USER MOD reduce.3.24.130724 H: found=0, std=0, add=743, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 741 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= -3.09! USER MOD Single : A 22 MET CE :methyl -164:sc= -12.1! (180deg=-13.8!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0.667 K(o=0.67,f=-0.04) USER MOD Single : A 29 ASN : amide:sc= 0.0282 K(o=0.028,f=-2.7) USER MOD Single : A 30 GLN : amide:sc= -2.94! C(o=-2.9!,f=-3.5!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 0.871 K(o=0.87,f=-0.19) USER MOD Single : A 44 CYS SG : rot 57:sc= -0.0235 USER MOD Single : A 45 ASN : amide:sc= -0.0414 K(o=-0.041,f=-11!) USER MOD Single : A 49 GLN : amide:sc= -1.13 X(o=-1.1,f=-0.88) USER MOD Single : A 50 LYS NZ :NH3+ 146:sc= -3.35! (180deg=-5.38!) USER MOD Single : A 53 LYS NZ :NH3+ 161:sc= -0.05 (180deg=-0.302) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= -0.0829 USER MOD Single : A 65 LYS NZ :NH3+ -166:sc= -0.558 (180deg=-1.18) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 75 LYS NZ :NH3+ -130:sc= -0.653 (180deg=-2.38!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -0.124 X(o=-0.12,f=-0.025) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 30:sc= 0.252! USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.931 12.522 2.327 1.00 0.00 N ATOM 2 CA GLY A 1 2.637 11.213 1.773 1.00 0.00 C ATOM 3 C GLY A 1 3.635 10.794 0.712 1.00 0.00 C ATOM 4 O GLY A 1 4.210 9.708 0.786 1.00 0.00 O ATOM 0 H1 GLY A 1 2.220 12.762 3.047 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.875 12.510 2.763 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.909 13.233 1.568 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.633 10.475 2.575 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.636 11.221 1.342 1.00 0.00 H new ATOM 8 N SER A 2 3.841 11.657 -0.277 1.00 0.00 N ATOM 9 CA SER A 2 4.773 11.368 -1.361 1.00 0.00 C ATOM 10 C SER A 2 6.128 10.931 -0.811 1.00 0.00 C ATOM 11 O SER A 2 6.643 11.520 0.139 1.00 0.00 O ATOM 12 CB SER A 2 4.946 12.598 -2.255 1.00 0.00 C ATOM 13 OG SER A 2 5.500 13.682 -1.530 1.00 0.00 O ATOM 0 H SER A 2 3.376 12.562 -0.350 1.00 0.00 H new ATOM 0 HA SER A 2 4.360 10.552 -1.954 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.593 12.351 -3.097 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.981 12.889 -2.669 1.00 0.00 H new ATOM 0 HG SER A 2 5.602 14.455 -2.124 1.00 0.00 H new ATOM 19 N SER A 3 6.698 9.894 -1.416 1.00 0.00 N ATOM 20 CA SER A 3 7.991 9.375 -0.985 1.00 0.00 C ATOM 21 C SER A 3 9.027 9.506 -2.097 1.00 0.00 C ATOM 22 O SER A 3 8.696 9.440 -3.280 1.00 0.00 O ATOM 23 CB SER A 3 7.861 7.909 -0.565 1.00 0.00 C ATOM 24 OG SER A 3 7.491 7.094 -1.663 1.00 0.00 O ATOM 0 H SER A 3 6.285 9.397 -2.205 1.00 0.00 H new ATOM 0 HA SER A 3 8.324 9.963 -0.130 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.808 7.561 -0.152 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.116 7.819 0.226 1.00 0.00 H new ATOM 0 HG SER A 3 7.416 6.162 -1.368 1.00 0.00 H new ATOM 30 N GLY A 4 10.284 9.693 -1.707 1.00 0.00 N ATOM 31 CA GLY A 4 11.351 9.831 -2.682 1.00 0.00 C ATOM 32 C GLY A 4 11.793 8.498 -3.251 1.00 0.00 C ATOM 33 O GLY A 4 11.038 7.526 -3.231 1.00 0.00 O ATOM 0 H GLY A 4 10.583 9.751 -0.734 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.015 10.476 -3.494 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.204 10.324 -2.215 1.00 0.00 H new ATOM 37 N SER A 5 13.019 8.451 -3.761 1.00 0.00 N ATOM 38 CA SER A 5 13.559 7.228 -4.343 1.00 0.00 C ATOM 39 C SER A 5 14.524 6.547 -3.378 1.00 0.00 C ATOM 40 O SER A 5 15.583 6.065 -3.779 1.00 0.00 O ATOM 41 CB SER A 5 14.271 7.537 -5.661 1.00 0.00 C ATOM 42 OG SER A 5 13.375 7.459 -6.756 1.00 0.00 O ATOM 0 H SER A 5 13.658 9.246 -3.783 1.00 0.00 H new ATOM 0 HA SER A 5 12.728 6.550 -4.537 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.709 8.534 -5.616 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.092 6.835 -5.808 1.00 0.00 H new ATOM 0 HG SER A 5 13.854 7.662 -7.586 1.00 0.00 H new ATOM 48 N SER A 6 14.149 6.511 -2.103 1.00 0.00 N ATOM 49 CA SER A 6 14.982 5.892 -1.078 1.00 0.00 C ATOM 50 C SER A 6 15.111 4.391 -1.316 1.00 0.00 C ATOM 51 O SER A 6 14.141 3.722 -1.671 1.00 0.00 O ATOM 52 CB SER A 6 14.395 6.152 0.311 1.00 0.00 C ATOM 53 OG SER A 6 14.650 7.480 0.732 1.00 0.00 O ATOM 0 H SER A 6 13.274 6.903 -1.755 1.00 0.00 H new ATOM 0 HA SER A 6 15.975 6.337 -1.134 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.320 5.973 0.294 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.824 5.451 1.027 1.00 0.00 H new ATOM 0 HG SER A 6 14.263 7.621 1.621 1.00 0.00 H new ATOM 59 N GLY A 7 16.317 3.868 -1.118 1.00 0.00 N ATOM 60 CA GLY A 7 16.553 2.450 -1.316 1.00 0.00 C ATOM 61 C GLY A 7 15.631 1.587 -0.476 1.00 0.00 C ATOM 62 O GLY A 7 15.574 1.733 0.745 1.00 0.00 O ATOM 0 H GLY A 7 17.135 4.401 -0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.416 2.205 -2.369 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.589 2.219 -1.068 1.00 0.00 H new ATOM 66 N ARG A 8 14.907 0.685 -1.132 1.00 0.00 N ATOM 67 CA ARG A 8 13.982 -0.202 -0.438 1.00 0.00 C ATOM 68 C ARG A 8 14.536 -1.622 -0.374 1.00 0.00 C ATOM 69 O ARG A 8 14.528 -2.348 -1.367 1.00 0.00 O ATOM 70 CB ARG A 8 12.622 -0.205 -1.140 1.00 0.00 C ATOM 71 CG ARG A 8 11.457 -0.491 -0.207 1.00 0.00 C ATOM 72 CD ARG A 8 10.262 -1.050 -0.964 1.00 0.00 C ATOM 73 NE ARG A 8 10.534 -2.376 -1.514 1.00 0.00 N ATOM 74 CZ ARG A 8 10.525 -3.489 -0.789 1.00 0.00 C ATOM 75 NH1 ARG A 8 10.258 -3.436 0.509 1.00 0.00 N ATOM 76 NH2 ARG A 8 10.782 -4.657 -1.362 1.00 0.00 N ATOM 0 H ARG A 8 14.944 0.550 -2.142 1.00 0.00 H new ATOM 0 HA ARG A 8 13.857 0.167 0.580 1.00 0.00 H new ATOM 0 HB2 ARG A 8 12.466 0.763 -1.616 1.00 0.00 H new ATOM 0 HB3 ARG A 8 12.633 -0.952 -1.933 1.00 0.00 H new ATOM 0 HG2 ARG A 8 11.769 -1.201 0.559 1.00 0.00 H new ATOM 0 HG3 ARG A 8 11.167 0.426 0.307 1.00 0.00 H new ATOM 0 HD2 ARG A 8 9.403 -1.104 -0.296 1.00 0.00 H new ATOM 0 HD3 ARG A 8 9.995 -0.370 -1.773 1.00 0.00 H new ATOM 0 HE ARG A 8 10.742 -2.451 -2.510 1.00 0.00 H new ATOM 0 HH11 ARG A 8 10.059 -2.539 0.953 1.00 0.00 H new ATOM 0 HH12 ARG A 8 10.252 -4.292 1.064 1.00 0.00 H new ATOM 0 HH21 ARG A 8 10.987 -4.701 -2.360 1.00 0.00 H new ATOM 0 HH22 ARG A 8 10.775 -5.511 -0.804 1.00 0.00 H new ATOM 90 N GLY A 9 15.017 -2.012 0.803 1.00 0.00 N ATOM 91 CA GLY A 9 15.569 -3.343 0.975 1.00 0.00 C ATOM 92 C GLY A 9 15.400 -3.863 2.389 1.00 0.00 C ATOM 93 O GLY A 9 15.575 -3.120 3.355 1.00 0.00 