1.00 0.00 C ATOM 188 C SER A 9 -11.931 6.831 6.234 1.00 0.00 C ATOM 189 O SER A 9 -11.376 6.670 5.151 1.00 0.00 O ATOM 190 CB SER A 9 -13.582 8.564 5.464 1.00 0.00 C ATOM 191 OG SER A 9 -14.531 9.481 5.988 1.00 0.00 O ATOM 0 H SER A 9 -11.289 9.654 5.917 1.00 0.00 H new ATOM 0 HA SER A 9 -13.174 8.036 7.492 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.040 9.018 4.634 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.089 7.684 5.070 1.00 0.00 H new ATOM 0 HG SER A 9 -15.157 9.744 5.281 1.00 0.00 H new ATOM 197 N VAL A 10 -11.947 5.880 7.169 1.00 0.00 N ATOM 198 CA VAL A 10 -11.386 4.521 6.992 1.00 0.00 C ATOM 199 C VAL A 10 -12.162 3.727 5.924 1.00 0.00 C ATOM 200 O VAL A 10 -13.376 3.881 5.778 1.00 0.00 O ATOM 201 CB VAL A 10 -11.349 3.774 8.345 1.00 0.00 C ATOM 202 CG1 VAL A 10 -10.736 2.374 8.236 1.00 0.00 C ATOM 203 CG2 VAL A 10 -10.521 4.537 9.392 1.00 0.00 C ATOM 0 H VAL A 10 -12.356 6.026 8.092 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.362 4.618 6.632 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.393 3.699 8.648 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -10.737 1.899 9.217 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.323 1.773 7.541 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.711 2.453 7.872 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -10.518 3.981 10.329 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.498 4.650 9.034 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -10.959 5.522 9.555 1.00 0.00 H new ATOM 213 N LEU A 11 -11.449 2.876 5.177 1.00 0.00 N ATOM 214 CA LEU A 11 -11.937 2.132 4.004 1.00 0.00 C ATOM 215 C LEU A 11 -11.612 0.631 4.088 1.00 0.00 C ATOM 216 O LEU A 11 -12.447 -0.200 3.730 1.00 0.00 O ATOM 217 CB LEU A 11 -11.307 2.726 2.728 1.00 0.00 C ATOM 218 CG LEU A 11 -11.700 4.169 2.366 1.00 0.00 C ATOM 219 CD1 LEU A 11 -10.918 4.594 1.122 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.194 4.304 2.058 1.00 0.00 C ATOM 0 H LEU A 11 -10.470 2.676 5.381 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.022 2.229 3.977 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.223 2.686 2.834 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.569 2.082 1.889 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.470 4.799 3.225 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.187 5.616 0.854 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.849 4.543 1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.160 3.927 0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.422 5.340 1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.451 3.663 1.215 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.774 4.005 2.931 1.00 0.00 H new ATOM 232 N CYS A 12 -10.416 0.279 4.575 1.00 0.00 N ATOM 233 CA CYS A 12 -9.996 -1.100 4.839 1.00 0.00 C ATOM 234 C CYS A 12 -8.956 -1.142 5.962 1.00 0.00 C ATOM 235 O CYS A 12 -8.023 -0.340 5.984 1.00 0.00 O ATOM 236 CB CYS A 12 -9.415 -1.715 3.558 1.00 0.00 C ATOM 237 SG CYS A 12 -9.099 -3.490 3.777 1.00 0.00 S ATOM 0 H CYS A 12 -9.696 0.965 4.802 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.864 -1.678 5.156 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -10.108 -1.564 2.731 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.488 -1.206 3.294 1.00 0.00 H new ATOM 0 HG CYS A 12 -8.611 -3.983 2.678 1.00 0.00 H new ATOM 243 N VAL A 13 -9.101 -2.108 6.868 1.00 0.00 N ATOM 244 CA VAL A 13 -8.124 -2.425 7.918 1.00 0.00 C ATOM 245 C VAL A 13 -7.835 -3.927 7.902 1.00 0.00 C ATOM 246 O VAL A 13 -8.758 -4.741 7.975 1.00 0.00 O ATOM 247 CB VAL A 13 -8.615 -1.938 9.298 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.682 -2.350 10.446 1.00 0.00 C ATOM 249 CG2 VAL A 13 -8.730 -0.407 9.321 1.00 0.00 C ATOM 0 H VAL A 13 -9.923 -2.711 6.896 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.192 -1.896 7.720 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.586 -2.410 9.448 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.081 -1.979 11.390 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.611 -3.437 10.485 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.691 -1.927 10.279 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.078 -0.083 10.302 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.754 0.034 9.118 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.440 -0.084 8.560 1.00 0.00 H new ATOM 259 N LYS A 14 -6.549 -4.290 7.821 1.00 0.00 N ATOM 260 CA LYS A 14 -6.038 -5.672 7.903 1.00 0.00 C ATOM 261 C LYS A 14 -4.943 -5.772 8.982 1.00 0.00 C ATOM 262 O LYS A 14 -4.078 -4.895 9.027 1.00 0.00 O ATOM 263 CB LYS A 14 -5.517 -6.169 6.535 1.00 0.00 C ATOM 264 CG LYS A 14 -6.551 -6.183 5.394 1.00 0.00 C ATOM 265 CD LYS A 14 -7.668 -7.217 5.596 1.00 0.00 C ATOM 266 CE LYS A 14 -8.588 -7.256 4.375 1.00 0.00 C ATOM 267 NZ LYS A 14 -9.632 -8.301 4.518 1.00 0.00 N ATOM 0 H LYS A 14 -5.804 -3.606 7.692 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.866 -6.321 8.186 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.680 -5.539 6.235 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.127 -7.179 6.660 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.995 -5.192 5.304 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.040 -6.390 4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.234 -8.203 5.763 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.246 -6.968 6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.061 -6.283 4.242 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -7.998 -7.449 3.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.328 -8.203 3.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.191 -9.242 4.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.109 -8.192 5.435 1.00 0.00 H new ATOM 281 N PRO A 15 -4.940 -6.810 9.839 1.00 0.00 N ATOM 282 CA PRO A 15 -4.025 -6.904 10.983 1.00 0.00 C ATOM 283 C PRO A 15 -2.596 -7.355 10.638 1.00 0.00 C ATOM 284 O PRO A 15 -1.700 -7.202 11.466 1.00 0.00 O ATOM 285 CB PRO A 15 -4.676 -7.917 11.925 1.00 0.00 C ATOM 286 CG PRO A 15 -5.441 -8.837 10.975 1.00 0.00 C ATOM 287 CD PRO A 15 -5.924 -7.883 9.890 1.00 0.00 C ATOM 0 HA PRO A 15 -3.892 -5.912 11.414 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -3.932 -8.465 12.504 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.342 -7.432 12.639 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.801 -9.620 10.568 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.272 -9.333 11.476 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.000 -8.390 8.928 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.915 -7.494 10.124 1.00 0.00 H new ATOM 295 N ASP A 16 -2.376 -7.922 9.448 1.00 0.00 N ATOM 296 CA ASP A 16 -1.084 -8.460 9.014 1.00 0.00 C ATOM 297 C ASP A 16 -0.716 -7.941 7.618 1.00 0.00 C ATOM 298 O ASP A 16 -1.281 -8.362 6.603 1.00 0.00 O ATOM 299 CB ASP A 16 -1.110 -9.997 9.045 1.00 0.00 C ATOM 300 CG ASP A 16 -1.071 -10.551 10.479 1.00 0.00 C ATOM 301 OD1 ASP A 16 0.027 -10.570 11.086 1.00 0.00 O ATOM 302 OD2 ASP A 16 -2.124 -11.007 10.988 1.00 0.00 O ATOM 0 H ASP A 16 -3.108 -8.022 8.744 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.315 -8.117 9.707 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.010 -10.353 8.544 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.259 -10.384 8.485 1.00 0.00 H new ATOM 307 N VAL A 17 0.261 -7.034 7.577 1.00 0.00 N ATOM 308 CA VAL A 17 0.918 -6.542 6.357 1.00 0.00 C ATOM 309 C VAL A 17 2.422 -6.380 6.601 1.00 0.00 C ATOM 310 O VAL A 17 2.851 -5.971 7.687 1.00 0.00 O ATOM 311 CB VAL A 17 0.244 -5.255 5.828 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.430 -4.034 6.735 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.733 -4.888 4.425 1.00 0.00 C ATOM 0 H VAL A 17 0.633 -6.603 8.423 1.00 0.00 H new ATOM 0 HA VAL A 17 0.797 -7.281 5.565 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.817 -5.502 5.807 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.072 -3.173 6.294 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.001 -4.241 7.716 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.493 -3.819 6.842 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.234 -3.978 4.092 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.810 -4.724 4.447 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.503 -5.700 3.736 1.00 0.00 H new ATOM 323 N SER A 18 3.228 -6.720 5.596 1.00 0.00 N ATOM 324 CA SER A 18 4.691 -6.800 5.699 1.00 0.00 C ATOM 325 C SER A 18 5.365 -5.919 4.651 1.00 0.00 C ATOM 326 O SER A 18 5.079 -6.061 3.465 1.00 0.00 O ATOM 327 CB SER A 18 5.146 -8.253 5.529 1.00 0.00 C ATOM 328 OG SER A 18 4.542 -9.094 6.500 1.00 0.00 O ATOM 0 H SER A 18 2.878 -6.953 4.667 1.00 0.00 H new ATOM 0 HA SER A 18 4.984 -6.440 6.685 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.889 -8.603 4.529 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.231 -8.310 5.618 1.00 0.00 H new ATOM 0 HG SER A 18 4.847 -10.016 6.369 1.00 0.00 H new ATOM 334 N VAL A 19 6.257 -5.021 5.077 1.00 0.00 N ATOM 335 CA VAL A 19 7.000 -4.090 4.211 1.00 0.00 C ATOM 336 C VAL A 19 8.336 -4.663 3.785 1.00 0.00 C ATOM 337 O VAL A 19 9.111 -5.168 4.600 1.00 0.00 O ATOM 338 CB VAL A 19 7.193 -2.708 4.859 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.126 -1.777 4.063 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.848 -1.991 4.968 1.00 0.00 C ATOM 0 H VAL A 19 6.492 -4.915 6.064 1.00 0.00 H new ATOM 0 HA VAL A 19 6.385 -3.953 3.321 1.00 0.00 H new ATOM 0 HB VAL A 19 7.642 -2.905 5.832 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.214 -0.822 4.580 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.111 -2.236 3.977 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.714 -1.614 3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.993 -1.013 5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.421 -1.864 3.973 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.169 -2.583 5.581 1.00 0.00 H new ATOM 350 N TYR A 20 8.631 -4.475 2.505 1.00 0.00 N ATOM 351 CA TYR A 20 9.929 -4.721 1.907 1.00 0.00 C ATOM 352 C TYR A 20 10.392 -3.463 1.169 1.00 0.00 C ATOM 353 O TYR A 20 9.683 -2.918 0.318 1.00 0.00 O ATOM 354 CB TYR A 20 9.864 -5.929 0.963 1.00 0.00 C ATOM 355 CG TYR A 20 8.855 -7.004 1.328 1.00 0.00 C ATOM 356 CD1 TYR A 20 9.139 -7.933 2.344 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.615 -7.046 0.667 1.00 0.00 C ATOM 358 CE1 TYR A 20 8.186 -8.905 2.704 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.670 -8.034 1.001 1.00 0.00 C ATOM 360 CZ TYR A 20 6.949 -8.963 2.024 1.00 0.00 C ATOM 361 OH TYR A 20 6.032 -9.920 2.335 1.00 0.00 O ATOM 0 H TYR A 20 7.944 -4.134 1.833 1.00 0.00 H new ATOM 0 HA TYR A 20 10.653 -4.954 2.688 1.00 0.00 H new ATOM 0 HB2 TYR A 20 9.636 -5.569 -0.040 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.853 -6.386 0.920 1.00 0.00 H new ATOM 0 HD1 TYR A 20 10.092 -7.901 2.851 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.387 -6.319 -0.098 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.400 -9.605 3.498 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.729 -8.081 0.473 1.00 0.00 H new ATOM 0 HH TYR A 20 6.121 -10.164 3.280 1.00 0.00 H new ATOM 371 N ARG A 21 11.611 -3.021 1.460 1.00 0.00 N ATOM 372 CA ARG A 21 12.363 -2.115 0.579 1.00 0.00 C ATOM 373 C ARG A 21 12.684 -2.839 -0.733 1.00 0.00 C ATOM 374 O ARG A 21 13.112 -3.995 -0.721 1.00 0.00 O ATOM 375 CB ARG A 21 13.630 -1.602 1.280 1.00 0.00 C ATOM 376 CG ARG A 21 13.280 -0.592 2.386 1.00 0.00 C ATOM 377 CD ARG A 21 14.534 -0.031 3.065 1.00 0.00 C ATOM 378 NE ARG A 21 15.162 -1.021 3.963 1.00 0.00 N ATOM 379 CZ ARG A 21 16.143 -0.817 4.817 1.00 0.00 C ATOM 380 NH1 ARG A 21 16.487 -1.785 5.611 1.00 0.00 N ATOM 381 NH2 ARG A 21 16.779 0.317 4.907 1.00 0.00 N ATOM 0 H ARG A 21 12.111 -3.277 2.311 1.00 0.00 H new ATOM 0 HA ARG A 21 11.756 -1.239 0.348 1.00 0.00 H new ATOM 0 HB2 ARG A 21 14.177 -2.441 1.709 1.00 0.00 H new ATOM 0 HB3 ARG A 21 14.289 -1.132 0.550 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.701 0.227 1.960 1.00 0.00 H new ATOM 0 HG3 ARG A 21 12.648 -1.075 3.132 1.00 0.00 H new ATOM 0 HD2 ARG A 21 15.252 0.277 2.305 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.271 0.860 3.634 1.00 0.00 H new ATOM 0 HE ARG A 21 14.794 -1.971 3.916 1.00 0.00 H new ATOM 0 HH11 ARG A 21 16.000 -2.680 5.565 1.00 0.00 H new ATOM 0 HH12 ARG A 21 17.244 -1.650 6.281 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.523 1.095 4.299 1.00 0.00 H new ATOM 0 HH22 ARG A 21 17.533 0.426 5.585 1.00 0.00 H new ATOM 395 N ILE A 22 12.454 -2.161 -1.858 1.00 0.00 N ATOM 396 CA ILE A 22 12.548 -2.736 -3.212 1.00 0.00 C ATOM 397 C ILE A 22 13.766 -2.205 -3.995 1.00 0.00 C ATOM 398 O ILE A 22 14.165 -1.052 -3.795 1.00 0.00 O ATOM 399 CB ILE A 22 11.226 -2.562 -4.002 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.830 -1.084 -4.209 1.00 0.00 C ATOM 401 CG2 ILE A 22 10.094 -3.357 -3.330 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.552 -0.919 -5.038 1.00 0.00 C ATOM 0 H ILE A 22 12.191 -1.175 -1.860 1.00 0.00 H new ATOM 0 HA ILE A 22 12.709 -3.807 -3.087 1.00 0.00 H new ATOM 0 HB ILE A 22 11.397 -2.965 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.690 -0.611 -3.237 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.648 -0.560 -4.703 1.00 0.00 H new ATOM 0 HG21 ILE A 22 9.172 -3.225 -3.896 1.00 0.00 H new ATOM 0 HG22 ILE A 22 10.357 -4.415 -3.305 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.950 -2.995 -2.312 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.325 0.141 -5.149 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.697 -1.364 -6.022 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.724 -1.416 -4.533 1.00 0.00 H new ATOM 414 N PRO A 23 14.365 -3.012 -4.893 1.00 0.00 N ATOM 415 CA PRO A 23 15.440 -2.571 -5.788 1.00 0.00 C ATOM 416 C PRO A 23 14.944 -1.575 -6.860 1.00 0.00 C ATOM 417 O PRO A 23 13.738 -1.504 -7.120 1.00 0.00 O ATOM 418 CB PRO A 23 15.973 -3.861 -6.428 1.00 0.00 C ATOM 419 CG PRO A 23 14.747 -4.772 -6.449 1.00 0.00 C ATOM 420 CD PRO A 23 14.042 -4.413 -5.148 1.00 0.00 C ATOM 0 HA PRO A 23 16.212 -2.029 -5.242 1.00 0.00 H new ATOM 0 HB2 PRO A 23 16.360 -3.683 -7.431 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.786 -4.294 -5.845 1.00 0.00 H new ATOM 0 HG2 PRO A 23 14.116 -4.582 -7.317 1.00 0.00 H new ATOM 0 HG3 PRO A 23 15.026 -5.825 -6.482 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.965 -4.556 -5.235 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.383 -5.048 -4.330 1.00 0.00 H new ATOM 428 N PRO A 24 15.848 -0.833 -7.534 1.00 0.00 N ATOM 429 CA PRO A 24 15.505 -0.042 -8.718 1.00 0.00 C ATOM 430 C PRO A 24 15.044 -0.969 -9.858 1.00 0.00 C ATOM 431 O PRO A 24 15.807 -1.808 -10.347 1.00 0.00 O ATOM 432 CB PRO A 24 16.772 0.751 -9.062 1.00 0.00 C ATOM 433 CG PRO A 24 17.904 -0.114 -8.507 1.00 0.00 C ATOM 434 CD PRO A 24 17.279 -0.752 -7.266 1.00 0.00 C ATOM 0 HA PRO A 24 14.673 0.641 -8.547 1.00 0.00 H new ATOM 0 HB2 PRO A 24 16.872 0.899 -10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 24 16.762 1.740 -8.603 1.00 0.00 H new ATOM 0 HG2 PRO A 24 18.227 -0.866 -9.227 1.00 0.00 H new ATOM 0 HG3 PRO A 24 18.781 0.483 -8.255 1.00 0.00 H new ATOM 0 HD2 PRO A 24 17.698 -1.741 -7.083 1.00 0.00 H new ATOM 0 HD3 PRO A 24 17.476 -0.152 -6.377 1.00 0.00 H new ATOM 442 N ARG A 25 13.769 -0.849 -10.247 1.00 0.00 N ATOM 443 CA ARG A 25 13.037 -1.822 -11.083 1.00 0.00 C ATOM 444 C ARG A 25 11.910 -1.179 -11.900 1.00 0.00 C ATOM 445 O ARG A 25 11.477 -0.062 -11.616 1.00 0.00 O ATOM 446 CB ARG A 25 12.441 -2.908 -10.159 1.00 0.00 C ATOM 447 CG ARG A 25 13.254 -4.198 -10.056 1.00 0.00 C ATOM 448 CD ARG A 25 13.258 -4.977 -11.372 1.00 0.00 C ATOM 449 NE ARG A 25 13.723 -6.354 -11.130 1.00 0.00 N ATOM 450 CZ ARG A 25 14.104 -7.260 -12.007 1.00 0.00 C ATOM 451 NH1 ARG A 25 14.467 -8.439 -11.596 1.00 0.00 N ATOM 452 NH2 ARG A 25 14.139 -7.025 -13.289 1.00 0.00 N ATOM 0 H ARG A 25 13.195 -0.048 -9.983 1.00 0.00 H new ATOM 0 HA ARG A 25 13.744 -2.246 -11.796 1.00 0.00 H new ATOM 0 HB2 ARG A 25 12.328 -2.489 -9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 25 11.441 -3.156 -10.515 1.00 0.00 H new ATOM 0 HG2 ARG A 25 14.279 -3.959 -9.773 1.00 0.00 H new ATOM 0 HG3 ARG A 25 12.842 -4.824 -9.265 1.00 0.00 H new ATOM 0 HD2 ARG A 25 12.256 -4.991 -11.801 1.00 0.00 H new ATOM 0 HD3 ARG A 25 13.908 -4.485 -12.096 1.00 0.00 H new ATOM 0 HE ARG A 25 13.754 -6.645 -10.153 1.00 0.00 H new ATOM 0 HH11 ARG A 25 14.456 -8.658 -10.600 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.763 -9.145 -12.270 1.00 0.00 H new ATOM 0 HH21 ARG A 25 13.865 -6.110 -13.648 1.00 0.00 H new ATOM 0 HH22 ARG A 25 14.441 -7.756 -13.933 1.00 0.00 H new ATOM 466 N ALA A 26 11.401 -1.931 -12.878 1.00 0.00 N ATOM 467 CA ALA A 26 10.219 -1.568 -13.656 1.00 0.00 C ATOM 468 C ALA A 26 8.920 -1.841 -12.873 1.00 0.00 C ATOM 469 O ALA A 26 8.648 -2.954 -12.417 1.00 0.00 O ATOM 470 CB ALA A 26 10.257 -2.281 -15.009 1.00 0.00 C ATOM 0 H ALA A 26 11.807 -2.825 -13.155 1.00 0.00 H new ATOM 0 HA ALA A 26 10.230 -0.494 -13.844 1.00 0.00 H new ATOM 0 HB1 ALA A 26 9.375 -2.009 -15.588 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.154 -1.983 -15.552 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.270 -3.360 -14.852 1.00 0.00 H new ATOM 476 N SER A 27 8.107 -0.801 -12.753 1.00 0.00 N ATOM 477 CA SER A 27 7.078 -0.624 -11.715 1.00 0.00 C ATOM 478 C SER A 27 5.767 -1.404 -11.888 1.00 0.00 C ATOM 479 O SER A 27 5.002 -1.541 -10.933 1.00 0.00 O ATOM 480 CB SER A 27 6.795 0.871 -11.559 1.00 0.00 C ATOM 481 OG SER A 27 6.400 1.434 -12.802 1.00 0.00 O ATOM 0 H SER A 27 8.141 -0.016 -13.403 1.00 0.00 H new ATOM 0 HA SER A 27 7.506 -1.064 -10.814 1.00 0.00 H new ATOM 0 HB2 SER A 27 6.010 1.023 -10.818 1.00 0.00 H new ATOM 0 HB3 SER A 27 7.686 1.379 -11.189 1.00 0.00 H new ATOM 0 HG SER A 27 6.221 2.390 -12.686 1.00 0.00 H new ATOM 487 N ASN A 28 5.520 -1.954 -13.078 1.00 0.00 N ATOM 488 CA ASN A 28 4.431 -2.905 -13.358 1.00 0.00 C ATOM 489 C ASN A 28 4.871 -4.053 -14.296 1.00 0.00 C ATOM 490 O ASN A 28 4.037 -4.746 -14.886 1.00 0.00 O ATOM 491 CB ASN A 28 3.185 -2.138 -13.841 1.00 0.00 C ATOM 492 CG ASN A 28 3.458 -1.167 -14.977 1.00 0.00 C ATOM 493 OD1 ASN A 28 3.762 -1.547 -16.101 1.00 0.00 O ATOM 494 ND2 ASN A 28 3.385 0.119 -14.719 1.00 0.00 N ATOM 0 H ASN A 28 6.086 -1.747 -13.901 1.00 0.00 H new ATOM 0 HA ASN A 28 4.158 -3.413 -12.433 1.00 0.00 H new ATOM 0 HB2 ASN A 28 2.432 -2.856 -14.164 1.00 0.00 H new ATOM 0 HB3 ASN A 28 2.761 -1.588 -13.001 1.00 0.00 H new ATOM 0 HD21 ASN A 28 3.581 0.799 -15.454 1.00 0.00 H new ATOM 0 HD22 ASN A 28 3.132 0.438 -13.784 1.00 0.00 H new ATOM 501 N ARG A 29 6.192 -4.250 -14.436 1.00 0.00 N ATOM 502 CA ARG A 29 6.825 -5.225 -15.351 1.00 0.00 C ATOM 503 C ARG A 29 7.942 -6.049 -14.708 1.00 0.00 C ATOM 504 O ARG A 29 8.194 -7.171 -15.144 1.00 0.00 O ATOM 505 CB ARG A 29 7.395 -4.506 -16.581 1.00 0.00 C ATOM 506 CG ARG A 29 6.370 -3.629 -17.308 1.00 0.00 C ATOM 507 CD ARG A 29 6.987 -3.150 -18.618 1.00 0.00 C ATOM 508 NE ARG A 29 6.082 -2.228 -19.331 1.00 0.00 N ATOM 509 CZ ARG A 29 6.281 -1.684 -20.518 1.00 0.00 C ATOM 510 NH1 ARG A 29 5.392 -0.883 -21.032 1.00 0.00 N ATOM 511 NH2 ARG A 29 7.357 -1.917 -21.217 1.00 0.00 N ATOM 0 H ARG A 29 6.876 -3.718 -13.898 1.00 0.00 H new ATOM 0 HA ARG A 29 6.032 -5.918 -15.630 1.00 0.00 H new ATOM 0 HB2 ARG A 29 8.237 -3.886 -16.272 1.00 0.00 H new ATOM 0 HB3 ARG A 29 7.785 -5.248 -17.277 1.00 0.00 H new ATOM 0 HG2 ARG A 29 5.458 -4.194 -17.503 1.00 0.00 H new ATOM 0 HG3 ARG A 29 6.091 -2.778 -16.687 1.00 0.00 H new ATOM 0 HD2 ARG A 29 7.934 -2.649 -18.415 1.00 0.00 H new ATOM 0 HD3 ARG A 29 7.210 -4.008 -19.253 1.00 0.00 H new ATOM 0 HE ARG A 29 5.212 -1.985 -18.858 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.537 -0.673 -20.517 1.00 0.00 H new ATOM 0 HH12 ARG A 29 5.551 -0.466 -21.949 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.079 -2.537 -20.850 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.477 -1.479 -22.130 1.00 0.00 H new ATOM 525 N GLY A 30 8.622 -5.490 -13.702 1.00 0.00 N ATOM 526 CA GLY A 30 9.779 -6.102 -13.040 1.00 0.00 C ATOM 527 C GLY A 30 9.606 -6.389 -11.548 1.00 0.00 C ATOM 528 O GLY A 30 10.315 -7.233 -11.003 1.00 0.00 O ATOM 0 H GLY A 30 8.378 -4.578 -13.316 1.00 0.00 H new ATOM 0 HA2 GLY A 30 10.014 -7.038 -13.548 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.639 -5.445 -13.169 1.00 0.00 H new ATOM 532 N TYR A 31 8.646 -5.745 -10.882 1.00 0.00 N ATOM 533 CA TYR A 31 8.165 -6.157 -9.564 1.00 0.00 C ATOM 534 C TYR A 31 7.429 -7.505 -9.681 1.00 0.00 C ATOM 535 O TYR A 31 6.303 -7.539 -10.165 1.00 0.00 O ATOM 536 CB TYR A 31 7.190 -5.095 -9.031 1.00 0.00 C ATOM 537 CG TYR A 31 7.672 -3.675 -8.793 1.00 0.00 C ATOM 538 CD1 TYR A 31 9.029 -3.291 -8.860 1.00 0.00 C ATOM 539 CD2 TYR A 31 6.690 -2.710 -8.499 1.00 0.00 C ATOM 540 CE1 TYR A 31 9.381 -1.938 -8.671 1.00 0.00 C ATOM 541 CE2 TYR A 31 7.044 -1.367 -8.287 1.00 0.00 C ATOM 542 CZ TYR A 31 8.393 -0.972 -8.380 1.00 0.00 C ATOM 543 OH TYR A 31 8.724 0.338 -8.219 1.00 0.00 O ATOM 0 H TYR A 31 8.177 -4.916 -11.246 1.00 0.00 H new ATOM 0 HA TYR A 31 9.010 -6.262 -8.884 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.355 -5.041 -9.730 1.00 0.00 H new ATOM 0 HB3 TYR A 31 6.792 -5.465 -8.086 1.00 0.00 H new ATOM 0 HD1 TYR A 31 9.793 -4.029 -9.055 1.00 0.00 H new ATOM 0 HD2 TYR A 31 5.653 -3.005 -8.436 1.00 0.00 H new ATOM 0 HE1 TYR A 31 10.416 -1.638 -8.750 1.00 0.00 H new ATOM 0 HE2 TYR A 31 6.282 -0.638 -8.053 1.00 0.00 H new ATOM 0 HH TYR A 31 7.916 0.858 -8.025 1.00 0.00 H new ATOM 553 N ARG A 32 8.008 -8.617 -9.216 1.00 0.00 N ATOM 554 CA ARG A 32 7.378 -9.965 -9.283 1.00 0.00 C ATOM 555 C ARG A 32 7.097 -10.596 -7.930 1.00 0.00 C ATOM 556 O ARG A 32 7.002 -11.814 -7.830 1.00 0.00 O ATOM 557 CB ARG A 32 8.142 -10.919 -10.220 1.00 0.00 C ATOM 558 CG ARG A 32 9.537 -11.337 -9.727 1.00 0.00 C ATOM 559 CD ARG A 32 10.585 -10.707 -10.637 1.00 0.00 C ATOM 560 NE ARG A 32 11.961 -10.960 -10.178 1.00 0.00 N ATOM 561 CZ ARG A 32 12.681 -12.061 -10.244 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.883 -12.031 -9.753 1.00 0.00 N ATOM 563 NH2 ARG A 32 12.247 -13.169 -10.775 1.00 0.00 N ATOM 0 H ARG A 32 8.930 -8.621 -8.779 1.00 0.00 H new ATOM 0 HA ARG A 32 6.395 -9.791 -9.721 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.542 -11.817 -10.368 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.246 -10.441 -11.194 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.687 -11.013 -8.697 1.00 0.00 H new ATOM 0 HG3 ARG A 32 9.632 -12.423 -9.737 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.466 -11.098 -11.647 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.416 -9.632 -10.689 1.00 0.00 H new ATOM 0 HE ARG A 32 12.427 -10.163 -9.744 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.241 -11.173 -9.333 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.469 -12.865 -9.787 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.306 -13.213 -11.166 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.848 -13.993 -10.799 1.00 0.00 H new ATOM 577 N ALA A 33 7.028 -9.763 -6.894 1.00 0.00 N ATOM 578 CA ALA A 33 7.106 -10.109 -5.475 1.00 0.00 C ATOM 579 C ALA A 33 8.407 -10.838 -5.058 1.00 0.00 C ATOM 580 O ALA A 33 9.093 -10.399 -4.138 1.00 0.00 O ATOM 581 CB ALA A 33 5.826 -10.865 -5.131 1.00 0.00 C ATOM 0 H ALA A 33 6.908 -8.760 -7.032 1.00 0.00 H new ATOM 0 HA ALA A 33 7.171 -9.197 -4.881 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.840 -11.144 -4.078 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.963 -10.228 -5.326 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.758 -11.764 -5.744 1.00 0.00 H new ATOM 587 N SER A 34 8.817 -11.886 -5.781 1.00 0.00 N ATOM 588 CA SER A 34 10.041 -12.675 -5.559 1.00 0.00 C ATOM 589 C SER A 34 11.353 -11.896 -5.753 1.00 0.00 C ATOM 590 O SER A 34 12.426 -12.396 -5.415 1.00 0.00 O ATOM 591 CB SER A 34 10.046 -13.896 -6.491 1.00 0.00 C ATOM 592 OG SER A 34 8.865 -14.669 -6.334 1.00 0.00 O ATOM 0 H SER A 34 8.279 -12.227 -6.578 1.00 0.00 H new ATOM 0 HA SER A 34 10.011 -12.969 -4.510 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.132 -13.566 -7.526 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.919 -14.514 -6.280 1.00 0.00 H new ATOM 0 HG SER A 34 8.895 -15.438 -6.940 1.00 0.00 H new ATOM 598 N ASP A 35 11.283 -10.667 -6.275 1.00 0.00 N ATOM 599 CA ASP A 35 12.416 -9.737 -6.377 1.00 0.00 C ATOM 600 C ASP A 35 12.722 -9.015 -5.046 1.00 0.00 C ATOM 601 O ASP A 35 13.748 -8.343 -4.928 1.00 0.00 O ATOM 602 CB ASP A 35 12.118 -8.723 -7.498 1.00 0.00 C ATOM 603 CG ASP A 35 13.361 -8.390 -8.330 1.00 0.00 C ATOM 604 OD1 ASP A 35 13.894 -9.312 -8.991 1.00 0.00 O ATOM 605 OD2 ASP A 35 13.736 -7.207 -8.444 1.00 0.00 O ATOM 0 H ASP A 35 10.416 -10.280 -6.648 1.00 0.00 H new ATOM 0 HA ASP A 35 13.311 -10.312 -6.614 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.344 -9.125 -8.151 1.00 0.00 H new ATOM 0 HB3 ASP A 35 11.721 -7.807 -7.060 1.00 0.00 H new ATOM 610 N TRP A 36 11.825 -9.118 -4.056 1.00 0.00 N ATOM 611 CA TRP A 36 11.843 -8.381 -2.792 1.00 0.00 C ATOM 612 C TRP A 36 12.308 -9.251 -1.609 1.00 0.00 C ATOM 613 O TRP A 36 12.508 -10.464 -1.724 1.00 0.00 O ATOM 614 CB TRP A 36 10.433 -7.821 -2.528 1.00 0.00 C ATOM 615 CG TRP A 36 9.698 -7.112 -3.631 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.212 -6.580 -4.767 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.272 -6.796 -3.662 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.204 -5.989 -5.507 1.00 0.00 N ATOM 619 CE2 TRP A 36 8.004 -6.037 -4.837 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.181 -7.052 -2.802 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.741 -5.511 -5.116 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.908 -6.508 -3.059 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.691 -5.729 -4.209 1.00 0.00 C ATOM 0 H TRP A 36 11.028 -9.751 -4.122 1.00 0.00 H new ATOM 0 HA TRP A 36 12.565 -7.569 -2.879 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.808 -8.652 -2.201 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.508 -7.129 -1.689 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.253 -6.613 -5.052 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.334 -5.572 -6.429 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.326 -7.676 -1.932 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.573 -4.943 -6.019 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 5.096 -6.690 -2.371 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.718 -5.299 -4.395 1.00 0.00 H new ATOM 634 N LYS A 37 12.433 -8.628 -0.433 1.00 0.00 N ATOM 635 CA LYS A 37 12.873 -9.230 0.844 1.00 0.00 C ATOM 636 C LYS A 37 11.800 -10.079 1.552 1.00 0.00 C ATOM 637 O LYS A 37 11.580 -9.944 2.753 1.00 0.00 O ATOM 638 CB LYS A 37 13.454 -8.128 1.739 1.00 0.00 C ATOM 639 CG LYS A 37 14.869 -7.761 1.285 1.00 0.00 C ATOM 640 CD LYS A 37 15.436 -6.642 2.152 1.00 0.00 C ATOM 641 CE LYS A 37 15.723 -7.057 3.599 1.00 0.00 C ATOM 642 NZ LYS A 37 16.217 -5.912 4.404 1.00 0.00 N ATOM 0 H LYS A 37 12.220 -7.635 -0.334 1.00 0.00 H new ATOM 0 HA LYS A 37 13.652 -9.957 0.617 1.00 0.00 H new ATOM 0 HB2 LYS A 37 12.814 -7.247 1.703 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.474 -8.465 2.775 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.515 -8.637 1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.852 -7.447 0.241 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.359 -6.278 1.700 1.00 0.00 H new ATOM 0 HD3 LYS A 37 14.733 -5.809 2.157 1.00 0.00 H new ATOM 0 HE2 LYS A 37 14.815 -7.457 4.051 1.00 0.00 H new ATOM 0 HE3 LYS A 37 16.463 -7.857 3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 16.561 -6.256 5.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 16.994 -5.441 3.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 15.443 -5.235 4.556 1.00 0.00 H new ATOM 656 N LEU A 38 11.127 -10.968 0.821 1.00 0.00 N ATOM 657 CA LEU A 38 9.924 -11.685 1.286 1.00 0.00 C ATOM 658 C LEU A 38 10.090 -12.462 2.608 1.00 0.00 C ATOM 659 O LEU A 38 9.149 -12.527 3.398 1.00 0.00 O ATOM 660 CB LEU A 38 9.431 -12.648 0.194 1.00 0.00 C ATOM 661 CG LEU A 38 9.005 -11.989 -1.129 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.408 -13.072 -2.031 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.963 -10.887 -0.935 1.00 0.00 C ATOM 0 H LEU A 38 11.402 -11.219 -0.129 1.00 0.00 H new ATOM 0 HA LEU A 38 9.193 -10.903 1.490 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.223 -13.366 -0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.585 -13.213 0.587 1.00 0.00 H new ATOM 0 HG LEU A 38 9.888 -11.528 -1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.098 -12.628 -2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.156 -13.842 -2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.544 -13.519 -1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.701 -10.459 -1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.071 -11.307 -0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.373 -10.108 -0.293 1.00 0.00 H new ATOM 675 N ASP A 39 11.274 -13.027 2.865 1.00 0.00 N ATOM 676 CA ASP A 39 11.579 -13.789 4.091 1.00 0.00 C ATOM 677 C ASP A 39 12.262 -12.936 5.188 1.00 0.00 C ATOM 678 O ASP A 39 12.555 -13.427 6.282 1.00 0.00 O ATOM 679 CB ASP A 39 12.382 -15.042 3.703 1.00 0.00 C ATOM 680 CG ASP A 39 12.476 -16.080 4.838 1.00 0.00 C ATOM 681 OD1 ASP A 39 13.601 -16.531 5.165 1.00 0.00 O ATOM 682 OD2 ASP A 39 11.417 -16.504 5.364 1.00 0.00 O ATOM 0 H ASP A 39 12.063 -12.970 2.221 1.00 0.00 H new ATOM 0 HA ASP A 39 10.643 -14.102 4.555 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.919 -15.507 2.832 1.00 0.00 H new ATOM 0 HB3 ASP A 39 13.388 -14.744 3.408 1.00 0.00 H new ATOM 687 N GLN A 40 12.498 -11.649 4.908 1.00 0.00 N ATOM 688 CA GLN A 40 13.147 -10.672 5.794 1.00 0.00 C ATOM 689 C GLN A 40 12.513 -9.263 5.657 1.00 0.00 C ATOM 690 O GLN A 40 13.208 -8.321 5.261 1.00 0.00 O ATOM 691 CB GLN A 40 14.688 -10.674 5.593 1.00 0.00 C ATOM 692 CG GLN A 40 15.205 -10.815 4.145 1.00 0.00 C ATOM 693 CD GLN A 40 15.272 -12.251 3.619 1.00 0.00 C ATOM 694 OE1 GLN A 40 15.470 -13.219 4.340 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.139 -12.447 2.323 1.00 0.00 N ATOM 0 H GLN A 40 12.229 -11.239 4.014 1.00 0.00 H new ATOM 0 HA GLN A 40 12.969 -10.977 6.825 1.00 0.00 H new ATOM 0 HB2 GLN A 40 15.085 -9.746 6.006 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.106 -11.490 6.183 1.00 0.00 H new ATOM 0 HG2 GLN A 40 14.560 -10.233 3.487 1.00 0.00 H new ATOM 0 HG3 GLN A 40 16.201 -10.376 4.086 1.00 0.00 H new ATOM 0 HE21 GLN A 40 14.973 -11.655 1.702 1.00 0.00 H new ATOM 0 HE22 GLN A 40 15.202 -13.391 1.941 1.00 0.00 H new ATOM 704 N PRO A 41 