USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 843 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 LYS NZ :NH3+ 172:sc= -0.697 (180deg=-0.77) USER MOD Set 1.2: A 109 SER OG : rot 180:sc= 0.227 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 44:sc= 0.0499 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -6.05! C(o=-6!,f=-13!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.969 K(o=-0.97,f=-3.1!) USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.444 USER MOD Single : A 56 LYS NZ :NH3+ 151:sc= -0.146 (180deg=-0.615) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= -2.04 USER MOD Single : A 60 MET CE :methyl 164:sc= -0.0273 (180deg=-0.605) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 124:sc= 0.031 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -2.88! C(o=-2.9!,f=-7.1!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.372 K(o=-0.37,f=-2.9!) USER MOD Single : A 96 THR OG1 : rot 89:sc= 0.123 USER MOD Single : A 100 LYS NZ :NH3+ 158:sc= 0.96 (180deg=0.537) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 8:sc= 1.12 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.133 -22.696 19.378 1.00 0.00 N ATOM 2 CA GLY A 1 -5.431 -22.663 18.726 1.00 0.00 C ATOM 3 C GLY A 1 -6.534 -22.287 19.717 1.00 0.00 C ATOM 4 O GLY A 1 -7.051 -23.145 20.432 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.402 -22.953 18.684 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.919 -21.758 19.774 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.147 -23.400 20.143 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.412 -21.944 17.907 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.647 -23.638 18.289 1.00 0.00 H new ATOM 8 N SER A 2 -6.862 -21.003 19.730 1.00 0.00 N ATOM 9 CA SER A 2 -7.894 -20.503 20.622 1.00 0.00 C ATOM 10 C SER A 2 -8.425 -19.163 20.108 1.00 0.00 C ATOM 11 O SER A 2 -7.709 -18.424 19.434 1.00 0.00 O ATOM 12 CB SER A 2 -7.363 -20.351 22.049 1.00 0.00 C ATOM 13 OG SER A 2 -7.804 -21.407 22.897 1.00 0.00 O ATOM 0 H SER A 2 -6.431 -20.294 19.137 1.00 0.00 H new ATOM 0 HA SER A 2 -8.709 -21.227 20.642 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.273 -20.332 22.030 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.692 -19.396 22.458 1.00 0.00 H new ATOM 0 HG SER A 2 -7.719 -22.262 22.426 1.00 0.00 H new ATOM 19 N SER A 3 -9.677 -18.890 20.447 1.00 0.00 N ATOM 20 CA SER A 3 -10.312 -17.652 20.028 1.00 0.00 C ATOM 21 C SER A 3 -10.459 -17.628 18.506 1.00 0.00 C ATOM 22 O SER A 3 -9.490 -17.852 17.781 1.00 0.00 O ATOM 23 CB SER A 3 -9.515 -16.436 20.504 1.00 0.00 C ATOM 24 OG SER A 3 -10.363 -15.345 20.853 1.00 0.00 O ATOM 0 H SER A 3 -10.268 -19.505 21.007 1.00 0.00 H new ATOM 0 HA SER A 3 -11.302 -17.604 20.482 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.909 -16.715 21.366 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.827 -16.123 19.719 1.00 0.00 H new ATOM 0 HG SER A 3 -9.817 -14.589 21.153 1.00 0.00 H new ATOM 30 N GLY A 4 -11.678 -17.354 18.065 1.00 0.00 N ATOM 31 CA GLY A 4 -11.964 -17.297 16.641 1.00 0.00 C ATOM 32 C GLY A 4 -13.428 -17.641 16.362 1.00 0.00 C ATOM 33 O GLY A 4 -13.853 -18.777 16.566 1.00 0.00 O ATOM 0 H GLY A 4 -12.479 -17.169 18.669 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.742 -16.300 16.262 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.315 -17.992 16.108 1.00 0.00 H new ATOM 37 N SER A 5 -14.161 -16.638 15.901 1.00 0.00 N ATOM 38 CA SER A 5 -15.569 -16.820 15.592 1.00 0.00 C ATOM 39 C SER A 5 -16.149 -15.528 15.012 1.00 0.00 C ATOM 40 O SER A 5 -15.831 -14.436 15.481 1.00 0.00 O ATOM 41 CB SER A 5 -16.355 -17.244 16.834 1.00 0.00 C ATOM 42 OG SER A 5 -16.336 -16.242 17.846 1.00 0.00 O ATOM 0 H SER A 5 -13.806 -15.696 15.734 1.00 0.00 H new ATOM 0 HA SER A 5 -15.657 -17.615 14.851 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.387 -17.457 16.555 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.935 -18.168 17.231 1.00 0.00 H new ATOM 0 HG SER A 5 -16.850 -16.550 18.621 1.00 0.00 H new ATOM 48 N SER A 6 -16.989 -15.695 14.002 1.00 0.00 N ATOM 49 CA SER A 6 -17.616 -14.555 13.354 1.00 0.00 C ATOM 50 C SER A 6 -18.823 -15.018 12.535 1.00 0.00 C ATOM 51 O SER A 6 -19.084 -16.215 12.430 1.00 0.00 O ATOM 52 CB SER A 6 -16.620 -13.814 12.459 1.00 0.00 C ATOM 53 OG SER A 6 -15.897 -14.704 11.613 1.00 0.00 O ATOM 0 H SER A 6 -17.250 -16.602 13.616 1.00 0.00 H new ATOM 0 HA SER A 6 -17.952 -13.864 14.127 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.154 -13.086 11.848 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.920 -13.256 13.081 1.00 0.00 H new ATOM 0 HG SER A 6 -15.273 -14.192 11.057 1.00 0.00 H new ATOM 59 N GLY A 7 -19.526 -14.044 11.976 1.00 0.00 N ATOM 60 CA GLY A 7 -20.699 -14.337 11.170 1.00 0.00 C ATOM 61 C GLY A 7 -20.325 -15.158 9.934 1.00 0.00 C ATOM 62 O GLY A 7 -19.345 -15.901 9.952 1.00 0.00 O ATOM 0 H GLY A 7 -19.306 -13.052 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.428 -14.885 11.768 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.175 -13.406 10.862 1.00 0.00 H new ATOM 66 N ALA A 8 -21.125 -14.996 8.891 1.00 0.00 N ATOM 67 CA ALA A 8 -20.890 -15.713 7.649 1.00 0.00 C ATOM 68 C ALA A 8 -21.220 -14.799 6.467 1.00 0.00 C ATOM 69 O ALA A 8 -22.185 -15.038 5.743 1.00 0.00 O ATOM 70 CB ALA A 8 -21.716 -17.000 7.638 1.00 0.00 C ATOM 0 H ALA A 8 -21.937 -14.379 8.880 1.00 0.00 H new ATOM 0 HA ALA A 8 -19.841 -15.998 7.563 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -21.540 -17.538 6.706 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -21.423 -17.627 8.480 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -22.775 -16.754 7.720 1.00 0.00 H new ATOM 76 N PRO A 9 -20.378 -13.743 6.304 1.00 0.00 N ATOM 77 CA PRO A 9 -20.570 -12.792 5.222 1.00 0.00 C ATOM 78 C PRO A 9 -20.136 -13.390 3.883 1.00 0.00 C ATOM 79 O PRO A 9 -19.657 -14.522 3.830 1.00 0.00 O ATOM 80 CB PRO A 9 -19.755 -11.573 5.621 1.00 0.00 C ATOM 81 CG PRO A 9 -18.770 -12.056 6.673 1.00 0.00 C ATOM 82 CD PRO A 9 -19.224 -13.429 7.142 1.00 0.00 C ATOM 0 HA PRO A 9 -21.617 -12.525 5.077 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -19.233 -11.154 4.761 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -20.397 -10.787 6.019 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -17.763 -12.108 6.258 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -18.734 -11.359 7.510 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -18.434 -14.170 7.022 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -19.493 -13.418 8.198 1.00 0.00 H new ATOM 90 N ALA A 10 -20.320 -12.603 2.832 1.00 0.00 N ATOM 91 CA ALA A 10 -19.953 -13.041 1.496 1.00 0.00 C ATOM 92 C ALA A 10 -19.551 -11.825 0.659 1.00 0.00 C ATOM 93 O ALA A 10 -20.393 -10.994 0.321 1.00 0.00 O ATOM 94 CB ALA A 10 -21.116 -13.818 0.876 1.00 0.00 C ATOM 0 H ALA A 10 -20.718 -11.665 2.879 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.096 -13.713 1.534 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -20.841 -14.147 -0.126 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -21.343 -14.687 1.493 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -21.994 -13.175 0.819 1.00 0.00 H new ATOM 100 N GLU A 11 -18.265 -11.760 0.347 1.00 0.00 N ATOM 101 CA GLU A 11 -17.741 -10.660 -0.444 1.00 0.00 C ATOM 102 C GLU A 11 -16.899 -11.195 -1.604 1.00 0.00 C ATOM 103 O GLU A 11 -15.866 -11.826 -1.387 1.00 0.00 O ATOM 104 CB GLU A 11 -16.929 -9.697 0.424 1.00 0.00 C ATOM 105 CG GLU A 11 -17.823 -8.604 1.014 1.00 0.00 C ATOM 106 CD GLU A 11 -17.044 -7.301 1.203 1.00 0.00 C ATOM 107 OE1 GLU A 11 -16.323 -7.214 2.221 1.00 0.00 O ATOM 108 OE2 GLU A 11 -17.186 -6.422 0.326 1.00 0.00 O ATOM 0 H GLU A 11 -17.570 -12.452 0.628 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.582 -10.103 -0.857 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -16.444 -10.249 1.229 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -16.138 -9.242 -0.173 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.674 -8.431 0.356 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -18.223 -8.935 1.972 1.00 0.00 H new ATOM 115 N PRO A 12 -17.384 -10.916 -2.844 1.00 0.00 N ATOM 116 CA PRO A 12 -16.688 -11.361 -4.038 1.00 0.00 C ATOM 117 C PRO A 12 -15.442 -10.511 -4.296 1.00 0.00 C ATOM 118 O PRO A 12 -15.259 -9.467 -3.672 1.00 0.00 O ATOM 119 CB PRO A 12 -17.716 -11.263 -5.153 1.00 0.00 C ATOM 120 CG PRO A 12 -18.801 -10.332 -4.638 1.00 0.00 C ATOM 121 CD PRO A 12 -18.604 -10.171 -3.139 1.00 0.00 C ATOM 0 HA PRO A 12 -16.312 -12.380 -3.950 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -17.266 -10.872 -6.066 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -18.125 -12.244 -5.394 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -18.742 -9.365 -5.137 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -19.788 -10.741 -4.852 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -18.504 -9.121 -2.863 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -19.454 -10.567 -2.583 1.00 0.00 H new ATOM 129 N ALA A 13 -14.619 -10.989 -5.218 1.00 0.00 N ATOM 130 CA ALA A 13 -13.396 -10.285 -5.566 1.00 0.00 C ATOM 131 C ALA A 13 -13.701 -9.244 -6.645 1.00 0.00 C ATOM 132 O ALA A 13 -14.862 -8.914 -6.882 1.00 0.00 O ATOM 133 CB ALA A 13 -12.336 -11.294 -6.013 1.00 0.00 C ATOM 0 H ALA A 13 -14.775 -11.855 -5.734 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.998 -9.756 -4.700 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -11.419 -10.766 -6.274 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -12.134 -11.993 -5.202 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -12.699 -11.842 -6.882 1.00 0.00 H new ATOM 139 N ALA A 14 -12.639 -8.757 -7.269 1.00 0.00 N ATOM 140 CA ALA A 14 -12.779 -7.760 -8.317 1.00 0.00 C ATOM 141 C ALA A 14 -11.409 -7.150 -8.620 1.00 0.00 C ATOM 142 O ALA A 14 -10.973 -7.137 -9.770 1.00 0.00 O ATOM 143 CB ALA A 14 -13.804 -6.708 -7.887 1.00 0.00 C ATOM 0 H ALA A 14 -11.678 -9.034 -7.069 1.00 0.00 H new ATOM 0 HA ALA A 14 -13.147 -8.217 -9.236 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -13.909 -5.960 -8.673 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -14.767 -7.188 -7.712 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -13.467 -6.225 -6.970 1.00 0.00 H new ATOM 149 N PRO A 15 -10.753 -6.645 -7.541 1.00 0.00 N ATOM 150 CA PRO A 15 -9.441 -6.035 -7.681 1.00 0.00 C ATOM 151 C PRO A 15 -8.361 -7.099 -7.885 1.00 0.00 C ATOM 152 O PRO A 15 -8.379 -8.141 -7.233 1.00 0.00 O ATOM 153 CB PRO A 15 -9.246 -5.227 -6.409 1.00 0.00 C ATOM 154 CG PRO A 15 -10.244 -5.781 -5.405 1.00 0.00 C ATOM 155 CD PRO A 15 -11.239 -6.643 -6.165 1.00 0.00 C ATOM 0 HA PRO A 15 -9.366 -5.394 -8.560 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -8.225 -5.323 -6.038 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -9.422 -4.166 -6.589 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -9.733 -6.370 -4.643 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -10.757 -4.969 -4.889 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -11.279 -7.653 -5.758 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -12.247 -6.233 -6.102 1.00 0.00 H new ATOM 163 N LYS A 16 -7.444 -6.799 -8.794 1.00 0.00 N ATOM 164 CA LYS A 16 -6.358 -7.716 -9.092 1.00 0.00 C ATOM 165 C LYS A 16 -5.183 -6.934 -9.683 1.00 0.00 C ATOM 166 O LYS A 16 -5.339 -5.781 -10.082 1.00 0.00 O ATOM 167 CB LYS A 16 -6.849 -8.856 -9.987 1.00 0.00 C ATOM 168 CG LYS A 16 -6.633 -10.213 -9.314 1.00 0.00 C ATOM 169 CD LYS A 16 -7.763 -11.184 -9.663 1.00 0.00 C ATOM 170 CE LYS A 16 -7.939 -12.237 -8.567 1.00 0.00 C ATOM 171 NZ LYS A 16 -7.527 -13.571 -9.059 1.00 0.00 N ATOM 0 H LYS A 16 -7.432 -5.933 -9.334 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.999 -8.190 -8.178 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -7.908 -8.720 -10.208 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -6.319 -8.830 -10.939 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.678 -10.632 -9.631 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -6.581 -10.083 -8.233 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.694 -10.632 -9.795 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.546 -11.674 -10.612 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.345 -11.965 -7.695 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.980 -12.267 -8.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.653 -14.274 -8.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.112 -13.835 -9.