USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 905 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 84 MET CE :methyl 158:sc= -0.196 (180deg=-1.1) USER MOD Set 1.2: A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0538) USER MOD Single : A 7 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.101) USER MOD Single : A 8 GLN : amide:sc= -1.69 X(o=-1.7,f=-1.7) USER MOD Single : A 12 ASN :FLIP amide:sc= -0.84 F(o=-1.4,f=-0.84) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0176 USER MOD Single : A 18 SER OG : rot 55:sc= 1.09 USER MOD Single : A 19 TYR OH : rot 51:sc= -3.02! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot -120:sc= -0.0392 USER MOD Single : A 28 SER OG : rot -49:sc= 0.672 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -1.14 K(o=-1.1,f=-3.7!) USER MOD Single : A 36 GLN : amide:sc= -0.0162 X(o=-0.016,f=-0.063) USER MOD Single : A 39 GLN :FLIP amide:sc= -0.273 F(o=-3.4,f=-0.27) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -7.9! C(o=-7.9!,f=-13!) USER MOD Single : A 59 THR OG1 : rot -4:sc= 0.576 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0.00278 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ -146:sc=-0.00464 (180deg=-0.0359) USER MOD Single : A 81 TYR OH : rot -173:sc= -3.47! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 94 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0118) USER MOD Single : A 98 THR OG1 : rot -64:sc= -5.34! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.704 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= -0.0366 X(o=-0.037,f=-0.022) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0.22 K(o=0.22,f=-5.3!) USER MOD Single : A 123 TYR OH : rot -154:sc= 0.348 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.00057 USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.734 29.197 0.554 1.00 0.00 N ATOM 2 CA MET A 1 2.488 29.854 -0.499 1.00 0.00 C ATOM 3 C MET A 1 1.973 29.443 -1.880 1.00 0.00 C ATOM 4 O MET A 1 1.775 30.290 -2.750 1.00 0.00 O ATOM 5 CB MET A 1 3.968 29.484 -0.375 1.00 0.00 C ATOM 6 CG MET A 1 4.788 30.668 0.142 1.00 0.00 C ATOM 7 SD MET A 1 6.362 30.098 0.758 1.00 0.00 S ATOM 8 CE MET A 1 7.181 31.664 1.012 1.00 0.00 C ATOM 0 H1 MET A 1 2.009 29.592 1.476 1.00 0.00 H new ATOM 0 H2 MET A 1 0.717 29.351 0.401 1.00 0.00 H new ATOM 0 H3 MET A 1 1.935 28.177 0.540 1.00 0.00 H new ATOM 0 HA MET A 1 2.364 30.931 -0.391 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.079 28.637 0.302 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.350 29.169 -1.346 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.942 31.391 -0.659 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.242 31.181 0.934 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.185 31.491 1.398 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.244 32.200 0.065 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.614 32.259 1.728 1.00 0.00 H new ATOM 16 N ALA A 2 1.771 28.143 -2.038 1.00 0.00 N ATOM 17 CA ALA A 2 1.283 27.610 -3.299 1.00 0.00 C ATOM 18 C ALA A 2 1.275 26.081 -3.232 1.00 0.00 C ATOM 19 O ALA A 2 2.264 25.436 -3.574 1.00 0.00 O ATOM 20 CB ALA A 2 2.147 28.138 -4.446 1.00 0.00 C ATOM 0 H ALA A 2 1.936 27.443 -1.314 1.00 0.00 H new ATOM 0 HA ALA A 2 0.260 27.938 -3.484 1.00 0.00 H new ATOM 0 HB1 ALA A 2 1.781 27.738 -5.391 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.096 29.227 -4.469 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.181 27.826 -4.296 1.00 0.00 H new ATOM 26 N GLU A 3 0.146 25.547 -2.788 1.00 0.00 N ATOM 27 CA GLU A 3 -0.004 24.107 -2.671 1.00 0.00 C ATOM 28 C GLU A 3 -1.272 23.768 -1.883 1.00 0.00 C ATOM 29 O GLU A 3 -1.721 24.556 -1.054 1.00 0.00 O ATOM 30 CB GLU A 3 1.230 23.477 -2.021 1.00 0.00 C ATOM 31 CG GLU A 3 2.052 22.697 -3.048 1.00 0.00 C ATOM 32 CD GLU A 3 3.541 22.725 -2.696 1.00 0.00 C ATOM 33 OE1 GLU A 3 3.895 22.852 -1.514 1.00 0.00 O ATOM 34 OE2 GLU A 3 4.342 22.610 -3.700 1.00 0.00 O ATOM 0 H GLU A 3 -0.673 26.086 -2.505 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.099 23.689 -3.673 1.00 0.00 H new ATOM 0 HB2 GLU A 3 1.847 24.256 -1.572 1.00 0.00 H new ATOM 0 HB3 GLU A 3 0.921 22.811 -1.215 1.00 0.00 H new ATOM 0 HG2 GLU A 3 1.704 21.665 -3.089 1.00 0.00 H new ATOM 0 HG3 GLU A 3 1.901 23.124 -4.039 1.00 0.00 H new ATOM 40 N ALA A 4 -1.813 22.592 -2.172 1.00 0.00 N ATOM 41 CA ALA A 4 -3.019 22.140 -1.502 1.00 0.00 C ATOM 42 C ALA A 4 -3.572 20.914 -2.229 1.00 0.00 C ATOM 43 O ALA A 4 -4.025 21.014 -3.369 1.00 0.00 O ATOM 44 CB ALA A 4 -4.030 23.285 -1.439 1.00 0.00 C ATOM 0 H ALA A 4 -1.437 21.940 -2.861 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.799 21.844 -0.476 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -4.935 22.944 -0.936 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -3.600 24.120 -0.886 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -4.277 23.608 -2.450 1.00 0.00 H new ATOM 50 N LEU A 5 -3.518 19.782 -1.542 1.00 0.00 N ATOM 51 CA LEU A 5 -4.008 18.537 -2.109 1.00 0.00 C ATOM 52 C LEU A 5 -3.054 18.074 -3.213 1.00 0.00 C ATOM 53 O LEU A 5 -2.798 18.810 -4.164 1.00 0.00 O ATOM 54 CB LEU A 5 -5.457 18.694 -2.574 1.00 0.00 C ATOM 55 CG LEU A 5 -6.452 17.668 -2.027 1.00 0.00 C ATOM 56 CD1 LEU A 5 -7.095 18.167 -0.731 1.00 0.00 C ATOM 57 CD2 LEU A 5 -7.497 17.301 -3.083 1.00 0.00 C ATOM 0 H LEU A 5 -3.142 19.701 -0.597 1.00 0.00 H new ATOM 0 HA LEU A 5 -4.024 17.753 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -5.802 19.690 -2.294 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -5.476 18.644 -3.663 1.00 0.00 H new ATOM 0 HG LEU A 5 -5.906 16.756 -1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.798 17.420 -0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -6.321 18.337 0.017 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -7.625 19.100 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -8.192 16.570 -2.669 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.045 18.196 -3.379 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -7.000 16.875 -3.954 1.00 0.00 H new ATOM 68 N PHE A 6 -2.556 16.857 -3.050 1.00 0.00 N ATOM 69 CA PHE A 6 -1.637 16.288 -4.020 1.00 0.00 C ATOM 70 C PHE A 6 -2.235 16.324 -5.428 1.00 0.00 C ATOM 71 O PHE A 6 -1.509 16.226 -6.417 1.00 0.00 O ATOM 72 CB PHE A 6 -1.405 14.831 -3.615 1.00 0.00 C ATOM 73 CG PHE A 6 -0.328 14.121 -4.437 1.00 0.00 C ATOM 74 CD1 PHE A 6 0.843 14.755 -4.717 1.00 0.00 C ATOM 75 CD2 PHE A 6 -0.541 12.856 -4.889 1.00 0.00 C ATOM 76 CE1 PHE A 6 1.842 14.096 -5.480 1.00 0.00 C ATOM 77 CE2 PHE A 6 0.458 12.197 -5.652 1.00 0.00 C ATOM 78 CZ PHE A 6 1.629 12.831 -5.931 1.00 0.00 C ATOM 0 H PHE A 6 -2.772 16.249 -2.260 1.00 0.00 H new ATOM 0 HA PHE A 6 -0.709 16.860 -4.033 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -1.125 14.797 -2.562 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -2.342 14.284 -3.713 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.012 15.760 -4.359 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -1.471 12.353 -4.667 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.771 14.599 -5.702 1.00 0.00 H new ATOM 0 HE2 PHE A 6 0.289 11.193 -6.011 1.00 0.00 H new ATOM 0 HZ PHE A 6 2.390 12.329 -6.511 1.00 0.00 H new ATOM 87 N LYS A 7 -3.552 16.466 -5.474 1.00 0.00 N ATOM 88 CA LYS A 7 -4.254 16.516 -6.744 1.00 0.00 C ATOM 89 C LYS A 7 -3.430 17.326 -7.747 1.00 0.00 C ATOM 90 O LYS A 7 -2.901 16.774 -8.709 1.00 0.00 O ATOM 91 CB LYS A 7 -5.677 17.044 -6.548 1.00 0.00 C ATOM 92 CG LYS A 7 -6.512 16.854 -7.817 1.00 0.00 C ATOM 93 CD LYS A 7 -7.458 15.659 -7.675 1.00 0.00 C ATOM 94 CE LYS A 7 -6.841 14.397 -8.284 1.00 0.00 C ATOM 95 NZ LYS A 7 -7.007 14.396 -9.754 1.00 0.00 N ATOM 0 H LYS A 7 -4.150 16.548 -4.652 1.00 0.00 H new ATOM 0 HA LYS A 7 -4.364 15.514 -7.158 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -6.150 16.524 -5.715 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -5.643 18.101 -6.285 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.088 17.757 -8.016 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.853 16.701 -8.671 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -7.679 15.488 -6.621 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -8.405 15.879 -8.168 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.782 14.345 -8.032 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -7.314 13.512 -7.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -6.739 13.465 -10.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -8.000 14.593 -9.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -6.399 15.128 -10.173 1.00 0.00 H new ATOM 105 N GLN A 8 -3.347 18.622 -7.487 1.00 0.00 N ATOM 106 CA GLN A 8 -2.597 19.514 -8.353 1.00 0.00 C ATOM 107 C GLN A 8 -1.153 19.026 -8.495 1.00 0.00 C ATOM 108 O GLN A 8 -0.666 18.831 -9.608 1.00 0.00 O ATOM 109 CB GLN A 8 -2.641 20.951 -7.833 1.00 0.00 C ATOM 110 CG GLN A 8 -2.047 21.044 -6.427 1.00 0.00 C ATOM 111 CD GLN A 8 -2.480 22.337 -5.732 1.00 0.00 C ATOM 112 OE1 GLN A 8 -3.644 22.555 -5.439 1.00 0.00 O ATOM 113 NE2 GLN A 8 -1.481 23.179 -5.485 1.00 0.00 N ATOM 0 H GLN A 8 -3.788 19.076 -6.687 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.062 19.506 -9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.088 21.603 -8.509 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.672 21.305 -7.820 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.366 20.185 -5.836 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.959 21.005 -6.485 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -0.529 22.934 -5.757 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -1.667 24.070 -5.024 1.00 0.00 H new ATOM 120 N LEU A 9 -0.511 18.843 -7.351 1.00 0.00 N ATOM 121 CA LEU A 9 0.868 18.381 -7.334 1.00 0.00 C ATOM 122 C LEU A 9 1.063 17.330 -8.427 1.00 0.00 C ATOM 123 O LEU A 9 2.047 17.372 -9.164 1.00 0.00 O ATOM 124 CB LEU A 9 1.251 17.892 -5.935 1.00 0.00 C ATOM 125 CG LEU A 9 1.515 18.981 -4.893 1.00 0.00 C ATOM 126 CD1 LEU A 9 2.162 20.209 -5.536 1.00 0.00 C ATOM 127 CD2 LEU A 9 0.235 19.338 -4.136 1.00 0.00 C ATOM 0 H LEU A 9 -0.919 19.006 -6.430 1.00 0.00 H new ATOM 0 HA LEU A 9 1.548 19.203 -7.557 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.452 17.249 -5.565 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.145 17.274 -6.020 1.00 0.00 H new ATOM 0 HG LEU A 9 2.222 18.590 -4.162 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.339 20.968 -4.774 1.00 0.00 H new ATOM 0 HD12 LEU A 9 3.110 19.924 -5.992 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.498 20.611 -6.301 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.451 20.114 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.514 19.702 -4.839 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.145 18.453 -3.627 1.00 0.00 H new ATOM 138 N ASP A 10 0.110 16.412 -8.499 1.00 0.00 N ATOM 139 CA ASP A 10 0.165 15.351 -9.490 1.00 0.00 C ATOM 140 C ASP A 10 -0.365 15.879 -10.826 1.00 0.00 C ATOM 141 O ASP A 10 0.366 15.927 -11.813 1.00 0.00 O ATOM 142 CB ASP A 10 -0.702 14.163 -9.074 1.00 0.00 C ATOM 143 CG ASP A 10 -0.127 12.788 -9.422 1.00 0.00 C ATOM 144 OD1 ASP A 10 1.026 12.672 -9.867 1.00 0.00 O ATOM 145 OD2 ASP A 10 -0.924 11.795 -9.217 1.00 0.00 O ATOM 0 H ASP A 10 -0.705 16.381 -7.887 1.00 0.00 H new ATOM 0 HA ASP A 10 1.202 15.026 -9.579 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -0.864 14.210 -7.997 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -1.679 14.262 -9.548 1.00 0.00 H new ATOM 150 N ALA A 11 -1.633 16.263 -10.812 1.00 0.00 N ATOM 151 CA ALA A 11 -2.270 16.785 -12.009 1.00 0.00 C ATOM 152 C ALA A 11 -2.529 15.637 -12.987 1.00 0.00 C ATOM 153 O ALA A 11 -3.628 15.510 -13.524 1.00 0.00 O ATOM 154 CB ALA A 11 -1.393 17.882 -12.616 1.00 0.00 C ATOM 0 H ALA A 11 -2.236 16.223 -9.991 1.00 0.00 H new ATOM 0 HA ALA A 11 -3.233 17.234 -11.767 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -1.870 18.274 -13.514 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.264 18.687 -11.892 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -0.419 17.467 -12.874 1.00 0.00 H new ATOM 160 N ASN A 12 -1.496 14.830 -13.187 1.00 0.00 N ATOM 161 CA ASN A 12 -1.599 13.697 -14.091 1.00 0.00 C ATOM 162 C ASN A 12 -2.986 13.065 -13.956 1.00 0.00 C ATOM 163 O ASN A 12 -3.527 12.537 -14.926 1.00 0.00 O ATOM 164 CB ASN A 12 -0.558 12.627 -13.751 1.00 0.00 C ATOM 165 CG ASN A 12 0.800 13.262 -13.444 1.00 0.00 C ATOM 166 OD1 ASN A 12 1.095 14.307 -14.211 1.00 0.00 O flip ATOM 167 ND2 ASN A 12 1.531 12.830 -12.568 1.00 0.00 N flip ATOM 0 H ASN A 12 -0.586 14.938 -12.739 1.00 0.00 H new ATOM 0 HA ASN A 12 -1.430 14.058 -15.105 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -0.895 12.047 -12.892 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -0.459 11.933 -14.585 1.00 0.00 H new ATOM 0 HD21 ASN A 12 1.243 12.023 -12.015 1.00 0.00 H new ATOM 0 HD22 ASN A 12 2.431 13.276 -12.388 1.00 0.00 H new ATOM 173 N GLY A 13 -3.521 13.142 -12.747 1.00 0.00 N ATOM 174 CA GLY A 13 -4.835 12.585 -12.473 1.00 0.00 C ATOM 175 C GLY A 13 -4.819 11.059 -12.588 1.00 0.00 C ATOM 176 O GLY A 13 -5.870 10.429 -12.689 1.00 0.00 O ATOM 0 H GLY A 13 -3.069 13.582 -11.946 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.155 12.874 -11.472 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -5.562 12.998 -13.172 1.00 0.00 H new ATOM 180 N ASP A 14 -3.613 10.510 -12.568 1.00 0.00 N ATOM 181 CA ASP A 14 -3.446 9.070 -12.668 1.00 0.00 C ATOM 182 C ASP A 14 -3.678 8.436 -11.294 1.00 0.00 C ATOM 183 O ASP A 14 -3.802 7.218 -11.182 1.00 0.00 O ATOM 184 CB ASP A 14 -2.029 8.710 -13.121 1.00 0.00 C ATOM 185 CG ASP A 14 -0.906 9.366 -12.314 1.00 0.00 C ATOM 186 OD1 ASP A 14 0.230 9.501 -12.793 1.00 0.00 O ATOM 187 OD2 ASP A 14 -1.240 9.751 -11.129 1.00 0.00 O ATOM 0 H ASP A 14 -2.743 11.036 -12.484 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.164 8.698 -13.398 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.910 7.628 -13.067 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -1.916 8.991 -14.168 1.00 0.00 H new ATOM 192 N GLY A 15 -3.729 9.293 -10.285 1.00 0.00 N ATOM 193 CA GLY A 15 -3.945 8.833 -8.924 1.00 0.00 C ATOM 194 C GLY A 15 -2.669 8.221 -8.343 1.00 0.00 C ATOM 195 O GLY A 15 -2.218 8.616 -7.270 1.00 0.00 O ATOM 0 H GLY A 15 -3.625 10.303 -10.383 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.269 9.667 -8.301 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -4.746 8.094 -8.909 1.00 0.00 H new ATOM 199 N SER A 16 -2.121 7.265 -9.080 1.00 0.00 N ATOM 200 CA SER A 16 -0.905 6.594 -8.652 1.00 0.00 C ATOM 201 C SER A 16 0.316 7.279 -9.270 1.00 0.00 C ATOM 202 O SER A 16 0.213 7.905 -10.324 1.00 0.00 O ATOM 203 CB SER A 16 -0.931 5.112 -9.032 1.00 0.00 C ATOM 204 OG SER A 16 -1.574 4.893 -10.285 1.00 0.00 O ATOM 0 H SER A 16 -2.497 6.939 -9.971 1.00 0.00 H new ATOM 0 HA SER A 16 -0.841 6.662 -7.566 1.00 0.00 H new ATOM 0 HB2 SER A 16 0.089 4.731 -9.077 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.448 4.548 -8.256 1.00 0.00 H new ATOM 0 HG SER A 16 -1.569 3.935 -10.492 1.00 0.00 H new ATOM 209 N VAL A 17 1.442 7.137 -8.588 1.00 0.00 N ATOM 210 CA VAL A 17 2.681 7.734 -9.057 1.00 0.00 C ATOM 211 C VAL A 17 3.804 7.411 -8.069 1.00 0.00 C ATOM 212 O VAL A 17 3.600 6.660 -7.117 1.00 0.00 O ATOM 213 CB VAL A 17 2.489 9.237 -9.272 1.00 0.00 C ATOM 214 CG1 VAL A 17 2.971 10.031 -8.056 1.00 0.00 C ATOM 215 CG2 VAL A 17 3.196 9.703 -10.547 1.00 0.00 C ATOM 0 H VAL A 17 1.523 6.617 -7.714 1.00 0.00 H new ATOM 0 HA VAL A 17 2.966 7.314 -10.022 1.00 0.00 H new ATOM 0 HB VAL A 17 1.422 9.425 -9.393 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.823 11.096 -8.235 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.403 9.729 -7.176 