11.210 -9.075 5.962 1.00 0.00 N ATOM 705 CA PRO A 41 10.568 -7.760 5.904 1.00 0.00 C ATOM 706 C PRO A 41 11.302 -6.723 6.763 1.00 0.00 C ATOM 707 O PRO A 41 11.695 -6.984 7.903 1.00 0.00 O ATOM 708 CB PRO A 41 9.114 -7.952 6.355 1.00 0.00 C ATOM 709 CG PRO A 41 9.168 -9.247 7.169 1.00 0.00 C ATOM 710 CD PRO A 41 10.269 -10.056 6.481 1.00 0.00 C ATOM 0 HA PRO A 41 10.603 -7.366 4.888 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.765 -7.113 6.956 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.437 -8.039 5.505 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.406 -9.054 8.215 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.213 -9.772 7.151 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.756 -10.732 7.184 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.861 -10.670 5.678 1.00 0.00 H new ATOM 718 N ASP A 42 11.466 -5.525 6.204 1.00 0.00 N ATOM 719 CA ASP A 42 12.105 -4.383 6.860 1.00 0.00 C ATOM 720 C ASP A 42 11.238 -3.827 8.006 1.00 0.00 C ATOM 721 O ASP A 42 11.763 -3.263 8.970 1.00 0.00 O ATOM 722 CB ASP A 42 12.379 -3.304 5.804 1.00 0.00 C ATOM 723 CG ASP A 42 13.359 -3.795 4.736 1.00 0.00 C ATOM 724 OD1 ASP A 42 12.907 -4.234 3.658 1.00 0.00 O ATOM 725 OD2 ASP A 42 14.591 -3.705 4.954 1.00 0.00 O ATOM 0 H ASP A 42 11.150 -5.315 5.257 1.00 0.00 H new ATOM 0 HA ASP A 42 13.044 -4.708 7.309 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.442 -3.011 5.331 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.783 -2.415 6.288 1.00 0.00 H new ATOM 730 N TRP A 43 9.919 -4.030 7.919 1.00 0.00 N ATOM 731 CA TRP A 43 8.938 -3.756 8.978 1.00 0.00 C ATOM 732 C TRP A 43 7.690 -4.640 8.807 1.00 0.00 C ATOM 733 O TRP A 43 7.345 -5.016 7.686 1.00 0.00 O ATOM 734 CB TRP A 43 8.576 -2.263 8.941 1.00 0.00 C ATOM 735 CG TRP A 43 7.442 -1.823 9.815 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.546 -1.283 11.051 1.00 0.00 C ATOM 737 CD2 TRP A 43 6.016 -1.830 9.502 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.289 -0.934 11.511 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.312 -1.211 10.578 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.252 -2.295 8.412 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.926 -1.001 10.540 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.861 -2.071 8.361 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.198 -1.426 9.417 1.00 0.00 C ATOM 0 H TRP A 43 9.487 -4.405 7.075 1.00 0.00 H new ATOM 0 HA TRP A 43 9.368 -3.995 9.950 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.461 -1.691 9.219 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.335 -1.997 7.912 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.469 -1.145 11.595 1.00 0.00 H new ATOM 0 HE1 TRP A 43 6.107 -0.523 12.427 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.737 -2.828 7.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.424 -0.518 11.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.299 -2.400 7.499 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.132 -1.257 9.366 1.00 0.00 H new ATOM 754 N THR A 44 6.977 -4.946 9.896 1.00 0.00 N ATOM 755 CA THR A 44 5.649 -5.590 9.856 1.00 0.00 C ATOM 756 C THR A 44 4.657 -4.911 10.799 1.00 0.00 C ATOM 757 O THR A 44 5.029 -4.410 11.863 1.00 0.00 O ATOM 758 CB THR A 44 5.701 -7.092 10.176 1.00 0.00 C ATOM 759 OG1 THR A 44 6.264 -7.351 11.446 1.00 0.00 O ATOM 760 CG2 THR A 44 6.491 -7.893 9.154 1.00 0.00 C ATOM 0 H THR A 44 7.304 -4.754 10.843 1.00 0.00 H new ATOM 0 HA THR A 44 5.306 -5.473 8.828 1.00 0.00 H new ATOM 0 HB THR A 44 4.658 -7.407 10.155 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.655 -8.249 11.453 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.490 -8.946 9.437 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.033 -7.781 8.171 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.517 -7.528 9.120 1.00 0.00 H new ATOM 768 N GLY A 45 3.376 -4.926 10.430 1.00 0.00 N ATOM 769 CA GLY A 45 2.312 -4.302 11.219 1.00 0.00 C ATOM 770 C GLY A 45 0.924 -4.434 10.600 1.00 0.00 C ATOM 771 O GLY A 45 0.601 -5.455 9.990 1.00 0.00 O ATOM 0 H GLY A 45 3.046 -5.372 9.574 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.300 -4.750 12.213 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.542 -3.244 11.349 1.00 0.00 H new ATOM 775 N ARG A 46 0.100 -3.398 10.787 1.00 0.00 N ATOM 776 CA ARG A 46 -1.304 -3.315 10.360 1.00 0.00 C ATOM 777 C ARG A 46 -1.485 -2.339 9.195 1.00 0.00 C ATOM 778 O ARG A 46 -0.785 -1.329 9.091 1.00 0.00 O ATOM 779 CB ARG A 46 -2.210 -2.907 11.537 1.00 0.00 C ATOM 780 CG ARG A 46 -2.012 -3.752 12.807 1.00 0.00 C ATOM 781 CD ARG A 46 -3.102 -3.422 13.839 1.00 0.00 C ATOM 782 NE ARG A 46 -2.892 -4.131 15.118 1.00 0.00 N ATOM 783 CZ ARG A 46 -3.605 -3.982 16.222 1.00 0.00 C ATOM 784 NH1 ARG A 46 -3.215 -4.530 17.336 1.00 0.00 N ATOM 785 NH2 ARG A 46 -4.705 -3.284 16.248 1.00 0.00 N ATOM 0 H ARG A 46 0.408 -2.551 11.264 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.596 -4.307 10.016 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -2.024 -1.860 11.778 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.251 -2.982 11.223 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.047 -4.812 12.556 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.027 -3.558 13.232 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -3.116 -2.347 14.019 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -4.077 -3.690 13.433 1.00 0.00 H new ATOM 0 HE ARG A 46 -2.123 -4.800 15.153 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -2.355 -5.078 17.361 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -3.769 -4.411 18.184 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -5.042 -2.831 15.398 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -5.229 -3.191 17.118 1.00 0.00 H new ATOM 799 N LEU A 47 -2.464 -2.634 8.346 1.00 0.00 N ATOM 800 CA LEU A 47 -2.919 -1.802 7.233 1.00 0.00 C ATOM 801 C LEU A 47 -4.083 -0.900 7.666 1.00 0.00 C ATOM 802 O LEU A 47 -4.979 -1.349 8.382 1.00 0.00 O ATOM 803 CB LEU A 47 -3.352 -2.745 6.099 1.00 0.00 C ATOM 804 CG LEU A 47 -3.928 -2.056 4.849 1.00 0.00 C ATOM 805 CD1 LEU A 47 -2.886 -1.208 4.118 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.432 -3.137 3.903 1.00 0.00 C ATOM 0 H LEU A 47 -2.990 -3.505 8.418 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.116 -1.147 6.896 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.492 -3.343 5.799 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.100 -3.435 6.489 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.729 -1.389 5.167 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.343 -0.744 3.244 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.513 -0.433 4.787 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.058 -1.842 3.801 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.846 -2.673 3.008 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.606 -3.791 3.624 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.206 -3.723 4.399 1.00 0.00 H new ATOM 818 N ARG A 48 -4.108 0.336 7.163 1.00 0.00 N ATOM 819 CA ARG A 48 -5.187 1.321 7.329 1.00 0.00 C ATOM 820 C ARG A 48 -5.335 2.135 6.047 1.00 0.00 C ATOM 821 O ARG A 48 -4.640 3.122 5.827 1.00 0.00 O ATOM 822 CB ARG A 48 -4.850 2.179 8.561 1.00 0.00 C ATOM 823 CG ARG A 48 -5.742 3.409 8.812 1.00 0.00 C ATOM 824 CD ARG A 48 -5.301 3.985 10.161 1.00 0.00 C ATOM 825 NE ARG A 48 -5.861 5.309 10.478 1.00 0.00 N ATOM 826 CZ ARG A 48 -5.933 5.822 11.694 1.00 0.00 C ATOM 827 NH1 ARG A 48 -6.428 7.012 11.854 1.00 0.00 N ATOM 828 NH2 ARG A 48 -5.512 5.192 12.755 1.00 0.00 N ATOM 0 H ARG A 48 -3.339 0.699 6.600 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.153 0.846 7.501 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.895 1.540 9.443 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.819 2.520 8.467 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.624 4.145 8.017 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.795 3.129 8.833 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.585 3.287 10.949 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.213 4.053 10.173 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.219 5.870 9.705 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.756 7.541 11.046 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.488 7.418 12.788 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -5.105 4.261 12.667 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -5.589 5.630 13.673 1.00 0.00 H new ATOM 842 N ILE A 49 -6.243 1.704 5.180 1.00 0.00 N ATOM 843 CA ILE A 49 -6.655 2.471 4.002 1.00 0.00 C ATOM 844 C ILE A 49 -7.734 3.454 4.438 1.00 0.00 C ATOM 845 O ILE A 49 -8.657 3.101 5.175 1.00 0.00 O ATOM 846 CB ILE A 49 -7.107 1.565 2.842 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.027 0.500 2.576 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.377 2.404 1.578 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.366 -0.409 1.404 1.00 0.00 C ATOM 0 H ILE A 49 -6.720 0.807 5.272 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.803 3.023 3.604 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.036 1.065 3.114 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.076 0.995 2.381 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.893 -0.106 3.472 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.696 1.749 0.767 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.161 3.132 1.785 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.466 2.926 1.286 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.568 -1.138 1.266 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.302 -0.930 1.606 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.472 0.189 0.499 1.00 0.00 H new ATOM 861 N THR A 50 -7.593 4.691 3.986 1.00 0.00 N ATOM 862 CA THR A 50 -8.319 5.870 4.462 1.00 0.00 C ATOM 863 C THR A 50 -8.544 6.856 3.313 1.00 0.00 C ATOM 864 O THR A 50 -7.923 6.723 2.259 1.00 0.00 O ATOM 865 CB THR A 50 -7.549 6.560 5.613 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.178 6.221 5.705 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.136 6.185 6.968 1.00 0.00 C ATOM 0 H THR A 50 -6.936 4.916 3.239 1.00 0.00 H new ATOM 0 HA THR A 50 -9.287 5.544 4.842 1.00 0.00 H new ATOM 0 HB THR A 50 -7.646 7.619 5.374 1.00 0.00 H new ATOM 0 HG1 THR A 50 -5.806 6.114 4.805 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.575 6.684 7.758 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.180 6.497 7.011 1.00 0.00 H new ATOM 0 HG23 THR A 50 -8.074 5.105 7.105 1.00 0.00 H new ATOM 875 N SER A 51 -9.410 7.858 3.475 1.00 0.00 N ATOM 876 CA SER A 51 -9.631 8.900 2.472 1.00 0.00 C ATOM 877 C SER A 51 -10.189 10.177 3.080 1.00 0.00 C ATOM 878 O SER A 51 -10.758 10.174 4.178 1.00 0.00 O ATOM 879 CB SER A 51 -10.578 8.385 1.383 1.00 0.00 C ATOM 880 OG SER A 51 -11.868 8.114 1.906 1.00 0.00 O ATOM 0 H SER A 51 -9.982 7.970 4.312 1.00 0.00 H new ATOM 0 HA SER A 51 -8.662 9.142 2.036 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.655 9.124 0.586 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.166 7.479 0.939 1.00 0.00 H new ATOM 0 HG SER A 51 -11.908 7.184 2.211 1.00 0.00 H new ATOM 886 N LYS A 52 -10.042 11.281 2.343 1.00 0.00 N ATOM 887 CA LYS A 52 -10.899 12.453 2.471 1.00 0.00 C ATOM 888 C LYS A 52 -11.019 13.231 1.154 1.00 0.00 C ATOM 889 O LYS A 52 -10.024 13.692 0.595 1.00 0.00 O ATOM 890 CB LYS A 52 -10.392 13.315 3.630 1.00 0.00 C ATOM 891 CG LYS A 52 -11.431 14.317 4.141 1.00 0.00 C ATOM 892 CD LYS A 52 -12.829 13.764 4.461 1.00 0.00 C ATOM 893 CE LYS A 52 -12.823 12.624 5.484 1.00 0.00 C ATOM 894 NZ LYS A 52 -14.212 12.252 5.855 1.00 0.00 N ATOM 0 H LYS A 52 -9.316 11.383 1.634 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.915 12.132 2.699 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -10.090 12.665 4.451 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -9.503 13.857 3.308 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -11.036 14.785 5.043 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.540 15.104 3.395 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -13.453 14.575 4.838 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -13.289 13.410 3.539 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -12.307 11.758 5.070 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.272 12.928 6.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -14.261 11.229 6.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.493 12.770 6.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.856 12.496 5.076 1.00 0.00 H new ATOM 908 N GLY A 53 -12.248 13.364 0.652 1.00 0.00 N ATOM 909 CA GLY A 53 -12.570 14.006 -0.616 1.00 0.00 C ATOM 910 C GLY A 53 -11.983 13.217 -1.777 1.00 0.00 C ATOM 911 O GLY A 53 -12.068 11.988 -1.837 1.00 0.00 O ATOM 0 H GLY A 53 -13.074 13.014 1.138 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.652 14.080 -0.729 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -12.179 15.023 -0.625 1.00 0.00 H new ATOM 915 N LYS A 54 -11.322 13.937 -2.675 1.00 0.00 N ATOM 916 CA LYS A 54 -10.641 13.408 -3.860 1.00 0.00 C ATOM 917 C LYS A 54 -9.190 12.970 -3.585 1.00 0.00 C ATOM 918 O LYS A 54 -8.357 12.963 -4.490 1.00 0.00 O ATOM 919 CB LYS A 54 -10.787 14.462 -4.961 1.00 0.00 C ATOM 920 CG LYS A 54 -12.236 14.547 -5.470 1.00 0.00 C ATOM 921 CD LYS A 54 -12.408 15.465 -6.686 1.00 0.00 C ATOM 922 CE LYS A 54 -12.048 16.925 -6.375 1.00 0.00 C ATOM 923 NZ LYS A 54 -12.278 17.806 -7.551 1.00 0.00 N ATOM 0 H LYS A 54 -11.240 14.951 -2.598 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.106 12.477 -4.186 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.477 15.435 -4.579 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.123 14.218 -5.790 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.580 13.546 -5.730 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -12.875 14.904 -4.663 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -11.780 15.105 -7.501 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.440 15.414 -7.033 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.645 17.277 -5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -11.003 16.986 -6.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -12.025 18.785 -7.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.690 17.485 -8.