O ATOM 0 H GLY A 9 15.034 -1.430 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 9 15.083 -4.027 0.279 1.00 0.00 H new ATOM 0 HA3 GLY A 9 16.629 -3.329 0.721 1.00 0.00 H new ATOM 97 N SER A 10 15.058 -5.141 2.511 1.00 0.00 N ATOM 98 CA SER A 10 14.859 -5.758 3.817 1.00 0.00 C ATOM 99 C SER A 10 15.552 -7.115 3.888 1.00 0.00 C ATOM 100 O SER A 10 16.128 -7.582 2.905 1.00 0.00 O ATOM 101 CB SER A 10 13.366 -5.919 4.107 1.00 0.00 C ATOM 102 OG SER A 10 12.839 -4.758 4.727 1.00 0.00 O ATOM 0 H SER A 10 14.913 -5.770 1.721 1.00 0.00 H new ATOM 0 HA SER A 10 15.299 -5.105 4.570 1.00 0.00 H new ATOM 0 HB2 SER A 10 12.831 -6.114 3.178 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.209 -6.783 4.753 1.00 0.00 H new ATOM 0 HG SER A 10 11.883 -4.885 4.901 1.00 0.00 H new ATOM 108 N ARG A 11 15.491 -7.744 5.057 1.00 0.00 N ATOM 109 CA ARG A 11 16.113 -9.047 5.258 1.00 0.00 C ATOM 110 C ARG A 11 15.601 -10.057 4.235 1.00 0.00 C ATOM 111 O ARG A 11 16.385 -10.722 3.558 1.00 0.00 O ATOM 112 CB ARG A 11 15.836 -9.555 6.674 1.00 0.00 C ATOM 113 CG ARG A 11 16.528 -10.870 6.995 1.00 0.00 C ATOM 114 CD ARG A 11 16.193 -11.347 8.400 1.00 0.00 C ATOM 115 NE ARG A 11 17.119 -12.377 8.863 1.00 0.00 N ATOM 116 CZ ARG A 11 17.050 -12.941 10.063 1.00 0.00 C ATOM 117 NH1 ARG A 11 16.103 -12.578 10.917 1.00 0.00 N ATOM 118 NH2 ARG A 11 17.929 -13.872 10.412 1.00 0.00 N ATOM 0 H ARG A 11 15.017 -7.372 5.880 1.00 0.00 H new ATOM 0 HA ARG A 11 17.189 -8.933 5.124 1.00 0.00 H new ATOM 0 HB2 ARG A 11 16.158 -8.800 7.391 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.761 -9.679 6.803 1.00 0.00 H new ATOM 0 HG2 ARG A 11 16.227 -11.627 6.271 1.00 0.00 H new ATOM 0 HG3 ARG A 11 17.607 -10.748 6.899 1.00 0.00 H new ATOM 0 HD2 ARG A 11 16.220 -10.501 9.086 1.00 0.00 H new ATOM 0 HD3 ARG A 11 15.176 -11.739 8.417 1.00 0.00 H new ATOM 0 HE ARG A 11 17.859 -12.680 8.230 1.00 0.00 H new ATOM 0 HH11 ARG A 11 15.425 -11.864 10.653 1.00 0.00 H new ATOM 0 HH12 ARG A 11 16.053 -13.013 11.838 1.00 0.00 H new ATOM 0 HH21 ARG A 11 18.659 -14.155 9.758 1.00 0.00 H new ATOM 0 HH22 ARG A 11 17.875 -14.304 11.334 1.00 0.00 H new ATOM 132 N PHE A 12 14.281 -10.166 4.128 1.00 0.00 N ATOM 133 CA PHE A 12 13.664 -11.095 3.189 1.00 0.00 C ATOM 134 C PHE A 12 13.359 -10.406 1.862 1.00 0.00 C ATOM 135 O PHE A 12 13.003 -9.227 1.829 1.00 0.00 O ATOM 136 CB PHE A 12 12.378 -11.675 3.783 1.00 0.00 C ATOM 137 CG PHE A 12 11.640 -12.584 2.842 1.00 0.00 C ATOM 138 CD1 PHE A 12 10.862 -12.062 1.821 1.00 0.00 C ATOM 139 CD2 PHE A 12 11.725 -13.960 2.978 1.00 0.00 C ATOM 140 CE1 PHE A 12 10.181 -12.897 0.955 1.00 0.00 C ATOM 141 CE2 PHE A 12 11.047 -14.800 2.114 1.00 0.00 C ATOM 142 CZ PHE A 12 10.275 -14.267 1.100 1.00 0.00 C ATOM 0 H PHE A 12 13.618 -9.622 4.680 1.00 0.00 H new ATOM 0 HA PHE A 12 14.369 -11.906 3.003 1.00 0.00 H new ATOM 0 HB2 PHE A 12 12.623 -12.226 4.691 1.00 0.00 H new ATOM 0 HB3 PHE A 12 11.721 -10.856 4.075 1.00 0.00 H new ATOM 0 HD1 PHE A 12 10.787 -10.991 1.701 1.00 0.00 H new ATOM 0 HD2 PHE A 12 12.328 -14.382 3.768 1.00 0.00 H new ATOM 0 HE1 PHE A 12 9.575 -12.478 0.165 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.121 -15.871 2.232 1.00 0.00 H new ATOM 0 HZ PHE A 12 9.746 -14.920 0.422 1.00 0.00 H new ATOM 152 N THR A 13 13.501 -11.149 0.769 1.00 0.00 N ATOM 153 CA THR A 13 13.243 -10.610 -0.560 1.00 0.00 C ATOM 154 C THR A 13 12.145 -11.396 -1.268 1.00 0.00 C ATOM 155 O THR A 13 12.030 -12.610 -1.099 1.00 0.00 O ATOM 156 CB THR A 13 14.514 -10.629 -1.430 1.00 0.00 C ATOM 157 OG1 THR A 13 15.657 -10.294 -0.635 1.00 0.00 O ATOM 158 CG2 THR A 13 14.391 -9.650 -2.588 1.00 0.00 C ATOM 0 H THR A 13 13.793 -12.126 0.778 1.00 0.00 H new ATOM 0 HA THR A 13 12.919 -9.578 -0.425 1.00 0.00 H new ATOM 0 HB THR A 13 14.636 -11.634 -1.835 1.00 0.00 H new ATOM 0 HG1 THR A 13 16.461 -10.310 -1.195 1.00 0.00 H new ATOM 0 HG21 THR A 13 15.300 -9.681 -3.189 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.537 -9.925 -3.208 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.247 -8.642 -2.199 1.00 0.00 H new ATOM 166 N TRP A 14 11.341 -10.696 -2.061 1.00 0.00 N ATOM 167 CA TRP A 14 10.252 -11.330 -2.795 1.00 0.00 C ATOM 168 C TRP A 14 10.608 -11.487 -4.269 1.00 0.00 C ATOM 169 O TRP A 14 10.482 -10.545 -5.052 1.00 0.00 O ATOM 170 CB TRP A 14 8.969 -10.510 -2.653 1.00 0.00 C ATOM 171 CG TRP A 14 8.145 -10.897 -1.462 1.00 0.00 C ATOM 172 CD1 TRP A 14 7.773 -10.090 -0.425 1.00 0.00 C ATOM 173 CD2 TRP A 14 7.594 -12.189 -1.185 1.00 0.00 C ATOM 174 NE1 TRP A 14 7.024 -10.802 0.480 1.00 0.00 N ATOM 175 CE2 TRP A 14 6.899 -12.092 0.037 1.00 0.00 C ATOM 176 CE3 TRP A 14 7.619 -13.418 -1.850 1.00 0.00 C ATOM 177 CZ2 TRP A 14 6.237 -13.178 0.604 1.00 0.00 C ATOM 178 CZ3 TRP A 14 6.961 -14.494 -1.285 1.00 0.00 C ATOM 179 CH2 TRP A 14 6.277 -14.369 -0.069 1.00 0.00 C ATOM 0 H TRP A 14 11.423 -9.691 -2.212 1.00 0.00 H new ATOM 0 HA TRP A 14 10.091 -12.321 -2.372 1.00 0.00 H new ATOM 0 HB2 TRP A 14 9.228 -9.454 -2.579 1.00 0.00 H new ATOM 0 HB3 TRP A 14 8.369 -10.629 -3.555 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.030 -9.045 -0.330 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.625 -10.430 1.342 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.143 -13.525 -2.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 5.710 -13.084 1.542 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.974 -15.448 -1.790 1.00 0.00 H new ATOM 0 HH2 TRP A 14 5.772 -15.229 0.345 1.00 0.00 H new ATOM 190 N ARG A 15 11.054 -12.683 -4.642 1.00 0.00 N ATOM 191 CA ARG A 15 11.430 -12.962 -6.022 1.00 0.00 C ATOM 192 C ARG A 15 10.219 -12.861 -6.946 1.00 0.00 C ATOM 193 O ARG A 15 9.094 -13.161 -6.547 1.00 0.00 O ATOM 194 CB ARG A 15 12.054 -14.354 -6.132 1.00 0.00 C ATOM 195 CG ARG A 15 13.444 -14.448 -5.525 1.00 0.00 C ATOM 196 CD ARG A 15 14.466 -13.685 -6.354 1.00 0.00 C ATOM 197 NE ARG A 15 14.539 -12.277 -5.972 1.00 0.00 N ATOM 198 CZ ARG A 15 15.414 -11.421 -6.487 1.00 0.00 C ATOM 199 NH1 ARG A 15 16.285 -11.827 -7.400 1.00 0.00 N ATOM 200 NH2 ARG A 15 15.418 -10.155 -6.089 1.00 0.00 N ATOM 0 H ARG A 15 11.163 -13.474 -4.007 1.00 0.00 H new ATOM 0 HA ARG A 15 12.164 -12.217 -6.330 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.402 -15.075 -5.639 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.106 -14.638 -7.183 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.427 -14.050 -4.510 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.741 -15.494 -5.452 1.00 0.00 