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.527 -13.543 -9.343 1.00 0.00 H new ATOM 185 N SER A 17 -4.034 -7.592 -9.720 1.00 0.00 N ATOM 186 CA SER A 17 -2.833 -6.973 -10.255 1.00 0.00 C ATOM 187 C SER A 17 -1.810 -8.048 -10.625 1.00 0.00 C ATOM 188 O SER A 17 -1.814 -9.137 -10.053 1.00 0.00 O ATOM 189 CB SER A 17 -2.229 -5.987 -9.252 1.00 0.00 C ATOM 190 OG SER A 17 -1.264 -5.133 -9.860 1.00 0.00 O ATOM 0 H SER A 17 -3.909 -8.548 -9.388 1.00 0.00 H new ATOM 0 HA SER A 17 -3.105 -6.417 -11.152 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.023 -5.383 -8.814 1.00 0.00 H new ATOM 0 HB3 SER A 17 -1.762 -6.539 -8.437 1.00 0.00 H new ATOM 0 HG SER A 17 -0.903 -4.517 -9.189 1.00 0.00 H new ATOM 196 N GLY A 18 -0.958 -7.705 -11.580 1.00 0.00 N ATOM 197 CA GLY A 18 0.068 -8.628 -12.034 1.00 0.00 C ATOM 198 C GLY A 18 1.464 -8.024 -11.861 1.00 0.00 C ATOM 199 O GLY A 18 2.217 -8.435 -10.980 1.00 0.00 O ATOM 0 H GLY A 18 -0.957 -6.801 -12.052 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -0.001 -9.560 -11.472 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.098 -8.875 -13.083 1.00 0.00 H new ATOM 203 N GLU A 19 1.765 -7.058 -12.716 1.00 0.00 N ATOM 204 CA GLU A 19 3.056 -6.393 -12.669 1.00 0.00 C ATOM 205 C GLU A 19 3.182 -5.394 -13.821 1.00 0.00 C ATOM 206 O GLU A 19 2.664 -5.632 -14.912 1.00 0.00 O ATOM 207 CB GLU A 19 4.198 -7.410 -12.698 1.00 0.00 C ATOM 208 CG GLU A 19 4.857 -7.536 -11.323 1.00 0.00 C ATOM 209 CD GLU A 19 5.480 -8.921 -11.137 1.00 0.00 C ATOM 210 OE1 GLU A 19 5.927 -9.483 -12.160 1.00 0.00 O ATOM 211 OE2 GLU A 19 5.497 -9.385 -9.977 1.00 0.00 O ATOM 0 H GLU A 19 1.137 -6.720 -13.445 1.00 0.00 H new ATOM 0 HA GLU A 19 3.126 -5.844 -11.730 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.816 -8.381 -13.012 1.00 0.00 H new ATOM 0 HB3 GLU A 19 4.942 -7.106 -13.435 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.625 -6.770 -11.213 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.116 -7.359 -10.543 1.00 0.00 H new ATOM 218 N ALA A 20 3.872 -4.299 -13.540 1.00 0.00 N ATOM 219 CA ALA A 20 4.072 -3.264 -14.540 1.00 0.00 C ATOM 220 C ALA A 20 4.967 -2.167 -13.960 1.00 0.00 C ATOM 221 O ALA A 20 5.194 -2.120 -12.752 1.00 0.00 O ATOM 222 CB ALA A 20 2.714 -2.727 -14.998 1.00 0.00 C ATOM 0 H ALA A 20 4.300 -4.106 -12.634 1.00 0.00 H new ATOM 0 HA ALA A 20 4.575 -3.670 -15.418 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.864 -1.951 -15.748 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.128 -3.539 -15.428 1.00 0.00 H new ATOM 0 HB3 ALA A 20 2.181 -2.308 -14.144 1.00 0.00 H new ATOM 228 N GLU A 21 5.452 -1.312 -14.849 1.00 0.00 N ATOM 229 CA GLU A 21 6.317 -0.218 -14.440 1.00 0.00 C ATOM 230 C GLU A 21 5.767 0.452 -13.180 1.00 0.00 C ATOM 231 O GLU A 21 4.569 0.386 -12.910 1.00 0.00 O ATOM 232 CB GLU A 21 6.489 0.797 -15.571 1.00 0.00 C ATOM 233 CG GLU A 21 5.149 1.439 -15.939 1.00 0.00 C ATOM 234 CD GLU A 21 5.043 1.658 -17.450 1.00 0.00 C ATOM 235 OE1 GLU A 21 6.082 2.015 -18.046 1.00 0.00 O ATOM 236 OE2 GLU A 21 3.925 1.464 -17.974 1.00 0.00 O ATOM 0 H GLU A 21 5.262 -1.355 -15.850 1.00 0.00 H new ATOM 0 HA GLU A 21 7.301 -0.626 -14.210 1.00 0.00 H new ATOM 0 HB2 GLU A 21 7.195 1.570 -15.267 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.913 0.304 -16.446 1.00 0.00 H new ATOM 0 HG2 GLU A 21 4.331 0.802 -15.602 1.00 0.00 H new ATOM 0 HG3 GLU A 21 5.044 2.392 -15.421 1.00 0.00 H new ATOM 243 N THR A 22 6.669 1.082 -12.441 1.00 0.00 N ATOM 244 CA THR A 22 6.288 1.764 -11.216 1.00 0.00 C ATOM 245 C THR A 22 6.849 3.187 -11.202 1.00 0.00 C ATOM 246 O THR A 22 7.986 3.406 -10.788 1.00 0.00 O ATOM 247 CB THR A 22 6.760 0.913 -10.035 1.00 0.00 C ATOM 248 OG1 THR A 22 5.806 -0.143 -9.965 1.00 0.00 O ATOM 249 CG2 THR A 22 6.614 1.638 -8.696 1.00 0.00 C ATOM 0 H THR A 22 7.662 1.134 -12.667 1.00 0.00 H new ATOM 0 HA THR A 22 5.206 1.874 -11.144 1.00 0.00 H new ATOM 0 HB THR A 22 7.803 0.632 -10.183 1.00 0.00 H new ATOM 0 HG1 THR A 22 6.037 -0.744 -9.226 1.00 0.00 H new ATOM 0 HG21 THR A 22 6.963 0.990 -7.892 1.00 0.00 H new ATOM 0 HG22 THR A 22 7.209 2.551 -8.710 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.566 1.890 -8.531 1.00 0.00 H new ATOM 257 N PRO A 23 6.002 4.143 -11.670 1.00 0.00 N ATOM 258 CA PRO A 23 6.401 5.539 -11.715 1.00 0.00 C ATOM 259 C PRO A 23 6.383 6.160 -10.317 1.00 0.00 C ATOM 260 O PRO A 23 5.854 5.568 -9.378 1.00 0.00 O ATOM 261 CB PRO A 23 5.420 6.199 -12.670 1.00 0.00 C ATOM 262 CG PRO A 23 4.231 5.256 -12.763 1.00 0.00 C ATOM 263 CD PRO A 23 4.648 3.920 -12.168 1.00 0.00 C ATOM 0 HA PRO A 23 7.425 5.672 -12.063 1.00 0.00 H new ATOM 0 HB2 PRO A 23 5.114 7.178 -12.301 1.00 0.00 H new ATOM 0 HB3 PRO A 23 5.873 6.355 -13.649 1.00 0.00 H new ATOM 0 HG2 PRO A 23 3.377 5.664 -12.223 1.00 0.00 H new ATOM 0 HG3 PRO A 23 3.922 5.132 -13.801 1.00 0.00 H new ATOM 0 HD2 PRO A 23 3.976 3.617 -11.365 1.00 0.00 H new ATOM 0 HD3 PRO A 23 4.627 3.129 -12.917 1.00 0.00 H new ATOM 271 N PRO A 24 6.983 7.377 -10.220 1.00 0.00 N ATOM 272 CA PRO A 24 7.041 8.084 -8.953 1.00 0.00 C ATOM 273 C PRO A 24 5.680 8.689 -8.600 1.00 0.00 C ATOM 274 O PRO A 24 5.086 9.402 -9.406 1.00 0.00 O ATOM 275 CB PRO A 24 8.126 9.132 -9.136 1.00 0.00 C ATOM 276 CG PRO A 24 8.312 9.282 -10.637 1.00 0.00 C ATOM 277 CD PRO A 24 7.620 8.109 -11.311 1.00 0.00 C ATOM 0 HA PRO A 24 7.277 7.427 -8.116 1.00 0.00 H new ATOM 0 HB2 PRO A 24 7.835 10.079 -8.682 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.054 8.821 -8.657 1.00 0.00 H new ATOM 0 HG2 PRO A 24 7.888 10.225 -10.982 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.372 9.297 -10.891 1.00 0.00 H new ATOM 0 HD2 PRO A 24 6.886 8.449 -12.041 1.00 0.00 H new ATOM 0 HD3 PRO A 24 8.334 7.482 -11.845 1.00 0.00 H new ATOM 285 N LYS A 25 5.226 8.380 -7.393 1.00 0.00 N ATOM 286 CA LYS A 25 3.947 8.884 -6.924 1.00 0.00 C ATOM 287 C LYS A 25 4.049 9.213 -5.433 1.00 0.00 C ATOM 288 O LYS A 25 4.905 9.995 -5.024 1.00 0.00 O ATOM 289 CB LYS A 25 2.827 7.898 -7.261 1.00 0.00 C ATOM 290 CG LYS A 25 3.171 6.489 -6.774 1.00 0.00 C ATOM 291 CD LYS A 25 1.911 5.729 -6.356 1.00 0.00 C ATOM 292 CE LYS A 25 2.078 4.225 -6.578 1.00 0.00 C ATOM 293 NZ LYS A 25 1.157 3.752 -7.635 1.00 0.00 N ATOM 0 H LYS A 25 5.721 7.787 -6.727 1.00 0.00 H new ATOM 0 HA LYS A 25 3.690 9.810 -7.438 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.896 8.229 -6.800 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.662 7.884 -8.338 1.00 0.00 H new ATOM 0 HG2 LYS A 25 3.684 5.942 -7.565 1.00 0.00 H new ATOM 0 HG3 LYS A 25 3.859 6.550 -5.931 1.00 0.00 H new ATOM 0 HD2 LYS A 25 1.697 5.923 -5.305 1.00 0.00 H new ATOM 0 HD3 LYS A 25 1.057 6.092 -6.928 1.00 0.00 H new ATOM 0 HE2 LYS A 25 3.108 4.005 -6.860 1.00 0.00 H new ATOM 0 HE3 LYS A 25 1.880 3.690 -5.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 1.283 2.729 -7.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 0.175 3.945 -7.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.364 4.250 -8.524 1.00 0.00 H new ATOM 307 N HIS A 26 3.164 8.598 -4.662 1.00 0.00 N ATOM 308 CA HIS A 26 3.144 8.815 -3.226 1.00 0.00 C ATOM 309 C HIS A 26 3.655 7.563 -2.510 1.00 0.00 C ATOM 310 O HIS A 26 3.308 6.444 -2.885 1.00 0.00 O ATOM 311 CB HIS A 26 1.749 9.237 -2.759 1.00 0.00 C ATOM 312 CG HIS A 26 1.710 9.775 -1.349 1.00 0.00 C ATOM 313 ND1 HIS A 26 1.807 8.963 -0.233 1.00 0.00 N ATOM 314 CD2 HIS A 26 1.584 11.052 -0.886 1.00 0.00 C ATOM 315 CE1 HIS A 26 1.741 9.726 0.847 1.00 0.00 C ATOM 316 NE2 HIS A 26 1.601 11.021 0.441 1.00 0.00 N ATOM 0 H HIS A 26 2.456 7.949 -5.005 1.00 0.00 H new ATOM 0 HA HIS A 26 3.813 9.636 -2.970 1.00 0.00 H new ATOM 0 HB2 HIS A 26 1.365 9.998 -3.438 1.00 0.00 H new ATOM 0 HB3 HIS A 26 1.079 8.380 -2.829 1.00 0.00 H new ATOM 0 HD2 HIS A 26 1.487 11.938 -1.496 1.00 0.00 H new ATOM 0 HE1 HIS A 26 1.789 9.383 1.870 1.00 0.00 H new ATOM 0 HE2 HIS A 26 1.522 11.831 1.055 1.00 0.00 H new ATOM 324 N PRO A 27 4.493 7.800 -1.465 1.00 0.00 N ATOM 325 CA PRO A 27 5.056 6.705 -0.694 1.00 0.00 C ATOM 326 C PRO A 27 4.007 6.098 0.241 1.00 0.00 C ATOM 327 O PRO A 27 4.005 4.890 0.475 1.00 0.00 O ATOM 328 CB PRO A 27 6.234 7.313 0.050 1.00 0.00 C ATOM 329 CG PRO A 27 6.008 8.816 0.033 1.00 0.00 C ATOM 330 CD PRO A 27 4.926 9.112 -0.993 1.00 0.00 C ATOM 0 HA PRO A 27 5.383 5.874 -1.319 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.286 6.938 1.072 1.00 0.00 H new ATOM 0 HB3 PRO A 27 7.176 7.054 -0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.706 9.168 1.019 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.930 9.338 -0.223 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.099 9.665 -0.548 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.312 9.720 -1.811 1.00 0.00 H new ATOM 338 N GLY A 28 3.142 6.963 0.749 1.00 0.00 N ATOM 339 CA GLY A 28 2.091 6.526 1.652 1.00 0.00 C ATOM 340 C GLY A 28 1.320 5.342 1.065 1.00 0.00 C ATOM 341 O GLY A 28 0.926 4.431 1.792 1.00 0.00 O ATOM 0 H GLY A 28 3.147 7.964 0.553 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.525 6.242 2.611 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.406 7.351 1.844 1.00 0.00 H new ATOM 345 N VAL A 29 1.128 5.393 -0.244 1.00 0.00 N ATOM 346 CA VAL A 29 0.411 4.336 -0.937 1.00 0.00 C ATOM 347 C VAL A 29 1.345 3.142 -1.142 1.00 0.00 C ATOM 348 O VAL A 29 1.063 2.041 -0.672 1.00 0.00 O ATOM 349 CB VAL A 29 -0.172 4.871 -2.247 1.00 0.00 C ATOM 350 CG1 VAL A 29 -1.087 3.835 -2.903 1.00 0.00 C ATOM 351 CG2 VAL A 29 -0.912 6.190 -2.020 1.00 0.00 C ATOM 0 H VAL A 29 1.456 6.150 -0.844 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.432 3.990 -0.339 1.00 0.00 H new ATOM 0 HB VAL A 29 0.657 5.065 -2.928 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -1.488 4.240 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.518 2.931 -3.118 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.908 3.595 -2.227 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.316 6.548 -2.967 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.727 6.033 -1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.221 6.930 -1.618 1.00 0.00 H new ATOM 361 N LEU A 30 2.438 3.400 -1.844 1.00 0.00 N ATOM 362 CA LEU A 30 3.416 2.360 -2.117 1.00 0.00 C ATOM 363 C LEU A 30 3.675 1.562 -0.837 1.00 0.00 C ATOM 364 O LEU A 30 3.887 0.351 -0.889 1.00 0.00 O ATOM 365 CB LEU A 30 4.680 2.961 -2.734 1.00 0.00 C ATOM 366 CG LEU A 30 4.478 3.794 -4.001 1.00 0.00 C ATOM 367 CD1 LEU A 30 5.477 4.950 -4.063 1.00 0.00 C ATOM 368 CD2 LEU A 30 4.541 2.914 -5.251 1.00 0.00 C ATOM 0 H LEU A 30 2.669 4.315 -2.232 1.00 0.00 H new ATOM 0 HA LEU A 30 3.031 1.659 -2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.163 3.588 -1.985 1.00 0.00 H new ATOM 0 HB3 LEU A 30 5.370 2.149 -2.963 1.00 0.00 H new ATOM 0 HG LEU A 30 3.481 4.233 -3.966 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.311 5.526 -4.974 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.341 5.596 -3.195 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.492 4.554 -4.064 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.394 3.531 -6.138 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.515 2.427 -5.304 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.759 2.156 -5.202 1.00 0.00 H new ATOM 380 N LYS A 31 3.649 2.272 0.281 1.00 0.00 N ATOM 381 CA LYS A 31 3.879 1.645 1.571 1.00 0.00 C ATOM 382 C LYS A 31 3.012 0.389 1.685 1.00 0.00 C ATOM 383 O LYS A 31 3.374 -0.558 2.381 1.00 0.00 O ATOM 384 CB LYS A 31 3.656 2.651 2.703 1.00 0.00 C ATOM 385 CG LYS A 31 4.682 2.456 3.820 1.00 0.00 C ATOM 386 CD LYS A 31 4.846 3.735 4.644 1.00 0.00 C ATOM 387 CE LYS A 31 6.221 3.783 5.313 1.00 0.00 C ATOM 388 NZ LYS A 31 6.472 5.125 5.885 1.00 0.00 N ATOM 0 H LYS A 31 3.472 3.276 0.320 1.00 0.00 H new ATOM 0 HA LYS A 31 4.917 1.325 1.659 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.728 3.666 2.312 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.649 2.535 3.105 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.367 1.639 4.469 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.642 2.170 3.391 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.720 4.605 4.000 1.00 0.00 H new ATOM 0 HD3 LYS A 31 4.066 3.785 5.404 1.00 0.00 H new ATOM 0 HE2 LYS A 31 6.276 3.030 6.099 1.00 0.00 H new ATOM 0 HE3 LYS A 31 6.995 3.541 4.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.409 5.141 6.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.440 5.837 5.