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.281 17.766 -7.824 1.00 0.00 H new ATOM 937 N THR A 55 -8.888 12.594 -2.340 1.00 0.00 N ATOM 938 CA THR A 55 -7.598 12.024 -1.924 1.00 0.00 C ATOM 939 C THR A 55 -7.824 10.783 -1.060 1.00 0.00 C ATOM 940 O THR A 55 -8.581 10.825 -0.088 1.00 0.00 O ATOM 941 CB THR A 55 -6.741 13.053 -1.162 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.687 14.291 -1.847 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.293 12.585 -1.021 1.00 0.00 C ATOM 0 H THR A 55 -9.551 12.679 -1.569 1.00 0.00 H new ATOM 0 HA THR A 55 -7.054 11.741 -2.825 1.00 0.00 H new ATOM 0 HB THR A 55 -7.214 13.163 -0.186 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.138 14.923 -1.338 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.719 13.336 -0.478 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.267 11.643 -0.473 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.859 12.442 -2.011 1.00 0.00 H new ATOM 951 N ALA A 56 -7.154 9.681 -1.396 1.00 0.00 N ATOM 952 CA ALA A 56 -7.037 8.490 -0.555 1.00 0.00 C ATOM 953 C ALA A 56 -5.667 8.450 0.136 1.00 0.00 C ATOM 954 O ALA A 56 -4.722 9.109 -0.294 1.00 0.00 O ATOM 955 CB ALA A 56 -7.315 7.231 -1.380 1.00 0.00 C ATOM 0 H ALA A 56 -6.664 9.590 -2.286 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.787 8.531 0.234 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.225 6.351 -0.743 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.324 7.280 -1.790 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.595 7.164 -2.195 1.00 0.00 H new ATOM 961 N TYR A 57 -5.558 7.671 1.205 1.00 0.00 N ATOM 962 CA TYR A 57 -4.395 7.580 2.079 1.00 0.00 C ATOM 963 C TYR A 57 -4.187 6.111 2.482 1.00 0.00 C ATOM 964 O TYR A 57 -4.977 5.567 3.255 1.00 0.00 O ATOM 965 CB TYR A 57 -4.636 8.473 3.317 1.00 0.00 C ATOM 966 CG TYR A 57 -4.963 9.935 3.041 1.00 0.00 C ATOM 967 CD1 TYR A 57 -3.947 10.801 2.590 1.00 0.00 C ATOM 968 CD2 TYR A 57 -6.266 10.440 3.254 1.00 0.00 C ATOM 969 CE1 TYR A 57 -4.228 12.159 2.345 1.00 0.00 C ATOM 970 CE2 TYR A 57 -6.554 11.793 2.992 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.536 12.658 2.539 1.00 0.00 C ATOM 972 OH TYR A 57 -5.822 13.966 2.303 1.00 0.00 O ATOM 0 H TYR A 57 -6.316 7.055 1.500 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.496 7.926 1.570 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.454 8.043 3.895 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.746 8.434 3.945 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.948 10.422 2.432 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.044 9.785 3.619 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -3.443 12.820 2.008 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.556 12.169 3.138 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.770 14.132 2.488 1.00 0.00 H new ATOM 982 N ILE A 58 -3.136 5.455 1.982 1.00 0.00 N ATOM 983 CA ILE A 58 -2.705 4.137 2.477 1.00 0.00 C ATOM 984 C ILE A 58 -1.743 4.385 3.632 1.00 0.00 C ATOM 985 O ILE A 58 -0.601 4.789 3.414 1.00 0.00 O ATOM 986 CB ILE A 58 -2.071 3.253 1.374 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.037 2.870 0.230 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.538 1.941 1.986 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.252 3.973 -0.808 1.00 0.00 C ATOM 0 H ILE A 58 -2.558 5.819 1.224 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.574 3.571 2.814 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.275 3.863 0.948 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.652 1.983 -0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.001 2.599 0.660 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.095 1.327 1.202 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.783 2.171 2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.360 1.397 2.452 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.943 3.622 -1.575 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.669 4.855 -0.321 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.298 4.230 -1.269 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.204 4.157 4.862 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.409 4.284 6.084 1.00 0.00 C ATOM 1003 C LYS A 59 -1.085 2.913 6.677 1.00 0.00 C ATOM 1004 O LYS A 59 -1.895 1.988 6.649 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.097 5.237 7.078 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.343 6.611 6.430 1.00 0.00 C ATOM 1007 CD LYS A 59 -2.563 7.731 7.455 1.00 0.00 C ATOM 1008 CE LYS A 59 -2.643 9.076 6.721 1.00 0.00 C ATOM 1009 NZ LYS A 59 -2.718 10.215 7.666 1.00 0.00 N ATOM 0 H LYS A 59 -3.167 3.871 5.041 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.447 4.735 5.839 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.044 4.808 7.405 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.477 5.354 7.967 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.491 6.866 5.800 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.214 6.547 5.778 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.481 7.553 8.015 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -1.747 7.745 8.177 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.769 9.193 6.080 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.518 9.084 6.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.856 11.098 7.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.517 10.074 8.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.834 10.273 8.211 1.00 0.00 H new ATOM 1023 N LEU A 60 0.124 2.795 7.208 1.00 0.00 N ATOM 1024 CA LEU A 60 0.664 1.616 7.886 1.00 0.00 C ATOM 1025 C LEU A 60 0.927 1.944 9.359 1.00 0.00 C ATOM 1026 O LEU A 60 1.548 2.963 9.660 1.00 0.00 O ATOM 1027 CB LEU A 60 1.947 1.177 7.159 1.00 0.00 C ATOM 1028 CG LEU A 60 1.748 0.036 6.150 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.692 0.297 5.075 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.070 -0.215 5.434 1.00 0.00 C ATOM 0 H LEU A 60 0.796 3.562 7.177 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.050 0.793 7.857 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.367 2.037 6.638 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.682 0.865 7.901 1.00 0.00 H new ATOM 0 HG LEU A 60 1.400 -0.815 6.736 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.626 -0.566 4.412 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.275 0.465 5.548 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.971 1.178 4.497 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.946 -1.023 4.713 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.380 0.691 4.913 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.831 -0.493 6.163 1.00 0.00 H new ATOM 1042 N GLU A 61 0.474 1.090 10.279 1.00 0.00 N ATOM 1043 CA GLU A 61 0.545 1.334 11.730 1.00 0.00 C ATOM 1044 C GLU A 61 1.063 0.116 12.509 1.00 0.00 C ATOM 1045 O GLU A 61 0.850 -1.031 12.119 1.00 0.00 O ATOM 1046 CB GLU A 61 -0.813 1.803 12.288 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.314 3.100 11.633 1.00 0.00 C ATOM 1048 CD GLU A 61 -2.444 3.766 12.443 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.535 3.165 12.598 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -2.271 4.925 12.886 1.00 0.00 O ATOM 0 H GLU A 61 0.042 0.198 10.040 1.00 0.00 H new ATOM 0 HA GLU A 61 1.270 2.135 11.872 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.553 1.017 12.137 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.725 1.956 13.364 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.483 3.798 11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.671 2.882 10.627 1.00 0.00 H new ATOM 1057 N ASP A 62 1.763 0.352 13.619 1.00 0.00 N ATOM 1058 CA ASP A 62 2.372 -0.692 14.440 1.00 0.00 C ATOM 1059 C ASP A 62 1.311 -1.558 15.129 1.00 0.00 C ATOM 1060 O ASP A 62 0.347 -1.057 15.716 1.00 0.00 O ATOM 1061 CB ASP A 62 3.275 -0.033 15.480 1.00 0.00 C ATOM 1062 CG ASP A 62 4.138 -1.068 16.202 1.00 0.00 C ATOM 1063 OD1 ASP A 62 5.313 -1.266 15.815 1.00 0.00 O ATOM 1064 OD2 ASP A 62 3.606 -1.700 17.140 1.00 0.00 O ATOM 0 H ASP A 62 1.925 1.293 13.979 1.00 0.00 H new ATOM 0 HA ASP A 62 2.957 -1.349 13.797 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.916 0.703 14.994 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.665 0.505 16.206 1.00 0.00 H new ATOM 1069 N LYS A 63 1.522 -2.872 15.099 1.00 0.00 N ATOM 1070 CA LYS A 63 0.585 -3.876 15.619 1.00 0.00 C ATOM 1071 C LYS A 63 0.524 -4.010 17.139 1.00 0.00 C ATOM 1072 O LYS A 63 -0.358 -4.711 17.639 1.00 0.00 O ATOM 1073 CB LYS A 63 0.826 -5.234 14.922 1.00 0.00 C ATOM 1074 CG LYS A 63 2.315 -5.612 14.934 1.00 0.00 C ATOM 1075 CD LYS A 63 2.588 -7.009 14.374 1.00 0.00 C ATOM 1076 CE LYS A 63 4.070 -7.087 13.988 1.00 0.00 C ATOM 1077 NZ LYS A 63 4.424 -8.399 13.392 1.00 0.00 N ATOM 0 H LYS A 63 2.368 -3.282 14.704 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.408 -3.503 15.368 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.248 -6.010 15.423 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.469 -5.185 13.893 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.874 -4.879 14.352 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.688 -5.559 15.957 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.348 -7.770 15.116 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.958 -7.201 13.505 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.301 -6.293 13.278 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.684 -6.913 14.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.106 -8.257 12.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.848 -9.008 14.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.567 -8.853 13.017 1.00 0.00 H new ATOM 1091 N VAL A 64 1.407 -3.326 17.862 1.00 0.00 N ATOM 1092 CA VAL A 64 1.469 -3.312 19.328 1.00 0.00 C ATOM 1093 C VAL A 64 1.263 -1.900 19.882 1.00 0.00 C ATOM 1094 O VAL A 64 0.496 -1.728 20.831 1.00 0.00 O ATOM 1095 CB VAL A 64 2.815 -3.904 19.791 1.00 0.00 C ATOM 1096 CG1 VAL A 64 3.015 -3.816 21.309 1.00 0.00 C ATOM 1097 CG2 VAL A 64 2.939 -5.380 19.387 1.00 0.00 C ATOM 0 H VAL A 64 2.126 -2.744 17.432 1.00 0.00 H new ATOM 0 HA VAL A 64 0.659 -3.927 19.720 1.00 0.00 H new ATOM 0 HB VAL A 64 3.580 -3.303 19.299 1.00 0.00 H new ATOM 0 HG11 VAL A 64 3.980 -4.248 21.575 1.00 0.00 H new ATOM 0 HG12 VAL A 64 2.988 -2.772 21.620 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.220 -4.365 21.813 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.898 -5.771 19.727 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.132 -5.952 19.845 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.875 -5.467 18.302 1.00 0.00 H new ATOM 1107 N SER A 65 1.897 -0.887 19.283 1.00 0.00 N ATOM 1108 CA SER A 65 1.848 0.497 19.780 1.00 0.00 C ATOM 1109 C SER A 65 0.742 1.338 19.132 1.00 0.00 C ATOM 1110 O SER A 65 0.346 2.366 19.683 1.00 0.00 O ATOM 1111 CB SER A 65 3.205 1.180 19.579 1.00 0.00 C ATOM 1112 OG SER A 65 4.213 0.524 20.333 1.00 0.00 O ATOM 0 H SER A 65 2.459 -1.001 18.440 1.00 0.00 H new ATOM 0 HA SER A 65 1.613 0.433 20.842 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.470 1.170 18.522 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.140 2.225 19.881 1.00 0.00 H new ATOM 0 HG SER A 65 5.072 0.973 20.191 1.00 0.00 H new ATOM 1118 N GLY A 66 0.242 0.922 17.962 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.774 1.650 17.191 1.00 0.00 C ATOM 1120 C GLY A 66 -0.243 2.929 16.529 1.00 0.00 C ATOM 1121 O GLY A 66 -1.025 3.795 16.139 1.00 0.00 O ATOM 0 H GLY A 66 0.538 0.054 17.516 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.174 0.991 16.420 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.602 1.909 17.851 1.00 0.00 H new ATOM 1125 N GLU A 67 1.082 3.073 16.440 1.00 0.00 N ATOM 1126 CA GLU A 67 1.770 4.274 15.955 1.00 0.00 C ATOM 1127 C GLU A 67 2.023 4.231 14.439 1.00 0.00 C ATOM 1128 O GLU A 67 2.202 3.155 13.865 1.00 0.00 O ATOM 1129 CB GLU A 67 3.047 4.502 16.781 1.00 0.00 C ATOM 1130 CG GLU A 67 4.194 3.523 16.493 1.00 0.00 C ATOM 1131 CD GLU A 67 5.427 3.859 17.354 1.00 0.00 C ATOM 1132 OE1 GLU A 67 6.282 4.664 16.912 1.00 0.00 O ATOM 1133 OE2 GLU A 67 5.550 3.320 18.480 1.00 0.00 O ATOM 0 H GLU A 67 1.728 2.332 16.713 1.00 0.00 H new ATOM 0 HA GLU A 67 1.120 5.137 16.101 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.402 5.516 16.599 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.793 4.438 17.839 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.868 2.503 16.698 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.459 3.567 15.437 1.00 0.00 H new ATOM 1140 N LEU A 68 2.052 5.391 13.779 1.00 0.00 N ATOM 1141 CA LEU A 68 2.214 5.497 12.324 1.00 0.00 C ATOM 1142 C LEU A 68 3.642 5.125 11.885 1.00 0.00 C ATOM 1143 O LEU A 68 4.616 5.747 12.321 1.00 0.00 O ATOM 1144 CB LEU A 68 1.823 6.924 11.886 1.00 0.00 C ATOM 1145 CG LEU A 68 1.809 7.155 10.361 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.658 6.421 9.675 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.643 8.645 10.061 1.00 0.00 C ATOM 0 H LEU A 68 1.963 6.295 14.244 1.00 0.00 H new ATOM 0 HA LEU A 68 1.555 4.783 11.830 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.833 7.152 12.282 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.518 7.631 12.339 1.00 0.00 H new ATOM 0 HG LEU A 68 2.756 6.773 9.980 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.691 6.615 8.603 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.752 5.350 9.853 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.291 6.774 10.079 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.634 8.800 8.982 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.704 8.999 10.486 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.472 9.199 10.500 1.00 0.00 H new ATOM 1159 N PHE A 69 3.762 4.151 10.981 1.00 0.00 N ATOM 1160 CA PHE A 69 5.014 3.797 10.303 1.00 0.00 C ATOM 1161 C PHE A 69 5.227 4.658 9.049 1.00 0.00 C ATOM 1162 O PHE A 69 6.255 5.327 8.921 1.00 0.00 O ATOM 1163 CB PHE A 69 5.022 2.296 9.968 1.00 0.00 C ATOM 1164 CG PHE A 69 6.153 1.875 9.042 1.00 0.00 C ATOM 1165 CD1 PHE A 69 7.482 1.873 9.510 1.00 0.00 C ATOM 1166 CD2 PHE A 69 5.889 1.539 7.699 1.00 0.00 C ATOM 1167 CE1 PHE A 69 8.539 1.540 8.643 1.00 0.00 C ATOM 1168 CE2 PHE A 69 6.949 1.231 6.827 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.273 1.225 7.298 1.00 0.00 C ATOM 0 H PHE A 69 2.974 3.572 10.692 1.00 0.00 H new ATOM 0 HA PHE A 69 5.847 4.002 10.975 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.095 1.728 10.895 1.00 0.00 H new ATOM 0 HB3 PHE A 69 4.071 2.032 9.506 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.690 2.128 10.539 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.871 1.518 7.339 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.555 1.526 9.010 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.745 0.998 5.792 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.084 0.979 6.629 1.00 0.00 H new ATOM 1179 N ALA A 70 4.248 4.659 8.136 1.00 0.00 N ATOM 1180 CA ALA A 70 4.298 5.387 6.868 1.00 0.00 C ATOM 1181 C ALA A 70 2.892 5.677 6.309 1.00 0.00 C ATOM 1182 O ALA A 70 1.911 5.041 6.699 1.00 0.00 O ATOM 1183 CB ALA A 70 5.122 4.569 5.864 1.00 0.00 C ATOM 0 H ALA A 70 3.379 4.140 8.264 1.00 0.00 H new ATOM 0 HA ALA A 70 4.769 6.355 7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.168 5.100 4.913 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.131 4.429 6.251 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.652 3.597 5.714 1.00 0.00 H new ATOM 1189 N GLN A 71 2.806 6.625 5.372 1.00 0.00 N ATOM 1190 CA GLN A 71 1.566 7.043 4.707 1.00 0.00 C ATOM 1191 C GLN A 71 1.794 7.369 3.220 1.00 0.00 C ATOM 1192 O GLN A 71 2.741 8.075 2.886 1.00 0.00 O ATOM 1193 CB GLN A 71 0.955 8.250 5.446 1.00 0.00 C ATOM 1194 CG GLN A 71 1.963 9.374 5.752 1.00 0.00 C ATOM 1195 CD GLN A 71 1.309 10.747 5.863 1.00 0.00 C ATOM 1196 OE1 GLN A 71 0.267 10.934 6.481 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.899 11.751 5.250 1.00 0.00 N ATOM 0 H GLN A 71 3.623 7.140 5.044 1.00 0.00 H new ATOM 0 HA GLN A 71 0.865 6.209 4.746 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.143 8.658 4.844 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.516 7.905 6.382 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.480 9.147 6.685 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.719 9.400 4.967 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.766 11.596 4.736 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.489 