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.030 9.835 -7.890 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.044 10.775 -10.676 1.00 0.00 H new ATOM 0 HG22 VAL A 17 4.263 9.495 -10.468 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.785 9.172 -11.406 1.00 0.00 H new ATOM 225 N SER A 18 4.965 7.994 -8.330 1.00 0.00 N ATOM 226 CA SER A 18 6.120 7.776 -7.476 1.00 0.00 C ATOM 227 C SER A 18 6.111 8.778 -6.319 1.00 0.00 C ATOM 228 O SER A 18 6.573 9.909 -6.468 1.00 0.00 O ATOM 229 CB SER A 18 7.422 7.895 -8.270 1.00 0.00 C ATOM 230 OG SER A 18 7.800 9.253 -8.477 1.00 0.00 O ATOM 0 H SER A 18 5.130 8.617 -9.121 1.00 0.00 H new ATOM 0 HA SER A 18 6.062 6.765 -7.074 1.00 0.00 H new ATOM 0 HB2 SER A 18 8.219 7.374 -7.739 1.00 0.00 H new ATOM 0 HB3 SER A 18 7.305 7.401 -9.234 1.00 0.00 H new ATOM 0 HG SER A 18 7.847 9.715 -7.614 1.00 0.00 H new ATOM 235 N TYR A 19 5.581 8.327 -5.192 1.00 0.00 N ATOM 236 CA TYR A 19 5.506 9.169 -4.010 1.00 0.00 C ATOM 237 C TYR A 19 6.736 10.073 -3.902 1.00 0.00 C ATOM 238 O TYR A 19 6.655 11.175 -3.362 1.00 0.00 O ATOM 239 CB TYR A 19 5.482 8.216 -2.813 1.00 0.00 C ATOM 240 CG TYR A 19 4.076 7.785 -2.391 1.00 0.00 C ATOM 241 CD1 TYR A 19 3.003 8.009 -3.230 1.00 0.00 C ATOM 242 CD2 TYR A 19 3.880 7.173 -1.169 1.00 0.00 C ATOM 243 CE1 TYR A 19 1.681 7.603 -2.832 1.00 0.00 C ATOM 244 CE2 TYR A 19 2.557 6.768 -0.771 1.00 0.00 C ATOM 245 CZ TYR A 19 1.523 7.002 -1.621 1.00 0.00 C ATOM 246 OH TYR A 19 0.273 6.619 -1.245 1.00 0.00 O ATOM 0 H TYR A 19 5.199 7.389 -5.072 1.00 0.00 H new ATOM 0 HA TYR A 19 4.625 9.810 -4.051 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.066 7.328 -3.056 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.973 8.698 -1.967 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.156 8.489 -4.185 1.00 0.00 H new ATOM 0 HD2 TYR A 19 4.719 6.998 -0.512 1.00 0.00 H new ATOM 0 HE1 TYR A 19 0.833 7.771 -3.480 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.390 6.289 0.182 1.00 0.00 H new ATOM 0 HH TYR A 19 -0.133 6.083 -1.958 1.00 0.00 H new ATOM 255 N GLU A 20 7.846 9.571 -4.423 1.00 0.00 N ATOM 256 CA GLU A 20 9.091 10.320 -4.391 1.00 0.00 C ATOM 257 C GLU A 20 8.830 11.799 -4.681 1.00 0.00 C ATOM 258 O GLU A 20 9.361 12.673 -3.997 1.00 0.00 O ATOM 259 CB GLU A 20 10.106 9.739 -5.380 1.00 0.00 C ATOM 260 CG GLU A 20 10.688 8.425 -4.858 1.00 0.00 C ATOM 261 CD GLU A 20 9.981 7.222 -5.488 1.00 0.00 C ATOM 262 OE1 GLU A 20 10.248 6.886 -6.651 1.00 0.00 O ATOM 263 OE2 GLU A 20 9.127 6.631 -4.724 1.00 0.00 O ATOM 0 H GLU A 20 7.909 8.656 -4.869 1.00 0.00 H new ATOM 0 HA GLU A 20 9.516 10.236 -3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 20 9.625 9.571 -6.344 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.910 10.457 -5.546 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.754 8.382 -5.080 1.00 0.00 H new ATOM 0 HG3 GLU A 20 10.587 8.384 -3.774 1.00 0.00 H new ATOM 269 N GLU A 21 8.010 12.035 -5.695 1.00 0.00 N ATOM 270 CA GLU A 21 7.671 13.394 -6.083 1.00 0.00 C ATOM 271 C GLU A 21 6.856 14.073 -4.979 1.00 0.00 C ATOM 272 O GLU A 21 7.025 15.264 -4.722 1.00 0.00 O ATOM 273 CB GLU A 21 6.914 13.411 -7.413 1.00 0.00 C ATOM 274 CG GLU A 21 5.444 13.042 -7.212 1.00 0.00 C ATOM 275 CD GLU A 21 4.820 12.544 -8.518 1.00 0.00 C ATOM 276 OE1 GLU A 21 5.312 11.572 -9.110 1.00 0.00 O ATOM 277 OE2 GLU A 21 3.787 13.207 -8.916 1.00 0.00 O ATOM 0 H GLU A 21 7.570 11.308 -6.260 1.00 0.00 H new ATOM 0 HA GLU A 21 8.596 13.954 -6.222 1.00 0.00 H new ATOM 0 HB2 GLU A 21 6.986 14.401 -7.864 1.00 0.00 H new ATOM 0 HB3 GLU A 21 7.377 12.710 -8.108 1.00 0.00 H new ATOM 0 HG2 GLU A 21 5.360 12.270 -6.447 1.00 0.00 H new ATOM 0 HG3 GLU A 21 4.894 13.910 -6.850 1.00 0.00 H new ATOM 283 N VAL A 22 5.990 13.286 -4.357 1.00 0.00 N ATOM 284 CA VAL A 22 5.150 13.796 -3.288 1.00 0.00 C ATOM 285 C VAL A 22 5.991 13.966 -2.021 1.00 0.00 C ATOM 286 O VAL A 22 5.665 14.781 -1.160 1.00 0.00 O ATOM 287 CB VAL A 22 3.944 12.878 -3.087 1.00 0.00 C ATOM 288 CG1 VAL A 22 4.169 11.926 -1.910 1.00 0.00 C ATOM 289 CG2 VAL A 22 2.661 13.689 -2.898 1.00 0.00 C ATOM 0 H VAL A 22 5.852 12.299 -4.574 1.00 0.00 H new ATOM 0 HA VAL A 22 4.754 14.777 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 22 3.829 12.276 -3.988 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.296 11.284 -1.789 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.048 11.311 -2.103 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.323 12.504 -0.999 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.819 13.011 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.761 14.330 -2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.487 14.305 -3.780 1.00 0.00 H new ATOM 299 N LYS A 23 7.055 13.182 -1.947 1.00 0.00 N ATOM 300 CA LYS A 23 7.945 13.235 -0.799 1.00 0.00 C ATOM 301 C LYS A 23 8.663 14.585 -0.777 1.00 0.00 C ATOM 302 O LYS A 23 8.822 15.191 0.282 1.00 0.00 O ATOM 303 CB LYS A 23 8.894 12.034 -0.801 1.00 0.00 C ATOM 304 CG LYS A 23 8.391 10.937 0.139 1.00 0.00 C ATOM 305 CD LYS A 23 8.692 11.285 1.598 1.00 0.00 C ATOM 306 CE LYS A 23 7.399 11.474 2.394 1.00 0.00 C ATOM 307 NZ LYS A 23 7.701 11.873 3.787 1.00 0.00 N ATOM 0 H LYS A 23 7.322 12.506 -2.663 1.00 0.00 H new ATOM 0 HA LYS A 23 7.376 13.161 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.983 11.638 -1.813 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.890 12.352 -0.494 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.317 10.804 0.007 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.863 9.989 -0.117 1.00 0.00 H new ATOM 0 HD2 LYS A 23 9.289 10.492 2.049 1.00 0.00 H new ATOM 0 HD3 LYS A 23 9.288 12.197 1.643 1.00 0.00 H new ATOM 0 HE2 LYS A 23 6.780 12.234 1.918 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.825 10.548 2.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.812 11.997 4.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 8.273 11.134 4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 8.230 12.769 3.785 1.00 0.00 H new ATOM 317 N ALA A 24 9.077 15.019 -1.958 1.00 0.00 N ATOM 318 CA ALA A 24 9.774 16.287 -2.089 1.00 0.00 C ATOM 319 C ALA A 24 8.771 17.433 -1.934 1.00 0.00 C ATOM 320 O ALA A 24 9.079 18.453 -1.320 1.00 0.00 O ATOM 321 CB ALA A 24 10.508 16.332 -3.430 1.00 0.00 C ATOM 0 H ALA A 24 8.943 14.514 -2.834 1.00 0.00 H new ATOM 0 HA ALA A 24 10.523 16.395 -1.305 1.00 0.00 H new ATOM 0 HB1 ALA A 24 11.030 17.284 -3.527 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.229 15.516 -3.478 1.00 0.00 H new ATOM 0 HB3 ALA A 24 9.789 16.229 -4.242 1.00 0.00 H new ATOM 327 N PHE A 25 7.593 17.226 -2.505 1.00 0.00 N ATOM 328 CA PHE A 25 6.544 18.230 -2.439 1.00 0.00 C ATOM 329 C PHE A 25 6.150 18.517 -0.988 1.00 0.00 C ATOM 330 O PHE A 25 5.960 19.671 -0.610 1.00 0.00 O ATOM 331 CB PHE A 25 5.333 17.659 -3.179 1.00 0.00 C ATOM 332 CG PHE A 25 4.003 17.866 -2.451 1.00 0.00 C ATOM 333 CD1 PHE A 25 3.503 19.121 -2.291 1.00 0.00 C ATOM 334 CD2 PHE A 25 3.322 16.795 -1.963 1.00 0.00 C ATOM 335 CE1 PHE A 25 2.269 19.312 -1.615 1.00 0.00 C ATOM 336 CE2 PHE A 25 2.088 16.987 -1.286 1.00 0.00 C ATOM 337 CZ PHE A 25 1.588 18.241 -1.127 1.00 0.00 C ATOM 0 H PHE A 25 7.342 16.379 -3.015 1.00 0.00 H new ATOM 0 HA PHE A 25 6.892 19.162 -2.884 1.00 0.00 H new ATOM 0 HB2 PHE A 25 5.272 18.121 -4.164 1.00 0.00 H new ATOM 0 HB3 PHE A 25 5.487 16.591 -3.336 1.00 0.00 H new ATOM 0 HD1 PHE A 25 4.044 19.972 -2.678 1.00 0.00 H new ATOM 0 HD2 PHE A 25 3.719 15.799 -2.090 1.00 0.00 H new ATOM 0 HE1 PHE A 25 1.871 20.308 -1.488 1.00 0.00 H new ATOM 0 HE2 PHE A 25 1.547 16.137 -0.898 1.00 0.00 H new ATOM 0 HZ PHE A 25 0.649 18.387 -0.613 1.00 0.00 H new ATOM 346 N VAL A 26 6.040 17.446 -0.216 1.00 0.00 N ATOM 347 CA VAL A 26 5.672 17.568 1.185 1.00 0.00 C ATOM 348 C VAL A 26 6.909 17.951 2.000 1.00 0.00 C ATOM 349 O VAL A 26 6.803 18.655 3.005 1.00 0.00 O ATOM 350 CB VAL A 26 5.014 16.275 1.668 1.00 0.00 C ATOM 351 CG1 VAL A 26 5.169 16.114 3.182 1.00 0.00 C ATOM 352 CG2 VAL A 26 3.541 16.223 1.259 1.00 0.00 C ATOM 0 H VAL A 26 6.199 16.490 -0.534 1.00 0.00 H new ATOM 0 HA VAL A 26 4.936 18.360 1.319 1.00 0.00 H new ATOM 0 HB VAL A 26 5.524 15.440 1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.692 15.187 3.500 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.228 16.084 3.438 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.697 16.956 3.688 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.097 15.293 1.615 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.012 17.069 1.697 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.463 16.270 0.173 1.00 0.00 H new ATOM 362 N SER A 27 8.055 17.472 1.539 1.00 0.00 N ATOM 363 CA SER A 27 9.311 17.754 2.213 1.00 0.00 C ATOM 364 C SER A 27 9.657 19.238 2.073 1.00 0.00 C ATOM 365 O SER A 27 10.401 19.786 2.886 1.00 0.00 O ATOM 366 CB SER A 27 10.443 16.890 1.655 1.00 0.00 C ATOM 367 OG SER A 27 11.701 17.215 2.239 1.00 0.00 O ATOM 0 H SER A 27 8.140 16.890 0.706 1.00 0.00 H new ATOM 0 HA SER A 27 9.194 17.512 3.269 1.00 0.00 H new ATOM 0 HB2 SER A 27 10.220 15.839 1.837 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.500 17.021 0.574 1.00 0.00 H new ATOM 0 HG SER A 27 12.322 17.504 1.538 1.00 0.00 H new ATOM 372 N SER A 28 9.102 19.848 1.035 1.00 0.00 N ATOM 373 CA SER A 28 9.343 21.257 0.778 1.00 0.00 C ATOM 374 C SER A 28 8.338 22.110 1.553 1.00 0.00 C ATOM 375 O SER A 28 7.817 23.093 1.028 1.00 0.00 O ATOM 376 CB SER A 28 9.259 21.566 -0.719 1.00 0.00 C ATOM 377 OG SER A 28 9.553 22.931 -0.999 1.00 0.00 O ATOM 0 H SER A 28 8.486 19.391 0.362 1.00 0.00 H new ATOM 0 HA SER A 28 10.351 21.499 1.116 1.00 0.00 H new ATOM 0 HB2 SER A 28 9.956 20.926 -1.261 1.00 0.00 H new ATOM 0 HB3 SER A 28 8.259 21.328 -1.083 1.00 0.00 H new ATOM 0 HG SER A 28 9.036 23.507 -0.398 1.00 0.00 H new ATOM 382 N LYS A 29 8.094 21.703 2.791 1.00 0.00 N ATOM 383 CA LYS A 29 7.160 22.418 3.643 1.00 0.00 C ATOM 384 C LYS A 29 7.837 22.740 4.976 1.00 0.00 C ATOM 385 O LYS A 29 8.417 23.812 5.139 1.00 0.00 O ATOM 386 CB LYS A 29 5.857 21.629 3.790 1.00 0.00 C ATOM 387 CG LYS A 29 4.681 22.393 3.179 1.00 0.00 C ATOM 388 CD LYS A 29 3.767 22.955 4.269 1.00 0.00 C ATOM 389 CE LYS A 29 2.357 22.372 4.156 1.00 0.00 C ATOM 390 NZ LYS A 29 2.145 21.325 5.181 1.00 0.00 N ATOM 0 H LYS A 29 8.527 20.887 3.224 1.00 0.00 H new ATOM 0 HA LYS A 29 6.881 23.369 3.189 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.958 20.659 3.302 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.661 21.436 4.845 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.055 23.207 2.558 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.111 21.730 2.528 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.182 22.725 5.251 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.723 24.041 4.188 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.619 23.164 4.279 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.210 21.951 3.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.183 20.940 5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.838 20.561 5.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.265 21.737 6.128 1.00 0.00 H new ATOM 400 N ARG A 30 7.742 21.792 5.897 1.00 0.00 N ATOM 401 CA ARG A 30 8.338 21.961 7.211 1.00 0.00 C ATOM 402 C ARG A 30 9.825 21.604 7.169 1.00 0.00 C ATOM 403 O ARG A 30 10.674 22.417 7.530 1.00 0.00 O ATOM 404 CB ARG A 30 7.639 21.083 8.251 1.00 0.00 C ATOM 405 CG ARG A 30 6.791 21.930 9.203 1.00 0.00 C ATOM 406 CD ARG A 30 7.456 22.043 10.576 1.00 0.00 C ATOM 407 NE ARG A 30 6.909 21.015 11.490 1.00 0.00 N ATOM 408 CZ ARG A 30 7.046 21.045 12.822 1.00 0.00 C ATOM 409 NH1 ARG A 30 7.711 22.051 13.405 1.00 0.00 N ATOM 410 NH2 ARG A 30 6.515 20.069 13.572 1.00 0.00 N ATOM 0 H ARG A 30 7.261 20.903 5.759 1.00 0.00 H new ATOM 0 HA ARG A 30 8.219 23.006 7.496 1.00 0.00 H new ATOM 0 HB2 ARG A 30 7.007 20.351 7.748 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.383 20.525 8.820 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.648 22.925 8.781 1.00 0.00 H new ATOM 0 HG3 ARG A 30 5.802 21.484 9.309 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.534 21.918 10.478 1.00 0.00 H new ATOM 0 HD3 ARG A 30 7.287 23.037 10.990 1.00 0.00 H new ATOM 0 HE ARG A 30 6.396 20.235 11.080 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.113 22.795 12.835 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.815 22.073 14.419 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.007 19.304 13.128 1.00 0.00 H new ATOM 0 HH22 ARG A 30 6.619 20.091 14.586 1.00 0.00 H new ATOM 421 N PRO A 31 10.103 20.353 6.713 1.00 0.00 N ATOM 422 CA PRO A 31 11.473 19.877 6.619 1.00 0.00 C ATOM 423 C PRO A 31 12.192 20.510 5.426 1.00 0.00 C ATOM 424 O PRO A 31 11.770 21.549 4.921 1.00 0.00 O ATOM 425 CB PRO A 31 11.358 18.366 6.511 1.00 0.00 C ATOM 426 CG PRO A 31 9.928 18.086 6.081 1.00 0.00 C ATOM 427 CD PRO A 31 9.124 19.361 6.277 1.00 0.00 C ATOM 0 HA PRO A 31 12.076 20.156 7.483 1.00 0.00 H new ATOM 0 HB2 PRO A 31 12.068 17.971 5.785 1.00 0.00 H new ATOM 0 HB3 PRO A 31 11.579 17.888 7.465 1.00 0.00 H new ATOM 0 HG2 PRO A 31 9.898 17.772 5.038 1.00 0.00 H new ATOM 0 HG3 PRO A 31 9.504 17.273 6.671 1.00 0.00 H new ATOM 0 HD2 PRO A 31 8.635 19.667 5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 31 8.340 19.224 7.022 1.00 0.00 H new ATOM 432 N ILE A 32 13.266 19.855 5.008 1.00 0.00 N ATOM 433 CA ILE A 32 14.048 20.340 3.883 1.00 0.00 C ATOM 434 C ILE A 32 14.956 19.218 3.377 1.00 0.00 C ATOM 435 O ILE A 32 15.087 19.017 2.171 1.00 0.00 O ATOM 436 CB ILE A 32 14.801 21.616 4.265 1.00 0.00 C ATOM 437 CG1 ILE A 32 15.407 22.285 3.029 1.00 0.00 C ATOM 438 CG2 ILE A 32 15.854 21.331 5.337 1.00 0.00 C ATOM 439 CD1 ILE A 32 14.480 23.375 2.486 1.00 0.00 C ATOM 0 H ILE A 32 13.613 18.993 5.428 1.00 0.00 H new ATOM 0 HA ILE A 32 13.394 20.618 3.056 1.00 0.00 H new ATOM 0 HB ILE A 32 14.087 22.319 4.694 1.00 0.00 H new ATOM 0 HG12 ILE A 32 16.374 22.718 3.283 1.00 0.00 H new ATOM 0 HG13 ILE A 32 15.586 21.537 2.257 1.00 0.00 H new ATOM 0 HG21 ILE A 32 16.375 22.255 5.590 1.00 0.00 H new ATOM 0 HG22 ILE A 32 15.368 20.932 6.228 1.00 0.00 H new ATOM 0 HG23 ILE A 32 16.571 20.603 4.958 1.00 0.00 H new ATOM 0 HD11 ILE A 32 14.934 23.835 1.608 1.00 0.00 H new ATOM 0 HD12 ILE A 32 13.522 22.934 2.210 1.00 0.00 H new ATOM 0 HD13 ILE A 32 14.323 24.134 3.252 1.00 0.00 H new ATOM 450 N LYS A 33 15.559 18.515 4.325 1.00 0.00 N ATOM 451 CA LYS A 33 16.450 17.419 3.991 1.00 0.00 C ATOM 452 C LYS A 33 15.869 16.110 4.531 1.00 0.00 C ATOM 453 O LYS A 33 15.865 15.883 5.741 1.00 0.00 O ATOM 454 CB LYS A 33 17.870 17.711 4.484 1.00 0.00 C ATOM 455 CG LYS A 33 18.550 18.761 3.602 1.00 0.00 C ATOM 456 CD LYS A 33 19.638 19.506 4.378 1.00 0.00 C ATOM 457 CE LYS A 33 19.457 21.020 4.257 1.00 0.00 C ATOM 458 NZ LYS A 33 20.315 21.724 5.237 1.00 0.00 N ATOM 0 H LYS A 33 15.447 18.684 5.325 1.00 0.00 H new ATOM 0 HA LYS A 33 16.529 17.311 2.909 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.836 18.063 5.515 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.457 16.792 4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.987 18.279 2.728 1.00 0.00 H new ATOM 0 HG3 LYS A 33 17.808 19.471 3.237 1.00 0.00 H new ATOM 0 HD2 LYS A 33 19.605 19.215 5.428 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.620 19.222 3.999 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.708 21.343 3.247 1.00 0.00 H new ATOM 0 HE3 LYS A 33 18.412 21.282 4.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.180 22.751 5.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.056 21.429 6.