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.743 5.342 6.595 1.00 0.00 H new ATOM 402 N VAL A 32 1.885 0.422 0.990 1.00 0.00 N ATOM 403 CA VAL A 32 0.964 -0.701 1.004 1.00 0.00 C ATOM 404 C VAL A 32 1.270 -1.621 -0.180 1.00 0.00 C ATOM 405 O VAL A 32 1.368 -2.836 -0.017 1.00 0.00 O ATOM 406 CB VAL A 32 -0.480 -0.195 1.010 1.00 0.00 C ATOM 407 CG1 VAL A 32 -0.578 1.174 1.685 1.00 0.00 C ATOM 408 CG2 VAL A 32 -1.050 -0.149 -0.409 1.00 0.00 C ATOM 0 H VAL A 32 1.589 1.209 0.413 1.00 0.00 H new ATOM 0 HA VAL A 32 1.092 -1.288 1.914 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.079 -0.897 1.589 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.615 1.511 1.676 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.230 1.097 2.715 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.041 1.891 1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -2.077 0.214 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.447 0.521 -1.022 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.032 -1.150 -0.841 1.00 0.00 H new ATOM 418 N GLU A 33 1.414 -1.006 -1.344 1.00 0.00 N ATOM 419 CA GLU A 33 1.707 -1.754 -2.555 1.00 0.00 C ATOM 420 C GLU A 33 2.861 -2.728 -2.310 1.00 0.00 C ATOM 421 O GLU A 33 2.877 -3.828 -2.861 1.00 0.00 O ATOM 422 CB GLU A 33 2.022 -0.812 -3.719 1.00 0.00 C ATOM 423 CG GLU A 33 0.903 0.213 -3.913 1.00 0.00 C ATOM 424 CD GLU A 33 0.813 0.655 -5.375 1.00 0.00 C ATOM 425 OE1 GLU A 33 1.854 1.110 -5.895 1.00 0.00 O ATOM 426 OE2 GLU A 33 -0.295 0.529 -5.939 1.00 0.00 O ATOM 0 H GLU A 33 1.333 0.002 -1.475 1.00 0.00 H new ATOM 0 HA GLU A 33 0.822 -2.330 -2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.963 -0.296 -3.530 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.153 -1.390 -4.634 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.048 -0.218 -3.600 1.00 0.00 H new ATOM 0 HG3 GLU A 33 1.085 1.080 -3.278 1.00 0.00 H new ATOM 433 N ALA A 34 3.799 -2.290 -1.483 1.00 0.00 N ATOM 434 CA ALA A 34 4.954 -3.109 -1.158 1.00 0.00 C ATOM 435 C ALA A 34 4.488 -4.380 -0.446 1.00 0.00 C ATOM 436 O ALA A 34 5.102 -5.437 -0.588 1.00 0.00 O ATOM 437 CB ALA A 34 5.937 -2.295 -0.315 1.00 0.00 C ATOM 0 H ALA A 34 3.782 -1.377 -1.028 1.00 0.00 H new ATOM 0 HA ALA A 34 5.477 -3.412 -2.065 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.803 -2.910 -0.071 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.260 -1.419 -0.878 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.449 -1.975 0.606 1.00 0.00 H new ATOM 443 N ILE A 35 3.405 -4.237 0.304 1.00 0.00 N ATOM 444 CA ILE A 35 2.850 -5.361 1.039 1.00 0.00 C ATOM 445 C ILE A 35 1.971 -6.193 0.102 1.00 0.00 C ATOM 446 O ILE A 35 2.184 -7.395 -0.049 1.00 0.00 O ATOM 447 CB ILE A 35 2.122 -4.874 2.294 1.00 0.00 C ATOM 448 CG1 ILE A 35 3.046 -4.024 3.168 1.00 0.00 C ATOM 449 CG2 ILE A 35 1.518 -6.047 3.068 1.00 0.00 C ATOM 450 CD1 ILE A 35 2.263 -2.918 3.879 1.00 0.00 C ATOM 0 H ILE A 35 2.897 -3.360 0.418 1.00 0.00 H new ATOM 0 HA ILE A 35 3.647 -6.015 1.394 1.00 0.00 H new ATOM 0 HB ILE A 35 1.295 -4.235 1.983 1.00 0.00 H new ATOM 0 HG12 ILE A 35 3.539 -4.657 3.906 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.830 -3.582 2.553 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.007 -5.673 3.955 1.00 0.00 H new ATOM 0 HG22 ILE A 35 0.805 -6.573 2.433 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.311 -6.732 3.368 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.943 -2.328 4.494 1.00 0.00 H new ATOM 0 HD12 ILE A 35 1.791 -2.272 3.138 1.00 0.00 H new ATOM 0 HD13 ILE A 35 1.496 -3.364 4.512 1.00 0.00 H new ATOM 462 N LEU A 36 1.003 -5.520 -0.502 1.00 0.00 N ATOM 463 CA LEU A 36 0.092 -6.182 -1.419 1.00 0.00 C ATOM 464 C LEU A 36 0.881 -7.143 -2.311 1.00 0.00 C ATOM 465 O LEU A 36 0.503 -8.303 -2.467 1.00 0.00 O ATOM 466 CB LEU A 36 -0.727 -5.151 -2.199 1.00 0.00 C ATOM 467 CG LEU A 36 -1.990 -4.635 -1.507 1.00 0.00 C ATOM 468 CD1 LEU A 36 -3.010 -5.759 -1.318 1.00 0.00 C ATOM 469 CD2 LEU A 36 -1.647 -3.943 -0.186 1.00 0.00 C ATOM 0 H LEU A 36 0.830 -4.523 -0.374 1.00 0.00 H new ATOM 0 HA LEU A 36 -0.634 -6.781 -0.868 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.085 -4.299 -2.421 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.014 -5.591 -3.154 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.452 -3.887 -2.152 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.898 -5.365 -0.824 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.286 -6.167 -2.290 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.573 -6.547 -0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.562 -3.585 0.286 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.150 -4.651 0.477 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.985 -3.099 -0.379 1.00 0.00 H new ATOM 481 N GLU A 37 1.963 -6.624 -2.872 1.00 0.00 N ATOM 482 CA GLU A 37 2.809 -7.421 -3.744 1.00 0.00 C ATOM 483 C GLU A 37 3.112 -8.774 -3.098 1.00 0.00 C ATOM 484 O GLU A 37 3.129 -9.800 -3.776 1.00 0.00 O ATOM 485 CB GLU A 37 4.100 -6.675 -4.087 1.00 0.00 C ATOM 486 CG GLU A 37 4.261 -6.524 -5.601 1.00 0.00 C ATOM 487 CD GLU A 37 5.724 -6.274 -5.975 1.00 0.00 C ATOM 488 OE1 GLU A 37 6.196 -5.151 -5.699 1.00 0.00 O ATOM 489 OE2 GLU A 37 6.337 -7.213 -6.528 1.00 0.00 O ATOM 0 H GLU A 37 2.273 -5.661 -2.740 1.00 0.00 H new ATOM 0 HA GLU A 37 2.272 -7.598 -4.676 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.091 -5.691 -3.619 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.955 -7.214 -3.679 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.903 -7.425 -6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.645 -5.697 -5.955 1.00 0.00 H new ATOM 496 N LYS A 38 3.345 -8.732 -1.794 1.00 0.00 N ATOM 497 CA LYS A 38 3.646 -9.942 -1.049 1.00 0.00 C ATOM 498 C LYS A 38 2.356 -10.734 -0.826 1.00 0.00 C ATOM 499 O LYS A 38 2.312 -11.938 -1.072 1.00 0.00 O ATOM 500 CB LYS A 38 4.391 -9.603 0.244 1.00 0.00 C ATOM 501 CG LYS A 38 5.723 -8.913 -0.055 1.00 0.00 C ATOM 502 CD LYS A 38 6.000 -7.796 0.953 1.00 0.00 C ATOM 503 CE LYS A 38 6.937 -8.278 2.062 1.00 0.00 C ATOM 504 NZ LYS A 38 8.349 -8.046 1.686 1.00 0.00 N ATOM 0 H LYS A 38 3.331 -7.879 -1.235 1.00 0.00 H new ATOM 0 HA LYS A 38 4.319 -10.583 -1.619 1.00 0.00 H new ATOM 0 HB2 LYS A 38 3.773 -8.954 0.865 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.570 -10.514 0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.531 -9.644 -0.024 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.705 -8.501 -1.064 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.445 -6.942 0.442 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.061 -7.453 1.388 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.711 -7.753 2.990 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.774 -9.340 2.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 8.971 -8.379 2.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.565 -8.566 0.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.505 -7.029 1.531 1.00 0.00 H new ATOM 518 N VAL A 39 1.338 -10.025 -0.362 1.00 0.00 N ATOM 519 CA VAL A 39 0.050 -10.647 -0.103 1.00 0.00 C ATOM 520 C VAL A 39 -0.293 -11.597 -1.252 1.00 0.00 C ATOM 521 O VAL A 39 -0.654 -12.750 -1.021 1.00 0.00 O ATOM 522 CB VAL A 39 -1.015 -9.571 0.121 1.00 0.00 C ATOM 523 CG1 VAL A 39 -2.406 -10.194 0.249 1.00 0.00 C ATOM 524 CG2 VAL A 39 -0.682 -8.717 1.347 1.00 0.00 C ATOM 0 H VAL A 39 1.378 -9.026 -0.159 1.00 0.00 H new ATOM 0 HA VAL A 39 0.090 -11.242 0.810 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.020 -8.918 -0.752 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -3.144 -9.407 0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.646 -10.738 -0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.421 -10.881 1.095 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.454 -7.960 1.484 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.636 -9.352 2.231 1.00 0.00 H new ATOM 0 HG23 VAL A 39 0.282 -8.229 1.200 1.00 0.00 H new ATOM 534 N GLN A 40 -0.169 -11.077 -2.464 1.00 0.00 N ATOM 535 CA GLN A 40 -0.461 -11.865 -3.649 1.00 0.00 C ATOM 536 C GLN A 40 0.217 -13.234 -3.558 1.00 0.00 C ATOM 537 O GLN A 40 -0.358 -14.243 -3.963 1.00 0.00 O ATOM 538 CB GLN A 40 -0.034 -11.126 -4.919 1.00 0.00 C ATOM 539 CG GLN A 40 -0.886 -9.874 -5.137 1.00 0.00 C ATOM 540 CD GLN A 40 -2.361 -10.239 -5.311 1.00 0.00 C ATOM 541 OE1 GLN A 40 -2.728 -11.391 -5.473 1.00 0.00 O ATOM 542 NE2 GLN A 40 -3.185 -9.195 -5.268 1.00 0.00 N ATOM 0 H GLN A 40 0.130 -10.120 -2.651 1.00 0.00 H new ATOM 0 HA GLN A 40 -1.539 -12.018 -3.702 1.00 0.00 H new ATOM 0 HB2 GLN A 40 1.017 -10.847 -4.846 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -0.128 -11.789 -5.779 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -0.772 -9.200 -4.288 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -0.534 -9.339 -6.019 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -2.812 -8.256 -5.129 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -4.190 -9.334 -5.374 1.00 0.00 H new ATOM 551 N GLY A 41 1.429 -13.224 -3.022 1.00 0.00 N ATOM 552 CA GLY A 41 2.191 -14.452 -2.872 1.00 0.00 C ATOM 553 C GLY A 41 1.534 -15.383 -1.851 1.00 0.00 C ATOM 554 O GLY A 41 1.653 -16.603 -1.952 1.00 0.00 O ATOM 0 H GLY A 41 1.902 -12.385 -2.686 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.266 -14.957 -3.835 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.207 -14.217 -2.555 1.00 0.00 H new ATOM 558 N LEU A 42 0.856 -14.772 -0.891 1.00 0.00 N ATOM 559 CA LEU A 42 0.181 -15.530 0.148 1.00 0.00 C ATOM 560 C LEU A 42 -1.182 -15.994 -0.369 1.00 0.00 C ATOM 561 O LEU A 42 -1.761 -16.942 0.160 1.00 0.00 O ATOM 562 CB LEU A 42 0.104 -14.717 1.442 1.00 0.00 C ATOM 563 CG LEU A 42 1.442 -14.280 2.041 1.00 0.00 C ATOM 564 CD1 LEU A 42 1.231 -13.469 3.321 1.00 0.00 C ATOM 565 CD2 LEU A 42 2.360 -15.482 2.268 1.00 0.00 C ATOM 0 H LEU A 42 0.760 -13.760 -0.811 1.00 0.00 H new ATOM 0 HA LEU A 42 0.750 -16.426 0.396 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.495 -13.826 1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -0.429 -15.307 2.187 1.00 0.00 H new ATOM 0 HG LEU A 42 1.940 -13.626 1.325 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.198 -13.171 3.726 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.642 -12.580 3.095 1.00 0.00 H new ATOM 0 HD13 LEU A 42 0.702 -14.078 4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.304 -15.143 2.694 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.882 -16.181 2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.549 -15.980 1.317 1.00 0.00 H new ATOM 577 N GLU A 43 -1.654 -15.306 -1.398 1.00 0.00 N ATOM 578 CA GLU A 43 -2.938 -15.635 -1.992 1.00 0.00 C ATOM 579 C GLU A 43 -2.827 -16.919 -2.818 1.00 0.00 C ATOM 580 O GLU A 43 -3.540 -17.888 -2.563 1.00 0.00 O ATOM 581 CB GLU A 43 -3.460 -14.478 -2.846 1.00 0.00 C ATOM 582 CG GLU A 43 -4.963 -14.279 -2.640 1.00 0.00 C ATOM 583 CD GLU A 43 -5.762 -14.902 -3.786 1.00 0.00 C ATOM 584 OE1 GLU A 43 -5.185 -15.001 -4.891 1.00 0.00 O ATOM 585 OE2 GLU A 43 -6.930 -15.266 -3.532 1.00 0.00 O ATOM 0 H GLU A 43 -1.170 -14.522 -1.835 1.00 0.00 H new ATOM 0 HA GLU A 43 -3.655 -15.803 -1.189 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -2.929 -13.562 -2.587 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.257 -14.677 -3.898 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.266 -14.728 -1.694 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.186 -13.214 -2.573 1.00 0.00 H new ATOM 592 N GLN A 44 -1.927 -16.883 -3.790 1.00 0.00 N ATOM 593 CA GLN A 44 -1.714 -18.032 -4.654 1.00 0.00 C ATOM 594 C GLN A 44 -1.648 -19.316 -3.824 1.00 0.00 C ATOM 595 O GLN A 44 -2.273 -20.316 -4.172 1.00 0.00 O ATOM 596 CB GLN A 44 -0.448 -17.857 -5.495 1.00 0.00 C ATOM 597 CG GLN A 44 0.798 -18.257 -4.701 1.00 0.00 C ATOM 598 CD GLN A 44 2.069 -18.015 -5.517 1.00 0.00 C ATOM 599 OE1 GLN A 44 2.033 -17.752 -6.708 1.00 0.00 O ATOM 600 NE2 GLN A 44 3.192 -18.119 -4.812 1.00 0.00 N ATOM 0 H GLN A 44 -1.337 -16.077 -3.998 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.558 -18.109 -5.339 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.519 -18.465 -6.397 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.361 -16.819 -5.816 1.00 0.00 H new ATOM 0 HG2 GLN A 44 0.842 -17.685 -3.774 1.00 0.00 H new ATOM 0 HG3 GLN A 44 0.735 -19.309 -4.423 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.151 -18.342 -3.817 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.094 -17.976 -5.266 1.00 0.00 H new ATOM 609 N ALA A 45 -0.885 -19.245 -2.743 1.00 0.00 N ATOM 610 CA ALA A 45 -0.730 -20.389 -1.861 1.00 0.00 C ATOM 611 C ALA A 45 -2.110 -20.876 -1.416 1.00 0.00 C ATOM 612 O ALA A 45 -2.380 -22.076 -1.420 1.00 0.00 O ATOM 613 CB ALA A 45 0.163 -20.005 -0.679 1.00 0.00 C ATOM 0 H ALA A 45 -0.368 -18.413 -2.458 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.243 -21.213 -2.383 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.279 -20.863 -0.017 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.141 -19.696 -1.047 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.295 -19.182 -0.129 1.00 0.00 H new ATOM 619 N VAL A 46 -2.947 -19.919 -1.042 1.00 0.00 N ATOM 620 CA VAL A 46 -4.293 -20.236 -0.595 1.00 0.00 C ATOM 621 C VAL A 46 -5.064 -20.896 -1.739 1.00 0.00 C ATOM 622 O VAL A 46 -5.395 -22.079 -1.669 1.00 0.00 O ATOM 623 CB VAL A 46 -4.977 -18.975 -0.062 1.00 0.00 C ATOM 624 CG1 VAL A 46 -6.488 -19.182 0.063 1.00 0.00 C ATOM 625 CG2 VAL A 46 -4.370 -18.546 1.276 1.00 0.00 C ATOM 0 H VAL A 46 -2.719 -18.925 -1.039 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.264 -20.948 0.230 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.807 -18.173 -0.780 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.950 -18.271 0.444 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.905 -19.418 -0.916 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.687 -20.004 0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -4.874 -17.648 1.633 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -4.495 -19.346 2.005 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.308 -18.338 1.144 1.00 0.00 H new ATOM 635 N ASP A 47 -5.328 -20.103 -2.767 1.00 0.00 N ATOM 636 CA ASP A 47 -6.054 -20.596 -3.926 1.00 0.00 C ATOM 637 C ASP A 47 -5.506 -21.969 -4.319 1.00 0.00 C ATOM 638 O ASP A 47 -6.223 -22.785 -4.897 1.00 0.00 O ATOM 639 CB ASP A 47 -5.884 -19.658 -5.122 1.00 0.00 C ATOM 640 CG ASP A 47 -7.187 -19.237 -5.805 1.00 0.00 C ATOM 641 OD1 ASP A 47 -8.153 -20.026 -5.718 1.00 0.00 O ATOM 642 OD2 ASP A 47 -7.188 -18.137 -6.398 1.00 0.00 O ATOM 0 H ASP A 47 -5.052 -19.122 -2.822 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.110 -20.656 -3.663 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.360 -18.762 -4.790 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.246 -20.146 -5.859 1.00 0.00 H new ATOM 647 N SER A 48 -4.240 -22.182 -3.991 1.00 0.00 N ATOM 648 CA SER A 48 -3.588 -23.442 -4.304 1.00 0.00 C ATOM 649 C SER A 48 -3.010 -24.062 -3.030 1.00 0.00 C ATOM 650 O SER A 48 -1.872 -24.528 -3.023 1.00 0.00 O ATOM 651 CB SER A 48 -2.485 -23.248 -5.346 1.00 0.00 C ATOM 652 OG SER A 48 -2.242 -24.436 -6.094 1.00 0.00 O ATOM 0 H SER A 48 -3.649 -21.503 -3.512 1.00 0.00 H new ATOM 0 HA SER A 48 -4.333 -24.117 -4.725 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.766 -22.443 -6.025 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.566 -22.939 -4.848 1.00 0.00 H new ATOM 0 HG SER A 48 -1.532 -24.271 -6.749 1.00 0.00 H new ATOM 658 N PHE A 49 -3.822 -24.048 -1.982 1.00 0.00 N ATOM 659 CA PHE A 49 -3.406 -24.603 -0.706 1.00 0.00 C ATOM 660 C PHE A 49 -3.966 -26.014 -0.513 1.00 0.00 C ATOM 661 O PHE A 49 -4.961 -26.381 -1.136 1.00 0.00 O ATOM 662 CB PHE A 49 -3.970 -23.690 0.384 1.00 0.00 C ATOM 663 CG PHE A 49 -3.929 -24.297 1.788 1.00 0.00 C ATOM 664 CD1 PHE A 49 -2.779 -24.257 2.512 1.00 0.00 C ATOM 665 CD2 PHE A 49 -5.043 -24.877 2.311 1.00 0.00 C ATOM 666 CE1 PHE A 49 -2.740 -24.821 3.815 1.00 0.00 C ATOM 667 CE2 PHE A 49 -5.004 -25.440 3.614 1.00 0.00 C ATOM 668 CZ PHE A 49 -3.854 -25.401 4.338 1.00 0.00 C ATOM 0 H PHE A 49 -4.766 -23.661 -1.991 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.319 -24.664 -0.664 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.409 -22.756 0.387 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.002 -23.441 0.137 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.895 -23.796 2.096 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.956 -24.909 1.736 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.827 -24.789 4.390 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.888 -25.899 4.030 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.825 -25.831 5.328 1.00 0.00 H new ATOM 678 N GLU A 50 -3.302 -26.766 0.353 1.00 0.00 N ATOM 679 CA GLU A 50 -3.720 -28.128 0.635 1.00 0.00 C ATOM 680 C GLU A 50 -3.524 -28.447 2.119 1.00 0.00 C ATOM 681 O GLU A 50 -2.447 -28.223 2.668 1.00 0.00 O ATOM 682 CB GLU A 50 -2.966 -29.127 -0.244 1.00 0.00 C ATOM 683 CG GLU A 50 -1.533 -29.324 0.254 1.00 0.00 C ATOM 684 CD GLU A 50 -0.593 -29.671 -0.903 1.00 0.00 C ATOM 685 OE1 GLU A 50 -0.873 -30.687 -1.575 1.00 0.00 O ATOM 686 OE2 GLU A 50 0.383 -28.913 -1.088 1.00 0.00 O ATOM 0 H GLU A 50 -2.478 -26.457 0.868 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.781 -28.217 0.401 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.489 -30.083 -0.245 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -2.951 -28.771 -1.274 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -1.188 -28.416 0.748 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -1.509 -30.120 0.998 1.00 0.00 H new ATOM 693 N GLY A 51 -4.583 -28.964 2.725 1.00 0.00 N ATOM 694 CA GLY A 51 -4.541 -29.316 4.134 1.00 0.00 C ATOM 695 C GLY A 51 -5.785 -28.807 4.864 1.00 0.00 C ATOM 696 O GLY A 51 -6.799 -28.506 4.235 1.00 0.00 O ATOM 0 H GLY A 51 -5.475 -29.147 2.266 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.470 -30.399 4.240 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.647 -28.892 4.592 1.00 0.00 H new ATOM 700 N LYS A 52 -5.668 -28.726 6.181 1.00 0.00 N ATOM 701 CA LYS A 52 -6.772 -28.258 7.003 1.00 0.00 C ATOM 702 C LYS A 52 -6.321 -27.037 7.807 1.00 0.00 C ATOM 703 O LYS A 52 -5.296 -26.430 7.499 1.00 0.00 O ATOM 704 CB LYS A 52 -7.315 -29.397 7.868 1.00 0.00 C ATOM 705 CG LYS A 52 -7.184 -30.742 7.150 1.00 0.00 C ATOM 706 CD LYS A 52 -8.141 -30.822 5.958 1.00 0.00 C ATOM 707 CE LYS A 52 -7.836 -32.046 5.092 1.00 0.00 C ATOM 708 NZ LYS A 52 -7.498 -31.632 3.712 1.00 0.00 N ATOM 0 H LYS A 52 -4.826 -28.976 6.700 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.605 -27.938 6.377 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -6.773 -29.431 8.813 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -8.362 -29.209 8.108 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -6.158 -30.877 6.807 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -7.397 -31.553 7.847 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -9.170 -30.872 6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -8.056 -29.917 5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -7.007 -32.607 5.523 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -8.698 -32.713 5.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -7.163 -32.457 3.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -8.343 -31.238 3.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -6.750 -30.910 3.740 1.00 0.00 H new ATOM 722 N LYS A 53 -7.110 -26.712 8.821 1.00 0.00 N ATOM 723 CA LYS A 53 -6.805 -25.574 9.671 1.00 0.00 C ATOM 724 C LYS A 53 -5.777 -25.990 10.725 1.00 0.00 C ATOM 725 O LYS A 53 -5.439 -25.207 11.611 1.00 0.00 O ATOM 726 CB LYS A 53 -8.088 -24.988 10.263 1.00 0.00 C ATOM 727 CG LYS A 53 -8.999 -24.439 9.162 1.00 0.00 C ATOM 728 CD LYS A 53 -10.116 -23.577 9.753 1.00 0.00 C ATOM 729 CE LYS A 53 -11.443 -23.833 9.036 1.00 0.00 C ATOM 730 NZ LYS A 53 -12.389 -24.536 9.932 1.00 0.00 N ATOM 0 H LYS A 53 -7.960 -27.217 9.073 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.355 -24.772 9.085 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -8.616 -25.756 10.828 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -7.839 -24.192 10.964 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.411 -23.847 8.460 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -9.432 -25.265 8.598 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -10.225 -23.795 10.816 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -9.850 -22.523 9.669 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -11.876 -22.887 8.711 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -11.270 -24.429 8.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -13.285 -24.702 9.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -11.980 -25.447 10.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -12.567 -23.953 10.775 1.00 0.00 H new ATOM 744 N THR A 54 -5.309 -27.223 10.594 1.00 0.00 N ATOM 745 CA THR A 54 -4.326 -27.753 11.523 1.00 0.00 C ATOM 746 C THR A 54 -2.943 -27.795 10.871 1.00 0.00 C ATOM 747 O THR A 54 -1.957 -27.367 11.470 1.00 0.00 O ATOM 748 CB THR A 54 -4.815 -29.123 11.999 1.00 0.00 C ATOM 749 OG1 THR A 54 -4.544 -29.989 10.900 1.00 0.00 O ATOM 750 CG2 THR A 54 -6.337 -29.180 12.151 1.00 0.00 C ATOM 0 H THR A 54 -5.593 -27.870 9.858 1.00 0.00 H new ATOM 0 HA THR A 54 -4.220 -27.108 12.395 1.00 0.00 H new ATOM 0 HB THR A 54 -4.345 -29.366 12.952 1.00 0.00 H new ATOM 0 HG1 THR A 54 -4.829 -30.900 11.123 1.00 0.00 H new ATOM 0 HG21 THR A 54 -6.632 -30.173 12.491 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.658 -28.437 12.881 1.00 0.00 H new ATOM 0 HG23 THR A 54 -6.807 -28.971 11.190 1.00 0.00 H new ATOM 758 N ASP A 55 -2.914 -28.314 9.653 1.00 0.00 N ATOM 759 CA ASP A 55 -1.668 -28.418 8.913 1.00 0.00 C ATOM 760 C ASP A 55 -0.837 -27.153 9.141 1.00 0.00 C ATOM 761 O ASP A 55 -1.360 -26.042 9.070 1.00 0.00 O ATOM 762 CB ASP A 55 -1.928 -28.547 7.411 1.00 0.00 C ATOM 763 CG ASP A 55 -2.519 -29.888 6.970 1.00 0.00 C ATOM 764 OD1 ASP A 55 -3.467 -30.341 7.648 1.00 0.00 O ATOM 765 OD2 ASP A 55 -2.009 -30.430 5.966 1.00 0.00 O ATOM 0 H ASP A 55 -3.734 -28.667 9.160 1.00 0.00 H new ATOM 0 HA ASP A 55 -1.140 -29.304 9.265 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.606 -27.750 7.105 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -0.989 -28.388 6.880 1.00 0.00 H new ATOM 770 N LYS A 56 0.443 -27.364 9.410 1.00 0.00 N ATOM 771 CA LYS A 56 1.350 -26.255 9.649 1.00 0.00 C ATOM 772 C LYS A 56 1.251 -25.262 8.489 1.00 0.00 C ATOM 773 O LYS A 56 1.310 -24.051 8.697 1.00 0.00 O ATOM 774 CB LYS A 56 2.769 -26.768 9.900 1.00 0.00 C ATOM 775 CG LYS A 56 3.535 -25.829 10.835 1.00 0.00 C ATOM 776 CD LYS A 56 4.114 -24.641 10.065 1.00 0.00 C ATOM 777 CE LYS A 56 4.289 -23.427 10.979 1.00 0.00 C ATOM 778 NZ LYS A 56 5.635 -22.837 10.805 1.00 0.00 N ATOM 0 H LYS A 56 0.873 -28.287 9.468 1.00 0.00 H new ATOM 0 HA LYS A 56 1.065 -25.718 10.554 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.727 -27.766 10.336 1.00 0.00 H new ATOM 0 HB3 LYS A 56 3.300 -26.856 8.952 1.00 0.00 H new ATOM 0 HG2 LYS A 56 2.870 -25.469 11.620 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.340 -26.376 11.326 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.076 -24.917 9.633 1.00 0.00 H new ATOM 0 HD3 LYS A 56 3.454 -24.384 9.236 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.527 -22.681 10.753 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.147 -23.723 12.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.596 -21.817 11.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.301 -23.293 11.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.955 -22.985 9.827 1.00 0.00 H new ATOM 792 N LYS A 57 1.103 -25.811 7.293 1.00 0.00 N ATOM 793 CA LYS A 57 0.996 -24.989 6.100 1.00 0.00 C ATOM 794 C LYS A 57 -0.045 -23.892 6.334 1.00 0.00 C ATOM 795 O LYS A 57 0.213 -22.719 6.066 1.00 0.00 O ATOM 796 CB LYS A 57 0.709 -25.858 4.874 1.00 0.00 C ATOM 797 CG LYS A 57 0.680 -25.014 3.598 1.00 0.00 C ATOM 798 CD LYS A 57 2.079 -24.501 3.249 1.00 0.00 C ATOM 799 CE LYS A 57 2.540 -25.046 1.895 1.00 0.00 C ATOM 800 NZ LYS A 57 3.379 -24.048 1.194 1.00 0.00 N ATOM 0 H LYS A 57 1.055 -26.816 7.124 1.00 0.00 H new ATOM 0 HA LYS A 57 1.944 -24.491 5.894 1.00 0.00 H new ATOM 0 HB2 LYS A 57 1.472 -26.631 4.785 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.247 -26.366 5.000 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.291 -25.610 2.772 1.00 0.00 H new ATOM 0 HG3 LYS A 57 0.002 -24.171 3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 57 2.075 -23.411 3.224 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.784 -24.800 4.025 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.104 -25.967 2.040 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.674 -25.296 1.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.684 -24.433 0.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 2.829 -23.179 1.