12.684 5.289 1.00 0.00 H new ATOM 1206 N ALA A 72 0.918 6.899 2.330 1.00 0.00 N ATOM 1207 CA ALA A 72 0.947 7.158 0.887 1.00 0.00 C ATOM 1208 C ALA A 72 -0.367 7.820 0.413 1.00 0.00 C ATOM 1209 O ALA A 72 -1.374 7.125 0.241 1.00 0.00 O ATOM 1210 CB ALA A 72 1.240 5.838 0.158 1.00 0.00 C ATOM 0 H ALA A 72 0.137 6.303 2.605 1.00 0.00 H new ATOM 0 HA ALA A 72 1.740 7.867 0.650 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.265 6.014 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.204 5.448 0.484 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.459 5.114 0.389 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.382 9.153 0.209 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.493 9.873 -0.416 1.00 0.00 C ATOM 1218 C PRO A 73 -1.646 9.539 -1.907 1.00 0.00 C ATOM 1219 O PRO A 73 -0.650 9.427 -2.625 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.203 11.368 -0.225 1.00 0.00 C ATOM 1221 CG PRO A 73 -0.182 11.404 0.908 1.00 0.00 C ATOM 1222 CD PRO A 73 0.597 10.110 0.699 1.00 0.00 C ATOM 0 HA PRO A 73 -2.434 9.579 0.049 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -0.805 11.817 -1.135 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -2.106 11.920 0.034 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.463 12.280 0.844 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -0.663 11.434 1.886 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.406 10.248 -0.018 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.051 9.768 1.629 1.00 0.00 H new ATOM 1230 N VAL A 74 -2.889 9.441 -2.385 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.257 9.102 -3.772 1.00 0.00 C ATOM 1232 C VAL A 74 -4.347 10.054 -4.269 1.00 0.00 C ATOM 1233 O VAL A 74 -5.362 10.216 -3.595 1.00 0.00 O ATOM 1234 CB VAL A 74 -3.792 7.653 -3.898 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.609 7.136 -5.327 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -3.164 6.641 -2.935 1.00 0.00 C ATOM 0 H VAL A 74 -3.705 9.602 -1.795 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.351 9.195 -4.371 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.845 7.729 -3.629 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.990 6.117 -5.397 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.156 7.777 -6.019 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.550 7.146 -5.585 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.605 5.658 -3.102 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.089 6.591 -3.109 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.351 6.952 -1.907 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.188 10.654 -5.452 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.206 11.561 -6.026 1.00 0.00 C ATOM 1248 C GLU A 75 -6.299 10.826 -6.825 1.00 0.00 C ATOM 1249 O GLU A 75 -7.419 11.321 -6.947 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.525 12.622 -6.906 1.00 0.00 C ATOM 1251 CG GLU A 75 -3.614 13.558 -6.100 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.040 14.673 -6.998 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -1.983 14.459 -7.640 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -3.638 15.774 -7.064 1.00 0.00 O ATOM 0 H GLU A 75 -3.363 10.532 -6.039 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.710 12.039 -5.186 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.938 12.126 -7.679 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.288 13.212 -7.414 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.176 14.001 -5.278 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.799 12.986 -5.657 1.00 0.00 H new ATOM 1261 N GLN A 76 -5.984 9.647 -7.376 1.00 0.00 N ATOM 1262 CA GLN A 76 -6.936 8.707 -7.987 1.00 0.00 C ATOM 1263 C GLN A 76 -6.305 7.315 -8.171 1.00 0.00 C ATOM 1264 O GLN A 76 -5.086 7.194 -8.285 1.00 0.00 O ATOM 1265 CB GLN A 76 -7.546 9.255 -9.298 1.00 0.00 C ATOM 1266 CG GLN A 76 -6.643 10.058 -10.255 1.00 0.00 C ATOM 1267 CD GLN A 76 -5.612 9.213 -10.993 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -5.903 8.586 -12.002 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -4.378 9.166 -10.543 1.00 0.00 N ATOM 0 H GLN A 76 -5.023 9.308 -7.410 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.769 8.595 -7.293 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.948 8.408 -9.855 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.391 9.890 -9.030 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -7.270 10.568 -10.987 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.124 10.830 -9.686 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.122 9.684 -9.703 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.677 8.611 -11.034 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.131 6.266 -8.195 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.707 4.867 -8.316 1.00 0.00 C ATOM 1280 C TYR A 77 -7.263 4.217 -9.603 1.00 0.00 C ATOM 1281 O TYR A 77 -8.463 4.356 -9.865 1.00 0.00 O ATOM 1282 CB TYR A 77 -7.163 4.096 -7.070 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.685 2.661 -7.027 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -7.596 1.604 -7.219 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -5.319 2.388 -6.825 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -7.142 0.271 -7.218 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -4.859 1.059 -6.861 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.767 -0.004 -7.048 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.308 -1.283 -7.077 1.00 0.00 O ATOM 0 H TYR A 77 -8.144 6.369 -8.129 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.620 4.832 -8.387 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.803 4.615 -6.182 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.252 4.107 -7.026 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.645 1.816 -7.367 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.626 3.196 -6.643 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.844 -0.540 -7.347 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.805 0.852 -6.745 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.064 -1.900 -7.170 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.446 3.497 -10.400 1.00 0.00 N ATOM 1300 CA PRO A 78 -4.987 3.383 -10.294 1.00 0.00 C ATOM 1301 C PRO A 78 -4.275 4.718 -10.589 1.00 0.00 C ATOM 1302 O PRO A 78 -4.747 5.523 -11.395 1.00 0.00 O ATOM 1303 CB PRO A 78 -4.591 2.291 -11.294 1.00 0.00 C ATOM 1304 CG PRO A 78 -5.668 2.400 -12.373 1.00 0.00 C ATOM 1305 CD PRO A 78 -6.916 2.763 -11.569 1.00 0.00 C ATOM 0 HA PRO A 78 -4.683 3.127 -9.279 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -3.594 2.460 -11.701 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.583 1.304 -10.831 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -5.425 3.165 -13.111 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -5.794 1.463 -12.915 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.598 3.371 -12.163 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -7.463 1.868 -11.273 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.136 4.947 -9.929 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.343 6.178 -10.041 1.00 0.00 C ATOM 1315 C GLY A 79 -0.928 6.065 -9.461 1.00 0.00 C ATOM 1316 O GLY A 79 -0.508 4.998 -9.015 1.00 0.00 O ATOM 0 H GLY A 79 -2.729 4.267 -9.287 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.272 6.458 -11.092 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.870 6.985 -9.531 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.188 7.179 -9.456 1.00 0.00 N ATOM 1321 CA ILE A 80 1.260 7.238 -9.156 1.00 0.00 C ATOM 1322 C ILE A 80 1.668 6.594 -7.819 1.00 0.00 C ATOM 1323 O ILE A 80 2.740 6.000 -7.719 1.00 0.00 O ATOM 1324 CB ILE A 80 1.743 8.710 -9.236 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.254 8.897 -8.969 1.00 0.00 C ATOM 1326 CG2 ILE A 80 0.986 9.648 -8.272 1.00 0.00 C ATOM 1327 CD1 ILE A 80 4.165 8.133 -9.935 1.00 0.00 C ATOM 0 H ILE A 80 -0.585 8.095 -9.666 1.00 0.00 H new ATOM 0 HA ILE A 80 1.756 6.632 -9.914 1.00 0.00 H new ATOM 0 HB ILE A 80 1.529 8.978 -10.271 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.492 9.959 -9.027 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.473 8.576 -7.951 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.370 10.663 -8.376 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.077 9.636 -8.512 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.130 9.309 -7.246 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.207 8.320 -9.677 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.959 7.065 -9.862 1.00 0.00 H new ATOM 0 HD13 ILE A 80 3.978 8.470 -10.955 1.00 0.00 H new ATOM 1339 N ALA A 81 0.822 6.689 -6.794 1.00 0.00 N ATOM 1340 CA ALA A 81 1.152 6.270 -5.434 1.00 0.00 C ATOM 1341 C ALA A 81 0.772 4.822 -5.100 1.00 0.00 C ATOM 1342 O ALA A 81 0.959 4.423 -3.952 1.00 0.00 O ATOM 1343 CB ALA A 81 0.574 7.302 -4.463 1.00 0.00 C ATOM 0 H ALA A 81 -0.122 7.063 -6.887 1.00 0.00 H new ATOM 0 HA ALA A 81 2.237 6.248 -5.334 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.808 7.010 -3.439 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.009 8.280 -4.670 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.508 7.353 -4.587 1.00 0.00 H new ATOM 1349 N VAL A 82 0.277 4.032 -6.064 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.109 2.623 -5.857 1.00 0.00 C ATOM 1351 C VAL A 82 0.104 1.782 -7.126 1.00 0.00 C ATOM 1352 O VAL A 82 -0.415 2.102 -8.195 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.579 2.489 -5.411 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -1.864 1.046 -4.972 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.020 3.413 -4.269 1.00 0.00 C ATOM 0 H VAL A 82 0.131 4.354 -7.021 1.00 0.00 H new ATOM 0 HA VAL A 82 0.539 2.247 -5.065 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.149 2.787 -6.291 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.904 0.960 -4.658 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.679 0.369 -5.806 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.211 0.783 -4.140 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.070 3.232 -4.039 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.415 3.212 -3.385 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.888 4.452 -4.570 1.00 0.00 H new ATOM 1365 N GLU A 83 0.825 0.670 -6.995 1.00 0.00 N ATOM 1366 CA GLU A 83 1.202 -0.264 -8.068 1.00 0.00 C ATOM 1367 C GLU A 83 1.135 -1.739 -7.636 1.00 0.00 C ATOM 1368 O GLU A 83 0.996 -2.059 -6.456 1.00 0.00 O ATOM 1369 CB GLU A 83 2.620 0.070 -8.582 1.00 0.00 C ATOM 1370 CG GLU A 83 2.617 1.114 -9.704 1.00 0.00 C ATOM 1371 CD GLU A 83 2.191 0.552 -11.081 1.00 0.00 C ATOM 1372 OE1 GLU A 83 1.323 -0.350 -11.148 1.00 0.00 O ATOM 1373 OE2 GLU A 83 2.706 1.040 -12.118 1.00 0.00 O ATOM 0 H GLU A 83 1.185 0.375 -6.087 1.00 0.00 H new ATOM 0 HA GLU A 83 0.472 -0.137 -8.868 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.225 0.437 -7.753 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.095 -0.843 -8.943 1.00 0.00 H new ATOM 0 HG2 GLU A 83 1.944 1.926 -9.430 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.615 1.543 -9.791 1.00 0.00 H new ATOM 1380 N THR A 84 1.239 -2.642 -8.610 1.00 0.00 N ATOM 1381 CA THR A 84 1.037 -4.102 -8.484 1.00 0.00 C ATOM 1382 C THR A 84 2.275 -4.885 -8.942 1.00 0.00 C ATOM 1383 O THR A 84 3.107 -4.378 -9.703 1.00 0.00 O ATOM 1384 CB THR A 84 -0.187 -4.543 -9.315 1.00 0.00 C ATOM 1385 OG1 THR A 84 0.063 -4.423 -10.701 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.430 -3.695 -9.032 1.00 0.00 C ATOM 0 H THR A 84 1.479 -2.370 -9.563 1.00 0.00 H new ATOM 0 HA THR A 84 0.865 -4.321 -7.430 1.00 0.00 H new ATOM 0 HB THR A 84 -0.364 -5.579 -9.026 1.00 0.00 H new ATOM 0 HG1 THR A 84 -0.728 -4.711 -11.202 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.259 -4.050 -9.644 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.695 -3.778 -7.978 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.222 -2.652 -9.273 1.00 0.00 H new ATOM 1394 N VAL A 85 2.408 -6.137 -8.494 1.00 0.00 N ATOM 1395 CA VAL A 85 3.417 -7.082 -9.013 1.00 0.00 C ATOM 1396 C VAL A 85 2.922 -7.829 -10.263 1.00 0.00 C ATOM 1397 O VAL A 85 1.746 -7.760 -10.628 1.00 0.00 O ATOM 1398 CB VAL A 85 3.876 -8.084 -7.942 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.423 -7.355 -6.717 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.767 -9.044 -7.528 1.00 0.00 C ATOM 0 H VAL A 85 1.820 -6.530 -7.759 1.00 0.00 H new ATOM 0 HA VAL A 85 4.277 -6.476 -9.300 1.00 0.00 H new ATOM 0 HB VAL A 85 4.671 -8.679 -8.391 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.742 -8.084 -5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.274 -6.739 -7.010 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.645 -6.720 -6.294 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.144 -9.730 -6.770 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.929 -8.478 -7.121 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.434 -9.611 -8.397 1.00 0.00 H new ATOM 1410 N THR A 86 3.807 -8.603 -10.892 1.00 0.00 N ATOM 1411 CA THR A 86 3.508 -9.441 -12.065 1.00 0.00 C ATOM 1412 C THR A 86 2.992 -10.831 -11.679 1.00 0.00 C ATOM 1413 O THR A 86 2.135 -11.387 -12.367 1.00 0.00 O ATOM 1414 CB THR A 86 4.753 -9.614 -12.951 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.758 -10.310 -12.251 1.00 0.00 O ATOM 1416 CG2 THR A 86 5.373 -8.289 -13.381 1.00 0.00 C ATOM 0 H THR A 86 4.781 -8.670 -10.595 1.00 0.00 H new ATOM 0 HA THR A 86 2.724 -8.918 -12.613 1.00 0.00 H new ATOM 0 HB THR A 86 4.408 -10.156 -13.831 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.544 -10.415 -12.826 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.247 -8.481 -14.003 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.643 -7.713 -13.949 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.673 -7.724 -12.498 1.00 0.00 H new ATOM 1424 N ASP A 87 3.514 -11.404 -10.587 1.00 0.00 N ATOM 1425 CA ASP A 87 3.400 -12.844 -10.315 1.00 0.00 C ATOM 1426 C ASP A 87 2.209 -13.231 -9.424 1.00 0.00 C ATOM 1427 O ASP A 87 1.538 -14.227 -9.709 1.00 0.00 O ATOM 1428 CB ASP A 87 4.712 -13.346 -9.704 1.00 0.00 C ATOM 1429 CG ASP A 87 4.729 -14.880 -9.578 1.00 0.00 C ATOM 1430 OD1 ASP A 87 4.512 -15.403 -8.460 1.00 0.00 O ATOM 1431 OD2 ASP A 87 4.963 -15.566 -10.602 1.00 0.00 O ATOM 0 H ASP A 87 4.024 -10.887 -9.871 1.00 0.00 H new ATOM 0 HA ASP A 87 3.208 -13.327 -11.273 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.549 -13.022 -10.322 1.00 0.00 H new ATOM 0 HB3 ASP A 87 4.850 -12.898 -8.720 1.00 0.00 H new ATOM 1436 N SER A 88 1.939 -12.466 -8.355 1.00 0.00 N ATOM 1437 CA SER A 88 0.895 -12.831 -7.368 1.00 0.00 C ATOM 1438 C SER A 88 0.111 -11.646 -6.804 1.00 0.00 C ATOM 1439 O SER A 88 0.682 -10.685 -6.297 1.00 0.00 O ATOM 1440 CB SER A 88 1.505 -13.650 -6.226 1.00 0.00 C ATOM 1441 OG SER A 88 0.494 -14.054 -5.311 1.00 0.00 O ATOM 0 H SER A 88 2.424 -11.593 -8.147 1.00 0.00 H new ATOM 0 HA SER A 88 0.170 -13.430 -7.920 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.011 -14.527 -6.629 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.258 -13.057 -5.707 1.00 0.00 H new ATOM 0 HG SER A 88 0.898 -14.578 -4.588 1.00 0.00 H new ATOM 1447 N SER A 89 -1.221 -11.737 -6.818 1.00 0.00 N ATOM 1448 CA SER A 89 -2.145 -10.645 -6.465 1.00 0.00 C ATOM 1449 C SER A 89 -2.166 -10.246 -4.976 1.00 