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.312 21.488 5.058 1.00 0.00 H new ATOM 468 N ASN A 34 15.393 15.286 3.611 1.00 0.00 N ATOM 469 CA ASN A 34 14.811 14.007 3.981 1.00 0.00 C ATOM 470 C ASN A 34 14.187 13.359 2.743 1.00 0.00 C ATOM 471 O ASN A 34 14.209 12.137 2.600 1.00 0.00 O ATOM 472 CB ASN A 34 13.709 14.186 5.027 1.00 0.00 C ATOM 473 CG ASN A 34 14.187 13.736 6.409 1.00 0.00 C ATOM 474 OD1 ASN A 34 15.243 13.147 6.568 1.00 0.00 O ATOM 475 ND2 ASN A 34 13.352 14.045 7.397 1.00 0.00 N ATOM 0 H ASN A 34 15.398 15.479 2.609 1.00 0.00 H new ATOM 0 HA ASN A 34 15.603 13.382 4.394 1.00 0.00 H new ATOM 0 HB2 ASN A 34 13.406 15.232 5.066 1.00 0.00 H new ATOM 0 HB3 ASN A 34 12.830 13.610 4.737 1.00 0.00 H new ATOM 0 HD21 ASN A 34 13.580 13.787 8.357 1.00 0.00 H new ATOM 0 HD22 ASN A 34 12.483 14.540 7.195 1.00 0.00 H new ATOM 481 N GLU A 35 13.645 14.205 1.880 1.00 0.00 N ATOM 482 CA GLU A 35 13.016 13.730 0.659 1.00 0.00 C ATOM 483 C GLU A 35 13.981 12.833 -0.120 1.00 0.00 C ATOM 484 O GLU A 35 13.558 11.879 -0.770 1.00 0.00 O ATOM 485 CB GLU A 35 12.538 14.900 -0.203 1.00 0.00 C ATOM 486 CG GLU A 35 13.714 15.575 -0.913 1.00 0.00 C ATOM 487 CD GLU A 35 14.565 16.375 0.075 1.00 0.00 C ATOM 488 OE1 GLU A 35 15.378 15.792 0.807 1.00 0.00 O ATOM 489 OE2 GLU A 35 14.360 17.649 0.063 1.00 0.00 O ATOM 0 H GLU A 35 13.628 15.218 2.002 1.00 0.00 H new ATOM 0 HA GLU A 35 12.140 13.140 0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.820 14.543 -0.941 1.00 0.00 H new ATOM 0 HB3 GLU A 35 12.019 15.628 0.421 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.330 14.820 -1.401 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.340 16.236 -1.695 1.00 0.00 H new ATOM 495 N GLN A 36 15.259 13.173 -0.028 1.00 0.00 N ATOM 496 CA GLN A 36 16.286 12.410 -0.716 1.00 0.00 C ATOM 497 C GLN A 36 16.327 10.976 -0.186 1.00 0.00 C ATOM 498 O GLN A 36 15.941 10.040 -0.886 1.00 0.00 O ATOM 499 CB GLN A 36 17.653 13.084 -0.580 1.00 0.00 C ATOM 500 CG GLN A 36 18.683 12.425 -1.499 1.00 0.00 C ATOM 501 CD GLN A 36 20.085 12.492 -0.889 1.00 0.00 C ATOM 502 OE1 GLN A 36 20.333 12.028 0.212 1.00 0.00 O ATOM 503 NE2 GLN A 36 20.983 13.095 -1.662 1.00 0.00 N ATOM 0 H GLN A 36 15.606 13.966 0.512 1.00 0.00 H new ATOM 0 HA GLN A 36 16.037 12.377 -1.777 1.00 0.00 H new ATOM 0 HB2 GLN A 36 17.566 14.143 -0.825 1.00 0.00 H new ATOM 0 HB3 GLN A 36 17.991 13.023 0.454 1.00 0.00 H new ATOM 0 HG2 GLN A 36 18.408 11.385 -1.673 1.00 0.00 H new ATOM 0 HG3 GLN A 36 18.681 12.922 -2.469 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.708 13.461 -2.573 1.00 0.00 H new ATOM 0 HE22 GLN A 36 21.947 13.192 -1.344 1.00 0.00 H new ATOM 510 N LEU A 37 16.799 10.847 1.045 1.00 0.00 N ATOM 511 CA LEU A 37 16.895 9.541 1.677 1.00 0.00 C ATOM 512 C LEU A 37 15.559 8.811 1.534 1.00 0.00 C ATOM 513 O LEU A 37 15.528 7.622 1.215 1.00 0.00 O ATOM 514 CB LEU A 37 17.369 9.681 3.125 1.00 0.00 C ATOM 515 CG LEU A 37 18.883 9.749 3.332 1.00 0.00 C ATOM 516 CD1 LEU A 37 19.223 10.228 4.744 1.00 0.00 C ATOM 517 CD2 LEU A 37 19.542 8.406 3.008 1.00 0.00 C ATOM 0 H LEU A 37 17.119 11.625 1.622 1.00 0.00 H new ATOM 0 HA LEU A 37 17.647 8.930 1.178 1.00 0.00 H new ATOM 0 HB2 LEU A 37 16.924 10.582 3.546 1.00 0.00 H new ATOM 0 HB3 LEU A 37 16.982 8.837 3.696 1.00 0.00 H new ATOM 0 HG LEU A 37 19.290 10.483 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 37 20.306 10.267 4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.804 11.222 4.902 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.802 9.537 5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.618 8.482 3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.135 7.634 3.661 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.343 8.144 1.969 1.00 0.00 H new ATOM 528 N LEU A 38 14.487 9.551 1.778 1.00 0.00 N ATOM 529 CA LEU A 38 13.151 8.988 1.680 1.00 0.00 C ATOM 530 C LEU A 38 12.903 8.517 0.246 1.00 0.00 C ATOM 531 O LEU A 38 12.768 7.320 -0.004 1.00 0.00 O ATOM 532 CB LEU A 38 12.110 9.989 2.187 1.00 0.00 C ATOM 533 CG LEU A 38 11.802 9.935 3.684 1.00 0.00 C ATOM 534 CD1 LEU A 38 11.322 8.543 4.096 1.00 0.00 C ATOM 535 CD2 LEU A 38 13.008 10.393 4.509 1.00 0.00 C ATOM 0 H LEU A 38 14.517 10.535 2.043 1.00 0.00 H new ATOM 0 HA LEU A 38 13.059 8.113 2.323 1.00 0.00 H new ATOM 0 HB2 LEU A 38 12.453 10.994 1.943 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.182 9.827 1.639 1.00 0.00 H new ATOM 0 HG LEU A 38 10.988 10.630 3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 38 11.110 8.533 5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 38 10.416 8.292 3.544 1.00 0.00 H new ATOM 0 HD13 LEU A 38 12.097 7.810 3.873 1.00 0.00 H new ATOM 0 HD21 LEU A 38 12.762 10.345 5.570 1.00 0.00 H new ATOM 0 HD22 LEU A 38 13.858 9.742 4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 38 13.263 11.418 4.242 1.00 0.00 H new ATOM 546 N GLN A 39 12.853 9.483 -0.660 1.00 0.00 N ATOM 547 CA GLN A 39 12.625 9.182 -2.063 1.00 0.00 C ATOM 548 C GLN A 39 13.255 7.836 -2.426 1.00 0.00 C ATOM 549 O GLN A 39 12.572 6.941 -2.925 1.00 0.00 O ATOM 550 CB GLN A 39 13.164 10.299 -2.958 1.00 0.00 C ATOM 551 CG GLN A 39 12.138 11.425 -3.108 1.00 0.00 C ATOM 552 CD GLN A 39 12.721 12.595 -3.902 1.00 0.00 C ATOM 553 OE1 GLN A 39 13.101 13.623 -3.148 1.00 0.00 O flip ATOM 554 NE2 GLN A 39 12.821 12.568 -5.117 1.00 0.00 N flip ATOM 0 H GLN A 39 12.967 10.475 -0.449 1.00 0.00 H new ATOM 0 HA GLN A 39 11.550 9.115 -2.230 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.086 10.697 -2.534 1.00 0.00 H new ATOM 0 HB3 GLN A 39 13.412 9.895 -3.940 1.00 0.00 H new ATOM 0 HG2 GLN A 39 11.248 11.047 -3.611 1.00 0.00 H new ATOM 0 HG3 GLN A 39 11.824 11.770 -2.123 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.510 11.747 -5.636 1.00 0.00 H new ATOM 0 HE22 GLN A 39 13.216 13.366 -5.614 1.00 0.00 H new ATOM 561 N LEU A 40 14.549 7.733 -2.163 1.00 0.00 N ATOM 562 CA LEU A 40 15.278 6.512 -2.455 1.00 0.00 C ATOM 563 C LEU A 40 14.643 5.348 -1.692 1.00 0.00 C ATOM 564 O LEU A 40 14.024 4.471 -2.293 1.00 0.00 O ATOM 565 CB LEU A 40 16.769 6.695 -2.166 1.00 0.00 C ATOM 566 CG LEU A 40 17.667 6.911 -3.386 1.00 0.00 C ATOM 567 CD1 LEU A 40 18.545 8.151 -3.208 1.00 0.00 C ATOM 568 CD2 LEU A 40 18.497 5.660 -3.683 1.00 0.00 C ATOM 0 H LEU A 40 15.112 8.477 -1.750 1.00 0.00 H new ATOM 0 HA LEU A 40 15.209 6.273 -3.516 1.00 0.00 H new ATOM 0 HB2 LEU A 40 16.887 7.547 -1.497 1.00 0.00 H new ATOM 0 HB3 LEU A 40 17.125 5.816 -1.628 1.00 0.00 H new ATOM 0 HG LEU A 40 17.030 7.089 -4.252 1.00 0.00 H new ATOM 0 HD11 LEU A 40 19.173 8.281 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU A 40 17.912 9.029 -3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 40 19.176 8.027 -2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 40 19.127 5.840 -4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 40 19.125 5.428 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 40 17.831 4.821 -3.883 1.00 0.00 H new ATOM 579 N ILE A 41 14.819 5.377 -0.379 1.00 0.00 N ATOM 580 CA ILE A 41 14.270 4.335 0.473 1.00 0.00 C ATOM 581 C ILE A 41 12.861 3.980 -0.007 1.00 0.00 C ATOM 582 O ILE A 41 12.406 2.851 0.173 1.00 0.00 O ATOM 583 CB ILE A 41 14.331 4.757 1.942 1.00 0.00 C ATOM 584 CG1 ILE A 41 15.781 4.868 2.420 1.00 0.00 C ATOM 585 CG2 ILE A 41 13.510 3.810 2.820 1.00 0.00 C ATOM 586 CD1 ILE A 41 16.476 3.507 2.384 1.00 0.00 C ATOM 0 H ILE A 41 15.334 6.105 0.116 1.00 0.00 H new ATOM 0 HA ILE A 41 14.870 3.428 0.401 1.00 0.00 H new ATOM 0 HB ILE A 41 13.884 5.747 2.032 1.00 0.00 H new ATOM 0 HG12 ILE A 41 16.322 5.573 1.790 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.804 5.265 3.435 1.00 0.00 H new ATOM 0 HG21 ILE A 41 13.571 4.133 3.859 1.00 0.00 H new ATOM 0 HG22 ILE A 41 12.469 3.824 2.496 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.904 2.798 2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 41 17.505 3.614 2.728 1.00 0.00 H new ATOM 0 HD12 ILE A 41 15.946 2.811 3.034 1.00 0.00 H new ATOM 0 HD13 ILE A 41 16.473 3.124 1.364 1.00 0.00 H new ATOM 597 N PHE A 42 12.209 4.965 -0.607 1.00 0.00 N ATOM 598 CA PHE A 42 10.861 4.771 -1.113 1.00 0.00 C ATOM 599 C PHE A 42 10.869 3.915 -2.382 1.00 0.00 C ATOM 600 O PHE A 42 10.351 2.800 -2.387 1.00 0.00 O ATOM 601 CB PHE A 42 10.305 6.156 -1.450 1.00 0.00 C ATOM 602 CG PHE A 42 9.094 6.563 -0.608 1.00 0.00 C ATOM 603 CD1 PHE A 42 7.968 5.800 -0.625 1.00 0.00 C ATOM 604 CD2 PHE A 42 9.143 7.686 0.156 1.00 0.00 C ATOM 605 CE1 PHE A 42 6.844 6.177 0.157 1.00 0.00 C ATOM 606 CE2 PHE A 42 8.019 8.063 0.937 1.00 0.00 C ATOM 607 CZ PHE A 42 6.893 7.301 0.921 1.00 0.00 C ATOM 0 H PHE A 42 12.589 5.900 -0.754 1.00 0.00 H new ATOM 0 HA PHE A 42 10.254 4.260 -0.366 1.00 0.00 H new ATOM 0 HB2 PHE A 42 11.094 6.896 -1.314 1.00 0.00 H new ATOM 0 HB3 PHE A 42 10.026 6.178 -2.503 1.00 0.00 H new ATOM 0 HD1 PHE A 42 7.929 4.908 -1.233 1.00 0.00 H new ATOM 0 HD2 PHE A 42 10.037 8.292 0.169 1.00 0.00 H new ATOM 0 HE1 PHE A 42 5.950 5.571 0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 42 8.058 8.955 1.544 1.00 0.00 H new ATOM 0 HZ PHE A 42 6.038 7.588 1.515 1.00 0.00 H new ATOM 616 N LYS A 43 11.464 4.471 -3.428 1.00 0.00 N ATOM 617 CA LYS A 43 11.547 3.774 -4.700 1.00 0.00 C ATOM 618 C LYS A 43 11.839 2.293 -4.446 1.00 0.00 C ATOM 619 O LYS A 43 11.422 1.434 -5.220 1.00 0.00 O ATOM 620 CB LYS A 43 12.565 4.452 -5.618 1.00 0.00 C ATOM 621 CG LYS A 43 13.947 3.812 -5.473 1.00 0.00 C ATOM 622 CD LYS A 43 15.044 4.878 -5.428 1.00 0.00 C ATOM 623 CE LYS A 43 15.910 4.826 -6.688 1.00 0.00 C ATOM 624 NZ LYS A 43 15.953 6.153 -7.342 1.00 0.00 N ATOM 0 H LYS A 43 11.893 5.396 -3.420 1.00 0.00 H new ATOM 0 HA LYS A 43 10.594 3.827 -5.226 1.00 0.00 H new ATOM 0 HB2 LYS A 43 12.233 4.377 -6.653 1.00 0.00 H new ATOM 0 HB3 LYS A 43 12.625 5.514 -5.379 1.00 0.00 H new ATOM 0 HG2 LYS A 43 13.980 3.212 -4.563 1.00 0.00 H new ATOM 0 HG3 LYS A 43 14.127 3.135 -6.308 1.00 0.00 H new ATOM 0 HD2 LYS A 43 14.593 5.866 -5.333 1.00 0.00 H new ATOM 0 HD3 LYS A 43 15.668 4.726 -4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 43 16.920 4.508 -6.429 1.00 0.00 H new ATOM 0 HE3 LYS A 43 15.511 4.085 -7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 16.545 6.100 -8.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 14.989 6.441 -7.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 16.355 6.851 -6.684 1.00 0.00 H new ATOM 634 N ALA A 44 12.552 2.041 -3.358 1.00 0.00 N ATOM 635 CA ALA A 44 12.904 0.680 -2.993 1.00 0.00 C ATOM 636 C ALA A 44 11.721 0.026 -2.276 1.00 0.00 C ATOM 637 O ALA A 44 11.342 -1.100 -2.596 1.00 0.00 O ATOM 638 CB ALA A 44 14.171 0.692 -2.135 1.00 0.00 C ATOM 0 H ALA A 44 12.895 2.757 -2.718 1.00 0.00 H new ATOM 0 HA ALA A 44 13.118 0.088 -3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 44 14.435 -0.330 -1.861 1.00 0.00 H new ATOM 0 HB2 ALA A 44 14.989 1.139 -2.700 1.00 0.00 H new ATOM 0 HB3 ALA A 44 13.993 1.275 -1.232 1.00 0.00 H new ATOM 644 N ILE A 45 11.171 0.761 -1.320 1.00 0.00 N ATOM 645 CA ILE A 45 10.038 0.267 -0.555 1.00 0.00 C ATOM 646 C ILE A 45 8.740 0.660 -1.263 1.00 0.00 C ATOM 647 O ILE A 45 7.682 0.718 -0.638 1.00 0.00 O ATOM 648 CB ILE A 45 10.119 0.749 0.894 1.00 0.00 C ATOM 649 CG1 ILE A 45 9.892 -0.407 1.870 1.00 0.00 C ATOM 650 CG2 ILE A 45 9.151 1.907 1.142 1.00 0.00 C ATOM 651 CD1 ILE A 45 11.207 -1.121 2.190 1.00 0.00 C ATOM 0 H ILE A 45 11.489 1.694 -1.058 1.00 0.00 H new ATOM 0 HA ILE A 45 10.057 -0.822 -0.505 1.00 0.00 H new ATOM 0 HB ILE A 45 11.126 1.128 1.072 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.446 -0.029 2.790 1.00 0.00 H new ATOM 0 HG13 ILE A 45 9.184 -1.116 1.441 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.229 2.230 2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.402 2.738 0.483 1.00 0.00 H new ATOM 0 HG23 ILE A 45 8.131 1.579 0.940 1.00 0.00 H new ATOM 0 HD11 ILE A 45 11.017 -1.938 2.886 1.00 0.00 H new ATOM 0 HD12 ILE A 45 11.638 -1.519 1.271 1.00 0.00 H new ATOM 0 HD13 ILE A 45 11.904 -0.415 2.641 1.00 0.00 H new ATOM 662 N ASP A 46 8.864 0.920 -2.556 1.00 0.00 N ATOM 663 CA ASP A 46 7.713 1.306 -3.355 1.00 0.00 C ATOM 664 C ASP A 46 7.215 0.094 -4.145 1.00 0.00 C ATOM 665 O ASP A 46 6.017 -0.048 -4.381 1.00 0.00 O ATOM 666 CB ASP A 46 8.081 2.405 -4.354 1.00 0.00 C ATOM 667 CG ASP A 46 6.916 2.927 -5.198 1.00 0.00 C ATOM 668 OD1 ASP A 46 5.884 2.257 -5.346 1.00 0.00 O ATOM 669 OD2 ASP A 46 7.102 4.090 -5.724 1.00 0.00 O ATOM 0 H ASP A 46 9.743 0.871 -3.070 1.00 0.00 H new ATOM 0 HA ASP A 46 6.942 1.676 -2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 46 8.517 3.241 -3.807 1.00 0.00 H new ATOM 0 HB3 ASP A 46 8.853 2.024 -5.023 1.00 0.00 H new ATOM 674 N ILE A 47 8.162 -0.747 -4.533 1.00 0.00 N ATOM 675 CA ILE A 47 7.835 -1.943 -5.292 1.00 0.00 C ATOM 676 C ILE A 47 6.586 -2.595 -4.695 1.00 0.00 C ATOM 677 O ILE A 47 5.844 -3.279 -5.397 1.00 0.00 O ATOM 678 CB ILE A 47 9.043 -2.880 -5.364 1.00 0.00 C ATOM 679 CG1 ILE A 47 9.082 -3.817 -4.156 1.00 0.00 C ATOM 680 CG2 ILE A 47 10.343 -2.086 -5.517 1.00 0.00 C ATOM 681 CD1 ILE A 47 9.288 -3.031 -2.858 1.00 0.00 C ATOM 0 H ILE A 47 9.155 -0.625 -4.336 1.00 0.00 H new ATOM 0 HA ILE A 47 7.599 -1.686 -6.325 1.00 0.00 H new ATOM 0 HB ILE A 47 8.940 -3.504 -6.252 1.00 0.00 H new ATOM 0 HG12 ILE A 47 8.152 -4.382 -4.099 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.888 -4.541 -4.279 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.186 -2.775 -5.566 1.00 0.00 H new ATOM 0 HG22 ILE A 47 10.303 -1.496 -6.432 1.00 0.00 H new ATOM 0 HG23 ILE A 47 10.466 -1.421 -4.662 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.312 -3.721 -2.015 1.00 0.00 H new ATOM 0 HD12 ILE A 47 10.231 -2.486 -2.908 1.00 0.00 H new ATOM 0 HD13 ILE A 47 8.468 -2.325 -2.726 1.00 0.00 H new ATOM 692 N ASP A 48 6.393 -2.359 -3.405 1.00 0.00 N ATOM 693 CA ASP A 48 5.247 -2.915 -2.707 1.00 0.00 C ATOM 694 C ASP A 48 3.994 -2.735 -3.567 1.00 0.00 C ATOM 695 O ASP A 48 3.035 -3.495 -3.439 1.00 0.00 O ATOM 696 CB ASP A 48 5.013 -2.198 -1.375 1.00 0.00 C ATOM 697 CG ASP A 48 3.775 -1.300 -1.333 1.00 0.00 C ATOM 698 OD1 ASP A 48 2.640 -1.784 -1.201 1.00 0.00 O ATOM 699 OD2 ASP A 48 4.013 -0.038 -1.442 1.00 0.00 O ATOM 0 H ASP A 48 7.011 -1.791 -2.826 1.00 0.00 H new ATOM 0 HA ASP A 48 5.446 -3.970 -2.519 1.00 0.00 H new ATOM 0 HB2 ASP A 48 4.928 -2.946 -0.587 1.00 0.00 H new ATOM 0 HB3 ASP A 48 5.890 -1.593 -1.146 1.00 0.00 H new ATOM 704 N GLY A 49 4.043 -1.726 -4.423 1.00 0.00 N ATOM 705 CA GLY A 49 2.924 -1.436 -5.305 1.00 0.00 C ATOM 706 C GLY A 49 3.335 -1.565 -6.772 1.00 0.00 C ATOM 707 O GLY A 49 2.630 -2.185 -7.567 1.00 0.00 O ATOM 0 H GLY A 49 4.840 -1.098 -4.525 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.102 -2.120 -5.092 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.557 -0.428 -5.114 1.00 0.00 H new ATOM 711 N ASN A 50 4.475 -0.968 -7.089 1.00 0.00 N ATOM 712 CA ASN A 50 4.988 -1.008 -8.448 1.00 0.00 C ATOM 713 C ASN A 50 5.837 0.240 -8.705 1.00 0.00 C ATOM 714 O ASN A 50 5.696 0.888 -9.741 1.00 0.00 O ATOM 715 CB ASN A 50 3.848 -1.021 -9.468 1.00 0.00 C ATOM 716 CG ASN A 50 2.720 -0.080 -9.041 1.00 0.00 C ATOM 717 OD1 ASN A 50 2.800 0.615 -8.041 1.00 0.00 O ATOM 718 ND2 ASN A 50 1.666 -0.096 -9.852 1.00 0.00 N ATOM 0 H ASN A 50 5.058 -0.454 -6.428 1.00 0.00 H new ATOM 0 HA ASN A 50 5.580 -1.916 -8.558 1.00 0.00 H new ATOM 0 HB2 ASN A 50 4.226 -0.721 -10.445 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.461 -2.034 -9.573 1.00 0.00 H new ATOM 0 HD21 ASN A 50 0.860 0.497 -9.653 1.00 0.00 H new ATOM 0 HD22 ASN A 50 1.663 -0.701 -10.673 1.00 0.00 H new ATOM 724 N GLY A 51 6.699 0.538 -7.744 1.00 0.00 N ATOM 725 CA GLY A 51 7.570 1.696 -7.853 1.00 0.00 C ATOM 726 C GLY A 51 6.757 2.979 -8.032 1.00 0.00 C ATOM 727 O GLY A 51 7.295 4.008 -8.436 1.00 0.00 O ATOM 0 H GLY A 51 6.813 -0.002 -6.886 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.189 1.775 -6.959 1.00 0.00 H new ATOM 0 HA3 GLY A 51 8.246 1.569 -8.699 1.00 0.00 H new ATOM 731 N GLU A 52 5.472 2.875 -7.723 1.00 0.00 N ATOM 732 CA GLU A 52 4.579 4.015 -7.846 1.00 0.00 C ATOM 733 C GLU A 52 3.371 3.843 -6.923 1.00 0.00 C ATOM 734 O GLU A 52 2.513 2.996 -7.169 1.00 0.00 O ATOM 735 CB GLU A 52 4.137 4.213 -9.297 1.00 0.00 C ATOM 736 CG GLU A 52 3.922 2.867 -9.992 1.00 0.00 C ATOM 737 CD GLU A 52 2.611 2.861 -10.781 1.00 0.00 C ATOM 738 OE1 GLU A 52 1.541 3.111 -10.205 1.00 0.00 O ATOM 739 OE2 GLU A 52 2.729 2.584 -12.034 1.00 0.00 O ATOM 0 H GLU A 52 5.029 2.020 -7.388 1.00 0.00 H new ATOM 0 HA GLU A 52 5.121 4.911 -7.542 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.214 4.792 -9.324 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.890 4.788 -9.835 1.00 0.00 H new ATOM 0 HG2 GLU A 52 4.756 2.663 -10.664 1.00 0.00 H new ATOM 0 HG3 GLU A 52 3.908 2.069 -9.250 1.00 0.00 H new ATOM 745 N ILE A 53 3.340 4.660 -5.880 1.00 0.00 N ATOM 746 CA ILE A 53 2.252 4.608 -4.920 1.00 0.00 C ATOM 747 C ILE A 53 1.258 5.731 -5.222 1.00 0.00 C ATOM 748 O ILE A 53 1.620 6.741 -5.824 1.00 0.00 O ATOM 749 CB ILE A 53 2.796 4.638 -3.490 1.00 0.00 C ATOM 750 CG1 ILE A 53 4.172 3.972 -3.413 1.00 0.00 C ATOM 751 CG2 ILE A 53 1.800 4.011 -2.512 1.00 0.00 C ATOM 752 CD1 ILE A 53 4.684 3.938 -1.973 1.00 0.00 C ATOM 0 H ILE A 53 4.052 5.362 -5.679 1.00 0.00 H new ATOM 0 HA ILE A 53 1.710 3.667 -5.010 1.00 0.00 H new ATOM 0 HB ILE A 53 2.925 5.679 -3.195 1.00 0.00 H new ATOM 0 HG12 ILE A 53 4.111 2.957 -3.805 1.00 0.00 H new ATOM 0 HG13 ILE A 53 4.878 4.515 -4.041 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.211 4.045 -1.503 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.863 4.567 -2.541 1.00 0.00 H new ATOM 0 HG23 ILE A 53 1.616 2.974 -2.794 1.00 0.00 H new ATOM 0 HD11 ILE A 53 5.663 3.460 -1.946 1.00 0.00 H new ATOM 0 HD12 ILE A 53 4.767 4.956 -1.592 1.00 0.00 H new ATOM 0 HD13 ILE A 53 3.988 3.374 -1.352 1.00 0.00 H new ATOM 763 N ASP A 54 0.023 5.518 -4.791 1.00 0.00 N ATOM 764 CA ASP A 54 -1.026 6.500 -5.008 1.00 0.00 C ATOM 765 C ASP A 54 -1.533 7.006 -3.656 1.00 0.00 C ATOM 766 O ASP A 54 -1.590 6.249 -2.688 1.00 0.00 O ATOM 767 CB ASP A 54 -2.209 5.885 -5.757 1.00 0.00 C ATOM 768 CG ASP A 54 -3.346 5.380 -4.867 1.00 0.00 C ATOM 769 OD1 ASP A 54 -3.179 4.421 -4.099 1.00 0.00 O ATOM 770 OD2 ASP A 54 -4.458 6.025 -4.985 1.00 0.00 O ATOM 0 H ASP A 54 -0.275 4.679 -4.292 1.00 0.00 H new ATOM 0 HA ASP A 54 -0.608 7.314 -5.600 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.610 6.629 -6.446 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -1.845 5.054 -6.362 1.00 0.00 H new ATOM 775 N LEU A 55 -1.887 8.282 -3.632 1.00 0.00 N ATOM 776 CA LEU A 55 -2.387 8.898 -2.415 1.00 0.00 C ATOM 777 C LEU A 55 -3.230 7.880 -1.643 1.00 0.00 C ATOM 778 O LEU A 55 -3.043 7.697 -0.441 1.00 0.00 O ATOM 779 CB LEU A 55 -3.133 10.194 -2.738 1.00 0.00 C ATOM 780 CG LEU A 55 -2.416 11.491 -2.358 1.00 0.00 C ATOM 781 CD1 LEU A 55 -2.874 11.989 -0.985 1.00 0.00 C ATOM 782 CD2 LEU A 55 -0.898 11.320 -2.428 1.00 0.00 C ATOM 0 H LEU A 55 -1.837 8.907 -4.437 1.00 0.00 H new ATOM 0 HA LEU A 55 -1.560 9.186 -1.766 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.338 10.215 -3.808 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.097 10.172 -2.229 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.687 12.256 -3.085 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -2.349 12.912 -0.739 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -3.948 12.177 -1.006 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -2.652 11.234 -0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.413 12.257 -2.153 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -0.588 10.535 -1.738 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.609 11.046 -3.443 1.00 0.00 H new ATOM 793 N ALA A 56 -4.140 7.244 -2.367 1.00 0.00 N ATOM 794 CA ALA A 56 -5.013 6.249 -1.764 1.00 0.00 C ATOM 795 C ALA A 56 -4.170 5.269 -0.945 1.00 0.00 C ATOM 796 O ALA A 56 -4.374 5.126 0.259 1.00 0.00 O ATOM 797 CB ALA A 56 -5.822 5.550 -2.859 1.00 0.00 C ATOM 0 H ALA A 56 -4.292 7.398 -3.364 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.723 6.721 -1.085 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.476 4.804 -2.408 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.424 6.286 -3.393 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.143 5.062 -3.558 1.00 0.00 H new ATOM 803 N GLU A 57 -3.243 4.617 -1.632 1.00 0.00 N ATOM 804 CA GLU A 57 -2.370 3.654 -0.983 1.00 0.00 C ATOM 805 C GLU A 57 -1.900 4.191 0.371 1.00 0.00 C ATOM 806 O GLU A 57 -1.995 3.499 1.383 1.00 0.00 O ATOM 807 CB GLU A 57 -1.179 3.304 -1.878 1.00 0.00 C ATOM 808 CG GLU A 57 -1.267 1.857 -2.368 1.00 0.00 C ATOM 809 CD GLU A 57 0.001 1.455 -3.122 1.00 0.00 C ATOM 810 OE1 GLU A 57 0.082 1.644 -4.344 1.00 0.00 O ATOM 811 OE2 GLU A 57 0.926 0.930 -2.392 1.00 0.00 O ATOM 0 H GLU A 57 -3.078 4.737 -2.631 1.00 0.00 H new ATOM 0 HA GLU A 57 -2.935 2.738 -0.812 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -1.151 3.980 -2.733 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.250 3.449 -1.326 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.416 1.190 -1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.133 1.742 -3.019 1.00 0.00 H new ATOM 817 N PHE A 58 -1.404 5.419 0.344 1.00 0.00 N ATOM 818 CA PHE A 58 -0.919 6.056 1.557 1.00 0.00 C ATOM 819 C PHE A 58 -2.057 6.263 2.560 1.00 0.00 C ATOM 820 O PHE A 58 -2.054 5.668 3.636 1.00 0.00 O ATOM 821 CB PHE A 58 -0.358 7.421 1.152 1.00 0.00 C ATOM 822 CG PHE A 58 -0.404 8.468 2.266 1.00 0.00 C ATOM 823 CD1 PHE A 58 0.379 8.322 3.369 1.00 0.00 C ATOM 824 CD2 PHE A 58 -1.226 9.546 2.154 1.00 0.00 C ATOM 825 CE1 PHE A 58 0.338 9.294 4.403 1.00 0.00 C ATOM 826 CE2 PHE A 58 -1.268 10.518 3.188 1.00 0.00 C ATOM 827 CZ PHE A 58 -0.485 10.371 4.291 1.00 0.00 C ATOM 0 H PHE A 58 -1.327 5.990 -0.498 1.00 0.00 H new ATOM 0 HA PHE A 58 -0.163 5.429 2.030 1.00 0.00 H new ATOM 0 HB2 PHE A 58 0.675 7.296 0.827 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -0.919 7.793 0.295 1.00 0.00 H new ATOM 0 HD1 PHE A 58 1.032 7.466 3.458 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.847 9.663 1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.960 9.178 5.278 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.921 11.374 3.099 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.517 11.110 5.078 1.00 0.00 H new ATOM 836 N THR A 59 -3.000 7.107 2.170 1.00 0.00 N ATOM 837 CA THR A 59 -4.141 7.399 3.022 1.00 0.00 C ATOM 838 C THR A 59 -4.723 6.106 3.594 1.00 0.00 C ATOM 839 O THR A 59 -4.801 5.941 4.811 1.00 0.00 O ATOM 840 CB THR A 59 -5.147 8.209 2.202 1.00 0.00 C ATOM 841 OG1 THR A 59 -4.424 9.376 1.819 1.00 0.00 O ATOM 842 CG2 THR A 59 -6.298 8.748 3.055 1.00 0.00 C ATOM 0 H THR A 59 -2.998 7.598 1.276 1.00 0.00 H new ATOM 0 HA THR A 59 -3.849 7.996 3.886 1.00 0.00 H new ATOM 0 HB THR A 59 -5.548 7.587 1.402 1.00 0.00 H new ATOM 0 HG1 THR A 59 -3.536 9.361 2.233 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.983 9.315 2.425 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.832 7.916 3.514 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.900 9.398 3.835 1.00 0.00 H new ATOM 850 N LYS A 60 -5.119 5.222 2.690 1.00 0.00 N ATOM 851 CA LYS A 60 -5.693 3.948 3.091 1.00 0.00 C ATOM 852 C LYS A 60 -4.824 3.322 4.184 1.00 0.00 C ATOM 853 O LYS A 60 -5.257 3.196 5.328 1.00 0.00 O ATOM 854 CB LYS A 60 -5.893 3.045 1.872 1.00 0.00 C ATOM 855 CG LYS A 60 -7.070 2.089 2.085 1.00 0.00 C ATOM 856 CD LYS A 60 -7.951 2.018 0.837 1.00 0.00 C ATOM 857 CE LYS A 60 -9.423 2.240 1.192 1.00 0.00 C ATOM 858 NZ LYS A 60 -10.282 1.287 0.454 1.00 0.00 N ATOM 0 H LYS A 60 -5.054 5.362 1.682 1.00 0.00 H new ATOM 0 HA LYS A 60 -6.685 4.094 3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -6.072 3.656 0.987 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -4.984 2.473 1.686 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -6.696 1.094 2.328 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -7.664 2.422 2.936 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -7.629 2.770 0.117 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -7.831 1.046 0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -9.568 2.114 2.265 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -9.712 3.263 0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -11.278 1.450 0.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.156 1.426 -0.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.017 0.314 0.706 1.00 0.00 H new ATOM 868 N PHE A 61 -3.615 2.949 3.793 1.00 0.00 N ATOM 869 CA PHE A 61 -2.682 2.340 4.725 1.00 0.00 C ATOM 870 C PHE A 61 -2.686 3.078 6.065 1.00 0.00 C ATOM 871 O PHE A 61 -2.621 2.453 7.122 1.00 0.00 O ATOM 872 CB PHE A 61 -1.289 2.450 4.100 1.00 0.00 C ATOM 873 CG PHE A 61 -0.896 1.246 3.242 1.00 0.00 C ATOM 874 CD1 PHE A 61 -1.755 0.771 2.301 1.00 0.00 C ATOM 875 CD2 PHE A 61 0.314 0.650 3.420 1.00 0.00 C ATOM 876 CE1 PHE A 61 -1.390 -0.346 1.504 1.00 0.00 C ATOM 877 CE2 PHE A 61 0.679 -0.468 2.623 1.00 0.00 C ATOM 878 CZ PHE A 61 -0.180 -0.942 1.682 1.00 0.00 C ATOM 0 H PHE A 61 -3.260 3.057 2.843 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.964 1.304 4.910 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.247 3.350 3.486 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -0.554 2.572 4.895 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.716 1.244 2.160 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.997 1.027 4.167 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.073 -0.722 0.757 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.639 -0.942 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.098 -1.792 1.076 1.00 0.00 H new ATOM 887 N ALA A 62 -2.762 4.398 5.978 1.00 0.00 N ATOM 888 CA ALA A 62 -2.776 5.228 7.170 1.00 0.00 C ATOM 889 C ALA A 62 -4.003 4.879 8.015 1.00 0.00 C ATOM 890 O ALA A 62 -3.875 4.526 9.187 1.00 0.00 O ATOM 891 CB ALA A 62 -2.746 6.703 6.766 1.00 0.00 C ATOM 0 H ALA A 62 -2.815 4.913 5.099 1.00 0.00 H new ATOM 0 HA ALA A 62 -1.892 5.039 7.779 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -2.757 7.326 7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.841 6.905 6.194 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.620 6.931 6.155 1.00 0.00 H new ATOM 897 N ALA A 63 -5.165 4.989 7.387 1.00 0.00 N ATOM 898 CA ALA A 63 -6.413 4.690 8.066 1.00 0.00 C ATOM 899 C ALA A 63 -6.403 3.230 8.524 1.00 0.00 C ATOM 900 O ALA A 63 -7.156 2.852 9.420 1.00 0.00 O ATOM 901 CB ALA A 63 -7.589 5.002 7.136 1.00 0.00 C ATOM 0 H ALA A 63 -5.267 5.281 6.415 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.525 5.313 8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.526 4.777 7.646 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.568 6.057 6.864 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.512 4.394 6.235 1.00 0.00 H new ATOM 907 N ALA A 64 -5.543 2.451 7.888 1.00 0.00 N ATOM 908 CA ALA A 64 -5.425 1.040 8.217 1.00 0.00 C ATOM 909 C ALA A 64 -4.571 0.885 9.479 1.00 0.00 C ATOM 910 O ALA A 64 -4.870 0.057 10.336 1.00 0.00 O ATOM 911 CB ALA A 64 -4.842 0.283 7.023 1.00 0.00 C ATOM 0 H ALA A 64 -4.920 2.769 7.146 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.405 0.612 8.426 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.754 -0.775 7.271 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.499 0.400 6.162 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -3.857 0.683 6.785 1.00 0.00 H new ATOM 917 N VAL A 65 -3.526 1.697 9.550 1.00 0.00 N ATOM 918 CA VAL A 65 -2.628 1.661 10.691 1.00 0.00 C ATOM 919 C VAL A 65 -3.263 2.420 11.858 1.00 0.00 C ATOM 920 O VAL A 65 -2.912 2.192 13.015 1.00 0.00 O ATOM 921 CB VAL A 65 -1.256 2.212 10.295 1.00 0.00 C ATOM 922 CG1 VAL A 65 -1.147 3.702 10.627 1.00 0.00 C ATOM 923 CG2 VAL A 65 -0.133 1.416 10.963 1.00 0.00 C ATOM 0 H VAL A 65 -3.282 2.383 8.836 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.468 0.634 11.019 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.148 2.102 9.216 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.163 4.069 10.336 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.915 4.253 10.084 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.286 3.847 11.698 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.831 1.828 10.665 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.236 1.480 12.046 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.193 0.372 10.654 1.00 0.00 H new ATOM 933 N LYS A 66 -4.185 3.306 11.515 1.00 0.00 N ATOM 934 CA LYS A 66 -4.871 4.101 12.519 1.00 0.00 C ATOM 935 C LYS A 66 -5.367 3.182 13.638 1.00 0.00 C ATOM 936 O LYS A 66 -4.917 3.287 14.778 1.00 0.00 O ATOM 937 CB LYS A 66 -5.978 4.938 11.876 1.00 0.00 C ATOM 938 CG LYS A 66 -5.831 6.416 12.245 1.00 0.00 C ATOM 939 CD LYS A 66 -6.724 7.292 11.364 1.00 0.00 C ATOM 940 CE LYS A 66 -6.993 8.644 12.028 1.00 0.00 C ATOM 941 NZ LYS A 66 -8.448 8.869 12.177 1.00 0.00 N ATOM 0 H LYS A 66 -4.474 3.491 10.554 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.185 4.817 12.972 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -5.942 4.824 10.793 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -6.952 4.573 12.203 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -6.094 6.561 13.293 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.791 6.721 12.132 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -6.247 7.447 10.396 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -7.668 6.781 11.176 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -6.512 8.678 13.006 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -6.555 9.443 11.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -8.612 9.791 12.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -8.899 8.858 11.