H new ATOM 0 HD2 ARG A 15 15.447 -14.145 -6.233 1.00 0.00 H new ATOM 0 HD3 ARG A 15 14.206 -13.761 -7.410 1.00 0.00 H new ATOM 0 HE ARG A 15 13.882 -11.933 -5.272 1.00 0.00 H new ATOM 0 HH11 ARG A 15 16.284 -12.799 -7.709 1.00 0.00 H new ATOM 0 HH12 ARG A 15 16.956 -11.167 -7.794 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.749 -9.839 -5.387 1.00 0.00 H new ATOM 0 HH22 ARG A 15 16.090 -9.498 -6.485 1.00 0.00 H new ATOM 214 N LYS A 16 10.458 -12.436 -8.182 1.00 0.00 N ATOM 215 CA LYS A 16 9.389 -12.296 -9.164 1.00 0.00 C ATOM 216 C LYS A 16 8.637 -13.611 -9.340 1.00 0.00 C ATOM 217 O LYS A 16 7.448 -13.618 -9.656 1.00 0.00 O ATOM 218 CB LYS A 16 9.960 -11.838 -10.508 1.00 0.00 C ATOM 219 CG LYS A 16 10.026 -10.328 -10.658 1.00 0.00 C ATOM 220 CD LYS A 16 11.178 -9.907 -11.555 1.00 0.00 C ATOM 221 CE LYS A 16 10.840 -10.099 -13.025 1.00 0.00 C ATOM 222 NZ LYS A 16 11.683 -9.243 -13.905 1.00 0.00 N ATOM 0 H LYS A 16 11.383 -12.182 -8.528 1.00 0.00 H new ATOM 0 HA LYS A 16 8.690 -11.544 -8.799 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.962 -12.251 -10.627 1.00 0.00 H new ATOM 0 HB3 LYS A 16 9.349 -12.248 -11.312 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.087 -9.961 -11.073 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.141 -9.869 -9.676 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.420 -8.860 -11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 16 12.066 -10.489 -11.306 1.00 0.00 H new ATOM 0 HE2 LYS A 16 10.979 -11.146 -13.296 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.788 -9.864 -13.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 11.422 -9.403 -14.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.532 -8.243 -13.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 12.685 -9.484 -13.767 1.00 0.00 H new ATOM 236 N GLU A 17 9.338 -14.721 -9.133 1.00 0.00 N ATOM 237 CA GLU A 17 8.734 -16.042 -9.269 1.00 0.00 C ATOM 238 C GLU A 17 7.655 -16.258 -8.213 1.00 0.00 C ATOM 239 O GLU A 17 6.562 -16.738 -8.516 1.00 0.00 O ATOM 240 CB GLU A 17 9.803 -17.130 -9.152 1.00 0.00 C ATOM 241 CG GLU A 17 11.029 -16.874 -10.012 1.00 0.00 C ATOM 242 CD GLU A 17 12.287 -17.496 -9.436 1.00 0.00 C ATOM 243 OE1 GLU A 17 12.182 -18.563 -8.796 1.00 0.00 O ATOM 244 OE2 GLU A 17 13.376 -16.914 -9.624 1.00 0.00 O ATOM 0 H GLU A 17 10.324 -14.732 -8.871 1.00 0.00 H new ATOM 0 HA GLU A 17 8.271 -16.102 -10.254 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.112 -17.214 -8.110 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.366 -18.088 -9.433 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.856 -17.272 -11.012 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.176 -15.799 -10.118 1.00 0.00 H new ATOM 251 N CYS A 18 7.969 -15.901 -6.972 1.00 0.00 N ATOM 252 CA CYS A 18 7.027 -16.057 -5.870 1.00 0.00 C ATOM 253 C CYS A 18 5.911 -15.021 -5.958 1.00 0.00 C ATOM 254 O CYS A 18 4.801 -15.246 -5.473 1.00 0.00 O ATOM 255 CB CYS A 18 7.753 -15.929 -4.530 1.00 0.00 C ATOM 256 SG CYS A 18 9.332 -16.808 -4.459 1.00 0.00 S ATOM 0 H CYS A 18 8.869 -15.502 -6.704 1.00 0.00 H new ATOM 0 HA CYS A 18 6.583 -17.050 -5.942 1.00 0.00 H new ATOM 0 HB2 CYS A 18 7.928 -14.873 -4.323 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.104 -16.306 -3.740 1.00 0.00 H new ATOM 0 HG CYS A 18 9.871 -16.638 -3.288 1.00 0.00 H new ATOM 262 N LEU A 19 6.213 -13.885 -6.577 1.00 0.00 N ATOM 263 CA LEU A 19 5.236 -12.813 -6.727 1.00 0.00 C ATOM 264 C LEU A 19 4.177 -13.181 -7.762 1.00 0.00 C ATOM 265 O LEU A 19 2.995 -12.891 -7.585 1.00 0.00 O ATOM 266 CB LEU A 19 5.933 -11.514 -7.135 1.00 0.00 C ATOM 267 CG LEU A 19 6.869 -10.899 -6.093 1.00 0.00 C ATOM 268 CD1 LEU A 19 7.448 -9.588 -6.603 1.00 0.00 C ATOM 269 CD2 LEU A 19 6.135 -10.684 -4.778 1.00 0.00 C ATOM 0 H LEU A 19 7.127 -13.683 -6.983 1.00 0.00 H new ATOM 0 HA LEU A 19 4.743 -12.668 -5.766 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.506 -11.702 -8.043 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.169 -10.779 -7.387 1.00 0.00 H new ATOM 0 HG LEU A 19 7.692 -11.592 -5.918 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.111 -9.165 -5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.010 -9.770 -7.519 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.638 -8.888 -6.808 1.00 0.00 H new ATOM 0 HD21 LEU A 19 6.816 -10.246 -4.049 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.292 -10.011 -4.937 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.770 -11.641 -4.405 1.00 0.00 H new ATOM 281 N ALA A 20 4.611 -13.824 -8.841 1.00 0.00 N ATOM 282 CA ALA A 20 3.701 -14.237 -9.902 1.00 0.00 C ATOM 283 C ALA A 20 2.688 -15.256 -9.391 1.00 0.00 C ATOM 284 O ALA A 20 1.516 -15.224 -9.767 1.00 0.00 O ATOM 285 CB ALA A 20 4.482 -14.809 -11.075 1.00 0.00 C ATOM 0 H ALA A 20 5.587 -14.070 -9.003 1.00 0.00 H new ATOM 0 HA ALA A 20 3.153 -13.357 -10.239 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.789 -15.113 -11.860 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.161 -14.051 -11.464 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.056 -15.674 -10.743 1.00 0.00 H new ATOM 291 N VAL A 21 3.147 -16.160 -8.532 1.00 0.00 N ATOM 292 CA VAL A 21 2.281 -17.189 -7.969 1.00 0.00 C ATOM 293 C VAL A 21 1.309 -16.595 -6.956 1.00 0.00 C ATOM 294 O VAL A 21 0.143 -16.986 -6.895 1.00 0.00 O ATOM 295 CB VAL A 21 3.100 -18.301 -7.287 1.00 0.00 C ATOM 296 CG1 VAL A 21 2.188 -19.424 -6.817 1.00 0.00 C ATOM 297 CG2 VAL A 21 4.168 -18.830 -8.231 1.00 0.00 C ATOM 0 H VAL A 21 4.114 -16.201 -8.211 1.00 0.00 H new ATOM 0 HA VAL A 21 1.720 -17.619 -8.799 1.00 0.00 H new ATOM 0 HB VAL A 21 3.597 -17.879 -6.413 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.784 -20.200 -6.338 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.464 -19.030 -6.104 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.661 -19.847 -7.672 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.737 -19.615 -7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.695 -19.236 -9.125 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.839 -18.018 -8.513 1.00 0.00 H new ATOM 307 N MET A 22 1.796 -15.647 -6.162 1.00 0.00 N ATOM 308 CA MET A 22 0.969 -14.997 -5.152 1.00 0.00 C ATOM 309 C MET A 22 -0.167 -14.213 -5.801 1.00 0.00 C ATOM 310 O MET A 22 -1.289 -14.198 -5.297 1.00 0.00 O ATOM 311 CB MET A 22 1.820 -14.063 -4.289 1.00 0.00 C ATOM 312 CG MET A 22 2.500 -14.764 -3.124 1.00 0.00 C ATOM 313 SD MET A 22 2.885 -13.641 -1.767 1.00 0.00 S ATOM 314 CE MET A 22 4.481 -13.015 -2.287 1.00 0.00 C ATOM 0 H MET A 22 2.759 -15.312 -6.198 1.00 0.00 H new ATOM 0 HA MET A 22 0.537 -15.772 -4.519 1.00 0.00 H new ATOM 0 HB2 MET A 22 2.580 -13.595 -4.915 1.00 0.00 H new ATOM 0 HB3 MET A 22 1.189 -13.263 -3.903 1.00 0.00 H new ATOM 0 HG2 MET A 22 1.854 -15.562 -2.758 1.00 0.00 H new ATOM 0 HG3 MET A 22 3.419 -15.233 -3.474 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.978 -12.539 -1.442 1.00 0.00 H new ATOM 0 HE2 MET A 22 5.094 -13.839 -2.652 1.00 0.00 H new ATOM 0 HE3 MET A 22 4.343 -12.285 -3.085 1.00 0.00 H new ATOM 324 N GLU A 23 0.133 -13.564 -6.922 1.00 0.00 N ATOM 325 CA GLU A 23 -0.864 -12.777 -7.638 1.00 0.00 C ATOM 326 C GLU A 23 -1.935 -13.679 -8.245 1.00 0.00 C ATOM 327 O GLU A 23 -3.105 -13.305 -8.325 1.00 0.00 O ATOM 328 CB GLU A 23 -0.198 -11.947 -8.737 1.00 0.00 C ATOM 329 CG GLU A 23 0.347 -10.615 -8.248 1.00 0.00 C ATOM 330 CD GLU A 23 1.534 -10.137 -9.062 1.00 0.00 C ATOM 331 OE1 GLU A 23 2.673 -10.537 -8.741 1.00 0.00 O ATOM 332 OE2 GLU A 23 1.324 -9.363 -10.019 1.00 0.00 O ATOM 0 H GLU A 23 1.057 -13.568 -7.353 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.341 -12.105 -6.924 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.616 -12.525 -9.174 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.921 -11.764 -9.532 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.443 -9.866 -8.290 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.642 -10.709 -7.203 1.00 0.00 H new ATOM 339 N SER A 24 -1.525 -14.869 -8.673 1.00 0.00 N ATOM 340 CA SER A 24 -2.447 -15.823 -9.277 1.00 0.00 C ATOM 341 C SER A 24 -3.512 -16.259 -8.275 1.00 0.00 C ATOM 342 O SER A 24 -4.704 -16.271 -8.584 1.00 0.00 O ATOM 343 CB SER A 24 -1.685 -17.046 -9.792 1.00 0.00 C ATOM 344 OG SER A 24 -2.561 -17.967 -10.418 1.00 0.00 O ATOM 0 H SER A 24 -0.560 -15.195 -8.612 1.00 0.00 H new ATOM 0 HA SER A 24 -2.941 -15.332 -10.115 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.919 -16.729 -10.500 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.171 -17.534 -8.963 1.00 0.00 H new ATOM 0 HG SER A 24 -2.049 -18.738 -10.740 1.00 0.00 H new ATOM 350 N TYR A 25 -3.074 -16.616 -7.073 1.00 0.00 N ATOM 351 CA TYR A 25 -3.988 -17.054 -6.025 1.00 0.00 C ATOM 352 C TYR A 25 -4.868 -15.901 -5.552 1.00 0.00 C ATOM 353 O TYR A 25 -6.034 -16.095 -5.210 1.00 0.00 O ATOM 354 CB TYR A 25 -3.204 -17.630 -4.844 1.00 0.00 C ATOM 355 CG TYR A 25 -2.764 -19.062 -5.051 1.00 0.00 C ATOM 356 CD1 TYR A 25 -1.915 -19.404 -6.096 1.00 0.00 C ATOM 357 CD2 TYR A 25 -3.197 -20.072 -4.201 1.00 0.00 C ATOM 358 CE1 TYR A 25 -1.510 -20.711 -6.289 1.00 0.00 C ATOM 359 CE2 TYR A 25 -2.797 -21.382 -4.386 1.00 0.00 C ATOM 360 CZ TYR A 25 -1.954 -21.696 -5.431 1.00 0.00 C ATOM 361 OH TYR A 25 -1.554 -22.999 -5.619 1.00 0.00 O ATOM 0 H TYR A 25 -2.091 -16.611 -6.800 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.631 -17.831 -6.440 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -2.325 -17.011 -4.665 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -3.821 -17.574 -3.947 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -1.565 -18.635 -6.769 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -3.857 -19.829 -3.382 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -0.850 -20.960 -7.107 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.143 -22.155 -3.716 1.00 0.00 H new ATOM 0 HH TYR A 25 -1.955 -23.567 -4.928 1.00 0.00 H new ATOM 371 N PHE A 26 -4.300 -14.700 -5.536 1.00 0.00 N ATOM 372 CA PHE A 26 -5.031 -13.514 -5.105 1.00 0.00 C ATOM 373 C PHE A 26 -6.191 -13.217 -6.050 1.00 0.00 C ATOM 374 O PHE A 26 -7.241 -12.733 -5.629 1.00 0.00 O ATOM 375 CB PHE A 26 -4.093 -12.308 -5.035 1.00 0.00 C ATOM 376 CG PHE A 26 -4.707 -11.107 -4.374 1.00 0.00 C ATOM 377 CD1 PHE A 26 -5.570 -10.280 -5.075 1.00 0.00 C ATOM 378 CD2 PHE A 26 -4.422 -10.806 -3.052 1.00 0.00 C ATOM 379 CE1 PHE A 26 -6.138 -9.175 -4.469 1.00 0.00 C ATOM 380 CE2 PHE A 26 -4.987 -9.703 -2.441 1.00 0.00 C ATOM 381 CZ PHE A 26 -5.845 -8.885 -3.151 1.00 0.00 C ATOM 0 H PHE A 26 -3.336 -14.522 -5.817 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.436 -13.708 -4.112 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.191 -12.590 -4.491 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.785 -12.039 -6.045 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.801 -10.501 -6.106 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.751 -11.441 -2.493 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.810 -8.539 -5.026 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.758 -9.480 -1.409 1.00 0.00 H new ATOM 0 HZ PHE A 26 -6.285 -8.021 -2.676 1.00 0.00 H new ATOM 391 N ASN A 27 -5.992 -13.510 -7.331 1.00 0.00 N ATOM 392 CA ASN A 27 -7.021 -13.273 -8.338 1.00 0.00 C ATOM 393 C ASN A 27 -8.221 -14.189 -8.115 1.00 0.00 C ATOM 394 O ASN A 27 -9.365 -13.791 -8.331 1.00 0.00 O ATOM 395 CB ASN A 27 -6.451 -13.494 -9.741 1.00 0.00 C ATOM 396 CG ASN A 27 -5.858 -12.228 -10.329 1.00 0.00 C ATOM 397 OD1 ASN A 27 -6.293 -11.755 -11.379 1.00 0.00 O ATOM 398 ND2 ASN A 27 -4.859 -11.673 -9.653 1.00 0.00 N ATOM 0 H ASN A 27 -5.129 -13.912 -7.696 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.353 -12.239 -8.246 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.684 -14.267 -9.701 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -7.240 -13.862 -10.397 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -4.420 -10.820 -10.000 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.530 -12.100 -8.787 1.00 0.00 H new ATOM 405 N GLU A 28 -7.950 -15.415 -7.680 1.00 0.00 N ATOM 406 CA GLU A 28 -9.008 -16.387 -7.428 1.00 0.00 C ATOM 407 C GLU A 28 -9.578 -16.218 -6.023 1.00 0.00 C ATOM 408 O GLU A 28 -10.768 -16.434 -5.794 1.00 0.00 O ATOM 409 CB GLU A 28 -8.477 -17.811 -7.607 1.00 0.00 C ATOM 410 CG GLU A 28 -7.599 -18.281 -6.460 1.00 0.00 C ATOM 411 CD GLU A 28 -7.493 -19.792 -6.388 1.00 0.00 C ATOM 412 OE1 GLU A 28 -8.527 -20.448 -6.142 1.00 0.00 O ATOM 413 OE2 GLU A 28 -6.377 -20.319 -6.578 1.00 0.00 O ATOM 0 H GLU A 28 -7.008 -15.759 -7.495 1.00 0.00 H new ATOM 0 HA GLU A 28 -9.806 -16.212 -8.149 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.320 -18.494 -7.712 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.907 -17.864 -8.535 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.602 -17.855 -6.573 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.002 -17.904 -5.520 1.00 0.00 H new ATOM 420 N ASN A 29 -8.720 -15.829 -5.085 1.00 0.00 N ATOM 421 CA