0.00 C ATOM 1450 O SER A 89 -2.972 -9.397 -4.592 1.00 0.00 O ATOM 1451 CB SER A 89 -3.567 -10.986 -6.940 1.00 0.00 C ATOM 1452 OG SER A 89 -3.551 -11.437 -8.288 1.00 0.00 O ATOM 0 H SER A 89 -1.705 -12.595 -7.082 1.00 0.00 H new ATOM 0 HA SER A 89 -1.757 -9.769 -6.984 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.995 -11.756 -6.299 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.206 -10.107 -6.853 1.00 0.00 H new ATOM 0 HG SER A 89 -4.464 -11.651 -8.572 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.302 -10.830 -4.125 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.162 -10.482 -2.699 1.00 0.00 C ATOM 1460 C ARG A 90 -0.027 -9.495 -2.386 1.00 0.00 C ATOM 1461 O ARG A 90 0.371 -9.381 -1.226 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.227 -11.737 -1.802 1.00 0.00 C ATOM 1463 CG ARG A 90 0.079 -12.533 -1.705 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.014 -13.703 -0.717 1.00 0.00 C ATOM 1465 NE ARG A 90 1.316 -14.308 -0.515 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.635 -15.358 0.219 1.00 0.00 C ATOM 1467 NH1 ARG A 90 2.858 -15.801 0.192 1.00 0.00 N ATOM 1468 NH2 ARG A 90 0.788 -15.983 0.985 1.00 0.00 N ATOM 0 H ARG A 90 -0.668 -11.574 -4.417 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.038 -9.890 -2.433 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.525 -11.433 -0.799 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.009 -12.395 -2.181 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.341 -12.916 -2.691 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.884 -11.866 -1.398 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.410 -13.353 0.236 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.709 -14.453 -1.095 1.00 0.00 H new ATOM 0 HE ARG A 90 2.088 -13.857 -1.005 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.555 -15.338 -0.391 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.119 -16.611 0.754 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.180 -15.666 1.040 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.092 -16.790 1.530 1.00 0.00 H new ATOM 1482 N TYR A 91 0.491 -8.781 -3.392 1.00 0.00 N ATOM 1483 CA TYR A 91 1.646 -7.901 -3.262 1.00 0.00 C ATOM 1484 C TYR A 91 1.443 -6.613 -4.071 1.00 0.00 C ATOM 1485 O TYR A 91 1.067 -6.653 -5.247 1.00 0.00 O ATOM 1486 CB TYR A 91 2.901 -8.643 -3.731 1.00 0.00 C ATOM 1487 CG TYR A 91 3.243 -9.907 -2.965 1.00 0.00 C ATOM 1488 CD1 TYR A 91 3.973 -9.822 -1.766 1.00 0.00 C ATOM 1489 CD2 TYR A 91 2.860 -11.166 -3.469 1.00 0.00 C ATOM 1490 CE1 TYR A 91 4.309 -10.991 -1.057 1.00 0.00 C ATOM 1491 CE2 TYR A 91 3.228 -12.340 -2.785 1.00 0.00 C ATOM 1492 CZ TYR A 91 3.946 -12.254 -1.573 1.00 0.00 C ATOM 1493 OH TYR A 91 4.261 -13.393 -0.896 1.00 0.00 O ATOM 0 H TYR A 91 0.107 -8.803 -4.337 1.00 0.00 H new ATOM 0 HA TYR A 91 1.765 -7.619 -2.216 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.777 -8.900 -4.783 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.749 -7.961 -3.667 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.277 -8.857 -1.388 1.00 0.00 H new ATOM 0 HD2 TYR A 91 2.284 -11.230 -4.380 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.843 -10.922 -0.121 1.00 0.00 H new ATOM 0 HE2 TYR A 91 2.961 -13.306 -3.187 1.00 0.00 H new ATOM 0 HH TYR A 91 4.283 -13.206 0.066 1.00 0.00 H new ATOM 1503 N PHE A 92 1.711 -5.470 -3.441 1.00 0.00 N ATOM 1504 CA PHE A 92 1.548 -4.130 -4.011 1.00 0.00 C ATOM 1505 C PHE A 92 2.749 -3.246 -3.656 1.00 0.00 C ATOM 1506 O PHE A 92 3.496 -3.549 -2.730 1.00 0.00 O ATOM 1507 CB PHE A 92 0.236 -3.511 -3.496 1.00 0.00 C ATOM 1508 CG PHE A 92 -1.017 -4.230 -3.964 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.529 -5.316 -3.230 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.664 -3.825 -5.146 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.673 -5.993 -3.683 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.827 -4.486 -5.582 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.328 -5.578 -4.853 1.00 0.00 C ATOM 0 H PHE A 92 2.061 -5.449 -2.483 1.00 0.00 H new ATOM 0 HA PHE A 92 1.500 -4.203 -5.097 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.253 -3.506 -2.406 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.187 -2.471 -3.819 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.042 -5.629 -2.318 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -1.266 -3.002 -5.722 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.051 -6.838 -3.128 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.334 -4.155 -6.476 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.213 -6.096 -5.192 1.00 0.00 H new ATOM 1523 N VAL A 93 2.936 -2.140 -4.371 1.00 0.00 N ATOM 1524 CA VAL A 93 3.926 -1.099 -4.050 1.00 0.00 C ATOM 1525 C VAL A 93 3.199 0.226 -3.864 1.00 0.00 C ATOM 1526 O VAL A 93 2.288 0.522 -4.634 1.00 0.00 O ATOM 1527 CB VAL A 93 5.014 -1.015 -5.138 1.00 0.00 C ATOM 1528 CG1 VAL A 93 6.016 0.122 -4.913 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.799 -2.328 -5.190 1.00 0.00 C ATOM 0 H VAL A 93 2.395 -1.932 -5.210 1.00 0.00 H new ATOM 0 HA VAL A 93 4.440 -1.351 -3.122 1.00 0.00 H new ATOM 0 HB VAL A 93 4.488 -0.821 -6.073 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.753 0.122 -5.716 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.488 1.076 -4.905 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.521 -0.021 -3.958 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.567 -2.263 -5.961 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.270 -2.509 -4.224 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.120 -3.149 -5.422 1.00 0.00 H new ATOM 1539 N ILE A 94 3.582 1.037 -2.874 1.00 0.00 N ATOM 1540 CA ILE A 94 2.988 2.364 -2.662 1.00 0.00 C ATOM 1541 C ILE A 94 4.043 3.456 -2.479 1.00 0.00 C ATOM 1542 O ILE A 94 5.119 3.210 -1.927 1.00 0.00 O ATOM 1543 CB ILE A 94 1.924 2.397 -1.540 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.437 2.091 -0.113 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.702 1.536 -1.893 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.614 0.611 0.260 1.00 0.00 C ATOM 0 H ILE A 94 4.308 0.796 -2.199 1.00 0.00 H new ATOM 0 HA ILE A 94 2.453 2.585 -3.585 1.00 0.00 H new ATOM 0 HB ILE A 94 1.623 3.444 -1.496 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.397 2.591 0.017 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.745 2.540 0.600 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.024 1.584 -1.081 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.246 1.910 -2.810 1.00 0.00 H new ATOM 0 HG23 ILE A 94 1.015 0.502 -2.039 1.00 0.00 H new ATOM 0 HD11 ILE A 94 2.978 0.535 1.285 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.656 0.098 0.176 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.334 0.149 -0.416 1.00 0.00 H new ATOM 1558 N ARG A 95 3.724 4.674 -2.938 1.00 0.00 N ATOM 1559 CA ARG A 95 4.611 5.848 -2.816 1.00 0.00 C ATOM 1560 C ARG A 95 4.345 6.606 -1.515 1.00 0.00 C ATOM 1561 O ARG A 95 3.562 7.559 -1.492 1.00 0.00 O ATOM 1562 CB ARG A 95 4.531 6.749 -4.060 1.00 0.00 C ATOM 1563 CG ARG A 95 5.738 7.694 -4.125 1.00 0.00 C ATOM 1564 CD ARG A 95 5.669 8.611 -5.350 1.00 0.00 C ATOM 1565 NE ARG A 95 6.869 9.464 -5.436 1.00 0.00 N ATOM 1566 CZ ARG A 95 7.332 10.100 -6.494 1.00 0.00 C ATOM 1567 NH1 ARG A 95 8.425 10.794 -6.386 1.00 0.00 N ATOM 1568 NH2 ARG A 95 6.737 10.067 -7.653 1.00 0.00 N ATOM 0 H ARG A 95 2.841 4.877 -3.407 1.00 0.00 H new ATOM 0 HA ARG A 95 5.640 5.492 -2.766 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.496 6.134 -4.959 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.609 7.330 -4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.777 8.298 -3.219 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.657 7.110 -4.158 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.579 8.010 -6.255 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.777 9.235 -5.292 1.00 0.00 H new ATOM 0 HE ARG A 95 7.404 9.575 -4.575 1.00 0.00 H new ATOM 0 HH11 ARG A 95 8.913 10.841 -5.491 1.00 0.00 H new ATOM 0 HH12 ARG A 95 8.795 11.291 -7.196 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.876 9.533 -7.769 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.133 10.575 -8.444 1.00 0.00 H new ATOM 1582 N ILE A 96 4.985 6.184 -0.429 1.00 0.00 N ATOM 1583 CA ILE A 96 4.865 6.855 0.872 1.00 0.00 C ATOM 1584 C ILE A 96 5.547 8.232 0.851 1.00 0.00 C ATOM 1585 O ILE A 96 6.594 8.406 0.227 1.00 0.00 O ATOM 1586 CB ILE A 96 5.274 5.958 2.062 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.769 5.561 2.097 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.402 4.694 2.105 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.604 6.449 3.023 1.00 0.00 C ATOM 0 H ILE A 96 5.601 5.371 -0.420 1.00 0.00 H new ATOM 0 HA ILE A 96 3.806 7.044 1.045 1.00 0.00 H new ATOM 0 HB ILE A 96 5.109 6.572 2.947 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.856 4.524 2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.177 5.614 1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.703 4.073 2.949 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.356 4.978 2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.528 4.133 1.179 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.643 6.120 3.004 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.545 7.484 2.685 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.219 6.377 4.040 1.00 0.00 H new ATOM 1601 N GLN A 97 4.917 9.221 1.488 1.00 0.00 N ATOM 1602 CA GLN A 97 5.268 10.647 1.438 1.00 0.00 C ATOM 1603 C GLN A 97 5.156 11.300 2.820 1.00 0.00 C ATOM 1604 O GLN A 97 4.237 11.030 3.596 1.00 0.00 O ATOM 1605 CB GLN A 97 4.349 11.391 0.453 1.00 0.00 C ATOM 1606 CG GLN A 97 4.685 11.118 -1.021 1.00 0.00 C ATOM 1607 CD GLN A 97 3.478 11.286 -1.938 1.00 0.00 C ATOM 1608 OE1 GLN A 97 3.083 12.383 -2.307 1.00 0.00 O ATOM 1609 NE2 GLN A 97 2.849 10.200 -2.333 1.00 0.00 N ATOM 0 H GLN A 97 4.108 9.043 2.083 1.00 0.00 H new ATOM 0 HA GLN A 97 6.302 10.716 1.102 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.316 11.101 0.642 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.419 12.462 0.641 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.477 11.795 -1.341 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.073 10.104 -1.120 1.00 0.00 H new ATOM 0 HE21 GLN A 97 3.175 9.283 -2.028 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.036 10.275 -2.944 1.00 0.00 H new ATOM 1618 N ASP A 98 6.064 12.235 3.093 1.00 0.00 N ATOM 1619 CA ASP A 98 6.137 12.969 4.372 1.00 0.00 C ATOM 1620 C ASP A 98 5.321 14.286 4.366 1.00 0.00 C ATOM 1621 O ASP A 98 5.332 15.047 5.334 1.00 0.00 O ATOM 1622 CB ASP A 98 7.617 13.189 4.720 1.00 0.00 C ATOM 1623 CG ASP A 98 7.883 13.599 6.179 1.00 0.00 C ATOM 1624 OD1 ASP A 98 7.292 12.999 7.108 1.00 0.00 O ATOM 1625 OD2 ASP A 98 8.754 14.478 6.392 1.00 0.00 O ATOM 0 H ASP A 98 6.784 12.514 2.427 1.00 0.00 H new ATOM 0 HA ASP A 98 5.668 12.368 5.151 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.165 12.271 4.510 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.020 13.959 4.062 1.00 0.00 H new ATOM 1630 N GLY A 99 4.616 14.571 3.261 1.00 0.00 N ATOM 1631 CA GLY A 99 3.751 15.751 3.087 1.00 0.00 C ATOM 1632 C GLY A 99 4.494 17.041 2.708 1.00 0.00 C ATOM 1633 O GLY A 99 3.929 18.132 2.805 1.00 0.00 O ATOM 0 H GLY A 99 4.632 13.969 2.438 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.013 15.533 2.315 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.203 15.922 4.013 1.00 0.00 H new ATOM 1637 N THR A 100 5.763 16.923 2.301 1.00 0.00 N ATOM 1638 CA THR A 100 6.698 18.045 2.069 1.00 0.00 C ATOM 1639 C THR A 100 7.596 17.852 0.827 1.00 0.00 C ATOM 1640 O THR A 100 8.624 18.515 0.680 1.00 0.00 O ATOM 1641 CB THR A 100 7.494 18.301 3.367 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.222 19.511 3.320 1.00 0.00 O ATOM 1643 CG2 THR A 100 8.454 17.160 3.717 1.00 0.00 C ATOM 0 H THR A 100 6.188 16.015 2.116 1.00 0.00 H new ATOM 0 HA THR A 100 6.120 18.937 1.828 1.00 0.00 H new ATOM 0 HB THR A 100 6.736 18.367 4.148 1.00 0.00 H new ATOM 0 HG1 THR A 100 8.566 19.651 2.413 1.00 0.00 H new ATOM 0 HG21 THR A 100 8.984 17.400 4.639 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.889 16.238 3.853 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.174 17.029 2.909 1.00 0.00 H new ATOM 1651 N GLY A 101 7.237 16.926 -0.074 1.00 0.00 N ATOM 1652 CA GLY A 101 8.000 16.606 -1.295 1.00 0.00 C ATOM 1653 C GLY A 101 9.054 15.497 -1.133 1.00 0.00 C ATOM 1654 O GLY A 101 9.679 15.094 -2.117 1.00 0.00 O ATOM 0 H GLY A 101 6.391 16.365 0.025 1.00 0.00 H new ATOM 0 HA2 GLY A 101 7.299 16.309 -2.075 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.498 17.512 -1.642 1.00 0.00 H new ATOM 1658 N ARG A 102 9.217 14.957 0.083 1.00 0.00 N ATOM 1659 CA ARG A 102 9.923 13.702 0.367 1.00 0.00 C ATOM 1660 C ARG A 102 9.024 12.544 -0.028 1.00 0.00 C ATOM 1661 O ARG A 102 7.849 12.521 0.346 1.00 0.00 O ATOM 1662 CB ARG A 102 10.234 13.565 1.866 1.00 0.00 C ATOM 1663 CG ARG A 102 11.174 14.647 2.389 1.00 0.00 C ATOM 1664 CD ARG A 102 11.241 14.611 3.920 1.00 0.00 C ATOM 1665 NE ARG A 102 12.124 15.666 4.451 1.00 0.00 N ATOM 1666 CZ ARG A 102 12.010 16.300 5.608 1.00 0.00 C ATOM 1667 NH1 ARG A 102 12.899 17.192 5.946 1.00 0.00 N ATOM 1668 NH2 ARG A 102 11.042 16.084 6.453 1.00 0.00 N ATOM 0 H ARG A 102 8.847 15.399 0.925 1.00 0.00 H new ATOM 0 HA ARG A 102 10.858 13.699 -0.193 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.301 13.601 2.428 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.679 12.587 2.050 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.171 14.502 1.973 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.829 15.627 2.058 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.239 14.734 4.331 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.602 13.636 4.246 1.00 0.00 H new ATOM 0 HE ARG A 102 12.911 15.938 3.861 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.678 17.399 5.320 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.816 17.683 6.836 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.321 15.396 6.237 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.006 16.603 7.330 1.00 0.00 H new ATOM 1682 N SER A 103 9.595 11.570 -0.718 1.00 0.00 N ATOM 1683 CA SER A 103 8.910 10.308 -1.005 1.00 0.00 C ATOM 1684 C SER A 103 9.825 9.089 -1.166 1.00 0.00 C ATOM 1685 O SER A 103 11.019 9.218 -1.453 1.00 0.00 O ATOM 1686 CB SER A 103 8.016 10.461 -2.243 1.00 0.00 C ATOM 1687 OG SER A 103 8.776 10.602 -3.434 1.00 0.00 O ATOM 0 H SER A 103 10.541 11.625 -1.096 1.00 0.00 H new ATOM 0 HA SER A 103 8.312 10.102 -0.117 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.365 9.591 -2.329 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.371 11.331 -2.119 1.00 0.00 H new ATOM 0 HG SER A 103 8.953 11.552 -3.599 1.00 0.00 H new ATOM 1693 N ALA A 104 9.240 7.898 -1.010 1.00 0.00 N ATOM 1694 CA ALA A 104 9.845 6.604 -1.326 1.00 0.00 C ATOM 1695 C ALA A 104 8.788 5.613 -1.843 1.00 0.00 C ATOM 1696 O ALA A 104 7.640 5.635 -1.401 1.00 0.00 O ATOM 1697 CB ALA A 104 10.548 6.060 -0.075 1.00 0.00 C ATOM 0 H ALA A 104 8.292 7.807 -0.645 1.00 0.00 H new ATOM 0 HA ALA A 104 10.580 6.735 -2.121 1.00 0.00 H new ATOM 0 HB1 ALA A 104 11.001 5.095 -0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.322 6.759 0.240 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.820 