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -8.857 8.116 12.767 1.00 0.00 H new ATOM 951 N GLU A 67 -6.287 2.301 13.273 1.00 0.00 N ATOM 952 CA GLU A 67 -6.849 1.364 14.231 1.00 0.00 C ATOM 953 C GLU A 67 -5.833 0.269 14.560 1.00 0.00 C ATOM 954 O GLU A 67 -5.301 0.223 15.668 1.00 0.00 O ATOM 955 CB GLU A 67 -8.155 0.762 13.709 1.00 0.00 C ATOM 956 CG GLU A 67 -9.007 0.220 14.858 1.00 0.00 C ATOM 957 CD GLU A 67 -9.673 -1.102 14.469 1.00 0.00 C ATOM 958 OE1 GLU A 67 -10.411 -1.155 13.474 1.00 0.00 O ATOM 959 OE2 GLU A 67 -9.401 -2.098 15.242 1.00 0.00 O ATOM 0 H GLU A 67 -6.657 2.216 12.326 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.079 1.906 15.148 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.716 1.520 13.162 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.934 -0.041 13.005 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -8.383 0.072 15.740 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.770 0.951 15.126 1.00 0.00 H new ATOM 965 N GLN A 68 -5.595 -0.587 13.577 1.00 0.00 N ATOM 966 CA GLN A 68 -4.652 -1.680 13.749 1.00 0.00 C ATOM 967 C GLN A 68 -4.340 -2.327 12.398 1.00 0.00 C ATOM 968 O GLN A 68 -5.246 -2.769 11.693 1.00 0.00 O ATOM 969 CB GLN A 68 -5.185 -2.713 14.742 1.00 0.00 C ATOM 970 CG GLN A 68 -4.186 -2.949 15.877 1.00 0.00 C ATOM 971 CD GLN A 68 -4.171 -4.421 16.296 1.00 0.00 C ATOM 972 OE1 GLN A 68 -3.471 -5.246 15.734 1.00 0.00 O ATOM 973 NE2 GLN A 68 -4.980 -4.702 17.313 1.00 0.00 N ATOM 0 H GLN A 68 -6.038 -0.546 12.659 1.00 0.00 H new ATOM 0 HA GLN A 68 -3.727 -1.276 14.159 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -6.134 -2.371 15.154 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -5.382 -3.652 14.225 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.188 -2.648 15.557 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -4.448 -2.326 16.732 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -5.540 -3.963 17.739 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.041 -5.656 17.668 1.00 0.00 H new ATOM 980 N ASP A 69 -3.054 -2.364 12.079 1.00 0.00 N ATOM 981 CA ASP A 69 -2.611 -2.951 10.826 1.00 0.00 C ATOM 982 C ASP A 69 -1.565 -4.029 11.114 1.00 0.00 C ATOM 983 O ASP A 69 -0.595 -3.784 11.830 1.00 0.00 O ATOM 984 CB ASP A 69 -1.967 -1.898 9.921 1.00 0.00 C ATOM 985 CG ASP A 69 -1.481 -2.418 8.567 1.00 0.00 C ATOM 986 OD1 ASP A 69 -1.840 -3.526 8.142 1.00 0.00 O ATOM 987 OD2 ASP A 69 -0.690 -1.623 7.930 1.00 0.00 O ATOM 0 H ASP A 69 -2.305 -1.997 12.667 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.482 -3.373 10.325 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.688 -1.099 9.749 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.121 -1.456 10.448 1.00 0.00 H new ATOM 992 N LEU A 70 -1.796 -5.202 10.542 1.00 0.00 N ATOM 993 CA LEU A 70 -0.886 -6.319 10.729 1.00 0.00 C ATOM 994 C LEU A 70 0.235 -6.237 9.690 1.00 0.00 C ATOM 995 O LEU A 70 0.511 -7.211 8.992 1.00 0.00 O ATOM 996 CB LEU A 70 -1.651 -7.644 10.705 1.00 0.00 C ATOM 997 CG LEU A 70 -1.745 -8.389 12.038 1.00 0.00 C ATOM 998 CD1 LEU A 70 -2.659 -7.649 13.016 1.00 0.00 C ATOM 999 CD2 LEU A 70 -2.185 -9.838 11.825 1.00 0.00 C ATOM 0 H LEU A 70 -2.601 -5.403 9.948 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.416 -6.267 11.711 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.662 -7.450 10.348 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.176 -8.302 9.977 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.752 -8.417 12.486 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.708 -8.200 13.955 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -2.262 -6.651 13.201 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.659 -7.568 12.590 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.244 -10.346 12.788 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -3.164 -9.854 11.346 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.461 -10.348 11.190 1.00 0.00 H new ATOM 1010 N SER A 71 0.850 -5.066 9.621 1.00 0.00 N ATOM 1011 CA SER A 71 1.933 -4.843 8.680 1.00 0.00 C ATOM 1012 C SER A 71 3.207 -5.532 9.176 1.00 0.00 C ATOM 1013 O SER A 71 3.799 -6.340 8.462 1.00 0.00 O ATOM 1014 CB SER A 71 2.185 -3.349 8.471 1.00 0.00 C ATOM 1015 OG SER A 71 2.260 -2.642 9.707 1.00 0.00 O ATOM 0 H SER A 71 0.618 -4.261 10.202 1.00 0.00 H new ATOM 0 HA SER A 71 1.645 -5.272 7.720 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.114 -3.212 7.918 1.00 0.00 H new ATOM 0 HB3 SER A 71 1.386 -2.928 7.861 1.00 0.00 H new ATOM 0 HG SER A 71 2.423 -1.692 9.531 1.00 0.00 H new ATOM 1020 N ASP A 72 3.591 -5.187 10.397 1.00 0.00 N ATOM 1021 CA ASP A 72 4.782 -5.761 10.997 1.00 0.00 C ATOM 1022 C ASP A 72 4.862 -7.247 10.641 1.00 0.00 C ATOM 1023 O ASP A 72 5.945 -7.771 10.385 1.00 0.00 O ATOM 1024 CB ASP A 72 4.743 -5.642 12.522 1.00 0.00 C ATOM 1025 CG ASP A 72 4.240 -4.298 13.052 1.00 0.00 C ATOM 1026 OD1 ASP A 72 4.798 -3.236 12.735 1.00 0.00 O ATOM 1027 OD2 ASP A 72 3.217 -4.368 13.834 1.00 0.00 O ATOM 0 H ASP A 72 3.097 -4.517 10.986 1.00 0.00 H new ATOM 0 HA ASP A 72 5.647 -5.218 10.615 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.106 -6.433 12.917 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.746 -5.817 12.911 1.00 0.00 H new ATOM 1032 N GLU A 73 3.700 -7.885 10.637 1.00 0.00 N ATOM 1033 CA GLU A 73 3.625 -9.300 10.317 1.00 0.00 C ATOM 1034 C GLU A 73 4.137 -9.551 8.898 1.00 0.00 C ATOM 1035 O GLU A 73 4.978 -10.422 8.682 1.00 0.00 O ATOM 1036 CB GLU A 73 2.197 -9.825 10.486 1.00 0.00 C ATOM 1037 CG GLU A 73 2.200 -11.265 11.005 1.00 0.00 C ATOM 1038 CD GLU A 73 1.241 -12.140 10.197 1.00 0.00 C ATOM 1039 OE1 GLU A 73 1.242 -12.081 8.959 1.00 0.00 O ATOM 1040 OE2 GLU A 73 0.476 -12.904 10.902 1.00 0.00 O ATOM 0 H GLU A 73 2.804 -7.448 10.850 1.00 0.00 H new ATOM 0 HA GLU A 73 4.262 -9.845 11.014 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.650 -9.186 11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.674 -9.780 9.531 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.208 -11.674 10.947 1.00 0.00 H new ATOM 0 HG3 GLU A 73 1.911 -11.277 12.056 1.00 0.00 H new ATOM 1046 N LYS A 74 3.607 -8.773 7.965 1.00 0.00 N ATOM 1047 CA LYS A 74 3.999 -8.900 6.572 1.00 0.00 C ATOM 1048 C LYS A 74 5.471 -8.508 6.424 1.00 0.00 C ATOM 1049 O LYS A 74 6.151 -8.970 5.508 1.00 0.00 O ATOM 1050 CB LYS A 74 3.056 -8.098 5.674 1.00 0.00 C ATOM 1051 CG LYS A 74 3.408 -6.609 5.701 1.00 0.00 C ATOM 1052 CD LYS A 74 3.694 -6.088 4.291 1.00 0.00 C ATOM 1053 CE LYS A 74 4.134 -4.624 4.325 1.00 0.00 C ATOM 1054 NZ LYS A 74 5.327 -4.420 3.474 1.00 0.00 N ATOM 0 H LYS A 74 2.909 -8.052 8.147 1.00 0.00 H new ATOM 0 HA LYS A 74 3.909 -9.936 6.244 1.00 0.00 H new ATOM 0 HB2 LYS A 74 3.116 -8.471 4.652 1.00 0.00 H new ATOM 0 HB3 LYS A 74 2.027 -8.238 6.004 1.00 0.00 H new ATOM 0 HG2 LYS A 74 2.586 -6.045 6.141 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.280 -6.449 6.336 1.00 0.00 H new ATOM 0 HD2 LYS A 74 4.472 -6.694 3.827 1.00 0.00 H new ATOM 0 HD3 LYS A 74 2.801 -6.188 3.674 1.00 0.00 H new ATOM 0 HE2 LYS A 74 3.321 -3.986 3.980 1.00 0.00 H new ATOM 0 HE3 LYS A 74 4.357 -4.329 5.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 5.612 -3.420 3.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 6.107 -5.014 3.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 5.102 -4.682 2.493 1.00 0.00 H new ATOM 1064 N VAL A 75 5.920 -7.661 7.338 1.00 0.00 N ATOM 1065 CA VAL A 75 7.298 -7.201 7.321 1.00 0.00 C ATOM 1066 C VAL A 75 8.217 -8.339 7.771 1.00 0.00 C ATOM 1067 O VAL A 75 9.344 -8.457 7.296 1.00 0.00 O ATOM 1068 CB VAL A 75 7.441 -5.942 8.179 1.00 0.00 C ATOM 1069 CG1 VAL A 75 8.889 -5.448 8.189 1.00 0.00 C ATOM 1070 CG2 VAL A 75 6.490 -4.843 7.703 1.00 0.00 C ATOM 0 H VAL A 75 5.353 -7.281 8.096 1.00 0.00 H new ATOM 0 HA VAL A 75 7.595 -6.924 6.310 1.00 0.00 H new ATOM 0 HB VAL A 75 7.168 -6.201 9.202 1.00 0.00 H new ATOM 0 HG11 VAL A 75 8.964 -4.552 8.806 1.00 0.00 H new ATOM 0 HG12 VAL A 75 9.536 -6.225 8.597 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.201 -5.215 7.171 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.612 -3.960 8.330 1.00 0.00 H new ATOM 0 HG22 VAL A 75 6.718 -4.588 6.668 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.461 -5.197 7.771 1.00 0.00 H new ATOM 1080 N GLY A 76 7.698 -9.149 8.683 1.00 0.00 N ATOM 1081 CA GLY A 76 8.457 -10.273 9.203 1.00 0.00 C ATOM 1082 C GLY A 76 8.812 -11.259 8.087 1.00 0.00 C ATOM 1083 O GLY A 76 9.979 -11.598 7.901 1.00 0.00 O ATOM 0 H GLY A 76 6.761 -9.049 9.075 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.369 -9.912 9.678 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.877 -10.783 9.973 1.00 0.00 H new ATOM 1087 N LEU A 77 7.781 -11.690 7.374 1.00 0.00 N ATOM 1088 CA LEU A 77 7.969 -12.630 6.282 1.00 0.00 C ATOM 1089 C LEU A 77 8.771 -11.955 5.167 1.00 0.00 C ATOM 1090 O LEU A 77 9.854 -12.417 4.810 1.00 0.00 O ATOM 1091 CB LEU A 77 6.622 -13.189 5.818 1.00 0.00 C ATOM 1092 CG LEU A 77 5.960 -14.203 6.753 1.00 0.00 C ATOM 1093 CD1 LEU A 77 6.996 -15.158 7.349 1.00 0.00 C ATOM 1094 CD2 LEU A 77 5.142 -13.497 7.836 1.00 0.00 C ATOM 0 H LEU A 77 6.814 -11.406 7.531 1.00 0.00 H new ATOM 0 HA LEU A 77 8.548 -13.491 6.616 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.935 -12.355 5.674 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.762 -13.659 4.845 1.00 0.00 H new ATOM 0 HG LEU A 77 5.267 -14.806 6.167 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.499 -15.868 8.010 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.497 -15.699 6.546 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.732 -14.588 7.917 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.682 -14.240 8.487 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.796 -12.854 8.425 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.364 -12.893 7.369 1.00 0.00 H new ATOM 1105 N LYS A 78 8.209 -10.875 4.647 1.00 0.00 N ATOM 1106 CA LYS A 78 8.857 -10.132 3.580 1.00 0.00 C ATOM 1107 C LYS A 78 10.359 -10.052 3.860 1.00 0.00 C ATOM 1108 O LYS A 78 11.168 -10.541 3.073 1.00 0.00 O ATOM 1109 CB LYS A 78 8.193 -8.766 3.396 1.00 0.00 C ATOM 1110 CG LYS A 78 8.497 -8.189 2.012 1.00 0.00 C ATOM 1111 CD LYS A 78 9.571 -7.102 2.095 1.00 0.00 C ATOM 1112 CE LYS A 78 8.953 -5.749 2.455 1.00 0.00 C ATOM 1113 NZ LYS A 78 9.348 -5.345 3.822 1.00 0.00 N ATOM 0 H LYS A 78 7.310 -10.496 4.945 1.00 0.00 H new ATOM 0 HA LYS A 78 8.736 -10.650 2.628 1.00 0.00 H new ATOM 0 HB2 LYS A 78 7.115 -8.862 3.525 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.546 -8.080 4.165 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.831 -8.986 1.347 1.00 0.00 H new ATOM 0 HG3 LYS A 78 7.587 -7.774 1.579 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.315 -7.377 2.843 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.092 -7.026 1.140 1.00 0.00 H new ATOM 0 HE2 LYS A 78 9.276 -4.993 1.739 1.00 0.00 H new ATOM 0 HE3 LYS A 78 7.867 -5.809 2.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.568 -4.821 4.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.564 -6.192 4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.191 -4.737 3.775 1.00 0.00 H new ATOM 1123 N ILE A 79 10.687 -9.433 4.985 1.00 0.00 N ATOM 1124 CA ILE A 79 12.077 -9.283 5.379 1.00 0.00 C ATOM 1125 C ILE A 79 12.780 -10.639 5.280 1.00 0.00 C ATOM 1126 O ILE A 79 13.741 -10.790 4.527 1.00 0.00 O ATOM 1127 CB ILE A 79 12.176 -8.640 6.763 1.00 0.00 C ATOM 1128 CG1 ILE A 79 11.830 -7.151 6.701 1.00 0.00 C ATOM 1129 CG2 ILE A 79 13.552 -8.883 7.384 1.00 0.00 C ATOM 1130 CD1 ILE A 79 13.086 -6.305 6.484 1.00 0.00 C ATOM 0 H ILE A 79 10.013 -9.030 5.636 1.00 0.00 H new ATOM 0 HA ILE A 79 12.593 -8.604 4.700 1.00 0.00 H new ATOM 0 HB ILE A 79 11.442 -9.115 7.413 1.00 0.00 H new ATOM 0 HG12 ILE A 79 11.122 -6.972 5.892 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.339 -6.849 7.626 1.00 0.00 H new ATOM 0 HG21 ILE A 79 13.595 -8.415 8.368 1.00 0.00 H new ATOM 0 HG22 ILE A 79 13.722 -9.955 7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 79 14.322 -8.452 6.743 1.00 0.00 H new ATOM 0 HD11 ILE A 79 12.812 -5.251 6.444 1.00 0.00 H new ATOM 0 HD12 ILE A 79 13.781 -6.468 7.307 1.00 0.00 H new ATOM 0 HD13 ILE A 79 13.561 -6.593 5.546 1.00 0.00 H new ATOM 1141 N LEU A 80 12.273 -11.590 6.050 1.00 0.00 N ATOM 1142 CA LEU A 80 12.840 -12.928 6.060 1.00 0.00 C ATOM 1143 C LEU A 80 13.001 -13.418 4.619 1.00 0.00 C ATOM 1144 O LEU A 80 13.974 -14.098 4.296 1.00 0.00 O ATOM 1145 CB LEU A 80 12.000 -13.860 6.936 1.00 0.00 C ATOM 1146 CG LEU A 80 12.664 -14.345 8.226 1.00 0.00 C ATOM 1147 CD1 LEU A 80 11.780 -14.053 9.440 1.00 0.00 C ATOM 1148 CD2 LEU A 80 13.033 -15.827 8.129 1.00 0.00 C ATOM 0 H LEU A 80 11.475 -11.461 6.672 1.00 0.00 H new ATOM 0 HA LEU A 80 13.834 -12.918 6.508 1.00 0.00 H new ATOM 0 HB2 LEU A 80 11.076 -13.345 7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 80 11.723 -14.732 6.343 1.00 0.00 H new ATOM 0 HG LEU A 80 13.592 -13.790 8.362 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.275 -14.408 10.344 1.00 0.00 H new ATOM 0 HD12 LEU A 80 11.610 -12.979 9.517 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.824 -14.564 9.325 1.00 0.00 H new ATOM 0 HD21 LEU A 80 13.503 -16.146 9.059 1.00 0.00 H new ATOM 0 HD22 LEU A 80 12.132 -16.416 7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 80 13.727 -15.976 7.302 1.00 0.00 H new ATOM 1159 N TYR A 81 12.033 -13.053 3.791 1.00 0.00 N ATOM 1160 CA TYR A 81 12.055 -13.447 2.393 1.00 0.00 C ATOM 1161 C TYR A 81 13.232 -12.800 1.660 1.00 0.00 C ATOM 1162 O TYR A 81 13.828 -13.412 0.774 1.00 0.00 O ATOM 1163 CB TYR A 81 10.748 -12.931 1.789 1.00 0.00 C ATOM 1164 CG TYR A 81 10.195 -13.807 0.662 1.00 0.00 C ATOM 1165 CD1 TYR A 81 9.328 -14.840 0.955 1.00 0.00 C ATOM 1166 CD2 TYR A 81 10.563 -13.565 -0.645 1.00 0.00 C ATOM 1167 CE1 TYR A 81 8.807 -15.665 -0.105 1.00 0.00 C ATOM 1168 CE2 TYR A 81 10.043 -14.389 -1.705 1.00 0.00 C ATOM 1169 CZ TYR A 81 9.190 -15.398 -1.382 1.00 0.00 C ATOM 1170 OH TYR A 81 8.699 -16.177 -2.384 1.00 0.00 O ATOM 0 H TYR A 81 11.228 -12.488 4.062 1.00 0.00 H new ATOM 0 HA TYR A 81 12.160 -14.528 2.300 1.00 0.00 H new ATOM 0 HB2 TYR A 81 10.000 -12.856 2.578 1.00 0.00 H new ATOM 0 HB3 TYR A 81 10.909 -11.923 1.406 1.00 0.00 H new ATOM 0 HD1 TYR A 81 9.040 -15.030 1.978 1.00 0.00 H new ATOM 0 HD2 TYR A 81 11.242 -12.757 -0.874 1.00 0.00 H new ATOM 0 HE1 TYR A 81 8.128 -16.477 0.110 1.00 0.00 H new ATOM 0 HE2 TYR A 81 10.324 -14.210 -2.732 1.00 0.00 H new ATOM 0 HH TYR A 81 9.142 -15.944 -3.226 1.00 0.00 H new ATOM 1179 N LYS A 82 13.533 -11.572 2.057 1.00 0.00 N ATOM 1180 CA LYS A 82 14.628 -10.837 1.449 1.00 0.00 C ATOM 1181 C LYS A 82 15.951 -11.306 2.055 1.00 0.00 C ATOM 1182 O LYS A 82 16.922 -11.534 1.335 1.00 0.00 O ATOM 1183 CB LYS A 82 14.395 -9.329 1.573 1.00 0.00 C ATOM 1184 CG LYS A 82 15.212 -8.741 2.725 1.00 0.00 C ATOM 1185 CD LYS A 82 16.700 -8.689 2.371 1.00 0.00 C ATOM 1186 CE LYS A 82 17.228 -7.255 2.435 1.00 0.00 C ATOM 1187 NZ LYS A 82 18.705 -7.250 2.542 1.00 0.00 N ATOM 0 H LYS A 82 13.037 -11.068 2.792 1.00 0.00 H new ATOM 0 HA LYS A 82 14.677 -11.042 0.380 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.669 -8.837 0.640 1.00 0.00 H new ATOM 0 HB3 LYS A 82 13.335 -9.133 1.737 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.854 -7.737 2.955 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.069 -9.344 3.622 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.264 -9.319 3.059 1.00 0.00 H new ATOM 0 HD3 LYS A 82 16.854 -9.093 1.370 1.00 0.00 H new ATOM 0 HE2 LYS A 82 16.920 -6.708 1.544 1.00 0.00 H new ATOM 0 HE3 LYS A 82 16.794 -6.739 3.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.047 -6.269 2.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 18.992 -7.754 3.