ASN A 29 -9.138 -15.632 -3.702 1.00 0.00 C ATOM 422 C ASN A 29 -8.268 -14.583 -3.015 1.00 0.00 C ATOM 423 O ASN A 29 -7.055 -14.752 -2.895 1.00 0.00 O ATOM 424 CB ASN A 29 -9.066 -16.953 -2.932 1.00 0.00 C ATOM 425 CG ASN A 29 -9.952 -16.954 -1.702 1.00 0.00 C ATOM 426 OD1 ASN A 29 -10.435 -15.906 -1.270 1.00 0.00 O ATOM 427 ND2 ASN A 29 -10.171 -18.132 -1.131 1.00 0.00 N ATOM 0 H ASN A 29 -7.732 -15.644 -5.258 1.00 0.00 H new ATOM 0 HA ASN A 29 -10.169 -15.278 -3.707 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -9.361 -17.770 -3.590 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.035 -17.141 -2.634 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -10.760 -18.195 -0.300 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -9.751 -18.975 -1.523 1.00 0.00 H new ATOM 434 N GLN A 30 -8.897 -13.501 -2.568 1.00 0.00 N ATOM 435 CA GLN A 30 -8.180 -12.426 -1.894 1.00 0.00 C ATOM 436 C GLN A 30 -7.621 -12.898 -0.556 1.00 0.00 C ATOM 437 O GLN A 30 -6.576 -12.427 -0.107 1.00 0.00 O ATOM 438 CB GLN A 30 -9.103 -11.225 -1.679 1.00 0.00 C ATOM 439 CG GLN A 30 -9.891 -10.834 -2.919 1.00 0.00 C ATOM 440 CD GLN A 30 -9.161 -9.820 -3.778 1.00 0.00 C ATOM 441 OE1 GLN A 30 -8.599 -10.162 -4.819 1.00 0.00 O ATOM 442 NE2 GLN A 30 -9.166 -8.565 -3.346 1.00 0.00 N ATOM 0 H GLN A 30 -9.901 -13.346 -2.660 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.347 -12.126 -2.529 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.800 -11.453 -0.872 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.507 -10.373 -1.354 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.096 -11.726 -3.511 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -10.855 -10.423 -2.618 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -9.645 -8.327 -2.477 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -8.691 -7.839 -3.883 1.00 0.00 H new ATOM 451 N TYR A 31 -8.324 -13.831 0.076 1.00 0.00 N ATOM 452 CA TYR A 31 -7.900 -14.366 1.365 1.00 0.00 C ATOM 453 C TYR A 31 -7.768 -15.885 1.308 1.00 0.00 C ATOM 454 O TYR A 31 -8.725 -16.625 1.536 1.00 0.00 O ATOM 455 CB TYR A 31 -8.894 -13.969 2.458 1.00 0.00 C ATOM 456 CG TYR A 31 -9.407 -12.553 2.325 1.00 0.00 C ATOM 457 CD1 TYR A 31 -10.390 -12.234 1.397 1.00 0.00 C ATOM 458 CD2 TYR A 31 -8.908 -11.535 3.128 1.00 0.00 C ATOM 459 CE1 TYR A 31 -10.860 -10.941 1.271 1.00 0.00 C ATOM 460 CE2 TYR A 31 -9.374 -10.240 3.011 1.00 0.00 C ATOM 461 CZ TYR A 31 -10.350 -9.948 2.081 1.00 0.00 C ATOM 462 OH TYR A 31 -10.817 -8.659 1.960 1.00 0.00 O ATOM 0 H TYR A 31 -9.190 -14.233 -0.283 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.923 -13.944 1.601 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.740 -14.656 2.435 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.416 -14.083 3.431 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -10.794 -13.010 0.763 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.143 -11.760 3.856 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -11.623 -10.709 0.542 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -8.976 -9.461 3.644 1.00 0.00 H new ATOM 0 HH TYR A 31 -10.355 -8.082 2.604 1.00 0.00 H new ATOM 472 N PRO A 32 -6.554 -16.362 0.997 1.00 0.00 N ATOM 473 CA PRO A 32 -6.267 -17.796 0.903 1.00 0.00 C ATOM 474 C PRO A 32 -6.295 -18.483 2.265 1.00 0.00 C ATOM 475 O PRO A 32 -5.588 -18.081 3.188 1.00 0.00 O ATOM 476 CB PRO A 32 -4.855 -17.837 0.313 1.00 0.00 C ATOM 477 CG PRO A 32 -4.243 -16.536 0.702 1.00 0.00 C ATOM 478 CD PRO A 32 -5.367 -15.537 0.713 1.00 0.00 C ATOM 0 HA PRO A 32 -7.010 -18.322 0.304 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.285 -18.677 0.710 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.882 -17.953 -0.770 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.772 -16.604 1.682 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.467 -16.243 -0.005 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.217 -14.772 1.475 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.456 -15.021 -0.243 1.00 0.00 H new ATOM 486 N ASP A 33 -7.116 -19.520 2.381 1.00 0.00 N ATOM 487 CA ASP A 33 -7.236 -20.264 3.630 1.00 0.00 C ATOM 488 C ASP A 33 -5.877 -20.789 4.082 1.00 0.00 C ATOM 489 O ASP A 33 -4.882 -20.657 3.369 1.00 0.00 O ATOM 490 CB ASP A 33 -8.216 -21.427 3.464 1.00 0.00 C ATOM 491 CG ASP A 33 -8.141 -22.055 2.086 1.00 0.00 C ATOM 492 OD1 ASP A 33 -8.623 -21.426 1.120 1.00 0.00 O ATOM 493 OD2 ASP A 33 -7.599 -23.174 1.973 1.00 0.00 O ATOM 0 H ASP A 33 -7.709 -19.865 1.626 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.616 -19.585 4.393 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.006 -22.186 4.218 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.231 -21.072 3.643 1.00 0.00 H new ATOM 498 N GLU A 34 -5.843 -21.382 5.271 1.00 0.00 N ATOM 499 CA GLU A 34 -4.605 -21.924 5.819 1.00 0.00 C ATOM 500 C GLU A 34 -3.981 -22.933 4.858 1.00 0.00 C ATOM 501 O GLU A 34 -2.776 -22.905 4.608 1.00 0.00 O ATOM 502 CB GLU A 34 -4.867 -22.588 7.172 1.00 0.00 C ATOM 503 CG GLU A 34 -3.663 -23.326 7.732 1.00 0.00 C ATOM 504 CD GLU A 34 -4.010 -24.181 8.935 1.00 0.00 C ATOM 505 OE1 GLU A 34 -4.689 -25.212 8.755 1.00 0.00 O ATOM 506 OE2 GLU A 34 -3.600 -23.817 10.058 1.00 0.00 O ATOM 0 H GLU A 34 -6.658 -21.499 5.873 1.00 0.00 H new ATOM 0 HA GLU A 34 -3.907 -21.098 5.957 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.180 -21.826 7.886 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.696 -23.288 7.069 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.235 -23.957 6.954 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.897 -22.603 8.014 1.00 0.00 H new ATOM 513 N ALA A 35 -4.810 -23.823 4.323 1.00 0.00 N ATOM 514 CA ALA A 35 -4.341 -24.839 3.390 1.00 0.00 C ATOM 515 C ALA A 35 -3.913 -24.214 2.066 1.00 0.00 C ATOM 516 O ALA A 35 -2.918 -24.622 1.467 1.00 0.00 O ATOM 517 CB ALA A 35 -5.424 -25.882 3.157 1.00 0.00 C ATOM 0 H ALA A 35 -5.810 -23.861 4.520 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.471 -25.326 3.830 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.060 -26.635 2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.679 -26.359 4.103 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.310 -25.400 2.743 1.00 0.00 H new ATOM 523 N LYS A 36 -4.671 -23.220 1.615 1.00 0.00 N ATOM 524 CA LYS A 36 -4.371 -22.537 0.362 1.00 0.00 C ATOM 525 C LYS A 36 -3.038 -21.799 0.451 1.00 0.00 C ATOM 526 O LYS A 36 -2.259 -21.790 -0.502 1.00 0.00 O ATOM 527 CB LYS A 36 -5.489 -21.552 0.014 1.00 0.00 C ATOM 528 CG LYS A 36 -5.333 -20.914 -1.356 1.00 0.00 C ATOM 529 CD LYS A 36 -5.629 -21.904 -2.469 1.00 0.00 C ATOM 530 CE LYS A 36 -7.122 -22.007 -2.741 1.00 0.00 C ATOM 531 NZ LYS A 36 -7.429 -23.040 -3.769 1.00 0.00 N ATOM 0 H LYS A 36 -5.498 -22.869 2.099 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.299 -23.288 -0.425 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.446 -22.072 0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -5.519 -20.767 0.770 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -6.005 -20.060 -1.439 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.318 -20.533 -1.467 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.113 -21.596 -3.378 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.239 -22.885 -2.198 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.644 -22.250 -1.815 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.498 -21.040 -3.