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.215 -23.829 1.773 1.00 0.00 H new ATOM 814 N TYR A 58 -1.199 -24.312 6.830 1.00 0.00 N ATOM 815 CA TYR A 58 -2.280 -23.380 7.103 1.00 0.00 C ATOM 816 C TYR A 58 -1.815 -22.258 8.032 1.00 0.00 C ATOM 817 O TYR A 58 -2.091 -21.085 7.783 1.00 0.00 O ATOM 818 CB TYR A 58 -3.369 -24.192 7.808 1.00 0.00 C ATOM 819 CG TYR A 58 -4.642 -23.397 8.107 1.00 0.00 C ATOM 820 CD1 TYR A 58 -5.529 -23.107 7.091 1.00 0.00 C ATOM 821 CD2 TYR A 58 -4.902 -22.971 9.394 1.00 0.00 C ATOM 822 CE1 TYR A 58 -6.727 -22.359 7.373 1.00 0.00 C ATOM 823 CE2 TYR A 58 -6.100 -22.223 9.676 1.00 0.00 C ATOM 824 CZ TYR A 58 -6.953 -21.954 8.651 1.00 0.00 C ATOM 825 OH TYR A 58 -8.085 -21.248 8.918 1.00 0.00 O ATOM 0 H TYR A 58 -1.409 -25.285 7.050 1.00 0.00 H new ATOM 0 HA TYR A 58 -2.633 -22.920 6.180 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -3.626 -25.051 7.188 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.969 -24.583 8.743 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -5.325 -23.441 6.084 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -4.207 -23.199 10.189 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -7.430 -22.125 6.587 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -6.316 -21.883 10.678 1.00 0.00 H new ATOM 0 HH TYR A 58 -8.115 -21.027 9.872 1.00 0.00 H new ATOM 835 N LEU A 59 -1.116 -22.656 9.085 1.00 0.00 N ATOM 836 CA LEU A 59 -0.610 -21.698 10.053 1.00 0.00 C ATOM 837 C LEU A 59 0.376 -20.754 9.362 1.00 0.00 C ATOM 838 O LEU A 59 0.251 -19.535 9.469 1.00 0.00 O ATOM 839 CB LEU A 59 -0.021 -22.422 11.266 1.00 0.00 C ATOM 840 CG LEU A 59 -1.017 -23.187 12.139 1.00 0.00 C ATOM 841 CD1 LEU A 59 -1.653 -24.342 11.363 1.00 0.00 C ATOM 842 CD2 LEU A 59 -0.357 -23.663 13.435 1.00 0.00 C ATOM 0 H LEU A 59 -0.888 -23.629 9.289 1.00 0.00 H new ATOM 0 HA LEU A 59 -1.422 -21.083 10.441 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.736 -23.123 10.914 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.490 -21.688 11.890 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.821 -22.505 12.417 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.357 -24.869 12.007 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.181 -23.949 10.494 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.875 -25.032 11.035 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.087 -24.204 14.038 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.478 -24.322 13.197 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.009 -22.802 13.995 1.00 0.00 H new ATOM 854 N MET A 60 1.333 -21.353 8.669 1.00 0.00 N ATOM 855 CA MET A 60 2.339 -20.580 7.961 1.00 0.00 C ATOM 856 C MET A 60 1.695 -19.456 7.147 1.00 0.00 C ATOM 857 O MET A 60 2.067 -18.292 7.286 1.00 0.00 O ATOM 858 CB MET A 60 3.126 -21.501 7.026 1.00 0.00 C ATOM 859 CG MET A 60 4.418 -21.982 7.690 1.00 0.00 C ATOM 860 SD MET A 60 5.044 -23.420 6.838 1.00 0.00 S ATOM 861 CE MET A 60 5.224 -22.751 5.193 1.00 0.00 C ATOM 0 H MET A 60 1.433 -22.364 8.583 1.00 0.00 H new ATOM 0 HA MET A 60 3.010 -20.133 8.695 1.00 0.00 H new ATOM 0 HB2 MET A 60 2.512 -22.359 6.753 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.362 -20.972 6.103 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.163 -21.186 7.674 1.00 0.00 H new ATOM 0 HG3 MET A 60 4.231 -22.222 8.737 1.00 0.00 H new ATOM 0 HE1 MET A 60 5.860 -23.409 4.600 1.00 0.00 H new ATOM 0 HE2 MET A 60 4.244 -22.673 4.723 1.00 0.00 H new ATOM 0 HE3 MET A 60 5.678 -21.762 5.250 1.00 0.00 H new ATOM 871 N ILE A 61 0.740 -19.844 6.315 1.00 0.00 N ATOM 872 CA ILE A 61 0.040 -18.884 5.478 1.00 0.00 C ATOM 873 C ILE A 61 -0.775 -17.940 6.365 1.00 0.00 C ATOM 874 O ILE A 61 -0.814 -16.734 6.124 1.00 0.00 O ATOM 875 CB ILE A 61 -0.794 -19.604 4.417 1.00 0.00 C ATOM 876 CG1 ILE A 61 0.101 -20.392 3.458 1.00 0.00 C ATOM 877 CG2 ILE A 61 -1.705 -18.623 3.676 1.00 0.00 C ATOM 878 CD1 ILE A 61 -0.725 -21.363 2.611 1.00 0.00 C ATOM 0 H ILE A 61 0.434 -20.811 6.202 1.00 0.00 H new ATOM 0 HA ILE A 61 0.752 -18.270 4.927 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.439 -20.324 4.920 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.639 -19.703 2.807 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.850 -20.945 4.025 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.287 -19.161 2.927 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.380 -18.146 4.386 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.098 -17.862 3.186 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.065 -21.911 1.938 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.242 -22.066 3.264 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.457 -20.805 2.027 1.00 0.00 H new ATOM 890 N GLU A 62 -1.406 -18.524 7.373 1.00 0.00 N ATOM 891 CA GLU A 62 -2.218 -17.751 8.296 1.00 0.00 C ATOM 892 C GLU A 62 -1.413 -16.575 8.854 1.00 0.00 C ATOM 893 O GLU A 62 -1.790 -15.418 8.671 1.00 0.00 O ATOM 894 CB GLU A 62 -2.754 -18.632 9.426 1.00 0.00 C ATOM 895 CG GLU A 62 -3.720 -17.852 10.320 1.00 0.00 C ATOM 896 CD GLU A 62 -2.967 -16.842 11.189 1.00 0.00 C ATOM 897 OE1 GLU A 62 -2.273 -17.301 12.121 1.00 0.00 O ATOM 898 OE2 GLU A 62 -3.103 -15.633 10.900 1.00 0.00 O ATOM 0 H GLU A 62 -1.371 -19.524 7.570 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.075 -17.355 7.751 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.263 -19.499 9.005 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -1.924 -19.008 10.023 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.453 -17.332 9.703 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.272 -18.544 10.956 1.00 0.00 H new ATOM 905 N GLU A 63 -0.320 -16.911 9.523 1.00 0.00 N ATOM 906 CA GLU A 63 0.541 -15.898 10.108 1.00 0.00 C ATOM 907 C GLU A 63 1.096 -14.979 9.018 1.00 0.00 C ATOM 908 O GLU A 63 1.101 -13.759 9.173 1.00 0.00 O ATOM 909 CB GLU A 63 1.673 -16.539 10.914 1.00 0.00 C ATOM 910 CG GLU A 63 2.915 -16.746 10.044 1.00 0.00 C ATOM 911 CD GLU A 63 4.044 -17.395 10.848 1.00 0.00 C ATOM 912 OE1 GLU A 63 4.606 -16.687 11.711 1.00 0.00 O ATOM 913 OE2 GLU A 63 4.319 -18.585 10.581 1.00 0.00 O ATOM 0 H GLU A 63 -0.011 -17.871 9.673 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.054 -15.296 10.795 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.922 -15.906 11.765 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.342 -17.497 11.315 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.664 -17.374 9.189 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.250 -15.787 9.648 1.00 0.00 H new ATOM 920 N TYR A 64 1.549 -15.600 7.939 1.00 0.00 N ATOM 921 CA TYR A 64 2.104 -14.853 6.823 1.00 0.00 C ATOM 922 C TYR A 64 1.137 -13.764 6.356 1.00 0.00 C ATOM 923 O TYR A 64 1.548 -12.635 6.091 1.00 0.00 O ATOM 924 CB TYR A 64 2.298 -15.865 5.693 1.00 0.00 C ATOM 925 CG TYR A 64 3.701 -16.473 5.635 1.00 0.00 C ATOM 926 CD1 TYR A 64 4.809 -15.668 5.801 1.00 0.00 C ATOM 927 CD2 TYR A 64 3.857 -17.827 5.417 1.00 0.00 C ATOM 928 CE1 TYR A 64 6.129 -16.240 5.746 1.00 0.00 C ATOM 929 CE2 TYR A 64 5.178 -18.399 5.363 1.00 0.00 C ATOM 930 CZ TYR A 64 6.249 -17.578 5.530 1.00 0.00 C ATOM 931 OH TYR A 64 7.496 -18.118 5.479 1.00 0.00 O ATOM 0 H TYR A 64 1.543 -16.612 7.814 1.00 0.00 H new ATOM 0 HA TYR A 64 3.035 -14.366 7.113 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.570 -16.668 5.809 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.085 -15.377 4.742 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.686 -14.609 5.972 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.989 -18.457 5.287 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.005 -15.621 5.873 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.315 -19.457 5.194 1.00 0.00 H new ATOM 0 HH TYR A 64 7.428 -19.083 5.320 1.00 0.00 H new ATOM 941 N LEU A 65 -0.131 -14.140 6.270 1.00 0.00 N ATOM 942 CA LEU A 65 -1.160 -13.210 5.840 1.00 0.00 C ATOM 943 C LEU A 65 -1.223 -12.037 6.820 1.00 0.00 C ATOM 944 O LEU A 65 -0.964 -10.894 6.444 1.00 0.00 O ATOM 945 CB LEU A 65 -2.496 -13.934 5.661 1.00 0.00 C ATOM 946 CG LEU A 65 -2.589 -14.884 4.466 1.00 0.00 C ATOM 947 CD1 LEU A 65 -3.814 -15.794 4.583 1.00 0.00 C ATOM 948 CD2 LEU A 65 -2.574 -14.109 3.146 1.00 0.00 C ATOM 0 H LEU A 65 -0.468 -15.077 6.491 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.915 -12.796 4.862 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.703 -14.502 6.568 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.283 -13.185 5.567 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.709 -15.527 4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.857 -16.459 3.721 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.742 -16.386 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.718 -15.185 4.616 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.641 -14.808 2.313 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -3.423 -13.426 3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.647 -13.540 3.068 1.00 0.00 H new ATOM 960 N THR A 66 -1.569 -12.359 8.058 1.00 0.00 N ATOM 961 CA THR A 66 -1.669 -11.346 9.095 1.00 0.00 C ATOM 962 C THR A 66 -0.428 -10.451 9.088 1.00 0.00 C ATOM 963 O THR A 66 -0.535 -9.233 9.221 1.00 0.00 O ATOM 964 CB THR A 66 -1.897 -12.057 10.430 1.00 0.00 C ATOM 965 OG1 THR A 66 -3.278 -12.407 10.405 1.00 0.00 O ATOM 966 CG2 THR A 66 -1.774 -11.111 11.626 1.00 0.00 C ATOM 0 H THR A 66 -1.784 -13.307 8.366 1.00 0.00 H new ATOM 0 HA THR A 66 -2.513 -10.680 8.917 1.00 0.00 H new ATOM 0 HB THR A 66 -1.179 -12.870 10.535 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.373 -13.373 10.543 1.00 0.00 H new ATOM 0 HG21 THR A 66 -1.945 -11.666 12.548 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.775 -10.676 11.644 1.00 0.00 H new ATOM 0 HG23 THR A 66 -2.515 -10.316 11.539 1.00 0.00 H new ATOM 974 N LYS A 67 0.722 -11.090 8.931 1.00 0.00 N ATOM 975 CA LYS A 67 1.983 -10.367 8.904 1.00 0.00 C ATOM 976 C LYS A 67 1.846 -9.147 7.992 1.00 0.00 C ATOM 977 O LYS A 67 2.391 -8.083 8.286 1.00 0.00 O ATOM 978 CB LYS A 67 3.129 -11.302 8.514 1.00 0.00 C ATOM 979 CG LYS A 67 3.800 -11.895 9.754 1.00 0.00 C ATOM 980 CD LYS A 67 4.627 -13.130 9.393 1.00 0.00 C ATOM 981 CE LYS A 67 5.535 -13.541 10.554 1.00 0.00 C ATOM 982 NZ LYS A 67 6.877 -12.937 10.400 1.00 0.00 N ATOM 0 H LYS A 67 0.807 -12.100 8.821 1.00 0.00 H new ATOM 0 HA LYS A 67 2.231 -9.996 9.898 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.749 -12.105 7.883 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.865 -10.755 7.925 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.442 -11.146 10.218 1.00 0.00 H new ATOM 0 HG3 LYS A 67 3.041 -12.163 10.489 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.962 -13.955 9.137 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.231 -12.922 8.510 1.00 0.00 H new ATOM 0 HE2 LYS A 67 5.093 -13.224 11.499 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.620 -14.627 10.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.481 -13.226 11.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.303 -13.260 9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.792 -11.901 10.388 1.00 0.00 H new ATOM 996 N GLU A 68 1.117 -9.340 6.903 1.00 0.00 N ATOM 997 CA GLU A 68 0.903 -8.268 5.946 1.00 0.00 C ATOM 998 C GLU A 68 -0.093 -7.249 6.504 1.00 0.00 C ATOM 999 O GLU A 68 0.009 -6.057 6.219 1.00 0.00 O ATOM 1000 CB GLU A 68 0.425 -8.821 4.601 1.00 0.00 C ATOM 1001 CG GLU A 68 1.320 -9.970 4.132 1.00 0.00 C ATOM 1002 CD GLU A 68 2.777 -9.517 4.014 1.00 0.00 C ATOM 1003 OE1 GLU A 68 3.010 -8.548 3.261 1.00 0.00 O ATOM 1004 OE2 GLU A 68 3.623 -10.151 4.680 1.00 0.00 O ATOM 0 H GLU A 68 0.667 -10.223 6.662 1.00 0.00 H new ATOM 0 HA GLU A 68 1.854 -7.763 5.777 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -0.604 -9.170 4.692 1.00 0.00 H new ATOM 0 HB3 GLU A 68 0.427 -8.026 3.855 1.00 0.00 H new ATOM 0 HG2 GLU A 68 1.249 -10.801 4.834 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.970 -10.338 3.167 1.00 0.00 H new ATOM 1011 N LEU A 69 -1.032 -7.756 7.289 1.00 0.00 N ATOM 1012 CA LEU A 69 -2.044 -6.905 7.890 1.00 0.00 C ATOM 1013 C LEU A 69 -1.368 -5.882 8.806 1.00 0.00 C ATOM 1014 O LEU A 69 -1.566 -4.678 8.651 1.00 0.00 O ATOM 1015 CB LEU A 69 -3.107 -7.751 8.594 1.00 0.00 C ATOM 1016 CG LEU A 69 -4.090 -8.488 7.681 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -4.997 -9.417 8.489 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -4.892 -7.502 6.829 1.00 0.00 C ATOM 0 H LEU A 69 -1.113 -8.746 7.523 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.574 -6.344 7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.602 -8.487 9.220 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.676 -7.103 9.260 1.00 0.00 H new ATOM 0 HG LEU A 69 -3.517 -9.113 6.996 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.686 -9.928 7.817 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.389 -10.153 9.014 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.564 -8.832 9.213 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.583 -8.052 6.190 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.455 -6.833 7.480 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.211 -6.918 6.210 1.00 0.00 H new ATOM 1030 N LEU A 70 -0.582 -6.400 9.739 1.00 0.00 N ATOM 1031 CA LEU A 70 0.125 -5.547 10.679 1.00 0.00 C ATOM 1032 C LEU A 70 0.979 -4.541 9.906 1.00 0.00 C ATOM 1033 O LEU A 70 1.145 -3.401 10.337 1.00 0.00 O ATOM 1034 CB LEU A 70 0.922 -6.393 11.675 1.00 0.00 C ATOM 1035 CG LEU A 70 0.113 -7.050 12.795 1.00 0.00 C ATOM 1036 CD1 LEU A 70 -0.494 -5.997 13.724 1.00 0.00 C ATOM 1037 CD2 LEU A 70 -0.950 -7.991 12.224 1.00 0.00 C ATOM 0 H LEU A 70 -0.419 -7.399 9.864 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.582 -4.972 11.277 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.442 -7.175 11.122 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.686 -5.761 12.128 1.00 0.00 H new ATOM 0 HG LEU A 70 0.791 -7.656 13.395 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.064 -6.491 14.511 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.303 -5.403 14.171 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.155 -5.345 13.153 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.511 -8.445 13.041 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -1.631 -7.427 11.586 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.467 -8.772 11.637 1.00 0.00 H new ATOM 1049 N ALA A 71 1.498 -4.998 8.776 1.00 0.00 N ATOM 1050 CA ALA A 71 2.330 -4.152 7.938 1.00 0.00 C ATOM 1051 C ALA A 71 1.457 -3.092 7.264 1.00 0.00 C ATOM 1052 O ALA A 71 1.942 -2.021 6.904 1.00 0.00 O ATOM 1053 CB ALA A 71 3.083 -5.018 6.925 1.00 0.00 C ATOM 0 H ALA A 71 1.358 -5.944 8.421 1.00 0.00 H new ATOM 0 HA ALA A 71 3.075 -3.631 8.539 1.00 0.00 H new ATOM 0 HB1 ALA A 71 3.707 -4.383 6.296 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.711 -5.734 7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.367 -5.554 6.302 1.00 0.00 H new ATOM 1059 N LEU A 72 0.184 -3.429 7.113 1.00 0.00 N ATOM 1060 CA LEU A 72 -0.761 -2.519 6.488 1.00 0.00 C ATOM 1061 C LEU A 72 -1.257 -1.512 7.527 1.00 0.00 C ATOM 1062 O LEU A 72 -1.552 -0.366 7.195 1.00 0.00 O ATOM 1063 CB LEU A 72 -1.884 -3.301 5.804 1.00 0.00 C ATOM 1064 CG LEU A 72 -1.550 -3.896 4.434 1.00 0.00 C ATOM 1065 CD1 LEU A 72 -2.353 -5.174 4.181 1.00 0.00 C ATOM 1066 CD2 LEU A 72 -1.752 -2.863 3.324 1.00 0.00 C ATOM 0 H LEU A 72 -0.215 -4.319 7.412 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.274 -1.947 5.698 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.190 -4.112 6.465 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.743 -2.640 5.691 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.496 -4.172 4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.097 -5.577 3.201 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.116 -5.910 4.949 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.419 -4.946 4.213 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.508 -3.311 2.361 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.791 -2.534 3.318 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.101 -2.007 3.501 1.00 0.00 H new ATOM 1078 N ASP A 73 -1.332 -1.977 8.766 1.00 0.00 N ATOM 1079 CA ASP A 73 -1.787 -1.132 9.856 1.00 0.00 C ATOM 1080 C ASP A 73 -0.702 -0.106 10.187 1.00 0.00 C ATOM 1081 O ASP A 73 -1.004 1.004 10.623 1.00 0.00 O ATOM 1082 CB ASP A 73 -2.058 -1.956 11.116 1.00 0.00 C ATOM 1083 CG ASP A 73 -3.295 -1.534 11.912 1.00 0.00 C ATOM 1084 OD1 ASP A 73 -4.362 -1.400 11.274 1.00 0.00 O ATOM 1085 OD2 ASP A 73 -3.146 -1.355 13.140 1.00 0.00 O ATOM 0 H ASP A 73 -1.085 -2.928 9.038 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.708 -0.642 9.541 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.168 -3.002 10.831 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -1.186 -1.893 11.768 1.00 0.00 H new ATOM 1090 N SER A 74 0.539 -0.513 9.967 1.00 0.00 N ATOM 1091 CA SER A 74 1.671 0.358 10.236 1.00 0.00 C ATOM 1092 C SER A 74 1.623 1.578 9.315 1.00 0.00 C ATOM 1093 O SER A 74 2.277 2.586 9.580 1.00 0.00 O ATOM 1094 CB SER A 74 2.995 -0.389 10.059 1.00 0.00 C ATOM 1095 OG SER A 74 4.098 0.349 10.579 1.00 0.00 O ATOM 0 H SER A 74 0.786 -1.434 9.606 1.00 0.00 H new ATOM 0 HA SER A 74 1.608 0.690 11.272 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.936 -1.355 10.561 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.160 -0.589 9.000 1.00 0.00 H new ATOM 0 HG SER A 74 4.924 -0.162 10.448 1.00 0.00 H new ATOM 1101 N VAL A 75 0.844 1.447 8.252 1.00 0.00 N ATOM 1102 CA VAL A 75 0.702 2.527 7.290 1.00 0.00 C ATOM 1103 C VAL A 75 -0.291 3.559 7.830 1.00 0.00 C ATOM 1104 O VAL A 75 -1.431 3.222 8.146 1.00 0.00 O ATOM 1105 CB VAL A 75 0.297 1.964 5.926 1.00 0.00 C ATOM 1106 CG1 VAL A 75 -0.015 3.090 4.938 1.00 0.00 C ATOM 1107 CG2 VAL A 75 1.378 1.033 5.374 1.00 0.00 C ATOM 0 H VAL A 75 0.304 0.609 8.035 1.00 0.00 H new ATOM 0 HA VAL A 75 1.654 3.037 7.146 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.612 1.378 6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.300 2.662 3.977 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.836 3.695 5.323 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.868 3.716 4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.065 0.647 4.404 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.311 1.585 5.261 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.530 0.202 6.063 1.00 0.00 H new ATOM 1117 N ASP A 76 0.179 4.794 7.919 1.00 0.00 N ATOM 1118 CA ASP A 76 -0.654 5.877 8.415 1.00 0.00 C ATOM 1119 C ASP A 76 -1.009 6.813 7.258 1.00 0.00 C ATOM 1120 O ASP A 76 -0.159 7.560 6.775 1.00 0.00 O ATOM 1121 CB ASP A 76 0.083 6.696 9.477 1.00 0.00 C ATOM 1122 CG ASP A 76 -0.769 7.113 10.677 1.00 0.00 C ATOM 1123 OD1 ASP A 76 -1.706 7.911 10.459 1.00 0.00 O ATOM 1124 OD2 ASP A 76 -0.463 6.626 11.787 1.00 0.00 O ATOM 0 H ASP A 76 1.125 5.069 7.656 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.550 5.439 8.855 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.932 6.116 9.837 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.486 7.593 9.007 1.00 0.00 H new ATOM 1129 N PRO A 77 -2.300 6.741 6.835 1.00 0.00 N ATOM 1130 CA PRO A 77 -2.777 7.572 5.744 1.00 0.00 C ATOM 1131 C PRO A 77 -2.973 9.019 6.202 1.00 0.00 C ATOM 1132 O PRO A 77 -3.012 9.934 5.381 1.00 0.00 O ATOM 1133 CB PRO A 77 -4.069 6.915 5.285 1.00 0.00 C ATOM 1134 CG PRO A 77 -4.508 6.015 6.428 1.00 0.00 C ATOM 1135 CD PRO A 77 -3.334 5.868 7.383 1.00 0.00 C ATOM 0 HA PRO A 77 -2.064 7.637 4.922 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -4.830 7.663 5.063 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -3.912 6.339 4.373 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -5.368 6.444 6.943 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.817 5.040 6.050 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.607 6.165 8.396 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -2.993 4.834 7.435 1.00 0.00 H new ATOM 1143 N GLU A 78 -3.090 9.181 7.512 1.00 0.00 N ATOM 1144 CA GLU A 78 -3.280 10.501 8.089 1.00 0.00 C ATOM 1145 C GLU A 78 -4.660 11.048 7.719 1.00 0.00 C ATOM 1146 O GLU A 78 -5.488 11.296 8.594 1.00 0.00 O ATOM 1147 CB GLU A 78 -2.173 11.458 7.644 1.00 0.00 C ATOM 1148 CG GLU A 78 -0.809 11.000 8.164 1.00 0.00 C ATOM 1149 CD GLU A 78 -0.009 12.180 8.718 1.00 0.00 C ATOM 1150 OE1 GLU A 78 -0.571 12.895 9.575 1.00 0.00 O ATOM 1151 OE2 GLU A 78 1.148 12.341 8.271 1.00 0.00 O ATOM 0 H GLU A 78 -3.057 8.420 8.190 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.225 10.414 9.174 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.151 11.513 6.556 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.387 12.462 8.010 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.946 10.251 8.944 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.250 10.523 7.359 1.00 0.00 H new ATOM 1158 N GLY A 79 -4.865 11.220 6.421 1.00 0.00 N ATOM 1159 CA GLY A 79 -6.130 11.734 5.925 1.00 0.00 C ATOM 1160 C GLY A 79 -6.115 11.847 4.400 1.00 0.00 C ATOM 1161 O GLY A 79 -6.690 12.778 3.837 1.00 0.00 O ATOM 0 H GLY A 79 -4.176 11.012 5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -6.941 11.076 6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.326 12.712 6.364 1.00 0.00 H new ATOM 1165 N ARG A 80 -5.452 10.887 3.773 1.00 0.00 N ATOM 1166 CA ARG A 80 -5.355 10.868 2.323 1.00 0.00 C ATOM 1167 C ARG A 80 -6.081 9.645 1.759 1.00 0.00 C ATOM 1168 O ARG A 80 -5.685 8.509 2.016 1.00 0.00 O ATOM 1169 CB ARG A 80 -3.894 10.839 1.870 1.00 0.00 C ATOM 1170 CG ARG A 80 -3.332 12.257 1.740 1.00 0.00 C ATOM 1171 CD ARG A 80 -1.988 12.249 1.009 1.00 0.00 C ATOM 1172 NE ARG A 80 -2.144 12.830 -0.343 1.00 0.00 N ATOM 1173 CZ ARG A 80 -1.148 13.401 -1.035 1.00 0.00 C ATOM 1174 NH1 ARG A 80 0.081 13.471 -0.506 1.00 0.00 N ATOM 1175 NH2 ARG A 80 -1.382 13.902 -2.256 1.00 0.00 N ATOM 0 H ARG A 80 -4.976 10.116 4.242 1.00 0.00 H new ATOM 0 HA ARG A 80 -5.823 11.778 1.947 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -3.299 10.272 2.586 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.817 10.324 0.912 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -4.040 12.885 1.199 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -3.209 12.695 2.730 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.253 12.820 1.576 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.611 11.229 0.934 1.00 0.00 H new ATOM 0 HE ARG A 80 -3.067 12.794 -0.775 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.259 13.090 0.423 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.839 13.905 -1.033 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -2.318 13.849 -2.658 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.624 14.337 -2.783 1.00 0.00 H new ATOM 1189 N ALA A 81 -7.132 9.919 0.999 1.00 0.00 N ATOM 1190 CA ALA A 81 -7.917 8.856 0.396 1.00 0.00 C ATOM 1191 C ALA A 81 -6.999 7.961 -0.439 1.00 0.00 C ATOM 1192 O ALA A 81 -7.012 6.740 -0.289 1.00 0.00 O ATOM 1193 CB ALA A 81 -9.049 9.464 -0.433 1.00 0.00 C ATOM 0 H ALA A 81 -7.458 10.862 0.787 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.374 8.234 1.165 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.638 8.666 -0.885 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.689 10.066 0.212 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.628 10.094 -1.217 1.00 0.00 H new ATOM 1199 N ASP A 82 -6.224 8.603 -1.301 1.00 0.00 N ATOM 1200 CA ASP A 82 -5.301 7.880 -2.160 1.00 0.00 C ATOM 1201 C ASP A 82 -4.597 6.794 -1.345 1.00 0.00 C ATOM 1202 O ASP A 82 -4.262 5.735 -1.874 1.00 0.00 O ATOM 1203 CB ASP A 82 -4.231 8.814 -2.728 1.00 0.00 C ATOM 1204 CG ASP A 82 -3.661 8.396 -4.085 1.00 0.00 C ATOM 1205 OD1 ASP A 82 -3.721 7.181 -4.375 1.00 0.00 O ATOM 1206 OD2 ASP A 82 -3.179 9.299 -4.801 1.00 0.00 O ATOM 0 H ASP A 82 -6.216 9.616 -1.423 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.873 7.446 -2.980 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -4.655 9.814 -2.822 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -3.412 8.881 -2.012 1.00 0.00 H new ATOM 1211 N VAL A 83 -4.393 7.094 -0.071 1.00 0.00 N ATOM 1212 CA VAL A 83 -3.734 6.156 0.823 1.00 0.00 C ATOM 1213 C VAL A 83 -4.791 5.335 1.564 1.00 0.00 C ATOM 1214 O VAL A 83 -4.856 4.117 1.411 1.00 0.00 O ATOM 1215 CB VAL A 83 -2.790 6.906 1.765 1.00 0.00 C ATOM 1216 CG1 VAL A 83 -1.909 5.931 2.548 1.00 0.00 C ATOM 1217 CG2 VAL A 83 -1.939 7.918 0.997 1.00 0.00 C ATOM 0 H VAL A 83 -4.672 7.973 0.364 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.118 5.457 0.257 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.399 7.457 2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.247 6.490 3.210 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.539 5.267 3.140 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.312 5.341 1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.277 8.437 1.690 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.343 7.398 0.247 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.589 8.642 0.506 1.00 0.00 H new ATOM 1227 N ARG A 84 -5.594 6.037 2.351 1.00 0.00 N ATOM 1228 CA ARG A 84 -6.646 5.389 3.116 1.00 0.00 C ATOM 1229 C ARG A 84 -7.278 4.261 2.299 1.00 0.00 C ATOM 1230 O ARG A 84 -7.735 3.265 2.858 1.00 0.00 O ATOM 1231 CB ARG A 84 -7.731 6.389 3.517 1.00 0.00 C ATOM 1232 CG ARG A 84 -7.401 7.048 4.858 1.00 0.00 C ATOM 1233 CD ARG A 84 -8.609 7.019 5.796 1.00 0.00 C ATOM 1234 NE ARG A 84 -8.185 7.337 7.178 1.00 0.00 N ATOM 1235 CZ ARG A 84 -8.895 7.027 8.271 1.00 0.00 C ATOM 1236 NH1 ARG A 84 -10.067 6.389 8.151 1.00 0.00 N ATOM 1237 NH2 ARG A 84 -8.432 7.355 9.486 1.00 0.00 N ATOM 0 H ARG A 84 -5.537 7.048 2.475 1.00 0.00 H new ATOM 0 HA ARG A 84 -6.195 4.979 4.019 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.829 7.154 2.746 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -8.693 5.880 3.585 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -6.562 6.532 5.324 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -7.089 8.079 4.693 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -9.357 7.738 5.462 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -9.078 6.035 5.768 1.00 0.00 H new ATOM 0 HE ARG A 84 -7.297 7.822 7.306 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -10.419 6.139 7.227 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -10.607 6.153 8.984 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.540 7.840 9.578 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.972 7.119 10.318 1.00 0.00 H new ATOM 1251 N GLN A 85 -7.285 4.454 0.988 1.00 0.00 N ATOM 1252 CA GLN A 85 -7.854 3.465 0.088 1.00 0.00 C ATOM 1253 C GLN A 85 -6.909 2.270 -0.053 1.00 0.00 C ATOM 1254 O GLN A 85 -7.165 1.203 0.503 1.00 0.00 O ATOM 1255 CB GLN A 85 -8.168 4.082 -1.276 1.00 0.00 C ATOM 1256 CG GLN A 85 -8.442 2.996 -2.318 1.00 0.00 C ATOM 1257 CD GLN A 85 -9.914 2.998 -2.738 1.00 0.00 C ATOM 1258 OE1 GLN A 85 -10.564 4.027 -2.809 1.00 0.00 O ATOM 1259 NE2 GLN A 85 -10.400 1.790 -3.011 1.00 0.00 N ATOM 0 H GLN A 85 -6.905 5.281 0.527 1.00 0.00 H new ATOM 0 HA GLN A 85 -8.793 3.111 0.514 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -9.035 4.738 -1.192 