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 19.115 -7.724 1.712 1.00 0.00 H new ATOM 1197 N LEU A 83 15.948 -11.438 3.373 1.00 0.00 N ATOM 1198 CA LEU A 83 17.136 -11.878 4.084 1.00 0.00 C ATOM 1199 C LEU A 83 17.342 -13.375 3.850 1.00 0.00 C ATOM 1200 O LEU A 83 18.279 -13.775 3.160 1.00 0.00 O ATOM 1201 CB LEU A 83 17.048 -11.493 5.563 1.00 0.00 C ATOM 1202 CG LEU A 83 18.368 -11.500 6.338 1.00 0.00 C ATOM 1203 CD1 LEU A 83 18.665 -10.121 6.928 1.00 0.00 C ATOM 1204 CD2 LEU A 83 18.369 -12.594 7.408 1.00 0.00 C ATOM 0 H LEU A 83 15.141 -11.248 3.967 1.00 0.00 H new ATOM 0 HA LEU A 83 18.020 -11.371 3.698 1.00 0.00 H new ATOM 0 HB2 LEU A 83 16.614 -10.496 5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 83 16.357 -12.177 6.056 1.00 0.00 H new ATOM 0 HG LEU A 83 19.173 -11.731 5.640 1.00 0.00 H new ATOM 0 HD11 LEU A 83 19.608 -10.154 7.473 1.00 0.00 H new ATOM 0 HD12 LEU A 83 18.736 -9.389 6.124 1.00 0.00 H new ATOM 0 HD13 LEU A 83 17.862 -9.836 7.608 1.00 0.00 H new ATOM 0 HD21 LEU A 83 19.318 -12.578 7.944 1.00 0.00 H new ATOM 0 HD22 LEU A 83 17.553 -12.418 8.109 1.00 0.00 H new ATOM 0 HD23 LEU A 83 18.237 -13.567 6.934 1.00 0.00 H new ATOM 1215 N MET A 84 16.451 -14.162 4.436 1.00 0.00 N ATOM 1216 CA MET A 84 16.523 -15.606 4.299 1.00 0.00 C ATOM 1217 C MET A 84 16.499 -16.020 2.827 1.00 0.00 C ATOM 1218 O MET A 84 17.371 -16.758 2.370 1.00 0.00 O ATOM 1219 CB MET A 84 15.343 -16.248 5.030 1.00 0.00 C ATOM 1220 CG MET A 84 15.799 -17.444 5.866 1.00 0.00 C ATOM 1221 SD MET A 84 16.038 -18.868 4.817 1.00 0.00 S ATOM 1222 CE MET A 84 14.555 -19.787 5.199 1.00 0.00 C ATOM 0 H MET A 84 15.675 -13.826 5.007 1.00 0.00 H new ATOM 0 HA MET A 84 17.461 -15.947 4.737 1.00 0.00 H new ATOM 0 HB2 MET A 84 14.866 -15.510 5.675 1.00 0.00 H new ATOM 0 HB3 MET A 84 14.595 -16.570 4.306 1.00 0.00 H new ATOM 0 HG2 MET A 84 16.728 -17.203 6.383 1.00 0.00 H new ATOM 0 HG3 MET A 84 15.056 -17.667 6.632 1.00 0.00 H new ATOM 0 HE1 MET A 84 14.337 -20.480 4.386 1.00 0.00 H new ATOM 0 HE2 MET A 84 14.701 -20.346 6.123 1.00 0.00 H new ATOM 0 HE3 MET A 84 13.720 -19.097 5.321 1.00 0.00 H new ATOM 1230 N ASP A 85 15.490 -15.526 2.123 1.00 0.00 N ATOM 1231 CA ASP A 85 15.341 -15.833 0.711 1.00 0.00 C ATOM 1232 C ASP A 85 15.724 -17.295 0.469 1.00 0.00 C ATOM 1233 O ASP A 85 14.895 -18.191 0.616 1.00 0.00 O ATOM 1234 CB ASP A 85 16.258 -14.957 -0.145 1.00 0.00 C ATOM 1235 CG ASP A 85 16.437 -15.426 -1.590 1.00 0.00 C ATOM 1236 OD1 ASP A 85 17.444 -16.064 -1.934 1.00 0.00 O ATOM 1237 OD2 ASP A 85 15.476 -15.108 -2.390 1.00 0.00 O ATOM 0 H ASP A 85 14.768 -14.915 2.505 1.00 0.00 H new ATOM 0 HA ASP A 85 14.304 -15.646 0.434 1.00 0.00 H new ATOM 0 HB2 ASP A 85 15.860 -13.942 -0.155 1.00 0.00 H new ATOM 0 HB3 ASP A 85 17.238 -14.911 0.330 1.00 0.00 H new ATOM 1242 N ALA A 86 16.983 -17.491 0.103 1.00 0.00 N ATOM 1243 CA ALA A 86 17.486 -18.828 -0.160 1.00 0.00 C ATOM 1244 C ALA A 86 18.887 -18.731 -0.766 1.00 0.00 C ATOM 1245 O ALA A 86 19.842 -19.283 -0.221 1.00 0.00 O ATOM 1246 CB ALA A 86 16.507 -19.571 -1.072 1.00 0.00 C ATOM 0 H ALA A 86 17.669 -16.746 -0.017 1.00 0.00 H new ATOM 0 HA ALA A 86 17.566 -19.397 0.766 1.00 0.00 H new ATOM 0 HB1 ALA A 86 16.884 -20.574 -1.270 1.00 0.00 H new ATOM 0 HB2 ALA A 86 15.535 -19.638 -0.584 1.00 0.00 H new ATOM 0 HB3 ALA A 86 16.404 -19.030 -2.013 1.00 0.00 H new ATOM 1252 N ASP A 87 18.967 -18.025 -1.884 1.00 0.00 N ATOM 1253 CA ASP A 87 20.236 -17.847 -2.570 1.00 0.00 C ATOM 1254 C ASP A 87 20.779 -16.448 -2.274 1.00 0.00 C ATOM 1255 O ASP A 87 21.988 -16.264 -2.136 1.00 0.00 O ATOM 1256 CB ASP A 87 20.067 -17.978 -4.085 1.00 0.00 C ATOM 1257 CG ASP A 87 21.312 -17.640 -4.906 1.00 0.00 C ATOM 1258 OD1 ASP A 87 21.928 -18.521 -5.524 1.00 0.00 O ATOM 1259 OD2 ASP A 87 21.651 -16.396 -4.895 1.00 0.00 O ATOM 0 H ASP A 87 18.173 -17.569 -2.333 1.00 0.00 H new ATOM 0 HA ASP A 87 20.921 -18.617 -2.216 1.00 0.00 H new ATOM 0 HB2 ASP A 87 19.765 -19.000 -4.315 1.00 0.00 H new ATOM 0 HB3 ASP A 87 19.253 -17.326 -4.402 1.00 0.00 H new ATOM 1264 N GLY A 88 19.861 -15.497 -2.183 1.00 0.00 N ATOM 1265 CA GLY A 88 20.233 -14.121 -1.906 1.00 0.00 C ATOM 1266 C GLY A 88 19.930 -13.219 -3.106 1.00 0.00 C ATOM 1267 O GLY A 88 20.521 -12.149 -3.247 1.00 0.00 O ATOM 0 H GLY A 88 18.859 -15.653 -2.296 1.00 0.00 H new ATOM 0 HA2 GLY A 88 19.691 -13.763 -1.031 1.00 0.00 H new ATOM 0 HA3 GLY A 88 21.295 -14.069 -1.666 1.00 0.00 H new ATOM 1271 N ASP A 89 19.012 -13.685 -3.939 1.00 0.00 N ATOM 1272 CA ASP A 89 18.625 -12.935 -5.122 1.00 0.00 C ATOM 1273 C ASP A 89 17.304 -12.212 -4.851 1.00 0.00 C ATOM 1274 O ASP A 89 17.193 -11.009 -5.080 1.00 0.00 O ATOM 1275 CB ASP A 89 18.419 -13.863 -6.321 1.00 0.00 C ATOM 1276 CG ASP A 89 19.530 -14.892 -6.540 1.00 0.00 C ATOM 1277 OD1 ASP A 89 20.722 -14.590 -6.376 1.00 0.00 O ATOM 1278 OD2 ASP A 89 19.126 -16.062 -6.901 1.00 0.00 O ATOM 0 H ASP A 89 18.525 -14.573 -3.818 1.00 0.00 H new ATOM 0 HA ASP A 89 19.422 -12.227 -5.348 1.00 0.00 H new ATOM 0 HB2 ASP A 89 17.474 -14.392 -6.194 1.00 0.00 H new ATOM 0 HB3 ASP A 89 18.325 -13.255 -7.221 1.00 0.00 H new ATOM 1283 N GLY A 90 16.336 -12.976 -4.368 1.00 0.00 N ATOM 1284 CA GLY A 90 15.027 -12.424 -4.064 1.00 0.00 C ATOM 1285 C GLY A 90 13.927 -13.175 -4.817 1.00 0.00 C ATOM 1286 O GLY A 90 12.751 -13.070 -4.471 1.00 0.00 O ATOM 0 H GLY A 90 16.432 -13.974 -4.179 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.844 -12.483 -2.991 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.002 -11.368 -4.334 1.00 0.00 H new ATOM 1290 N LYS A 91 14.347 -13.919 -5.829 1.00 0.00 N ATOM 1291 CA LYS A 91 13.412 -14.686 -6.632 1.00 0.00 C ATOM 1292 C LYS A 91 13.428 -16.146 -6.170 1.00 0.00 C ATOM 1293 O LYS A 91 14.452 -16.820 -6.268 1.00 0.00 O ATOM 1294 CB LYS A 91 13.714 -14.511 -8.122 1.00 0.00 C ATOM 1295 CG LYS A 91 13.235 -15.722 -8.925 1.00 0.00 C ATOM 1296 CD LYS A 91 13.639 -15.600 -10.396 1.00 0.00 C ATOM 1297 CE LYS A 91 15.138 -15.847 -10.576 1.00 0.00 C ATOM 1298 NZ LYS A 91 15.615 -15.246 -11.841 1.00 0.00 N ATOM 0 H LYS A 91 15.323 -14.007 -6.111 1.00 0.00 H new ATOM 0 HA LYS A 91 12.397 -14.316 -6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.226 -13.609 -8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.786 -14.376 -8.266 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.658 -16.633 -8.502 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.151 -15.808 -8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 91 13.075 -16.317 -10.992 1.00 0.00 H new ATOM 0 HD3 LYS A 91 13.384 -14.607 -10.766 1.00 0.00 H new ATOM 0 HE2 LYS A 91 15.686 -15.422 -9.735 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.338 -16.918 -10.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.634 -15.423 -11.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 15.105 -15.671 -12.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 15.442 -14.221 -11.825 1.00 0.00 H new ATOM 1308 N LEU A 92 12.282 -16.589 -5.675 1.00 0.00 N ATOM 1309 CA LEU A 92 12.152 -17.955 -5.197 1.00 0.00 C ATOM 1310 C LEU A 92 11.366 -18.776 -6.221 1.00 0.00 C ATOM 1311 O LEU A 92 10.226 -18.446 -6.544 1.00 0.00 O ATOM 1312 CB LEU A 92 11.542 -17.975 -3.794 1.00 0.00 C ATOM 1313 CG LEU A 92 12.448 -17.490 -2.661 1.00 0.00 C ATOM 1314 CD1 LEU A 92 13.893 -17.942 -2.884 1.00 0.00 C ATOM 1315 CD2 LEU A 92 12.343 -15.975 -2.485 1.00 0.00 C ATOM 0 H LEU A 92 11.435 -16.026 -5.595 1.00 0.00 H new ATOM 0 HA LEU A 92 13.133 -18.420 -5.100 1.00 0.00 H new ATOM 0 HB2 LEU A 92 10.643 -17.359 -3.802 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.228 -18.995 -3.570 1.00 0.00 H new ATOM 0 HG LEU A 92 12.107 -17.946 -1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 92 14.517 -17.584 -2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 92 13.932 -19.031 -2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 92 14.261 -17.533 -3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.997 -15.657 -1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.643 -15.480 -3.408 1.00 0.00 H new ATOM 0 HD23 LEU A 92 11.314 -15.707 -2.248 1.00 0.00 H new ATOM 1326 N THR A 93 12.007 -19.831 -6.704 1.00 0.00 N ATOM 1327 CA THR A 93 11.382 -20.702 -7.684 1.00 0.00 C ATOM 1328 C THR A 93 10.394 -21.651 -7.003 1.00 0.00 C ATOM 1329 O THR A 93 10.391 -21.775 -5.778 1.00 0.00 O ATOM 1330 CB THR A 93 12.492 -21.427 -8.448 1.00 0.00 C ATOM 1331 OG1 THR A 93 13.228 -22.103 -7.432 1.00 0.00 O ATOM 1332 CG2 THR A 93 13.507 -20.461 -9.062 1.00 0.00 C ATOM 0 H THR A 93 12.953 -20.102 -6.434 1.00 0.00 H new ATOM 0 HA THR A 93 10.793 -20.131 -8.401 1.00 0.00 H new ATOM 0 HB THR A 93 12.051 -22.039 -9.235 1.00 0.00 H new ATOM 0 HG1 THR A 93 13.967 -22.601 -7.840 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.273 -21.027 -9.593 1.00 0.00 H new ATOM 0 HG22 THR A 93 12.999 -19.795 -9.760 1.00 0.00 H new ATOM 0 HG23 THR A 93 13.973 -19.872 -8.272 1.00 0.00 H new ATOM 1340 N LYS A 94 9.579 -22.296 -7.825 1.00 0.00 N ATOM 1341 CA LYS A 94 8.588 -23.229 -7.316 1.00 0.00 C ATOM 1342 C LYS A 94 9.168 -23.975 -6.112 1.00 0.00 C ATOM 1343 O LYS A 94 8.941 -23.585 -4.968 1.00 0.00 O ATOM 1344 CB LYS A 94 8.099 -24.152 -8.433 1.00 0.00 C ATOM 1345 CG LYS A 94 9.241 -24.512 -9.388 1.00 0.00 C ATOM 1346 CD LYS A 94 9.048 -23.843 -10.750 1.00 0.00 C ATOM 1347 CE LYS A 94 9.301 -24.833 -11.888 1.00 0.00 C ATOM 1348 NZ LYS A 94 10.720 -25.251 -11.905 1.00 0.00 N ATOM 0 H LYS A 94 9.585 -22.191 -8.840 1.00 0.00 H new ATOM 0 HA LYS A 94 7.705 -22.694 -6.966 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.681 -25.061 -8.001 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.297 -23.665 -8.987 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.192 -24.200 -8.957 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.288 -25.594 -9.513 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.035 -23.449 -10.825 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.728 -22.996 -10.843 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.660 -25.706 -11.767 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.039 -24.375 -12.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.894 -25.856 -12.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.329 -24.410 -11.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.936 -25.782 -11.037 1.00 0.00 H new ATOM 1358 N GLU A 95 9.905 -25.035 -6.411 1.00 0.00 N ATOM 1359 CA GLU A 95 10.518 -25.838 -5.367 1.00 0.00 C ATOM 1360 C GLU A 95 11.022 -24.942 -4.234 1.00 0.00 C ATOM 1361 O GLU A 95 10.843 -25.261 -3.060 1.00 0.00 O ATOM 1362 CB GLU A 95 11.652 -26.697 -5.931 1.00 0.00 C ATOM 1363 CG GLU A 95 11.378 -28.185 -5.704 1.00 0.00 C ATOM 1364 CD GLU A 95 12.657 -29.009 -5.866 1.00 0.00 C ATOM 1365 OE1 GLU A 95 13.763 -28.483 -5.670 1.00 0.00 O ATOM 1366 OE2 GLU A 95 12.473 -30.239 -6.210 1.00 0.00 O ATOM 0 H GLU A 95 10.091 -25.356 -7.361 1.00 0.00 H new ATOM 0 HA GLU A 95 9.762 -26.511 -4.963 1.00 0.00 H new ATOM 0 HB2 GLU A 95 11.764 -26.503 -6.998 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.593 -26.420 -5.456 1.00 0.00 H new ATOM 0 HG2 GLU A 95 10.969 -28.335 -4.705 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.625 -28.532 -6.412 1.00 0.00 H new ATOM 1372 N GLU A 96 11.641 -23.838 -4.625 1.00 0.00 N ATOM 1373 CA GLU A 96 12.171 -22.893 -3.657 1.00 0.00 C ATOM 1374 C GLU A 96 11.049 -22.365 -2.762 1.00 0.00 C ATOM 1375 O GLU A 96 10.955 -22.736 -1.593 1.00 0.00 O ATOM 1376 CB GLU A 96 12.904 -21.746 -4.355 1.00 0.00 C ATOM 1377 CG GLU A 96 14.417 -21.975 -4.347 1.00 0.00 C ATOM 1378 CD GLU A 96 15.173 -20.645 -4.375 1.00 0.00 C ATOM 1379 OE1 GLU A 96 15.990 -20.377 -3.482 1.00 0.00 O ATOM 1380 OE2 GLU A 96 14.886 -19.876 -5.371 1.00 0.00 O ATOM 0 H GLU A 96 11.787 -23.577 -5.600 1.00 0.00 H new ATOM 0 HA GLU A 96 12.895 -23.413 -3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 96 12.552 -21.657 -5.383 1.00 0.00 H new ATOM 0 HB3 GLU A 96 12.673 -20.805 -3.856 1.00 0.00 H new ATOM 0 HG2 GLU A 96 14.698 -22.539 -3.458 1.00 0.00 H new ATOM 0 HG3 GLU A 96 14.702 -22.578 -5.210 1.00 0.00 H new ATOM 1386 N VAL A 97 10.226 -21.506 -3.346 1.00 0.00 N ATOM 1387 CA VAL A 97 9.114 -20.922 -2.616 1.00 0.00 C ATOM 1388 C VAL A 97 8.367 -22.025 -1.864 1.00 0.00 C ATOM 1389 O VAL A 97 8.237 -21.970 -0.642 1.00 0.00 O ATOM 1390 CB VAL A 97 8.215 -20.137 -3.572 1.00 0.00 C ATOM 1391 CG1 VAL A 97 6.737 -20.351 -3.237 1.00 0.00 C ATOM 1392 CG2 VAL A 97 8.569 -18.648 -3.561 1.00 0.00 C ATOM 0 H VAL A 97 10.307 -21.201 -4.316 1.00 0.00 H new ATOM 0 HA VAL A 97 9.477 -20.211 -1.874 1.00 0.00 H new ATOM 0 HB VAL A 97 8.388 -20.515 -4.579 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.120 -19.781 -3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.495 -21.410 -3.321 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.542 -20.014 -2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 97 7.915 -18.113 -4.249 1.00 0.00 H new ATOM 0 HG22 VAL A 97 8.439 -18.251 -2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 97 9.606 -18.518 -3.871 1.00 0.00 H new ATOM 1402 N THR A 98 7.896 -23.002 -2.626 1.00 0.00 N ATOM 1403 CA THR A 98 7.166 -24.116 -2.047 1.00 0.00 C ATOM 1404 C THR A 98 7.778 -24.514 -0.702 1.00 0.00 C ATOM 1405 O THR A 98 7.066 -24.655 0.291 1.00 0.00 O ATOM 1406 CB THR A 98 7.153 -25.255 -3.069 1.00 0.00 C ATOM 1407 OG1 THR A 98 8.515 -25.375 -3.472 1.00 0.00 O ATOM 1408 CG2 THR A 98 6.414 -24.879 -4.355 1.00 0.00 C ATOM 0 H THR A 98 8.006 -23.045 -3.639 1.00 0.00 H new ATOM 0 HA THR A 98 6.133 -23.842 -1.830 1.00 0.00 H new ATOM 0 HB THR A 98 6.686 -26.135 -2.627 1.00 0.00 H new ATOM 0 HG1 THR A 98 8.797 -24.551 -3.922 1.00 0.00 H new ATOM 0 HG21 THR A 98 6.434 -25.722 -5.046 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.380 -24.627 -4.120 1.00 0.00 H new ATOM 0 HG23 THR A 98 6.901 -24.020 -4.816 1.00 0.00 H new ATOM 1416 N THR A 99 9.091 -24.684 -0.713 1.00 0.00 N ATOM 1417 CA THR A 99 9.807 -25.063 0.494 1.00 0.00 C ATOM 1418 C THR A 99 9.895 -23.876 1.456 1.00 0.00 C ATOM 1419 O THR A 99 9.521 -23.990 2.622 1.00 0.00 O ATOM 1420 CB THR A 99 11.174 -25.611 0.079 1.00 0.00 C ATOM 1421 OG1 THR A 99 11.338 -26.779 0.881 1.00 0.00 O ATOM 1422 CG2 THR A 99 12.326 -24.701 0.510 1.00 0.00 C ATOM 0 H THR A 99 9.679 -24.566 -1.538 1.00 0.00 H new ATOM 0 HA THR A 99 9.279 -25.845 1.039 1.00 0.00 H new ATOM 0 HB THR A 99 11.199 -25.741 -1.003 1.00 0.00 H new ATOM 0 HG1 THR A 99 12.199 -27.199 0.675 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.273 -25.137 0.191 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.205 -23.719 0.052 1.00 0.00 H new ATOM 0 HG23 THR A 99 12.322 -24.598 1.595 1.00 0.00 H new ATOM 1430 N PHE A 100 10.392 -22.766 0.933 1.00 0.00 N ATOM 1431 CA PHE A 100 10.533 -21.559 1.730 1.00 0.00 C ATOM 1432 C PHE A 100 9.200 -21.164 2.369 1.00 0.00 C ATOM 1433 O PHE A 100 9.060 -21.192 3.590 1.00 0.00 O ATOM 1434 CB PHE A 100 10.981 -20.446 0.782 1.00 0.00 C ATOM 1435 CG PHE A 100 11.542 -19.212 1.493 1.00 0.00 C ATOM 1436 CD1 PHE A 100 12.820 -19.219 1.960 1.00 0.00 C ATOM 1437 CD2 PHE A 100 10.764 -18.108 1.656 1.00 0.00 C ATOM 1438 CE1 PHE A 100 13.340 -18.074 2.620 1.00 0.00 C ATOM 1439 CE2 PHE A 100 11.285 -16.964 2.315 1.00 0.00 C ATOM 1440 CZ PHE A 100 12.562 -16.971 2.783 1.00 0.00 C ATOM 0 H PHE A 100 10.703 -22.676 -0.034 1.00 0.00 H new ATOM 0 HA PHE A 100 11.253 -21.725 2.531 1.00 0.00 H new ATOM 0 HB2 PHE A 100 11.741 -20.841 0.108 1.00 0.00 H new ATOM 0 HB3 PHE A 100 10.134 -20.144 0.166 1.00 0.00 H new ATOM 0 HD1 PHE A 100 13.438 -20.095 1.829 1.00 0.00 H new ATOM 0 HD2 PHE A 100 9.750 -18.102 1.284 1.00 0.00 H new ATOM 0 HE1 PHE A 100 14.354 -18.079 2.993 1.00 0.00 H new ATOM 0 HE2 PHE A 100 10.667 -16.088 2.445 1.00 0.00 H new ATOM 0 HZ PHE A 100 12.958 -16.100 3.284 1.00 0.00 H new ATOM 1449 N PHE A 101 8.254 -20.808 1.513 1.00 0.00 N ATOM 1450 CA PHE A 101 6.937 -20.408 1.978 1.00 0.00 C ATOM 1451 C PHE A 101 6.348 -21.457 2.923 1.00 0.00 C ATOM 1452 O PHE A 101 5.632 -21.117 3.865 1.00 0.00 O ATOM 1453 CB PHE A 101 6.042 -20.292 0.742 1.00 0.00 C ATOM 1454 CG PHE A 101 5.116 -19.076 0.756 1.00 0.00 C ATOM 1455 CD1 PHE A 101 4.709 -18.544 1.940 1.00 0.00 C ATOM 1456 CD2 PHE A 101 4.699 -18.525 -0.416 1.00 0.00 C ATOM 1457 CE1 PHE A 101 3.849 -17.413 1.952 1.00 0.00 C ATOM 1458 CE2 PHE A 101 3.839 -17.395 -0.403 1.00 0.00 C ATOM 1459 CZ PHE A 101 3.433 -16.863 0.781 1.00 0.00 C ATOM 0 H PHE A 101 8.373 -20.788 0.500 1.00 0.00 H new ATOM 0 HA PHE A 101 7.004 -19.465 2.521 1.00 0.00 H new ATOM 0 HB2 PHE A 101 6.672 -20.246 -0.147 1.00 0.00 H new ATOM 0 HB3 PHE A 101 5.437 -21.195 0.658 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.039 -18.981 2.871 1.00 0.00 H new ATOM 0 HD2 PHE A 101 5.022 -18.947 -1.356 1.00 0.00 H new ATOM 0 HE1 PHE A 101 3.526 -16.990 2.892 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.507 -16.958 -1.333 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.780 -16.003 0.791 1.00 0.00 H new ATOM 1468 N LYS A 102 6.669 -22.711 2.639 1.00 0.00 N ATOM 1469 CA LYS A 102 6.181 -23.811 3.452 1.00 0.00 C ATOM 1470 C LYS A 102 6.764 -23.696 4.863 1.00 0.00 C ATOM 1471 O LYS A 102 6.024 -23.697 5.845 1.00 0.00 O ATOM 1472 CB LYS A 102 6.474 -25.150 2.773 1.00 0.00 C ATOM 1473 CG LYS A 102 6.328 -26.310 3.762 1.00 0.00 C ATOM 1474 CD LYS A 102 7.697 -26.855 4.173 1.00 0.00 C ATOM 1475 CE LYS A 102 7.732 -28.381 4.071 1.00 0.00 C ATOM 1476 NZ LYS A 102 8.034 -28.801 2.685 1.00 0.00 N ATOM 0 H LYS A 102 7.261 -22.989 1.857 1.00 0.00 H new ATOM 0 HA LYS A 102 5.097 -23.760 3.550 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.792 -25.294 1.935 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.484 -25.141 2.364 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.786 -25.973 4.646 1.00 0.00 H new ATOM 0 HG3 LYS A 102 5.736 -27.106 3.310 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.470 -26.426 3.535 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.922 -26.550 5.195 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.485 -28.780 4.750 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.772 -28.794 4.