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.456 -23.079 -3.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -6.952 -22.795 -4.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.093 -23.968 -3.440 1.00 0.00 H new ATOM 545 N ARG A 37 -2.784 -21.183 1.600 1.00 0.00 N ATOM 546 CA ARG A 37 -1.545 -20.443 1.813 1.00 0.00 C ATOM 547 C ARG A 37 -0.333 -21.356 1.655 1.00 0.00 C ATOM 548 O ARG A 37 0.677 -20.966 1.071 1.00 0.00 O ATOM 549 CB ARG A 37 -1.540 -19.805 3.203 1.00 0.00 C ATOM 550 CG ARG A 37 -2.307 -18.495 3.275 1.00 0.00 C ATOM 551 CD ARG A 37 -2.038 -17.763 4.580 1.00 0.00 C ATOM 552 NE ARG A 37 -2.913 -18.223 5.656 1.00 0.00 N ATOM 553 CZ ARG A 37 -2.628 -18.081 6.946 1.00 0.00 C ATOM 554 NH1 ARG A 37 -1.499 -17.495 7.318 1.00 0.00 N ATOM 555 NH2 ARG A 37 -3.475 -18.526 7.866 1.00 0.00 N ATOM 0 H ARG A 37 -3.419 -21.181 2.398 1.00 0.00 H new ATOM 0 HA ARG A 37 -1.486 -19.657 1.060 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.970 -20.507 3.917 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.509 -19.630 3.509 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.024 -17.860 2.435 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.375 -18.692 3.180 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.998 -17.910 4.871 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.179 -16.692 4.431 1.00 0.00 H new ATOM 0 HE ARG A 37 -3.790 -18.678 5.403 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -0.846 -17.152 6.613 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -1.283 -17.387 8.309 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -4.345 -18.977 7.583 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -3.256 -18.417 8.856 1.00 0.00 H new ATOM 569 N GLU A 38 -0.442 -22.572 2.182 1.00 0.00 N ATOM 570 CA GLU A 38 0.647 -23.539 2.100 1.00 0.00 C ATOM 571 C GLU A 38 0.831 -24.031 0.668 1.00 0.00 C ATOM 572 O GLU A 38 1.956 -24.208 0.202 1.00 0.00 O ATOM 573 CB GLU A 38 0.375 -24.725 3.028 1.00 0.00 C ATOM 574 CG GLU A 38 0.857 -24.507 4.452 1.00 0.00 C ATOM 575 CD GLU A 38 0.389 -25.595 5.399 1.00 0.00 C ATOM 576 OE1 GLU A 38 -0.830 -25.677 5.653 1.00 0.00 O ATOM 577 OE2 GLU A 38 1.244 -26.364 5.887 1.00 0.00 O ATOM 0 H GLU A 38 -1.272 -22.910 2.669 1.00 0.00 H new ATOM 0 HA GLU A 38 1.565 -23.043 2.415 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.696 -24.926 3.043 1.00 0.00 H new ATOM 0 HB3 GLU A 38 0.860 -25.612 2.621 1.00 0.00 H new ATOM 0 HG2 GLU A 38 1.946 -24.467 4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.499 -23.541 4.809 1.00 0.00 H new ATOM 584 N GLU A 39 -0.283 -24.251 -0.024 1.00 0.00 N ATOM 585 CA GLU A 39 -0.243 -24.725 -1.403 1.00 0.00 C ATOM 586 C GLU A 39 0.455 -23.712 -2.306 1.00 0.00 C ATOM 587 O GLU A 39 1.301 -24.075 -3.124 1.00 0.00 O ATOM 588 CB GLU A 39 -1.661 -24.989 -1.915 1.00 0.00 C ATOM 589 CG GLU A 39 -1.707 -25.880 -3.146 1.00 0.00 C ATOM 590 CD GLU A 39 -1.666 -27.355 -2.800 1.00 0.00 C ATOM 591 OE1 GLU A 39 -0.661 -27.797 -2.204 1.00 0.00 O ATOM 592 OE2 GLU A 39 -2.638 -28.069 -3.125 1.00 0.00 O ATOM 0 H GLU A 39 -1.223 -24.109 0.347 1.00 0.00 H new ATOM 0 HA GLU A 39 0.323 -25.656 -1.425 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.245 -25.452 -1.120 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.138 -24.037 -2.148 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.616 -25.668 -3.710 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.865 -25.639 -3.796 1.00 0.00 H new ATOM 599 N ILE A 40 0.094 -22.443 -2.152 1.00 0.00 N ATOM 600 CA ILE A 40 0.686 -21.378 -2.952 1.00 0.00 C ATOM 601 C ILE A 40 2.130 -21.118 -2.539 1.00 0.00 C ATOM 602 O ILE A 40 2.979 -20.808 -3.374 1.00 0.00 O ATOM 603 CB ILE A 40 -0.116 -20.069 -2.829 1.00 0.00 C ATOM 604 CG1 ILE A 40 0.237 -19.119 -3.975 1.00 0.00 C ATOM 605 CG2 ILE A 40 0.152 -19.409 -1.484 1.00 0.00 C ATOM 606 CD1 ILE A 40 1.431 -18.237 -3.682 1.00 0.00 C ATOM 0 H ILE A 40 -0.606 -22.127 -1.480 1.00 0.00 H new ATOM 0 HA ILE A 40 0.662 -21.712 -3.989 1.00 0.00 H new ATOM 0 HB ILE A 40 -1.179 -20.303 -2.892 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.439 -19.704 -4.872 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.625 -18.489 -4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.422 -18.485 -1.411 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.145 -20.084 -0.682 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.215 -19.184 -1.394 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.624 -17.590 -4.538 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.225 -17.626 -2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.306 -18.860 -3.494 1.00 0.00 H new ATOM 618 N ALA A 41 2.402 -21.247 -1.245 1.00 0.00 N ATOM 619 CA ALA A 41 3.745 -21.030 -0.721 1.00 0.00 C ATOM 620 C ALA A 41 4.709 -22.101 -1.220 1.00 0.00 C ATOM 621 O ALA A 41 5.837 -21.801 -1.609 1.00 0.00 O ATOM 622 CB ALA A 41 3.720 -21.006 0.800 1.00 0.00 C ATOM 0 H ALA A 41 1.710 -21.501 -0.540 1.00 0.00 H new ATOM 0 HA ALA A 41 4.098 -20.064 -1.083 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.729 -20.843 1.178 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.071 -20.200 1.141 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.342 -21.958 1.173 1.00 0.00 H new ATOM 628 N ASN A 42 4.257 -23.351 -1.204 1.00 0.00 N ATOM 629 CA ASN A 42 5.081 -24.467 -1.654 1.00 0.00 C ATOM 630 C ASN A 42 5.521 -24.269 -3.102 1.00 0.00 C ATOM 631 O ASN A 42 6.660 -24.568 -3.461 1.00 0.00 O ATOM 632 CB ASN A 42 4.313 -25.783 -1.519 1.00 0.00 C ATOM 633 CG ASN A 42 4.488 -26.416 -0.152 1.00 0.00 C ATOM 634 OD1 ASN A 