5.938 0.727 1.00 0.00 H new ATOM 1703 N PHE A 105 9.177 4.712 -2.746 1.00 0.00 N ATOM 1704 CA PHE A 105 8.363 3.553 -3.122 1.00 0.00 C ATOM 1705 C PHE A 105 8.715 2.363 -2.220 1.00 0.00 C ATOM 1706 O PHE A 105 9.867 1.920 -2.195 1.00 0.00 O ATOM 1707 CB PHE A 105 8.551 3.218 -4.607 1.00 0.00 C ATOM 1708 CG PHE A 105 7.829 4.145 -5.569 1.00 0.00 C ATOM 1709 CD1 PHE A 105 8.518 5.191 -6.214 1.00 0.00 C ATOM 1710 CD2 PHE A 105 6.469 3.929 -5.860 1.00 0.00 C ATOM 1711 CE1 PHE A 105 7.853 5.998 -7.156 1.00 0.00 C ATOM 1712 CE2 PHE A 105 5.809 4.720 -6.815 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.502 5.753 -7.467 1.00 0.00 C ATOM 0 H PHE A 105 10.068 4.765 -3.239 1.00 0.00 H new ATOM 0 HA PHE A 105 7.309 3.789 -2.978 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.616 3.238 -4.837 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.207 2.198 -4.781 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.558 5.374 -5.985 1.00 0.00 H new ATOM 0 HD2 PHE A 105 5.928 3.149 -5.345 1.00 0.00 H new ATOM 0 HE1 PHE A 105 8.380 6.806 -7.641 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.771 4.534 -7.047 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.999 6.359 -8.206 1.00 0.00 H new ATOM 1723 N ILE A 106 7.726 1.841 -1.489 1.00 0.00 N ATOM 1724 CA ILE A 106 7.862 0.654 -0.623 1.00 0.00 C ATOM 1725 C ILE A 106 6.948 -0.475 -1.099 1.00 0.00 C ATOM 1726 O ILE A 106 5.824 -0.222 -1.535 1.00 0.00 O ATOM 1727 CB ILE A 106 7.653 0.981 0.876 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.187 1.300 1.249 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.594 2.125 1.287 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.944 1.446 2.757 1.00 0.00 C ATOM 0 H ILE A 106 6.786 2.236 -1.479 1.00 0.00 H new ATOM 0 HA ILE A 106 8.892 0.308 -0.710 1.00 0.00 H new ATOM 0 HB ILE A 106 7.898 0.079 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.889 2.224 0.752 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.544 0.509 0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.447 2.356 2.342 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.628 1.823 1.122 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.375 3.009 0.689 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.892 1.669 2.936 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.208 0.516 3.260 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.559 2.257 3.148 1.00 0.00 H new ATOM 1742 N GLY A 107 7.413 -1.719 -1.001 1.00 0.00 N ATOM 1743 CA GLY A 107 6.612 -2.906 -1.299 1.00 0.00 C ATOM 1744 C GLY A 107 5.877 -3.388 -0.054 1.00 0.00 C ATOM 1745 O GLY A 107 6.432 -3.330 1.043 1.00 0.00 O ATOM 0 H GLY A 107 8.366 -1.934 -0.709 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.893 -2.677 -2.086 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.256 -3.700 -1.677 1.00 0.00 H new ATOM 1749 N ILE A 108 4.650 -3.875 -0.220 1.00 0.00 N ATOM 1750 CA ILE A 108 3.863 -4.540 0.820 1.00 0.00 C ATOM 1751 C ILE A 108 3.350 -5.904 0.354 1.00 0.00 C ATOM 1752 O ILE A 108 2.902 -6.066 -0.782 1.00 0.00 O ATOM 1753 CB ILE A 108 2.716 -3.668 1.378 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.719 -3.167 0.310 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.304 -2.512 2.199 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.435 -2.576 0.913 1.00 0.00 C ATOM 0 H ILE A 108 4.158 -3.817 -1.112 1.00 0.00 H new ATOM 0 HA ILE A 108 4.549 -4.702 1.651 1.00 0.00 H new ATOM 0 HB ILE A 108 2.117 -4.309 2.025 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.205 -2.411 -0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.456 -3.994 -0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.495 -1.897 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.889 -2.914 3.026 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.946 -1.903 1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.224 -2.242 0.111 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.072 -3.337 1.506 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.689 -1.729 1.550 1.00 0.00 H new ATOM 1768 N GLY A 109 3.406 -6.883 1.256 1.00 0.00 N ATOM 1769 CA GLY A 109 2.876 -8.234 1.086 1.00 0.00 C ATOM 1770 C GLY A 109 1.821 -8.577 2.134 1.00 0.00 C ATOM 1771 O GLY A 109 1.918 -8.168 3.296 1.00 0.00 O ATOM 0 H GLY A 109 3.843 -6.749 2.168 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.441 -8.329 0.091 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.693 -8.953 1.147 1.00 0.00 H new ATOM 1775 N PHE A 110 0.811 -9.331 1.705 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.323 -9.779 2.515 1.00 0.00 C ATOM 1777 C PHE A 110 -0.217 -11.273 2.856 1.00 0.00 C ATOM 1778 O PHE A 110 0.565 -12.017 2.259 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.620 -9.484 1.747 1.00 0.00 C ATOM 1780 CG PHE A 110 -1.996 -8.018 1.646 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -3.120 -7.539 2.346 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -1.254 -7.138 0.833 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -3.485 -6.186 2.246 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -1.606 -5.782 0.752 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.715 -5.306 1.465 1.00 0.00 C ATOM 0 H PHE A 110 0.757 -9.662 0.742 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.322 -9.239 3.462 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.525 -9.888 0.739 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.438 -10.019 2.229 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -3.701 -8.211 2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.411 -7.509 0.270 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.357 -5.822 2.769 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -1.024 -5.107 0.142 1.00 0.00 H new ATOM 0 HZ PHE A 110 -2.979 -4.260 1.414 1.00 0.00 H new ATOM 1795 N THR A 111 -1.051 -11.731 3.793 1.00 0.00 N ATOM 1796 CA THR A 111 -1.149 -13.153 4.157 1.00 0.00 C ATOM 1797 C THR A 111 -1.769 -13.998 3.033 1.00 0.00 C ATOM 1798 O THR A 111 -1.314 -15.112 2.768 1.00 0.00 O ATOM 1799 CB THR A 111 -1.893 -13.308 5.497 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.796 -14.638 5.956 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.378 -12.929 5.457 1.00 0.00 C ATOM 0 H THR A 111 -1.680 -11.128 4.323 1.00 0.00 H new ATOM 0 HA THR A 111 -0.140 -13.542 4.291 1.00 0.00 H new ATOM 0 HB THR A 111 -1.401 -12.606 6.170 1.00 0.00 H new ATOM 0 HG1 THR A 111 -2.271 -14.725 6.809 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.816 -13.071 6.445 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.479 -11.885 5.161 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.896 -13.562 4.736 1.00 0.00 H new ATOM 1809 N ASP A 112 -2.748 -13.457 2.295 1.00 0.00 N ATOM 1810 CA ASP A 112 -3.434 -14.154 1.203 1.00 0.00 C ATOM 1811 C ASP A 112 -4.061 -13.174 0.196 1.00 0.00 C ATOM 1812 O ASP A 112 -4.429 -12.047 0.545 1.00 0.00 O ATOM 1813 CB ASP A 112 -4.510 -15.089 1.786 1.00 0.00 C ATOM 1814 CG ASP A 112 -5.028 -16.079 0.731 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -6.091 -15.811 0.126 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -4.345 -17.096 0.470 1.00 0.00 O ATOM 0 H ASP A 112 -3.090 -12.507 2.444 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.694 -14.740 0.659 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.096 -15.640 2.631 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.341 -14.496 2.168 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.235 -13.618 -1.055 1.00 0.00 N ATOM 1822 CA ARG A 113 -4.935 -12.871 -2.119 1.00 0.00 C ATOM 1823 C ARG A 113 -6.345 -12.477 -1.717 1.00 0.00 C ATOM 1824 O ARG A 113 -6.767 -11.356 -1.977 1.00 0.00 O ATOM 1825 CB ARG A 113 -5.022 -13.739 -3.379 1.00 0.00 C ATOM 1826 CG ARG A 113 -3.640 -13.852 -4.010 1.00 0.00 C ATOM 1827 CD ARG A 113 -3.660 -14.719 -5.270 1.00 0.00 C ATOM 1828 NE ARG A 113 -3.618 -16.159 -4.949 1.00 0.00 N ATOM 1829 CZ ARG A 113 -2.543 -16.917 -4.800 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -2.672 -18.181 -4.519 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -1.329 -16.456 -4.920 1.00 0.00 N ATOM 0 H ARG A 113 -3.888 -14.525 -1.367 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.363 -11.961 -2.302 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -5.401 -14.729 -3.127 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.724 -13.300 -4.089 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -3.272 -12.857 -4.259 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -2.944 -14.277 -3.287 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -4.560 -14.502 -5.846 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -2.808 -14.463 -5.900 1.00 0.00 H new ATOM 0 HE ARG A 113 -4.519 -16.622 -4.828 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -3.601 -18.588 -4.414 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -1.844 -18.765 -4.404 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -1.177 -15.471 -5.138 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -0.532 -17.080 -4.796 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.038 -13.373 -1.027 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.388 -13.158 -0.520 1.00 0.00 C ATOM 1847 C GLY A 114 -8.514 -12.072 0.567 1.00 0.00 C ATOM 1848 O GLY A 114 -9.632 -11.712 0.934 1.00 0.00 O ATOM 0 H GLY A 114 -6.667 -14.295 -0.798 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.035 -12.890 -1.356 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.762 -14.099 -0.116 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.395 -11.517 1.051 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.341 -10.315 1.896 1.00 0.00 C ATOM 1854 C ASP A 115 -6.712 -9.126 1.154 1.00 0.00 C ATOM 1855 O ASP A 115 -7.145 -7.989 1.331 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.580 -10.616 3.195 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.456 -11.392 4.188 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -8.377 -10.768 4.767 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -7.224 -12.605 4.401 1.00 0.00 O ATOM 0 H ASP A 115 -6.471 -11.905 0.859 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.364 -10.033 2.145 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.684 -11.194 2.968 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.250 -9.682 3.650 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.741 -9.371 0.273 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.125 -8.337 -0.555 1.00 0.00 C ATOM 1866 C ALA A 116 -6.060 -7.772 -1.645 1.00 0.00 C ATOM 1867 O ALA A 116 -5.917 -6.623 -2.060 1.00 0.00 O ATOM 1868 CB ALA A 116 -3.885 -8.952 -1.177 1.00 0.00 C ATOM 0 H ALA A 116 -5.357 -10.303 0.114 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.884 -7.481 0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.389 -8.213 -1.807 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.204 -9.273 -0.389 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.170 -9.812 -1.782 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.063 -8.536 -2.084 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.129 -8.013 -2.947 1.00 0.00 C ATOM 1876 C PHE A 117 -8.928 -6.887 -2.270 1.00 0.00 C ATOM 1877 O PHE A 117 -9.358 -5.963 -2.956 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.048 -9.149 -3.427 1.00 0.00 C ATOM 1879 CG PHE A 117 -8.786 -9.555 -4.868 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -7.724 -10.422 -5.184 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -9.592 -9.037 -5.900 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -7.477 -10.781 -6.521 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -9.342 -9.391 -7.239 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.286 -10.266 -7.548 1.00 0.00 C ATOM 0 H PHE A 117 -7.161 -9.525 -1.855 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.652 -7.570 -3.821 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.913 -10.016 -2.781 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.087 -8.835 -3.327 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.096 -10.813 -4.397 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.404 -8.366 -5.663 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -6.665 -11.453 -6.759 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.961 -8.991 -8.028 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.097 -10.542 -8.575 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.070 -6.888 -0.939 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.758 -5.809 -0.216 1.00 0.00 C ATOM 1896 C ASP A 118 -8.963 -4.490 -0.223 1.00 0.00 C ATOM 1897 O ASP A 118 -9.567 -3.418 -0.225 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.084 -6.250 1.221 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.192 -7.312 1.303 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -11.058 -8.235 2.143 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -12.214 -7.206 0.584 1.00 0.00 O ATOM 0 H ASP A 118 -8.715 -7.630 -0.336 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.690 -5.611 -0.745 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -9.180 -6.644 1.685 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -10.385 -5.377 1.800 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.628 -4.539 -0.316 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.784 -3.355 -0.545 1.00 0.00 C ATOM 1908 C PHE A 119 -7.110 -2.690 -1.893 1.00 0.00 C ATOM 1909 O PHE A 119 -7.297 -1.476 -1.977 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.304 -3.765 -0.417 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.292 -2.742 -0.898 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.007 -2.622 -2.271 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -3.623 -1.918 0.022 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.115 -1.634 -2.723 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -2.738 -0.930 -0.429 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.486 -0.780 -1.802 1.00 0.00 C ATOM 0 H PHE A 119 -7.098 -5.406 -0.234 1.00 0.00 H new ATOM 0 HA PHE A 119 -6.992 -2.598 0.211 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.098 -3.988 0.630 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.153 -4.689 -0.976 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.475 -3.290 -2.979 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -3.791 -2.047 1.081 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.913 -1.531 -3.779 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.248 -0.281 0.282 1.00 0.00 H new ATOM 0 HZ PHE A 119 -1.811 -0.011 -2.149 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.251 -3.499 -2.942 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.524 -3.044 -4.305 1.00 0.00 C ATOM 1928 C ASN A 120 -8.996 -2.632 -4.524 1.00 0.00 C ATOM 1929 O ASN A 120 -9.277 -1.685 -5.265 1.00 0.00 O ATOM 1930 CB ASN A 120 -7.067 -4.192 -5.226 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.607 -4.113 -6.641 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -7.305 -3.207 -7.402 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.429 -5.060 -7.032 1.00 0.00 N ATOM 0 H ASN A 120 -7.177 -4.513 -2.866 1.00 0.00 H new ATOM 0 HA ASN A 120 -6.978 -2.127 -4.528 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -5.978 -4.198 -5.266 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -7.375 -5.140 -4.785 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -8.818 -5.041 -7.975 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -8.678 -5.815 -6.393 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.945 -3.316 -3.880 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.385 -3.033 -4.015 1.00 0.00 C ATOM 1942 C VAL A 121 -11.809 -1.821 -3.180 1.00 0.00 C ATOM 1943 O VAL A 121 -12.585 -0.998 -3.662 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.225 -4.290 -3.702 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.732 -4.007 -3.623 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -12.027 -5.345 -4.800 1.00 0.00 C ATOM 0 H VAL A 121 -9.740 -4.087 -3.245 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.578 -2.767 -5.054 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.879 -4.640 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.265 -4.932 -3.400 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -13.925 -3.279 -2.835 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.078 -3.610 -4.577 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.624 -6.227 -4.569 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.342 -4.935 -5.760 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.974 -5.623 -4.852 1.00 0.00 H new ATOM 1956 N SER A 122 -11.278 -1.638 -1.967 1.00 0.00 N ATOM 1957 CA SER A 122 -11.633 -0.479 -1.130 1.00 0.00 C ATOM 1958 C SER A 122 -11.150 0.860 -1.709 1.00 0.00 C ATOM 1959 O SER A 122 -11.842 1.871 -1.572 1.00 0.00 O ATOM 1960 CB SER A 122 -11.115 -0.659 0.294 1.00 0.00 C ATOM 1961 OG SER A 122 -9.708 -0.750 0.311 1.00 0.00 O ATOM 0 H SER A 122 -10.603 -2.273 -1.541 1.00 0.00 H new ATOM 0 HA SER A 122 -12.722 -0.438 -1.116 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.436 0.180 0.911 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.547 -1.559 0.731 1.00 0.00 H new ATOM 0 HG SER A 122 -9.438 -1.675 0.132 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.017 0.868 -2.424 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.523 2.035 -3.163 1.00 0.00 C ATOM 1969 C LEU A 123 -10.414 2.367 -4.370 1.00 0.00 C ATOM 1970 O LEU A 123 -10.884 3.499 -4.496 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.063 1.795 -3.592 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.032 1.878 -2.450 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.659 1.437 -2.963 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -6.893 3.303 -1.903 1.00 0.00 C ATOM 0 H LEU A 123 -9.410 0.052 -2.506 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.560 2.901 -2.503 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -7.992 0.811 -4.056 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.798 2.527 -4.355 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.386 1.226 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -4.932 1.497 -2.153 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.718 0.410 -3.323 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.348 2.090 -3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.156 3.314 -1.100 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.569 3.970 -2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.855 3.640 -1.517 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.711 1.394 -5.240 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.535 1.651 -6.430 1.00 0.00 C ATOM 1988 C GLN A 124 -13.001 1.979 -6.081 1.00 0.00 C ATOM 1989 O GLN A 124 -13.644 2.751 -6.791 1.00 0.00 O ATOM 1990 CB GLN A 124 -11.390 0.502 -7.443 1.00 0.00 C ATOM 1991 CG GLN A 124 -12.233 -0.735 -7.123 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.830 -1.929 -7.981 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.514 -2.326 -8.915 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.699 -2.541 -7.702 1.00 0.00 N ATOM 0 H GLN A 124 -10.396 0.428 -5.145 1.00 0.00 H new ATOM 0 HA GLN A 124 -11.158 2.554 -6.911 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.666 0.869 -8.432 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.341 0.209 -7.493 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -12.120 -0.990 -6.069 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -13.287 -0.509 -7.285 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -10.122 -2.217 -6.926 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.399 -3.339 -8.262 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.515 1.477 -4.953 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.854 1.790 -4.441 1.00 0.00 C ATOM 2005 C ASP A 125 -14.898 3.117 -3.653 1.00 0.00 C ATOM 2006 O ASP A 125 -15.975 3.578 -3.272 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.389 0.603 -3.624 1.00 0.00 C ATOM 2008 CG ASP A 125 -16.879 0.752 -3.263 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.689 1.113 -4.152 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.251 0.482 -2.096 1.00 0.00 O ATOM 0 H ASP A 125 -13.001 0.828 -4.358 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.514 1.945 -5.294 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.247 -0.317 -4.192 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.806 0.505 -2.708 1.00 0.00 H new ATOM 2015 N HIS A 126 -13.752 3.784 -3.470 1.00 0.00 N ATOM 2016 CA HIS A 126 -13.711 5.208 -3.132 1.00 0.00 C ATOM 2017 C HIS A 126 -13.674 6.092 -4.381 1.00 0.00 C ATOM 2018 O HIS A 126 -14.373 7.102 -4.432 1.00 0.00 O ATOM 2019 CB HIS A 126 -12.544 5.515 -2.183 1.00 0.00 C ATOM 2020 CG HIS A 126 -12.529 6.966 -1.763 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -13.382 7.534 -0.812 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -11.789 7.957 -2.342 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.149 8.857 -0.855 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -12.194 9.136 -1.755 1.00 0.00 N ATOM 0 H HIS A 126 -12.832 3.352 -3.552 1.00 0.00 H new ATOM 0 HA HIS A 126 -14.636 5.447 -2.608 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -12.618 4.882 -1.299 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -11.602 5.269 -2.674 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.036 7.840 -3.108 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -13.659 9.592 -0.250 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -11.829 10.064 -1.969 1.00 0.00 H new ATOM 2032 N PHE A 127 -12.912 5.710 -5.408 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.693 6.535 -6.603 1.00 0.00 C ATOM 2034 C PHE A 127 -13.691 6.317 -7.751 1.00 0.00 C ATOM 2035 O PHE A 127 -13.592 7.022 -8.754 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.236 6.395 -7.064 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.233 7.063 -6.142 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -10.221 8.466 -6.009 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -9.285 6.294 -5.448 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -9.249 9.092 -5.209 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -8.288 6.918 -4.681 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.269 8.319 -4.565 1.00 0.00 C ATOM 0 H PHE A 127 -12.425 4.814 -5.436 1.00 0.00 H new ATOM 0 HA PHE A 127 -12.888 7.564 -6.300 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -10.991 5.336 -7.145 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.138 6.822 -8.062 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -10.961 9.062 -6.523 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.323 5.216 -5.504 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -9.256 10.165 -5.090 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.538 6.323 -4.181 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.500 8.801 -3.980 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.683 5.420 -7.641 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.632 5.136 -8.745 1.00 0.00 C ATOM 2054 C LYS A 128 -16.378 6.360 -9.301 1.00 0.00 C ATOM 2055 O LYS A 128 -16.684 6.396 -10.492 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.592 3.976 -8.419 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.768 4.287 -7.479 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.315 4.533 -6.038 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.489 4.662 -5.066 1.00 0.00 C ATOM 2060 NZ LYS A 128 -19.182 3.366 -4.835 1.00 0.00 N ATOM 0 H LYS A 128 -14.855 4.873 -6.797 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.987 4.813 -9.563 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.999 3.599 -9.357 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -16.009 3.168 -7.977 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.299 5.166 -7.845 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.474 3.457 -7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.672 3.713 -5.718 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.715 5.442 -6.000 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.128 5.052 -4.114 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.202 5.387 -5.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.753 3.427 -3.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -19.802 3.155 -5.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.477 2.609 -4.733 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.623 7.381 -8.474 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.242 8.653 -8.892 1.00 0.00 C ATOM 2076 C TRP A 129 -16.246 9.658 -9.507 1.00 0.00 C ATOM 2077 O TRP A 129 -16.649 10.556 -10.245 1.00 0.00 O ATOM 2078 CB TRP A 129 -17.988 9.271 -7.702 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.121 9.715 -6.561 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.603 8.904 -5.615 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -16.659 11.062 -6.221 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -15.821 9.636 -4.748 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -15.850 10.980 -5.046 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -16.846 12.346 -6.780 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.273 12.108 -4.446 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -16.281 13.489 -6.180 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -15.508 13.374 -5.009 1.00 0.00 C ATOM 0 H TRP A 129 -16.395 7.352 -7.480 1.00 0.00 H new ATOM 0 HA TRP A 129 -17.944 8.420 -9.693 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.559 10.129 -8.058 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.707 8.543 -7.328 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.776 7.840 -5.547 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.286 9.232 -3.979 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -17.431 12.453 -7.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -14.657 12.006 -3.565 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -16.442 14.461 -6.622 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.096 14.257 -4.544 1.00 0.00 H new ATOM 2098 N VAL A 130 -14.945 9.482 -9.246 1.00 0.00 N ATOM 2099 CA VAL A 130 -13.833 10.251 -9.843 1.00 0.00 C ATOM 2100 C VAL A 130 -13.375 9.622 -11.171 1.00 0.00 C ATOM 2101 O VAL A 130 -12.977 10.333 -12.094 1.00 0.00 O ATOM 2102 CB VAL A 130 -12.657 10.363 -8.843 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -11.530 11.267 -9.360 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.116 10.937 -7.493 1.00 0.00 C ATOM 0 H VAL A 130 -14.620 8.774 -8.588 1.00 0.00 H new ATOM 0 HA VAL A 130 -14.191 11.257 -10.063 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.286 9.345 -8.723 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.731 11.311 -8.620 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -11.139 10.863 -10.294 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -11.919 12.270 -9.534 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.264 11.001 -6.816 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.535 11.932 -7.644 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -13.875 10.286 -7.060 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.507 8.295 -11.317 1.00 0.00 N ATOM 2115 CA LYS A 131 -13.141 7.489 -12.495 1.00 0.00 C ATOM 2116 C LYS A 131 -14.296 7.395 -13.500 1.00 0.00 C ATOM 2117 O LYS A 131 -14.551 6.351 -14.100 1.00 0.00 O ATOM 2118 CB LYS A 131 -12.573 6.126 -12.032 1.00 0.00 C ATOM 2119 CG LYS A 131 -11.125 6.243 -11.524 1.00 0.00 C ATOM 2120 CD LYS A 131 -10.133 6.346 -12.697 1.00 0.00 C ATOM 2121 CE LYS A 131 -8.756 6.810 -12.220 1.00 0.00 C ATOM 2122 NZ LYS A 131 -7.859 7.093 -13.366 1.00 0.00 N ATOM 0 H LYS A 131 -13.896 7.719 -10.570 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.345 7.985 -13.051 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -13.203 5.722 -11.239 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.610 5.418 -12.860 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -11.030 7.121 -10.885 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -10.880 5.375 -10.911 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.043 5.376 -13.186 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -10.517 7.044 -13.441 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -8.863 7.706 -11.609 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -8.310 6.043 -11.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -7.037 7.638 -13.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.536 6.197 -13.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.374 7.643 -14.083 1.00 0.00 H new ATOM 2136 N GLN A 132 -14.982 8.523 -13.689 1.00 0.00 N ATOM 2137 CA GLN A 132 -16.038 8.717 -14.689 1.00 0.00 C ATOM 2138 C GLN A 132 -15.523 9.298 -16.018 1.00 0.00 C ATOM 2139 O GLN A 132 -16.288 9.796 -16.848 1.00 0.00 O ATOM 2140 CB GLN A 132 -17.183 9.536 -14.072 1.00 0.00 C ATOM 2141 CG GLN A 132 -17.908 8.801 -12.930 1.00 0.00 C ATOM 2142 CD GLN A 132 -18.633 7.538 -13.400 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -19.415 7.543 -14.342 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -18.407 6.404 -12.772 1.00 0.00 N ATOM 0 H GLN A 132 -14.813 9.359 -13.130 1.00 0.00 H new ATOM 0 HA GLN A 132 -16.428 7.737 -14.965 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.785 10.478 -13.694 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -17.904 9.784 -14.851 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -17.184 8.533 -12.160 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -18.628 9.477 -12.469 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.759 6.377 -11.985 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -18.880 5.552 -13.073 1.00 0.00 H new ATOM 2153 N GLU A 133 -14.205 9.228 -16.212 1.00 0.00 N ATOM 2154 CA GLU A 133 -13.485 9.672 -17.413 1.00 0.00 C ATOM 2155 C GLU A 133 -13.611 8.730 -18.633 1.00 0.00 C ATOM 2156 O GLU A 133 -13.565 9.240 -19.774 1.00 0.00 O ATOM 2157 CB GLU A 133 -12.017 9.997 -17.065 1.00 0.00 C ATOM 2158 CG GLU A 133 -11.173 8.776 -16.643 1.00 0.00 C ATOM 2159 CD GLU A 133 -9.715 9.148 -16.274 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -9.030 9.850 -17.060 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -9.225 8.702 -15.205 1.00 0.00 O ATOM 2162 OXT GLU A 133 -13.767 7.498 -18.454 1.00 0.00 O ATOM 0 H GLU A 133 -13.579 8.843 -15.505 1.00 0.00 H new ATOM 0 HA GLU A 133 -13.980 10.585 -17.744 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.547 10.466 -17.930 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.002 10.729 -16.258 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -11.646 8.292 -15.789 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.163 8.050 -17.456 1.00 0.00 H new TER 2169 GLU A 133