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.054 -29.840 2.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.300 -28.437 2.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.960 -28.423 2.402 1.00 0.00 H new ATOM 1486 N LYS A 103 8.084 -23.598 4.916 1.00 0.00 N ATOM 1487 CA LYS A 103 8.774 -23.481 6.189 1.00 0.00 C ATOM 1488 C LYS A 103 8.270 -22.240 6.927 1.00 0.00 C ATOM 1489 O LYS A 103 8.242 -22.212 8.156 1.00 0.00 O ATOM 1490 CB LYS A 103 10.289 -23.500 5.980 1.00 0.00 C ATOM 1491 CG LYS A 103 10.961 -24.497 6.927 1.00 0.00 C ATOM 1492 CD LYS A 103 12.314 -23.971 7.408 1.00 0.00 C ATOM 1493 CE LYS A 103 13.429 -24.350 6.433 1.00 0.00 C ATOM 1494 NZ LYS A 103 14.193 -23.149 6.025 1.00 0.00 N ATOM 0 H LYS A 103 8.694 -23.597 4.098 1.00 0.00 H new ATOM 0 HA LYS A 103 8.552 -24.340 6.823 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.514 -23.766 4.947 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.695 -22.503 6.148 1.00 0.00 H new ATOM 0 HG2 LYS A 103 10.314 -24.683 7.784 1.00 0.00 H new ATOM 0 HG3 LYS A 103 11.098 -25.451 6.418 1.00 0.00 H new ATOM 0 HD2 LYS A 103 12.270 -22.887 7.512 1.00 0.00 H new ATOM 0 HD3 LYS A 103 12.536 -24.377 8.395 1.00 0.00 H new ATOM 0 HE2 LYS A 103 14.098 -25.072 6.900 1.00 0.00 H new ATOM 0 HE3 LYS A 103 13.002 -24.833 5.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 14.946 -23.425 5.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 13.554 -22.472 5.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 14.616 -22.705 6.865 1.00 0.00 H new ATOM 1504 N PHE A 104 7.884 -21.242 6.145 1.00 0.00 N ATOM 1505 CA PHE A 104 7.382 -20.000 6.708 1.00 0.00 C ATOM 1506 C PHE A 104 6.033 -20.215 7.396 1.00 0.00 C ATOM 1507 O PHE A 104 5.599 -19.385 8.193 1.00 0.00 O ATOM 1508 CB PHE A 104 7.198 -19.024 5.544 1.00 0.00 C ATOM 1509 CG PHE A 104 8.401 -18.111 5.301 1.00 0.00 C ATOM 1510 CD1 PHE A 104 9.655 -18.542 5.606 1.00 0.00 C ATOM 1511 CD2 PHE A 104 8.218 -16.868 4.781 1.00 0.00 C ATOM 1512 CE1 PHE A 104 10.772 -17.694 5.380 1.00 0.00 C ATOM 1513 CE2 PHE A 104 9.335 -16.020 4.555 1.00 0.00 C ATOM 1514 CZ PHE A 104 10.587 -16.452 4.859 1.00 0.00 C ATOM 0 H PHE A 104 7.909 -21.269 5.126 1.00 0.00 H new ATOM 0 HA PHE A 104 8.082 -19.619 7.452 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.997 -19.592 4.636 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.320 -18.407 5.736 1.00 0.00 H new ATOM 0 HD1 PHE A 104 9.801 -19.529 6.020 1.00 0.00 H new ATOM 0 HD2 PHE A 104 7.223 -16.525 4.540 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.768 -18.036 5.622 1.00 0.00 H new ATOM 0 HE2 PHE A 104 9.189 -15.033 4.142 1.00 0.00 H new ATOM 0 HZ PHE A 104 11.436 -15.808 4.686 1.00 0.00 H new ATOM 1523 N GLY A 105 5.407 -21.335 7.063 1.00 0.00 N ATOM 1524 CA GLY A 105 4.116 -21.670 7.639 1.00 0.00 C ATOM 1525 C GLY A 105 2.988 -21.429 6.635 1.00 0.00 C ATOM 1526 O GLY A 105 1.891 -21.020 7.013 1.00 0.00 O ATOM 0 H GLY A 105 5.770 -22.021 6.402 1.00 0.00 H new ATOM 0 HA2 GLY A 105 4.113 -22.714 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.946 -21.070 8.533 1.00 0.00 H new ATOM 1530 N TYR A 106 3.296 -21.690 5.373 1.00 0.00 N ATOM 1531 CA TYR A 106 2.322 -21.507 4.310 1.00 0.00 C ATOM 1532 C TYR A 106 2.343 -22.686 3.337 1.00 0.00 C ATOM 1533 O TYR A 106 2.775 -22.545 2.193 1.00 0.00 O ATOM 1534 CB TYR A 106 2.745 -20.239 3.566 1.00 0.00 C ATOM 1535 CG TYR A 106 2.885 -19.007 4.463 1.00 0.00 C ATOM 1536 CD1 TYR A 106 3.913 -18.936 5.380 1.00 0.00 C ATOM 1537 CD2 TYR A 106 1.983 -17.969 4.355 1.00 0.00 C ATOM 1538 CE1 TYR A 106 4.045 -17.776 6.224 1.00 0.00 C ATOM 1539 CE2 TYR A 106 2.115 -16.810 5.199 1.00 0.00 C ATOM 1540 CZ TYR A 106 3.139 -16.771 6.092 1.00 0.00 C ATOM 1541 OH TYR A 106 3.264 -15.676 6.890 1.00 0.00 O ATOM 0 H TYR A 106 4.207 -22.027 5.062 1.00 0.00 H new ATOM 0 HA TYR A 106 1.315 -21.435 4.720 1.00 0.00 H new ATOM 0 HB2 TYR A 106 3.697 -20.423 3.068 1.00 0.00 H new ATOM 0 HB3 TYR A 106 2.013 -20.027 2.786 1.00 0.00 H new ATOM 0 HD1 TYR A 106 4.618 -19.749 5.465 1.00 0.00 H new ATOM 0 HD2 TYR A 106 1.178 -18.026 3.637 1.00 0.00 H new ATOM 0 HE1 TYR A 106 4.846 -17.706 6.945 1.00 0.00 H new ATOM 0 HE2 TYR A 106 1.416 -15.990 5.124 1.00 0.00 H new ATOM 0 HH TYR A 106 2.548 -15.039 6.685 1.00 0.00 H new ATOM 1550 N GLU A 107 1.871 -23.825 3.826 1.00 0.00 N ATOM 1551 CA GLU A 107 1.830 -25.028 3.013 1.00 0.00 C ATOM 1552 C GLU A 107 0.588 -25.025 2.122 1.00 0.00 C ATOM 1553 O GLU A 107 0.664 -25.365 0.942 1.00 0.00 O ATOM 1554 CB GLU A 107 1.874 -26.283 3.889 1.00 0.00 C ATOM 1555 CG GLU A 107 2.730 -27.373 3.242 1.00 0.00 C ATOM 1556 CD GLU A 107 1.859 -28.520 2.726 1.00 0.00 C ATOM 1557 OE1 GLU A 107 1.966 -29.651 3.221 1.00 0.00 O ATOM 1558 OE2 GLU A 107 1.047 -28.202 1.774 1.00 0.00 O ATOM 0 H GLU A 107 1.514 -23.939 4.775 1.00 0.00 H new ATOM 0 HA GLU A 107 2.712 -25.040 2.372 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.278 -26.032 4.870 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.862 -26.656 4.047 1.00 0.00 H new ATOM 0 HG2 GLU A 107 3.304 -26.949 2.418 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.448 -27.755 3.968 1.00 0.00 H new ATOM 1564 N LYS A 108 -0.530 -24.636 2.719 1.00 0.00 N ATOM 1565 CA LYS A 108 -1.787 -24.583 1.993 1.00 0.00 C ATOM 1566 C LYS A 108 -1.702 -23.506 0.911 1.00 0.00 C ATOM 1567 O LYS A 108 -2.520 -23.478 -0.007 1.00 0.00 O ATOM 1568 CB LYS A 108 -2.957 -24.392 2.962 1.00 0.00 C ATOM 1569 CG LYS A 108 -4.022 -25.470 2.756 1.00 0.00 C ATOM 1570 CD LYS A 108 -3.563 -26.811 3.333 1.00 0.00 C ATOM 1571 CE LYS A 108 -3.707 -27.931 2.300 1.00 0.00 C ATOM 1572 NZ LYS A 108 -4.908 -28.747 2.584 1.00 0.00 N ATOM 0 H LYS A 108 -0.591 -24.355 3.698 1.00 0.00 H new ATOM 0 HA LYS A 108 -1.974 -25.529 1.486 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -2.593 -24.427 3.989 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -3.399 -23.407 2.814 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.952 -25.163 3.234 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -4.232 -25.580 1.692 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.523 -26.737 3.652 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -4.152 -27.050 4.219 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -3.779 -27.504 1.300 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -2.819 -28.563 2.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -4.991 -29.502 1.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -4.825 -29.170 3.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -5.754 -28.144 2.548 1.00 0.00 H new ATOM 1582 N VAL A 109 -0.706 -22.645 1.055 1.00 0.00 N ATOM 1583 CA VAL A 109 -0.504 -21.568 0.101 1.00 0.00 C ATOM 1584 C VAL A 109 0.216 -22.114 -1.133 1.00 0.00 C ATOM 1585 O VAL A 109 -0.141 -21.782 -2.262 1.00 0.00 O ATOM 1586 CB VAL A 109 0.246 -20.412 0.767 1.00 0.00 C ATOM 1587 CG1 VAL A 109 0.164 -19.142 -0.082 1.00 0.00 C ATOM 1588 CG2 VAL A 109 -0.279 -20.160 2.182 1.00 0.00 C ATOM 0 H VAL A 109 -0.030 -22.671 1.818 1.00 0.00 H new ATOM 0 HA VAL A 109 -1.462 -21.168 -0.231 1.00 0.00 H new ATOM 0 HB VAL A 109 1.296 -20.696 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.705 -18.337 0.415 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.608 -19.329 -1.060 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.880 -18.855 -0.207 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.271 -19.334 2.632 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -1.339 -19.909 2.138 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.144 -21.058 2.785 1.00 0.00 H new ATOM 1598 N VAL A 110 1.217 -22.943 -0.877 1.00 0.00 N ATOM 1599 CA VAL A 110 1.990 -23.539 -1.953 1.00 0.00 C ATOM 1600 C VAL A 110 1.049 -23.927 -3.096 1.00 0.00 C ATOM 1601 O VAL A 110 1.424 -23.849 -4.266 1.00 0.00 O ATOM 1602 CB VAL A 110 2.803 -24.722 -1.421 1.00 0.00 C ATOM 1603 CG1 VAL A 110 3.630 -25.364 -2.537 1.00 0.00 C ATOM 1604 CG2 VAL A 110 3.693 -24.294 -0.254 1.00 0.00 C ATOM 0 H VAL A 110 1.511 -23.216 0.061 1.00 0.00 H new ATOM 0 HA VAL A 110 2.707 -22.821 -2.351 1.00 0.00 H new ATOM 0 HB VAL A 110 2.103 -25.471 -1.050 1.00 0.00 H new ATOM 0 HG11 VAL A 110 4.198 -26.202 -2.133 1.00 0.00 H new ATOM 0 HG12 VAL A 110 2.965 -25.722 -3.323 1.00 0.00 H new ATOM 0 HG13 VAL A 110 4.317 -24.626 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 110 4.260 -25.153 0.105 1.00 0.00 H new ATOM 0 HG22 VAL A 110 4.382 -23.518 -0.588 1.00 0.00 H new ATOM 0 HG23 VAL A 110 3.072 -23.905 0.553 1.00 0.00 H new ATOM 1614 N ASP A 111 -0.153 -24.335 -2.719 1.00 0.00 N ATOM 1615 CA ASP A 111 -1.150 -24.734 -3.698 1.00 0.00 C ATOM 1616 C ASP A 111 -1.523 -23.526 -4.560 1.00 0.00 C ATOM 1617 O ASP A 111 -1.374 -23.560 -5.781 1.00 0.00 O ATOM 1618 CB ASP A 111 -2.422 -25.239 -3.015 1.00 0.00 C ATOM 1619 CG ASP A 111 -3.181 -26.324 -3.782 1.00 0.00 C ATOM 1620 OD1 ASP A 111 -4.244 -26.068 -4.365 1.00 0.00 O ATOM 1621 OD2 ASP A 111 -2.630 -27.490 -3.765 1.00 0.00 O ATOM 0 H ASP A 111 -0.460 -24.398 -1.748 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.726 -25.534 -4.305 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.158 -25.628 -2.031 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -3.091 -24.393 -2.855 1.00 0.00 H new ATOM 1626 N GLN A 112 -2.002 -22.487 -3.891 1.00 0.00 N ATOM 1627 CA GLN A 112 -2.399 -21.272 -4.581 1.00 0.00 C ATOM 1628 C GLN A 112 -1.176 -20.584 -5.190 1.00 0.00 C ATOM 1629 O GLN A 112 -1.288 -19.886 -6.197 1.00 0.00 O ATOM 1630 CB GLN A 112 -3.147 -20.326 -3.639 1.00 0.00 C ATOM 1631 CG GLN A 112 -4.657 -20.406 -3.868 1.00 0.00 C ATOM 1632 CD GLN A 112 -5.175 -21.824 -3.615 1.00 0.00 C ATOM 1633 OE1 GLN A 112 -5.129 -22.341 -2.511 1.00 0.00 O ATOM 1634 NE2 GLN A 112 -5.671 -22.419 -4.697 1.00 0.00 N ATOM 0 H GLN A 112 -2.124 -22.462 -2.879 1.00 0.00 H new ATOM 0 HA GLN A 112 -3.080 -21.542 -5.388 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -2.918 -20.581 -2.604 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -2.805 -19.303 -3.798 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -5.167 -19.705 -3.207 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.890 -20.107 -4.890 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -5.679 -21.928 -5.591 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -6.044 -23.366 -4.632 1.00 0.00 H new ATOM 1641 N ILE A 113 -0.034 -20.806 -4.555 1.00 0.00 N ATOM 1642 CA ILE A 113 1.209 -20.217 -5.023 1.00 0.00 C ATOM 1643 C ILE A 113 1.612 -20.868 -6.346 1.00 0.00 C ATOM 1644 O ILE A 113 1.913 -20.176 -7.318 1.00 0.00 O ATOM 1645 CB ILE A 113 2.287 -20.308 -3.939 1.00 0.00 C ATOM 1646 CG1 ILE A 113 1.845 -19.584 -2.665 1.00 0.00 C ATOM 1647 CG2 ILE A 113 3.631 -19.792 -4.456 1.00 0.00 C ATOM 1648 CD1 ILE A 113 1.988 -18.068 -2.819 1.00 0.00 C ATOM 0 H ILE A 113 0.056 -21.386 -3.721 1.00 0.00 H new ATOM 0 HA ILE A 113 1.075 -19.153 -5.219 1.00 0.00 H new ATOM 0 HB ILE A 113 2.425 -21.358 -3.681 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.808 -19.834 -2.441 1.00 0.00 H new ATOM 0 HG13 ILE A 113 2.445 -19.926 -1.821 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.378 -19.868 -3.666 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.945 -20.390 -5.312 1.00 0.00 H new ATOM 0 HG23 ILE A 113 3.528 -18.750 -4.759 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.667 -17.577 -1.900 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.030 -17.819 -3.019 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.368 -17.726 -3.648 1.00 0.00 H new ATOM 1659 N MET A 114 1.604 -22.193 -6.344 1.00 0.00 N ATOM 1660 CA MET A 114 1.966 -22.947 -7.532 1.00 0.00 C ATOM 1661 C MET A 114 0.979 -22.680 -8.671 1.00 0.00 C ATOM 1662 O MET A 114 1.365 -22.654 -9.838 1.00 0.00 O ATOM 1663 CB MET A 114 1.976 -24.442 -7.206 1.00 0.00 C ATOM 1664 CG MET A 114 2.974 -25.189 -8.092 1.00 0.00 C ATOM 1665 SD MET A 114 2.140 -26.484 -8.994 1.00 0.00 S ATOM 1666 CE MET A 114 3.178 -26.571 -10.443 1.00 0.00 C ATOM 0 H MET A 114 1.352 -22.764 -5.537 1.00 0.00 H new ATOM 0 HA MET A 114 2.958 -22.630 -7.852 1.00 0.00 H new ATOM 0 HB2 MET A 114 2.235 -24.588 -6.157 1.00 0.00 H new ATOM 0 HB3 MET A 114 0.978 -24.856 -7.348 1.00 0.00 H new ATOM 0 HG2 MET A 114 3.445 -24.495 -8.788 1.00 0.00 H new ATOM 0 HG3 MET A 114 3.769 -25.615 -7.480 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.797 -27.337 -11.118 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.176 -25.606 -10.950 1.00 0.00 H new ATOM 0 HE3 MET A 114 4.196 -26.823 -10.147 1.00 0.00 H new ATOM 1674 N LYS A 115 -0.275 -22.486 -8.291 1.00 0.00 N ATOM 1675 CA LYS A 115 -1.320 -22.221 -9.266 1.00 0.00 C ATOM 1676 C LYS A 115 -1.359 -20.722 -9.572 1.00 0.00 C ATOM 1677 O LYS A 115 -2.022 -20.294 -10.515 1.00 0.00 O ATOM 1678 CB LYS A 115 -2.658 -22.785 -8.784 1.00 0.00 C ATOM 1679 CG LYS A 115 -3.517 -23.243 -9.965 1.00 0.00 C ATOM 1680 CD LYS A 115 -3.377 -24.750 -10.192 1.00 0.00 C ATOM 1681 CE LYS A 115 -2.545 -25.041 -11.442 1.00 0.00 C ATOM 1682 NZ LYS A 115 -3.010 -26.284 -12.097 1.00 0.00 N ATOM 0 H LYS A 115 -0.591 -22.507 -7.322 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.104 -22.732 -10.204 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.482 -23.624 -8.111 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.193 -22.025 -8.214 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -4.562 -22.995 -9.777 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.219 -22.707 -10.866 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.907 -25.210 -9.323 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.365 -25.199 -10.296 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -2.620 -24.206 -12.139 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -1.493 -25.137 -11.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.434 -26.467 -12.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.916 -27.081 -11.