42 5.555 -26.941 0.169 1.00 0.00 O ATOM 635 ND2 ASN A 42 3.439 -26.370 0.660 1.00 0.00 N ATOM 0 H ASN A 42 3.325 -23.616 -0.885 1.00 0.00 H new ATOM 0 HA ASN A 42 5.970 -24.507 -1.024 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.253 -25.603 -1.700 1.00 0.00 H new ATOM 0 HB3 ASN A 42 4.653 -26.480 -2.285 1.00 0.00 H new ATOM 0 HD21 ASN A 42 3.497 -26.780 1.592 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.575 -25.925 0.352 1.00 0.00 H new ATOM 642 N ALA A 43 4.611 -23.762 -3.927 1.00 0.00 N ATOM 643 CA ALA A 43 4.906 -23.522 -5.334 1.00 0.00 C ATOM 644 C ALA A 43 5.990 -22.462 -5.495 1.00 0.00 C ATOM 645 O ALA A 43 6.831 -22.551 -6.390 1.00 0.00 O ATOM 646 CB ALA A 43 3.644 -23.104 -6.074 1.00 0.00 C ATOM 0 H ALA A 43 3.664 -23.510 -3.645 1.00 0.00 H new ATOM 0 HA ALA A 43 5.277 -24.452 -5.765 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.879 -22.928 -7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.898 -23.895 -5.997 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.249 -22.189 -5.632 1.00 0.00 H new ATOM 652 N CYS A 44 5.965 -21.460 -4.623 1.00 0.00 N ATOM 653 CA CYS A 44 6.946 -20.381 -4.669 1.00 0.00 C ATOM 654 C CYS A 44 8.345 -20.904 -4.361 1.00 0.00 C ATOM 655 O CYS A 44 9.321 -20.503 -4.993 1.00 0.00 O ATOM 656 CB CYS A 44 6.570 -19.279 -3.678 1.00 0.00 C ATOM 657 SG CYS A 44 4.936 -18.558 -3.959 1.00 0.00 S ATOM 0 H CYS A 44 5.276 -21.372 -3.876 1.00 0.00 H new ATOM 0 HA CYS A 44 6.947 -19.967 -5.677 1.00 0.00 H new ATOM 0 HB2 CYS A 44 6.607 -19.686 -2.668 1.00 0.00 H new ATOM 0 HB3 CYS A 44 7.318 -18.488 -3.730 1.00 0.00 H new ATOM 0 HG CYS A 44 4.036 -19.495 -3.921 1.00 0.00 H new ATOM 663 N ASN A 45 8.433 -21.801 -3.384 1.00 0.00 N ATOM 664 CA ASN A 45 9.713 -22.378 -2.990 1.00 0.00 C ATOM 665 C ASN A 45 10.284 -23.249 -4.105 1.00 0.00 C ATOM 666 O ASN A 45 11.499 -23.335 -4.280 1.00 0.00 O ATOM 667 CB ASN A 45 9.552 -23.205 -1.713 1.00 0.00 C ATOM 668 CG ASN A 45 9.557 -22.347 -0.463 1.00 0.00 C ATOM 669 OD1 ASN A 45 10.361 -21.423 -0.335 1.00 0.00 O ATOM 670 ND2 ASN A 45 8.657 -22.649 0.466 1.00 0.00 N ATOM 0 H ASN A 45 7.634 -22.144 -2.851 1.00 0.00 H new ATOM 0 HA ASN A 45 10.408 -21.560 -2.800 1.00 0.00 H new ATOM 0 HB2 ASN A 45 8.618 -23.765 -1.762 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.359 -23.935 -1.652 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.612 -22.106 1.328 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.010 -23.424 0.317 1.00 0.00 H new ATOM 677 N ALA A 46 9.398 -23.894 -4.857 1.00 0.00 N ATOM 678 CA ALA A 46 9.812 -24.756 -5.957 1.00 0.00 C ATOM 679 C ALA A 46 10.365 -23.937 -7.118 1.00 0.00 C ATOM 680 O ALA A 46 11.436 -24.235 -7.647 1.00 0.00 O ATOM 681 CB ALA A 46 8.646 -25.616 -6.422 1.00 0.00 C ATOM 0 H ALA A 46 8.388 -23.836 -4.724 1.00 0.00 H new ATOM 0 HA ALA A 46 10.607 -25.408 -5.596 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.970 -26.255 -7.244 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.299 -26.236 -5.596 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.833 -24.974 -6.760 1.00 0.00 H new ATOM 687 N VAL A 47 9.627 -22.904 -7.512 1.00 0.00 N ATOM 688 CA VAL A 47 10.043 -22.041 -8.611 1.00 0.00 C ATOM 689 C VAL A 47 11.407 -21.419 -8.335 1.00 0.00 C ATOM 690 O VAL A 47 12.200 -21.204 -9.252 1.00 0.00 O ATOM 691 CB VAL A 47 9.020 -20.918 -8.862 1.00 0.00 C ATOM 692 CG1 VAL A 47 7.762 -21.476 -9.510 1.00 0.00 C ATOM 693 CG2 VAL A 47 8.686 -20.202 -7.562 1.00 0.00 C ATOM 0 H VAL A 47 8.737 -22.644 -7.086 1.00 0.00 H new ATOM 0 HA VAL A 47 10.106 -22.669 -9.500 1.00 0.00 H new ATOM 0 HB VAL A 47 9.462 -20.194 -9.547 1.00 0.00 H new ATOM 0 HG11 VAL A 47 7.051 -20.668 -9.680 1.00 0.00 H new ATOM 0 HG12 VAL A 47 8.018 -21.940 -10.463 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.314 -22.221 -8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.962 -19.411 -7.758 1.00 0.00 H new ATOM 0 HG22 VAL A 47 8.263 -20.914 -6.853 1.00 0.00 H new ATOM 0 HG23 VAL A 47 9.593 -19.767 -7.143 1.00 0.00 H new ATOM 703 N ILE A 48 11.674 -21.131 -7.065 1.00 0.00 N ATOM 704 CA ILE A 48 12.943 -20.534 -6.668 1.00 0.00 C ATOM 705 C ILE A 48 13.977 -21.607 -6.342 1.00 0.00 C ATOM 706 O ILE A 48 15.171 -21.419 -6.569 1.00 0.00 O ATOM 707 CB ILE A 48 12.773 -19.613 -5.445 1.00 0.00 C ATOM 708 CG1 ILE A 48 12.495 -20.441 -4.189 1.00 0.00 C ATOM 709 CG2 ILE A 48 11.652 -18.614 -5.686 1.00 0.00 C ATOM 710 CD1 ILE A 48 12.415 -19.614 -2.925 1.00 0.00 C ATOM 0 H ILE A 48 11.028 -21.302 -6.294 1.00 0.00 H new ATOM 0 HA ILE A 48 13.292 -19.941 -7.514 1.00 0.00 H new ATOM 0 HB ILE A 48 13.700 -19.060 -5.294 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.557 -20.981 -4.320 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.280 -21.188 -4.075 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.544 -17.970 -4.813 1.00 0.00 H new ATOM 0 HG22 ILE A 48 11.889 -18.005 -6.559 1.00 0.00 H new ATOM 0 HG23 ILE A 48 10.719 -19.149 -5.859 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.216 -20.267 -2.075 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.361 -19.094 -2.770 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.611 -18.884 -3.018 1.00 0.00 H new ATOM 722 N GLN A 49 13.508 -22.731 -5.811 1.00 0.00 N ATOM 723 CA GLN A 49 14.392 -23.835 -5.456 1.00 0.00 C ATOM 724 C GLN A 49 15.345 -24.159 -6.601 1.00 0.00 C ATOM 725 O GLN A 49 14.921 -24.352 -7.741 1.00 0.00 O ATOM 726 CB GLN A 49 13.574 -25.074 -5.091 1.00 0.00 C ATOM 727 CG GLN A 49 14.413 -26.332 -4.934 1.00 0.00 C ATOM 728 CD GLN A 49 15.172 -26.368 -3.622 1.00 0.00 C ATOM 729 OE1 GLN A 49 14.626 -26.744 -2.585 1.00 0.00 O ATOM 730 NE2 GLN A 49 16.440 -25.974 -3.661 1.00 0.00 N ATOM 0 H GLN A 49 12.521 -22.901 -5.617 1.00 0.00 H new ATOM 0 HA GLN A 49 14.982 -23.531 -4.592 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.040 -24.885 -4.160 1.00 0.00 H new ATOM 0 HB3 GLN A 49 12.822 -25.243 -5.862 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.765 -27.206 -4.999 1.00 0.00 H new ATOM 0 HG3 GLN A 49 15.121 -26.398 -5.761 1.00 0.00 H new ATOM 0 HE21 GLN A 49 16.853 -25.670 -4.543 1.00 0.00 H new ATOM 0 HE22 GLN A 49 17.001 -25.976 -2.809 1.00 0.00 H new ATOM 739 N LYS A 50 16.636 -24.216 -6.292 1.00 0.00 N ATOM 740 CA LYS A 50 17.651 -24.517 -7.295 1.00 0.00 C ATOM 741 C LYS A 50 18.066 -25.984 -7.225 1.00 0.00 C ATOM 742 O LYS A 50 18.055 -26.607 -6.164 1.00 0.00 O ATOM 743 CB LYS A 50 18.875 -23.620 -7.097 1.00 0.00 C ATOM 744 CG LYS A 50 18.597 -22.148 -7.346 1.00 0.00 C ATOM 745 CD LYS A 50 17.970 -21.486 -6.130 1.00 0.00 C ATOM 746 CE LYS A 50 18.964 -21.368 -4.985 1.00 0.00 C ATOM 747 NZ LYS A 50 18.926 -22.559 -4.092 1.00 0.00 N ATOM 0 H LYS A 50 17.004 -24.058 -5.354 1.00 0.00 H new ATOM 0 HA LYS A 50 17.223 -24.325 -8.279 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.245 -23.744 -6.079 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.669 -23.950 -7.767 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.527 -21.639 -7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.932 -22.042 -8.203 1.00 0.00 H new ATOM 0 HD2 LYS A 50 17.606 -20.495 -6.401 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.106 -22.065 -5.805 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.970 -21.248 -5.388 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.745 -20.472 -4.