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -7.331 4.700 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -7.811 3.158 -3.192 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -8.178 2.020 -1.910 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -9.800 0.969 -2.931 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -11.372 1.685 -3.300 1.00 0.00 H new ATOM 1268 N ALA A 86 -5.838 2.490 -0.801 1.00 0.00 N ATOM 1269 CA ALA A 86 -4.853 1.444 -1.023 1.00 0.00 C ATOM 1270 C ALA A 86 -4.611 0.692 0.287 1.00 0.00 C ATOM 1271 O ALA A 86 -4.276 -0.492 0.274 1.00 0.00 O ATOM 1272 CB ALA A 86 -3.572 2.061 -1.587 1.00 0.00 C ATOM 0 H ALA A 86 -5.630 3.376 -1.261 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.217 0.723 -1.755 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.833 1.277 -1.754 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.793 2.558 -2.532 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.176 2.788 -0.878 1.00 0.00 H new ATOM 1278 N ARG A 87 -4.790 1.409 1.386 1.00 0.00 N ATOM 1279 CA ARG A 87 -4.594 0.824 2.702 1.00 0.00 C ATOM 1280 C ARG A 87 -5.772 -0.085 3.059 1.00 0.00 C ATOM 1281 O ARG A 87 -5.603 -1.293 3.217 1.00 0.00 O ATOM 1282 CB ARG A 87 -4.454 1.909 3.772 1.00 0.00 C ATOM 1283 CG ARG A 87 -4.043 1.303 5.115 1.00 0.00 C ATOM 1284 CD ARG A 87 -3.437 2.367 6.034 1.00 0.00 C ATOM 1285 NE ARG A 87 -3.889 2.151 7.426 1.00 0.00 N ATOM 1286 CZ ARG A 87 -5.173 2.159 7.809 1.00 0.00 C ATOM 1287 NH1 ARG A 87 -6.140 2.373 6.906 1.00 0.00 N ATOM 1288 NH2 ARG A 87 -5.491 1.953 9.094 1.00 0.00 N ATOM 0 H ARG A 87 -5.069 2.390 1.393 1.00 0.00 H new ATOM 0 HA ARG A 87 -3.675 0.239 2.671 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.711 2.642 3.457 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -5.399 2.440 3.883 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -4.912 0.853 5.596 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.320 0.504 4.952 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -2.349 2.324 5.986 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.732 3.361 5.697 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.179 1.986 8.139 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.898 2.530 5.927 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -7.118 2.379 7.197 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.755 1.790 9.782 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -6.469 1.959 9.385 1.00 0.00 H new ATOM 1302 N ARG A 88 -6.940 0.531 3.174 1.00 0.00 N ATOM 1303 CA ARG A 88 -8.145 -0.208 3.510 1.00 0.00 C ATOM 1304 C ARG A 88 -8.380 -1.329 2.496 1.00 0.00 C ATOM 1305 O ARG A 88 -9.009 -2.337 2.814 1.00 0.00 O ATOM 1306 CB ARG A 88 -9.367 0.713 3.532 1.00 0.00 C ATOM 1307 CG ARG A 88 -10.132 0.642 2.209 1.00 0.00 C ATOM 1308 CD ARG A 88 -11.392 1.508 2.257 1.00 0.00 C ATOM 1309 NE ARG A 88 -11.147 2.797 1.572 1.00 0.00 N ATOM 1310 CZ ARG A 88 -11.304 2.990 0.255 1.00 0.00 C ATOM 1311 NH1 ARG A 88 -11.705 1.978 -0.527 1.00 0.00 N ATOM 1312 NH2 ARG A 88 -11.058 4.194 -0.279 1.00 0.00 N ATOM 0 H ARG A 88 -7.077 1.533 3.040 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.006 -0.634 4.503 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -10.026 0.429 4.353 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.050 1.739 3.718 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -9.489 0.975 1.395 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -10.405 -0.392 1.998 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -12.221 0.985 1.780 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -11.681 1.686 3.293 1.00 0.00 H new ATOM 0 HE ARG A 88 -10.839 3.588 2.138 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -11.891 1.061 -0.120 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -11.825 2.124 -1.529 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -10.751 4.963 0.317 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -11.177 4.341 -1.281 1.00 0.00 H new ATOM 1326 N ASP A 89 -7.861 -1.117 1.295 1.00 0.00 N ATOM 1327 CA ASP A 89 -8.006 -2.097 0.233 1.00 0.00 C ATOM 1328 C ASP A 89 -7.062 -3.272 0.497 1.00 0.00 C ATOM 1329 O ASP A 89 -7.438 -4.429 0.312 1.00 0.00 O ATOM 1330 CB ASP A 89 -7.642 -1.495 -1.126 1.00 0.00 C ATOM 1331 CG ASP A 89 -8.186 -2.256 -2.337 1.00 0.00 C ATOM 1332 OD1 ASP A 89 -7.532 -3.248 -2.724 1.00 0.00 O ATOM 1333 OD2 ASP A 89 -9.243 -1.827 -2.847 1.00 0.00 O ATOM 0 H ASP A 89 -7.339 -0.280 1.034 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.046 -2.424 0.216 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.012 -0.470 -1.163 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -6.556 -1.445 -1.205 1.00 0.00 H new ATOM 1338 N GLY A 90 -5.855 -2.936 0.926 1.00 0.00 N ATOM 1339 CA GLY A 90 -4.855 -3.948 1.218 1.00 0.00 C ATOM 1340 C GLY A 90 -5.281 -4.813 2.406 1.00 0.00 C ATOM 1341 O GLY A 90 -5.223 -6.040 2.338 1.00 0.00 O ATOM 0 H GLY A 90 -5.547 -1.976 1.079 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -4.703 -4.578 0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.901 -3.469 1.436 1.00 0.00 H new ATOM 1345 N VAL A 91 -5.699 -4.140 3.467 1.00 0.00 N ATOM 1346 CA VAL A 91 -6.135 -4.831 4.669 1.00 0.00 C ATOM 1347 C VAL A 91 -7.323 -5.734 4.330 1.00 0.00 C ATOM 1348 O VAL A 91 -7.389 -6.876 4.783 1.00 0.00 O ATOM 1349 CB VAL A 91 -6.449 -3.818 5.771 1.00 0.00 C ATOM 1350 CG1 VAL A 91 -7.313 -4.448 6.865 1.00 0.00 C ATOM 1351 CG2 VAL A 91 -5.164 -3.230 6.358 1.00 0.00 C ATOM 0 H VAL A 91 -5.745 -3.122 3.520 1.00 0.00 H new ATOM 0 HA VAL A 91 -5.339 -5.470 5.052 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.017 -3.002 5.324 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.522 -3.706 7.636 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.251 -4.796 6.433 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -6.783 -5.292 7.307 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.416 -2.513 7.139 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.558 -4.031 6.782 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -4.602 -2.727 5.571 1.00 0.00 H new ATOM 1361 N ARG A 92 -8.233 -5.187 3.537 1.00 0.00 N ATOM 1362 CA ARG A 92 -9.415 -5.929 3.132 1.00 0.00 C ATOM 1363 C ARG A 92 -9.020 -7.129 2.269 1.00 0.00 C ATOM 1364 O ARG A 92 -9.670 -8.172 2.314 1.00 0.00 O ATOM 1365 CB ARG A 92 -10.381 -5.040 2.346 1.00 0.00 C ATOM 1366 CG ARG A 92 -11.339 -5.883 1.502 1.00 0.00 C ATOM 1367 CD ARG A 92 -12.568 -5.070 1.091 1.00 0.00 C ATOM 1368 NE ARG A 92 -13.538 -5.939 0.387 1.00 0.00 N ATOM 1369 CZ ARG A 92 -13.352 -6.424 -0.848 1.00 0.00 C ATOM 1370 NH1 ARG A 92 -12.233 -6.129 -1.523 1.00 0.00 N ATOM 1371 NH2 ARG A 92 -14.286 -7.205 -1.408 1.00 0.00 N ATOM 0 H ARG A 92 -8.176 -4.239 3.164 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.913 -6.277 4.037 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -10.950 -4.417 3.036 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -9.817 -4.367 1.700 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.823 -6.244 0.612 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.652 -6.761 2.068 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.034 -4.630 1.972 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.269 -4.246 0.443 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.401 -6.184 0.872 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.522 -5.535 -1.097 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.092 -6.499 -2.463 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.138 -7.430 -0.894 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.145 -7.575 -2.348 1.00 0.00 H new ATOM 1385 N LYS A 93 -7.955 -6.941 1.503 1.00 0.00 N ATOM 1386 CA LYS A 93 -7.466 -7.995 0.631 1.00 0.00 C ATOM 1387 C LYS A 93 -7.047 -9.198 1.477 1.00 0.00 C ATOM 1388 O LYS A 93 -7.644 -10.269 1.378 1.00 0.00 O ATOM 1389 CB LYS A 93 -6.354 -7.465 -0.277 1.00 0.00 C ATOM 1390 CG LYS A 93 -5.654 -8.610 -1.012 1.00 0.00 C ATOM 1391 CD LYS A 93 -6.373 -8.943 -2.321 1.00 0.00 C ATOM 1392 CE LYS A 93 -6.933 -10.366 -2.292 1.00 0.00 C ATOM 1393 NZ LYS A 93 -8.197 -10.442 -3.059 1.00 0.00 N ATOM 0 H LYS A 93 -7.418 -6.075 1.468 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.258 -8.335 -0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.773 -6.766 -1.001 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.627 -6.911 0.317 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.620 -8.335 -1.221 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.626 -9.493 -0.374 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.183 -8.233 -2.486 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.682 -8.837 -3.157 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -6.204 -11.059 -2.712 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.107 -10.673 -1.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -8.563 -11.415 -3.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.896 -9.796 -2.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.021 -10.169 -4.047 1.00 0.00 H new ATOM 1407 N VAL A 94 -6.025 -8.982 2.291 1.00 0.00 N ATOM 1408 CA VAL A 94 -5.520 -10.036 3.155 1.00 0.00 C ATOM 1409 C VAL A 94 -6.695 -10.728 3.849 1.00 0.00 C ATOM 1410 O VAL A 94 -6.867 -11.939 3.726 1.00 0.00 O ATOM 1411 CB VAL A 94 -4.498 -9.462 4.139 1.00 0.00 C ATOM 1412 CG1 VAL A 94 -3.799 -10.578 4.917 1.00 0.00 C ATOM 1413 CG2 VAL A 94 -3.480 -8.576 3.418 1.00 0.00 C ATOM 0 H VAL A 94 -5.532 -8.092 2.371 1.00 0.00 H new ATOM 0 HA VAL A 94 -4.998 -10.792 2.569 1.00 0.00 H new ATOM 0 HB VAL A 94 -5.036 -8.840 4.855 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.078 -10.143 5.609 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.539 -11.150 5.476 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.281 -11.238 4.221 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.765 -8.181 4.140 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.951 -9.165 2.669 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -3.997 -7.750 2.930 1.00 0.00 H new ATOM 1423 N GLN A 95 -7.473 -9.928 4.563 1.00 0.00 N ATOM 1424 CA GLN A 95 -8.627 -10.448 5.277 1.00 0.00 C ATOM 1425 C GLN A 95 -9.330 -11.519 4.440 1.00 0.00 C ATOM 1426 O GLN A 95 -9.451 -12.665 4.868 1.00 0.00 O ATOM 1427 CB GLN A 95 -9.593 -9.322 5.651 1.00 0.00 C ATOM 1428 CG GLN A 95 -9.023 -8.463 6.782 1.00 0.00 C ATOM 1429 CD GLN A 95 -10.016 -8.352 7.940 1.00 0.00 C ATOM 1430 OE1 GLN A 95 -11.149 -8.799 7.865 1.00 0.00 O ATOM 1431 NE2 GLN A 95 -9.530 -7.731 9.011 1.00 0.00 N ATOM 0 H GLN A 95 -7.327 -8.923 4.662 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.281 -10.907 6.203 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -9.786 -8.699 4.778 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -10.549 -9.745 5.958 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.090 -8.898 7.139 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.787 -7.468 6.404 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.572 -7.381 9.007 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -10.115 -7.605 9.837 1.00 0.00 H new ATOM 1440 N THR A 96 -9.774 -11.106 3.262 1.00 0.00 N ATOM 1441 CA THR A 96 -10.462 -12.016 2.362 1.00 0.00 C ATOM 1442 C THR A 96 -9.630 -13.281 2.144 1.00 0.00 C ATOM 1443 O THR A 96 -10.153 -14.392 2.218 1.00 0.00 O ATOM 1444 CB THR A 96 -10.767 -11.259 1.067 1.00 0.00 C ATOM 1445 OG1 THR A 96 -11.774 -10.322 1.442 1.00 0.00 O ATOM 1446 CG2 THR A 96 -11.450 -12.141 0.020 1.00 0.00 C ATOM 0 H THR A 96 -9.671 -10.154 2.910 1.00 0.00 H new ATOM 0 HA THR A 96 -11.406 -12.355 2.788 1.00 0.00 H new ATOM 0 HB THR A 96 -9.841 -10.857 0.655 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.351 -9.497 1.760 1.00 0.00 H new ATOM 0 HG21 THR A 96 -11.644 -11.555 -0.879 1.00 0.00 H new ATOM 0 HG22 THR A 96 -10.801 -12.981 -0.227 1.00 0.00 H new ATOM 0 HG23 THR A 96 -12.392 -12.516 0.419 1.00 0.00 H new ATOM 1454 N ILE A 97 -8.349 -13.071 1.880 1.00 0.00 N ATOM 1455 CA ILE A 97 -7.440 -14.181 1.651 1.00 0.00 C ATOM 1456 C ILE A 97 -7.474 -15.119 2.859 1.00 0.00 C ATOM 1457 O ILE A 97 -7.543 -16.337 2.701 1.00 0.00 O ATOM 1458 CB ILE A 97 -6.040 -13.665 1.311 1.00 0.00 C ATOM 1459 CG1 ILE A 97 -6.079 -12.725 0.105 1.00 0.00 C ATOM 1460 CG2 ILE A 97 -5.064 -14.825 1.103 1.00 0.00 C ATOM 1461 CD1 ILE A 97 -4.744 -11.999 -0.068 1.00 0.00 C ATOM 0 H ILE A 97 -7.919 -12.148 1.820 1.00 0.00 H new ATOM 0 HA ILE A 97 -7.758 -14.763 0.786 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.675 -13.085 2.158 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -6.307 -13.294 -0.796 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.879 -11.996 0.233 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.077 -14.431 0.863 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -5.005 -15.419 2.015 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -5.414 -15.452 0.283 