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -4.007 -26.179 -12.372 1.00 0.00 H new ATOM 1692 N ALA A 116 -0.638 -19.966 -8.757 1.00 0.00 N ATOM 1693 CA ALA A 116 -0.581 -18.524 -8.928 1.00 0.00 C ATOM 1694 C ALA A 116 0.315 -18.192 -10.122 1.00 0.00 C ATOM 1695 O ALA A 116 -0.098 -17.474 -11.033 1.00 0.00 O ATOM 1696 CB ALA A 116 -0.090 -17.875 -7.633 1.00 0.00 C ATOM 0 H ALA A 116 -0.088 -20.325 -7.976 1.00 0.00 H new ATOM 0 HA ALA A 116 -1.573 -18.123 -9.138 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -0.047 -16.793 -7.761 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -0.776 -18.117 -6.822 1.00 0.00 H new ATOM 0 HB3 ALA A 116 0.904 -18.251 -7.392 1.00 0.00 H new ATOM 1702 N ASP A 117 1.526 -18.729 -10.081 1.00 0.00 N ATOM 1703 CA ASP A 117 2.484 -18.499 -11.149 1.00 0.00 C ATOM 1704 C ASP A 117 2.360 -19.614 -12.189 1.00 0.00 C ATOM 1705 O ASP A 117 2.067 -20.758 -11.846 1.00 0.00 O ATOM 1706 CB ASP A 117 3.917 -18.508 -10.614 1.00 0.00 C ATOM 1707 CG ASP A 117 5.005 -18.347 -11.677 1.00 0.00 C ATOM 1708 OD1 ASP A 117 5.164 -19.200 -12.563 1.00 0.00 O ATOM 1709 OD2 ASP A 117 5.719 -17.278 -11.570 1.00 0.00 O ATOM 0 H ASP A 117 1.866 -19.323 -9.324 1.00 0.00 H new ATOM 0 HA ASP A 117 2.270 -17.526 -11.590 1.00 0.00 H new ATOM 0 HB2 ASP A 117 4.021 -17.705 -9.884 1.00 0.00 H new ATOM 0 HB3 ASP A 117 4.085 -19.445 -10.083 1.00 0.00 H new ATOM 1714 N ALA A 118 2.589 -19.240 -13.439 1.00 0.00 N ATOM 1715 CA ALA A 118 2.506 -20.194 -14.532 1.00 0.00 C ATOM 1716 C ALA A 118 2.410 -19.437 -15.859 1.00 0.00 C ATOM 1717 O ALA A 118 1.648 -19.822 -16.743 1.00 0.00 O ATOM 1718 CB ALA A 118 1.314 -21.128 -14.307 1.00 0.00 C ATOM 0 H ALA A 118 2.832 -18.290 -13.719 1.00 0.00 H new ATOM 0 HA ALA A 118 3.403 -20.813 -14.569 1.00 0.00 H new ATOM 0 HB1 ALA A 118 1.252 -21.843 -15.127 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.444 -21.664 -13.367 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.396 -20.542 -14.266 1.00 0.00 H new ATOM 1724 N ASN A 119 3.195 -18.374 -15.954 1.00 0.00 N ATOM 1725 CA ASN A 119 3.209 -17.560 -17.158 1.00 0.00 C ATOM 1726 C ASN A 119 4.559 -17.718 -17.860 1.00 0.00 C ATOM 1727 O ASN A 119 4.612 -17.937 -19.069 1.00 0.00 O ATOM 1728 CB ASN A 119 3.021 -16.078 -16.822 1.00 0.00 C ATOM 1729 CG ASN A 119 3.370 -15.799 -15.360 1.00 0.00 C ATOM 1730 OD1 ASN A 119 4.481 -16.021 -14.906 1.00 0.00 O ATOM 1731 ND2 ASN A 119 2.363 -15.301 -14.648 1.00 0.00 N ATOM 0 H ASN A 119 3.826 -18.057 -15.217 1.00 0.00 H new ATOM 0 HA ASN A 119 2.392 -17.892 -17.799 1.00 0.00 H new ATOM 0 HB2 ASN A 119 3.651 -15.471 -17.472 1.00 0.00 H new ATOM 0 HB3 ASN A 119 1.989 -15.786 -17.015 1.00 0.00 H new ATOM 0 HD21 ASN A 119 2.496 -15.081 -13.661 1.00 0.00 H new ATOM 0 HD22 ASN A 119 1.458 -15.139 -15.089 1.00 0.00 H new ATOM 1737 N GLY A 120 5.617 -17.601 -17.072 1.00 0.00 N ATOM 1738 CA GLY A 120 6.964 -17.728 -17.603 1.00 0.00 C ATOM 1739 C GLY A 120 8.007 -17.360 -16.546 1.00 0.00 C ATOM 1740 O GLY A 120 9.010 -16.718 -16.856 1.00 0.00 O ATOM 0 H GLY A 120 5.569 -17.420 -16.069 1.00 0.00 H new ATOM 0 HA2 GLY A 120 7.130 -18.750 -17.942 1.00 0.00 H new ATOM 0 HA3 GLY A 120 7.078 -17.081 -18.473 1.00 0.00 H new ATOM 1744 N ASP A 121 7.735 -17.781 -15.320 1.00 0.00 N ATOM 1745 CA ASP A 121 8.638 -17.503 -14.216 1.00 0.00 C ATOM 1746 C ASP A 121 8.763 -18.751 -13.339 1.00 0.00 C ATOM 1747 O ASP A 121 9.870 -19.182 -13.021 1.00 0.00 O ATOM 1748 CB ASP A 121 8.107 -16.363 -13.344 1.00 0.00 C ATOM 1749 CG ASP A 121 8.544 -14.962 -13.775 1.00 0.00 C ATOM 1750 OD1 ASP A 121 9.428 -14.804 -14.629 1.00 0.00 O ATOM 1751 OD2 ASP A 121 7.928 -13.994 -13.186 1.00 0.00 O ATOM 0 H ASP A 121 6.902 -18.313 -15.066 1.00 0.00 H new ATOM 0 HA ASP A 121 9.604 -17.218 -14.633 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.018 -16.403 -13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 121 8.433 -16.529 -12.317 1.00 0.00 H new ATOM 1756 N GLY A 122 7.612 -19.294 -12.972 1.00 0.00 N ATOM 1757 CA GLY A 122 7.579 -20.484 -12.137 1.00 0.00 C ATOM 1758 C GLY A 122 8.145 -20.193 -10.746 1.00 0.00 C ATOM 1759 O GLY A 122 8.335 -21.108 -9.945 1.00 0.00 O ATOM 0 H GLY A 122 6.696 -18.933 -13.237 1.00 0.00 H new ATOM 0 HA2 GLY A 122 6.553 -20.842 -12.049 1.00 0.00 H new ATOM 0 HA3 GLY A 122 8.155 -21.280 -12.609 1.00 0.00 H new ATOM 1763 N TYR A 123 8.398 -18.917 -10.500 1.00 0.00 N ATOM 1764 CA TYR A 123 8.939 -18.494 -9.219 1.00 0.00 C ATOM 1765 C TYR A 123 8.121 -17.341 -8.633 1.00 0.00 C ATOM 1766 O TYR A 123 7.154 -16.888 -9.243 1.00 0.00 O ATOM 1767 CB TYR A 123 10.360 -18.004 -9.502 1.00 0.00 C ATOM 1768 CG TYR A 123 10.423 -16.735 -10.353 1.00 0.00 C ATOM 1769 CD1 TYR A 123 10.021 -15.526 -9.820 1.00 0.00 C ATOM 1770 CD2 TYR A 123 10.882 -16.798 -11.653 1.00 0.00 C ATOM 1771 CE1 TYR A 123 10.080 -14.331 -10.622 1.00 0.00 C ATOM 1772 CE2 TYR A 123 10.941 -15.602 -12.454 1.00 0.00 C ATOM 1773 CZ TYR A 123 10.537 -14.427 -11.899 1.00 0.00 C ATOM 1774 OH TYR A 123 10.593 -13.299 -12.655 1.00 0.00 O ATOM 0 H TYR A 123 8.239 -18.161 -11.166 1.00 0.00 H new ATOM 0 HA TYR A 123 8.916 -19.315 -8.502 1.00 0.00 H new ATOM 0 HB2 TYR A 123 10.865 -17.819 -8.554 1.00 0.00 H new ATOM 0 HB3 TYR A 123 10.912 -18.796 -10.008 1.00 0.00 H new ATOM 0 HD1 TYR A 123 9.663 -15.477 -8.802 1.00 0.00 H new ATOM 0 HD2 TYR A 123 11.197 -17.743 -12.070 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.768 -13.379 -10.218 1.00 0.00 H new ATOM 0 HE2 TYR A 123 11.298 -15.637 -13.473 1.00 0.00 H new ATOM 0 HH TYR A 123 10.529 -13.537 -13.603 1.00 0.00 H new ATOM 1783 N ILE A 124 8.541 -16.898 -7.457 1.00 0.00 N ATOM 1784 CA ILE A 124 7.860 -15.807 -6.781 1.00 0.00 C ATOM 1785 C ILE A 124 8.882 -14.984 -5.994 1.00 0.00 C ATOM 1786 O ILE A 124 9.559 -15.508 -5.111 1.00 0.00 O ATOM 1787 CB ILE A 124 6.710 -16.341 -5.925 1.00 0.00 C ATOM 1788 CG1 ILE A 124 5.412 -16.411 -6.733 1.00 0.00 C ATOM 1789 CG2 ILE A 124 6.546 -15.512 -4.649 1.00 0.00 C ATOM 1790 CD1 ILE A 124 4.244 -16.863 -5.856 1.00 0.00 C ATOM 0 H ILE A 124 9.345 -17.275 -6.955 1.00 0.00 H new ATOM 0 HA ILE A 124 7.401 -15.136 -7.507 1.00 0.00 H new ATOM 0 HB ILE A 124 6.955 -17.358 -5.620 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.193 -15.433 -7.161 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.535 -17.103 -7.566 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.722 -15.912 -4.058 1.00 0.00 H new ATOM 0 HG22 ILE A 124 7.466 -15.556 -4.066 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.333 -14.476 -4.913 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.334 -16.904 -6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.456 -17.852 -5.449 1.00 0.00 H new ATOM 0 HD13 ILE A 124 4.108 -16.156 -5.038 1.00 0.00 H new ATOM 1801 N THR A 125 8.961 -13.708 -6.343 1.00 0.00 N ATOM 1802 CA THR A 125 9.889 -12.807 -5.680 1.00 0.00 C ATOM 1803 C THR A 125 9.230 -12.171 -4.454 1.00 0.00 C ATOM 1804 O THR A 125 8.008 -12.194 -4.319 1.00 0.00 O ATOM 1805 CB THR A 125 10.372 -11.784 -6.710 1.00 0.00 C ATOM 1806 OG1 THR A 125 9.373 -10.769 -6.686 1.00 0.00 O ATOM 1807 CG2 THR A 125 10.322 -12.324 -8.140 1.00 0.00 C ATOM 0 H THR A 125 8.398 -13.277 -7.076 1.00 0.00 H new ATOM 0 HA THR A 125 10.759 -13.343 -5.301 1.00 0.00 H new ATOM 0 HB THR A 125 11.392 -11.484 -6.472 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.608 -10.064 -7.324 1.00 0.00 H new ATOM 0 HG21 THR A 125 10.675 -11.558 -8.831 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.959 -13.205 -8.219 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.296 -12.594 -8.391 1.00 0.00 H new ATOM 1815 N LEU A 126 10.070 -11.617 -3.592 1.00 0.00 N ATOM 1816 CA LEU A 126 9.585 -10.976 -2.381 1.00 0.00 C ATOM 1817 C LEU A 126 8.356 -10.128 -2.715 1.00 0.00 C ATOM 1818 O LEU A 126 7.423 -10.041 -1.919 1.00 0.00 O ATOM 1819 CB LEU A 126 10.709 -10.188 -1.705 1.00 0.00 C ATOM 1820 CG LEU A 126 11.253 -8.990 -2.486 1.00 0.00 C ATOM 1821 CD1 LEU A 126 10.558 -7.696 -2.061 1.00 0.00 C ATOM 1822 CD2 LEU A 126 12.775 -8.895 -2.353 1.00 0.00 C ATOM 0 H LEU A 126 11.083 -11.599 -3.708 1.00 0.00 H new ATOM 0 HA LEU A 126 9.269 -11.725 -1.654 1.00 0.00 H new ATOM 0 HB2 LEU A 126 10.347 -9.833 -0.740 1.00 0.00 H new ATOM 0 HB3 LEU A 126 11.535 -10.871 -1.505 1.00 0.00 H new ATOM 0 HG LEU A 126 11.031 -9.141 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 126 10.964 -6.861 -2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 126 9.488 -7.779 -2.250 1.00 0.00 H new ATOM 0 HD13 LEU A 126 10.726 -7.525 -0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.137 -8.035 -2.917 1.00 0.00 H new ATOM 0 HD22 LEU A 126 13.042 -8.778 -1.303 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.232 -9.804 -2.744 1.00 0.00 H new ATOM 1833 N GLU A 127 8.395 -9.527 -3.895 1.00 0.00 N ATOM 1834 CA GLU A 127 7.295 -8.689 -4.345 1.00 0.00 C ATOM 1835 C GLU A 127 6.065 -9.546 -4.648 1.00 0.00 C ATOM 1836 O GLU A 127 4.948 -9.188 -4.279 1.00 0.00 O ATOM 1837 CB GLU A 127 7.701 -7.861 -5.566 1.00 0.00 C ATOM 1838 CG GLU A 127 6.531 -7.012 -6.065 1.00 0.00 C ATOM 1839 CD GLU A 127 6.502 -6.962 -7.595 1.00 0.00 C ATOM 1840 OE1 GLU A 127 7.193 -7.753 -8.253 1.00 0.00 O ATOM 1841 OE2 GLU A 127 5.727 -6.061 -8.097 1.00 0.00 O ATOM 0 H GLU A 127 9.170 -9.603 -4.553 1.00 0.00 H new ATOM 0 HA GLU A 127 7.041 -7.994 -3.544 1.00 0.00 H new ATOM 0 HB2 GLU A 127 8.540 -7.215 -5.309 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.040 -8.523 -6.363 1.00 0.00 H new ATOM 0 HG2 GLU A 127 5.593 -7.425 -5.693 1.00 0.00 H new ATOM 0 HG3 GLU A 127 6.615 -6.001 -5.666 1.00 0.00 H new ATOM 1847 N GLU A 128 6.311 -10.664 -5.316 1.00 0.00 N ATOM 1848 CA GLU A 128 5.237 -11.576 -5.673 1.00 0.00 C ATOM 1849 C GLU A 128 4.551 -12.107 -4.412 1.00 0.00 C ATOM 1850 O GLU A 128 3.351 -11.918 -4.228 1.00 0.00 O ATOM 1851 CB GLU A 128 5.757 -12.724 -6.539 1.00 0.00 C ATOM 1852 CG GLU A 128 5.880 -12.296 -8.002 1.00 0.00 C ATOM 1853 CD GLU A 128 5.868 -13.510 -8.932 1.00 0.00 C ATOM 1854 OE1 GLU A 128 6.924 -13.907 -9.448 1.00 0.00 O ATOM 1855 OE2 GLU A 128 4.709 -14.047 -9.114 1.00 0.00 O ATOM 0 H GLU A 128 7.239 -10.959 -5.620 1.00 0.00 H new ATOM 0 HA GLU A 128 4.501 -11.027 -6.260 1.00 0.00 H new ATOM 0 HB2 GLU A 128 6.729 -13.051 -6.169 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.083 -13.577 -6.462 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.058 -11.628 -8.259 1.00 0.00 H new ATOM 0 HG3 GLU A 128 6.803 -11.734 -8.144 1.00 0.00 H new ATOM 1861 N PHE A 129 5.346 -12.760 -3.576 1.00 0.00 N ATOM 1862 CA PHE A 129 4.829 -13.320 -2.338 1.00 0.00 C ATOM 1863 C PHE A 129 4.058 -12.267 -1.539 1.00 0.00 C ATOM 1864 O PHE A 129 2.941 -12.519 -1.090 1.00 0.00 O ATOM 1865 CB PHE A 129 6.036 -13.781 -1.519 1.00 0.00 C ATOM 1866 CG PHE A 129 5.982 -13.370 -0.046 1.00 0.00 C ATOM 1867 CD1 PHE A 129 6.484 -12.169 0.345 1.00 0.00 C ATOM 1868 CD2 PHE A 129 5.431 -14.207 0.873 1.00 0.00 C ATOM 1869 CE1 PHE A 129 6.433 -11.788 1.712 1.00 0.00 C ATOM 1870 CE2 PHE A 129 5.380 -13.827 2.240 1.00 0.00 C ATOM 1871 CZ PHE A 129 5.882 -12.625 2.631 1.00 0.00 C ATOM 0 H PHE A 129 6.342 -12.914 -3.731 1.00 0.00 H new ATOM 0 HA PHE A 129 4.147 -14.142 -2.557 1.00 0.00 H new ATOM 0 HB2 PHE A 129 6.110 -14.867 -1.580 1.00 0.00 H new ATOM 0 HB3 PHE A 129 6.943 -13.374 -1.966 1.00 0.00 H new ATOM 0 HD1 PHE A 129 6.922 -11.504 -0.385 1.00 0.00 H new ATOM 0 HD2 PHE A 129 5.032 -15.161 0.563 1.00 0.00 H new ATOM 0 HE1 PHE A 129 6.832 -10.833 2.022 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.943 -14.493 2.969 1.00 0.00 H new ATOM 0 HZ PHE A 129 5.843 -12.336 3.671 1.00 0.00 H new ATOM 1880 N LEU A 130 4.684 -11.109 -1.388 1.00 0.00 N ATOM 1881 CA LEU A 130 4.070 -10.017 -0.652 1.00 0.00 C ATOM 1882 C LEU A 130 2.901 -9.455 -1.462 1.00 0.00 C ATOM 1883 O LEU A 130 1.951 -8.918 -0.896 1.00 0.00 O ATOM 1884 CB LEU A 130 5.119 -8.968 -0.277 1.00 0.00 C ATOM 1885 CG LEU A 130 4.578 -7.600 0.144 1.00 0.00 C ATOM 1886 CD1 LEU A 130 4.137 -6.786 -1.074 1.00 0.00 C ATOM 1887 CD2 LEU A 130 3.455 -7.747 1.172 1.00 0.00 C ATOM 0 H LEU A 130 5.610 -10.903 -1.763 1.00 0.00 H new ATOM 0 HA LEU A 130 3.660 -10.377 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.725 -9.364 0.538 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.784 -8.827 -1.129 1.00 0.00 H new ATOM 0 HG LEU A 130 5.385 -7.047 0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.757 -5.818 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.988 -6.636 -1.739 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.352 -7.323 -1.606 1.00 0.00 H new ATOM 0 HD21 LEU A 130 3.089 -6.760 1.454 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.640 -8.327 0.740 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.836 -8.259 2.056 1.00 0.00 H new ATOM 1898 N ALA A 131 3.009 -9.599 -2.775 1.00 0.00 N ATOM 1899 CA ALA A 131 1.972 -9.113 -3.669 1.00 0.00 C ATOM 1900 C ALA A 131 0.698 -9.933 -3.459 1.00 0.00 C ATOM 1901 O ALA A 131 -0.372 -9.374 -3.218 1.00 0.00 O ATOM 1902 CB ALA A 131 2.473 -9.173 -5.113 1.00 0.00 C ATOM 0 H ALA A 131 3.799 -10.045 -3.241 1.00 0.00 H new ATOM 0 HA ALA A 131 1.734 -8.072 -3.450 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.695 -8.808 -5.784 1.00 0.00 H new ATOM 0 HB2 ALA A 131 3.362 -8.550 -5.216 1.00 0.00 H new ATOM 0 HB3 ALA A 131 2.720 -10.203 -5.370 1.00 0.00 H new ATOM 1908 N PHE A 132 0.854 -11.245 -3.558 1.00 0.00 N ATOM 1909 CA PHE A 132 -0.271 -12.148 -3.383 1.00 0.00 C ATOM 1910 C PHE A 132 -1.107 -11.751 -2.164 1.00 0.00 C ATOM 1911 O PHE A 132 -2.298 -12.052 -2.099 1.00 0.00 O ATOM 1912 CB PHE A 132 0.308 -13.545 -3.156 1.00 0.00 C ATOM 1913 CG PHE A 132 -0.690 -14.544 -2.568 1.00 0.00 C ATOM 1914 CD1 PHE A 132 -0.925 -14.563 -1.228 1.00 0.00 C ATOM 1915 CD2 PHE A 132 -1.343 -15.414 -3.384 1.00 0.00 C ATOM 1916 CE1 PHE A 132 -1.851 -15.491 -0.682 1.00 0.00 C ATOM 1917 CE2 PHE A 132 -2.269 -16.342 -2.838 1.00 0.00 C ATOM 1918 CZ PHE A 132 -2.504 -16.360 -1.499 1.00 0.00 C ATOM 0 H PHE A 132 1.743 -11.704 -3.757 1.00 0.00 H new ATOM 0 HA PHE A 132 -0.917 -12.113 -4.261 1.00 0.00 H new ATOM 0 HB2 PHE A 132 0.678 -13.933 -4.105 1.00 0.00 H new ATOM 0 HB3 PHE A 132 1.166 -13.468 -2.488 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -0.407 -13.872 -0.579 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -1.157 -15.399 -4.448 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -2.037 -15.507 0.382 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -2.787 -17.033 -3.486 1.00 0.00 H new ATOM 0 HZ PHE A 132 -3.209 -17.065 -1.084 1.00 0.00 H new ATOM 1927 N ASN A 133 -0.450 -11.081 -1.229 1.00 0.00 N ATOM 1928 CA ASN A 133 -1.118 -10.640 -0.016 1.00 0.00 C ATOM 1929 C ASN A 133 -1.688 -9.237 -0.233 1.00 0.00 C ATOM 1930 O ASN A 133 -2.903 -9.060 -0.302 1.00 0.00 O ATOM 1931 CB ASN A 133 -0.141 -10.576 1.160 1.00 0.00 C ATOM 1932 CG ASN A 133 -0.691 -11.328 2.373 1.00 0.00 C ATOM 1933 OD1 ASN A 133 -1.356 -10.771 3.231 1.00 0.00 O ATOM 1934 ND2 ASN A 133 -0.378 -12.619 2.396 1.00 0.00 N ATOM 0 H ASN A 133 0.538 -10.833 -1.287 1.00 0.00 H new ATOM 0 HA ASN A 133 -1.909 -11.355 0.211 1.00 0.00 H new ATOM 0 HB2 ASN A 133 0.817 -11.005 0.865 1.00 0.00 H new ATOM 0 HB3 ASN A 133 0.045 -9.536 1.427 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -0.698 -13.208 3.165 1.00 0.00 H new ATOM 0 HD22 ASN A 133 0.183 -13.021 1.645 1.00 0.00 H new ATOM 1940 N LEU A 134 -0.783 -8.275 -0.337 1.00 0.00 N ATOM 1941 CA LEU A 134 -1.181 -6.893 -0.546 1.00 0.00 C ATOM 1942 C LEU A 134 -2.174 -6.483 0.542 1.00 0.00 C ATOM 1943 O LEU A 134 -2.351 -7.197 1.528 1.00 0.00 O ATOM 1944 CB LEU A 134 -1.709 -6.697 -1.968 1.00 0.00 C ATOM 1945 CG LEU A 134 -0.716 -6.122 -2.981 1.00 0.00 C ATOM 1946 CD1 LEU A 134 -1.136 -6.457 -4.412 1.00 0.00 C ATOM 1947 CD2 LEU A 134 -0.531 -4.618 -2.774 1.00 0.00 C ATOM 0 H LEU A 134 0.224 -8.425 -0.280 1.00 0.00 H new ATOM 0 HA LEU A 134 -0.320 -6.230 -0.457 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -2.060 -7.660 -2.340 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.576 -6.037 -1.924 1.00 0.00 H new ATOM 0 HG LEU A 134 0.253 -6.591 -2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.413 -6.037 -5.111 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.174 -7.539 -4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -2.121 -6.034 -4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 134 0.179 -4.235 -3.506 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -1.489 -4.113 -2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -0.151 -4.433 -1.769 1.00 0.00 H new TER 1958 LEU A 134 HETATM 1959 CA CA A 145 2.325 10.538 -10.265 1.00 0.00 CA HETATM 1960 CA CA A 155 3.340 0.982 -4.705 1.00 0.00 CA HETATM 1961 CA CA A 175 17.303 -17.677 -4.789 1.00 0.00 CA HETATM 1962 CA CA A 185 5.769 -15.463 -11.898 1.00 0.00 CA