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -4.799 -11.337 -0.932 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -4.531 -11.412 0.825 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.950 -12.730 -0.220 1.00 0.00 H new ATOM 1473 N LEU A 98 -7.424 -14.517 4.038 1.00 0.00 N ATOM 1474 CA LEU A 98 -7.448 -15.284 5.271 1.00 0.00 C ATOM 1475 C LEU A 98 -8.795 -15.997 5.397 1.00 0.00 C ATOM 1476 O LEU A 98 -8.876 -17.082 5.971 1.00 0.00 O ATOM 1477 CB LEU A 98 -7.112 -14.388 6.466 1.00 0.00 C ATOM 1478 CG LEU A 98 -5.636 -14.331 6.867 1.00 0.00 C ATOM 1479 CD1 LEU A 98 -5.342 -13.080 7.696 1.00 0.00 C ATOM 1480 CD2 LEU A 98 -5.216 -15.611 7.592 1.00 0.00 C ATOM 0 H LEU A 98 -7.367 -13.507 4.165 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.679 -16.056 5.254 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.446 -13.375 6.241 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.689 -14.730 7.325 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.037 -14.264 5.959 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.287 -13.064 7.968 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.580 -12.192 7.111 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.950 -13.092 8.601 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.163 -15.545 7.866 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.818 -15.734 8.492 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.367 -16.468 6.935 1.00 0.00 H new ATOM 1492 N GLU A 99 -9.820 -15.358 4.852 1.00 0.00 N ATOM 1493 CA GLU A 99 -11.160 -15.918 4.896 1.00 0.00 C ATOM 1494 C GLU A 99 -11.303 -17.035 3.861 1.00 0.00 C ATOM 1495 O GLU A 99 -12.216 -17.855 3.949 1.00 0.00 O ATOM 1496 CB GLU A 99 -12.216 -14.832 4.680 1.00 0.00 C ATOM 1497 CG GLU A 99 -13.404 -15.372 3.882 1.00 0.00 C ATOM 1498 CD GLU A 99 -14.480 -14.299 3.706 1.00 0.00 C ATOM 1499 OE1 GLU A 99 -14.093 -13.155 3.387 1.00 0.00 O ATOM 1500 OE2 GLU A 99 -15.665 -14.648 3.896 1.00 0.00 O ATOM 0 H GLU A 99 -9.749 -14.458 4.378 1.00 0.00 H new ATOM 0 HA GLU A 99 -11.322 -16.344 5.886 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.561 -14.459 5.644 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -11.772 -13.988 4.152 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -13.064 -15.715 2.905 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.828 -16.236 4.394 1.00 0.00 H new ATOM 1507 N LYS A 100 -10.387 -17.032 2.903 1.00 0.00 N ATOM 1508 CA LYS A 100 -10.400 -18.035 1.852 1.00 0.00 C ATOM 1509 C LYS A 100 -9.682 -19.293 2.345 1.00 0.00 C ATOM 1510 O LYS A 100 -10.238 -20.389 2.294 1.00 0.00 O ATOM 1511 CB LYS A 100 -9.818 -17.462 0.558 1.00 0.00 C ATOM 1512 CG LYS A 100 -9.901 -18.483 -0.579 1.00 0.00 C ATOM 1513 CD LYS A 100 -10.075 -17.785 -1.930 1.00 0.00 C ATOM 1514 CE LYS A 100 -8.736 -17.263 -2.453 1.00 0.00 C ATOM 1515 NZ LYS A 100 -8.870 -16.806 -3.855 1.00 0.00 N ATOM 0 H LYS A 100 -9.631 -16.351 2.833 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.424 -18.324 1.614 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -10.360 -16.558 0.280 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.779 -17.174 0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.997 -19.091 -0.593 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -10.737 -19.160 -0.405 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -10.505 -18.481 -2.650 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -10.777 -16.958 -1.828 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -8.390 -16.440 -1.827 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -7.983 -18.049 -2.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -8.106 -16.135 -4.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -8.808 -17.624 -4.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.790 -16.337 -3.981 1.00 0.00 H new ATOM 1529 N LEU A 101 -8.458 -19.093 2.811 1.00 0.00 N ATOM 1530 CA LEU A 101 -7.659 -20.198 3.312 1.00 0.00 C ATOM 1531 C LEU A 101 -8.497 -21.026 4.288 1.00 0.00 C ATOM 1532 O LEU A 101 -8.565 -22.249 4.171 1.00 0.00 O ATOM 1533 CB LEU A 101 -6.348 -19.683 3.911 1.00 0.00 C ATOM 1534 CG LEU A 101 -5.478 -20.724 4.617 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -4.706 -21.572 3.604 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -4.549 -20.062 5.636 1.00 0.00 C ATOM 0 H LEU A 101 -8.000 -18.182 2.852 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.371 -20.861 2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.761 -19.229 3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.583 -18.892 4.623 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.133 -21.398 5.169 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.095 -22.304 4.133 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.409 -22.089 2.952 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.062 -20.927 3.005 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.942 -20.824 6.124 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.899 -19.351 5.127 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.144 -19.539 6.384 1.00 0.00 H new ATOM 1548 N GLU A 102 -9.113 -20.327 5.230 1.00 0.00 N ATOM 1549 CA GLU A 102 -9.944 -20.983 6.226 1.00 0.00 C ATOM 1550 C GLU A 102 -10.722 -22.138 5.591 1.00 0.00 C ATOM 1551 O GLU A 102 -10.597 -23.284 6.019 1.00 0.00 O ATOM 1552 CB GLU A 102 -10.892 -19.984 6.893 1.00 0.00 C ATOM 1553 CG GLU A 102 -10.189 -19.235 8.027 1.00 0.00 C ATOM 1554 CD GLU A 102 -11.054 -18.082 8.540 1.00 0.00 C ATOM 1555 OE1 GLU A 102 -12.268 -18.319 8.720 1.00 0.00 O ATOM 1556 OE2 GLU A 102 -10.482 -16.989 8.741 1.00 0.00 O ATOM 0 H GLU A 102 -9.053 -19.313 5.325 1.00 0.00 H new ATOM 0 HA GLU A 102 -9.295 -21.391 7.001 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -11.255 -19.272 6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -11.763 -20.509 7.284 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.973 -19.924 8.844 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.233 -18.848 7.675 1.00 0.00 H new ATOM 1563 N GLN A 103 -11.507 -21.795 4.581 1.00 0.00 N ATOM 1564 CA GLN A 103 -12.306 -22.789 3.883 1.00 0.00 C ATOM 1565 C GLN A 103 -11.398 -23.784 3.157 1.00 0.00 C ATOM 1566 O GLN A 103 -11.663 -24.985 3.157 1.00 0.00 O ATOM 1567 CB GLN A 103 -13.280 -22.124 2.909 1.00 0.00 C ATOM 1568 CG GLN A 103 -14.554 -21.675 3.628 1.00 0.00 C ATOM 1569 CD GLN A 103 -15.705 -22.647 3.363 1.00 0.00 C ATOM 1570 OE1 GLN A 103 -16.005 -23.525 4.156 1.00 0.00 O ATOM 1571 NE2 GLN A 103 -16.330 -22.444 2.207 1.00 0.00 N ATOM 0 H GLN A 103 -11.607 -20.843 4.229 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.896 -23.335 4.619 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.801 -21.265 2.440 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -13.535 -22.822 2.111 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.367 -21.611 4.700 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.832 -20.676 3.292 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -16.028 -21.691 1.589 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -17.112 -23.042 1.938 1.00 0.00 H new ATOM 1580 N LYS A 104 -10.347 -23.247 2.556 1.00 0.00 N ATOM 1581 CA LYS A 104 -9.399 -24.074 1.828 1.00 0.00 C ATOM 1582 C LYS A 104 -8.872 -25.173 2.752 1.00 0.00 C ATOM 1583 O LYS A 104 -8.554 -26.271 2.298 1.00 0.00 O ATOM 1584 CB LYS A 104 -8.297 -23.209 1.211 1.00 0.00 C ATOM 1585 CG LYS A 104 -8.894 -22.031 0.438 1.00 0.00 C ATOM 1586 CD LYS A 104 -8.656 -22.185 -1.066 1.00 0.00 C ATOM 1587 CE LYS A 104 -9.235 -23.505 -1.579 1.00 0.00 C ATOM 1588 NZ LYS A 104 -9.087 -23.599 -3.049 1.00 0.00 N ATOM 0 H LYS A 104 -10.131 -22.250 2.558 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.891 -24.570 0.991 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.639 -22.837 1.996 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.685 -23.815 0.543 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.964 -21.966 0.636 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.449 -21.099 0.787 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -9.114 -21.351 -1.598 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.587 -22.147 -1.275 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -8.726 -24.342 -1.102 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -10.288 -23.577 -1.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -9.485 -24.501 -3.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -9.593 -22.810 -3.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -8.079 -23.552 -3.300 1.00 0.00 H new ATOM 1602 N ALA A 105 -8.796 -24.840 4.032 1.00 0.00 N ATOM 1603 CA ALA A 105 -8.313 -25.785 5.025 1.00 0.00 C ATOM 1604 C ALA A 105 -9.507 -26.460 5.703 1.00 0.00 C ATOM 1605 O ALA A 105 -9.414 -26.881 6.855 1.00 0.00 O ATOM 1606 CB ALA A 105 -7.408 -25.060 6.023 1.00 0.00 C ATOM 0 H ALA A 105 -9.061 -23.928 4.405 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.717 -26.566 4.553 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.046 -25.769 6.768 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.560 -24.624 5.495 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.972 -24.270 6.519 1.00 0.00 H new ATOM 1612 N SER A 106 -10.601 -26.542 4.960 1.00 0.00 N ATOM 1613 CA SER A 106 -11.811 -27.158 5.475 1.00 0.00 C ATOM 1614 C SER A 106 -12.421 -28.079 4.416 1.00 0.00 C ATOM 1615 O SER A 106 -13.535 -28.572 4.585 1.00 0.00 O ATOM 1616 CB SER A 106 -12.828 -26.099 5.907 1.00 0.00 C ATOM 1617 OG SER A 106 -14.151 -26.624 5.969 1.00 0.00 O ATOM 0 H SER A 106 -10.674 -26.192 4.005 1.00 0.00 H new ATOM 0 HA SER A 106 -11.547 -27.748 6.352 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.548 -25.705 6.884 1.00 0.00 H new ATOM 0 HB3 SER A 106 -12.802 -25.264 5.207 1.00 0.00 H new ATOM 0 HG SER A 106 -14.123 -27.596 5.849 1.00 0.00 H new ATOM 1623 N GLY A 107 -11.664 -28.283 3.348 1.00 0.00 N ATOM 1624 CA GLY A 107 -12.116 -29.135 2.262 1.00 0.00 C ATOM 1625 C GLY A 107 -11.156 -30.308 2.049 1.00 0.00 C ATOM 1626 O GLY A 107 -10.220 -30.496 2.824 1.00 0.00 O ATOM 0 H GLY A 107 -10.740 -27.873 3.212 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -13.114 -29.513 2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.192 -28.551 1.345 1.00 0.00 H new ATOM 1630 N PRO A 108 -11.429 -31.085 0.968 1.00 0.00 N ATOM 1631 CA PRO A 108 -10.601 -32.234 0.643 1.00 0.00 C ATOM 1632 C PRO A 108 -9.268 -31.795 0.034 1.00 0.00 C ATOM 1633 O PRO A 108 -9.221 -30.843 -0.744 1.00 0.00 O ATOM 1634 CB PRO A 108 -11.442 -33.070 -0.308 1.00 0.00 C ATOM 1635 CG PRO A 108 -12.515 -32.137 -0.845 1.00 0.00 C ATOM 1636 CD PRO A 108 -12.530 -30.892 0.028 1.00 0.00 C ATOM 0 HA PRO A 108 -10.324 -32.814 1.523 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -10.833 -33.472 -1.118 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -11.887 -33.921 0.209 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -12.308 -31.873 -1.882 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -13.489 -32.626 -0.829 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -12.389 -29.990 -0.567 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -13.481 -30.785 0.549 1.00 0.00 H new ATOM 1644 N SER A 109 -8.218 -32.509 0.411 1.00 0.00 N ATOM 1645 CA SER A 109 -6.888 -32.205 -0.089 1.00 0.00 C ATOM 1646 C SER A 109 -6.426 -33.301 -1.051 1.00 0.00 C ATOM 1647 O SER A 109 -7.138 -34.281 -1.268 1.00 0.00 O ATOM 1648 CB SER A 109 -5.889 -32.052 1.061 1.00 0.00 C ATOM 1649 OG SER A 109 -5.753 -33.255 1.812 1.00 0.00 O ATOM 0 H SER A 109 -8.261 -33.297 1.057 1.00 0.00 H new ATOM 0 HA SER A 109 -6.933 -31.257 -0.625 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.917 -31.762 0.661 1.00 0.00 H new ATOM 0 HB3 SER A 109 -6.215 -31.248 1.720 1.00 0.00 H new ATOM 0 HG SER A 109 -5.106 -33.118 2.535 1.00 0.00 H new ATOM 1655 N SER A 110 -5.238 -33.100 -1.601 1.00 0.00 N ATOM 1656 CA SER A 110 -4.674 -34.059 -2.535 1.00 0.00 C ATOM 1657 C SER A 110 -5.559 -34.162 -3.779 1.00 0.00 C ATOM 1658 O SER A 110 -6.724 -34.546 -3.686 1.00 0.00 O ATOM 1659 CB SER A 110 -4.513 -35.434 -1.883 1.00 0.00 C ATOM 1660 OG SER A 110 -3.576 -35.409 -0.810 1.00 0.00 O ATOM 0 H SER A 110 -4.650 -32.287 -1.418 1.00 0.00 H new ATOM 0 HA SER A 110 -3.685 -33.708 -2.829 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.480 -35.775 -1.512 1.00 0.00 H new ATOM 0 HB3 SER A 110 -4.187 -36.155 -2.633 1.00 0.00 H new ATOM 0 HG SER A 110 -3.503 -36.305 -0.419 1.00 0.00 H new ATOM 1666 N GLY A 111 -4.972 -33.812 -4.914 1.00 0.00 N ATOM 1667 CA GLY A 111 -5.693 -33.860 -6.175 1.00 0.00 C ATOM 1668 C GLY A 111 -4.802 -33.407 -7.333 1.00 0.00 C ATOM 1669 O GLY A 111 -4.881 -32.260 -7.770 1.00 0.00 O ATOM 0 H GLY A 111 -4.006 -33.494 -4.987 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.046 -34.875 -6.358 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.575 -33.222 -6.118 1.00 0.00 H new TER 1673 GLY A 111