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 19.881 -22.750 -3.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 18.282 -22.376 -3.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 18.588 -23.384 -4.628 1.00 0.00 H new ATOM 761 N PRO A 51 18.441 -26.549 -8.382 1.00 0.00 N ATOM 762 CA PRO A 51 18.869 -27.948 -8.478 1.00 0.00 C ATOM 763 C PRO A 51 20.218 -28.189 -7.809 1.00 0.00 C ATOM 764 O PRO A 51 21.193 -27.493 -8.088 1.00 0.00 O ATOM 765 CB PRO A 51 18.970 -28.185 -9.987 1.00 0.00 C ATOM 766 CG PRO A 51 19.216 -26.835 -10.567 1.00 0.00 C ATOM 767 CD PRO A 51 18.479 -25.865 -9.686 1.00 0.00 C ATOM 0 HA PRO A 51 18.177 -28.622 -7.972 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.781 -28.872 -10.226 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.053 -28.624 -10.381 1.00 0.00 H new ATOM 0 HG2 PRO A 51 20.282 -26.609 -10.590 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.856 -26.780 -11.594 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.996 -24.907 -9.622 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.476 -25.662 -10.063 1.00 0.00 H new ATOM 775 N GLY A 52 20.266 -29.180 -6.924 1.00 0.00 N ATOM 776 CA GLY A 52 21.500 -29.495 -6.229 1.00 0.00 C ATOM 777 C GLY A 52 21.866 -28.450 -5.194 1.00 0.00 C ATOM 778 O GLY A 52 22.971 -28.462 -4.652 1.00 0.00 O ATOM 0 H GLY A 52 19.472 -29.770 -6.676 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.402 -30.465 -5.742 1.00 0.00 H new ATOM 0 HA3 GLY A 52 22.309 -29.583 -6.954 1.00 0.00 H new ATOM 782 N LYS A 53 20.937 -27.540 -4.920 1.00 0.00 N ATOM 783 CA LYS A 53 21.167 -26.482 -3.944 1.00 0.00 C ATOM 784 C LYS A 53 20.141 -26.550 -2.816 1.00 0.00 C ATOM 785 O LYS A 53 19.049 -27.091 -2.989 1.00 0.00 O ATOM 786 CB LYS A 53 21.104 -25.111 -4.622 1.00 0.00 C ATOM 787 CG LYS A 53 21.990 -24.067 -3.967 1.00 0.00 C ATOM 788 CD LYS A 53 23.462 -24.342 -4.227 1.00 0.00 C ATOM 789 CE LYS A 53 23.914 -23.749 -5.552 1.00 0.00 C ATOM 790 NZ LYS A 53 23.962 -22.261 -5.506 1.00 0.00 N ATOM 0 H LYS A 53 20.017 -27.514 -5.361 1.00 0.00 H new ATOM 0 HA LYS A 53 22.160 -26.625 -3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 53 21.395 -25.218 -5.667 1.00 0.00 H new ATOM 0 HB3 LYS A 53 20.073 -24.758 -4.613 1.00 0.00 H new ATOM 0 HG2 LYS A 53 21.731 -23.079 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 53 21.806 -24.054 -2.893 1.00 0.00 H new ATOM 0 HD2 LYS A 53 24.060 -23.924 -3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 53 23.637 -25.418 -4.230 1.00 0.00 H new ATOM 0 HE2 LYS A 53 24.901 -24.137 -5.806 1.00 0.00 H new ATOM 0 HE3 LYS A 53 23.234 -24.066 -6.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 24.562 -21.909 -6.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 23.000 -21.879 -5.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 24.357 -21.954 -4.594 1.00 0.00 H new ATOM 804 N LYS A 54 20.500 -25.997 -1.663 1.00 0.00 N ATOM 805 CA LYS A 54 19.611 -25.992 -0.507 1.00 0.00 C ATOM 806 C LYS A 54 18.950 -24.628 -0.335 1.00 0.00 C ATOM 807 O LYS A 54 19.602 -23.591 -0.464 1.00 0.00 O ATOM 808 CB LYS A 54 20.386 -26.359 0.760 1.00 0.00 C ATOM 809 CG LYS A 54 19.499 -26.582 1.973 1.00 0.00 C ATOM 810 CD LYS A 54 20.302 -27.060 3.171 1.00 0.00 C ATOM 811 CE LYS A 54 20.858 -25.892 3.970 1.00 0.00 C ATOM 812 NZ LYS A 54 21.779 -26.346 5.049 1.00 0.00 N ATOM 0 H LYS A 54 21.401 -25.546 -1.504 1.00 0.00 H new ATOM 0 HA LYS A 54 18.832 -26.735 -0.676 1.00 0.00 H new ATOM 0 HB2 LYS A 54 20.965 -27.263 0.573 1.00 0.00 H new ATOM 0 HB3 LYS A 54 21.099 -25.565 0.983 1.00 0.00 H new ATOM 0 HG2 LYS A 54 18.986 -25.654 2.225 1.00 0.00 H new ATOM 0 HG3 LYS A 54 18.730 -27.316 1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 54 19.670 -27.673 3.813 1.00 0.00 H new ATOM 0 HD3 LYS A 54 21.122 -27.693 2.832 1.00 0.00 H new ATOM 0 HE2 LYS A 54 21.388 -25.214 3.301 1.00 0.00 H new ATOM 0 HE3 LYS A 54 20.035 -25.328 4.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 22.137 -25.520 5.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 21.267 -26.973 5.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 22.578 -26.863 4.629 1.00 0.00 H new ATOM 826 N LEU A 55 17.655 -24.636 -0.041 1.00 0.00 N ATOM 827 CA LEU A 55 16.906 -23.399 0.151 1.00 0.00 C ATOM 828 C LEU A 55 17.239 -22.764 1.497 1.00 0.00 C ATOM 829 O LEU A 55 17.469 -23.463 2.484 1.00 0.00 O ATOM 830 CB LEU A 55 15.403 -23.670 0.060 1.00 0.00 C ATOM 831 CG LEU A 55 14.799 -23.636 -1.344 1.00 0.00 C ATOM 832 CD1 LEU A 55 13.379 -24.180 -1.327 1.00 0.00 C ATOM 833 CD2 LEU A 55 14.823 -22.220 -1.902 1.00 0.00 C ATOM 0 H LEU A 55 17.101 -25.485 0.070 1.00 0.00 H new ATOM 0 HA LEU A 55 17.192 -22.704 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.204 -24.649 0.496 1.00 0.00 H new ATOM 0 HB3 LEU A 55 14.884 -22.935 0.675 1.00 0.00 H new ATOM 0 HG LEU A 55 15.402 -24.271 -1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.965 -24.148 -2.335 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.388 -25.210 -0.971 1.00 0.00 H new ATOM 0 HD13 LEU A 55 12.764 -23.572 -0.663 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.389 -22.216 -2.902 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.244 -21.563 -1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 55 15.853 -21.866 -1.952 1.00 0.00 H new ATOM 845 N SER A 56 17.261 -21.435 1.530 1.00 0.00 N ATOM 846 CA SER A 56 17.568 -20.706 2.755 1.00 0.00 C ATOM 847 C SER A 56 16.290 -20.221 3.432 1.00 0.00 C ATOM 848 O SER A 56 15.266 -20.019 2.779 1.00 0.00 O ATOM 849 CB SER A 56 18.481 -19.516 2.450 1.00 0.00 C ATOM 850 OG SER A 56 19.297 -19.776 1.321 1.00 0.00 O ATOM 0 H SER A 56 17.070 -20.842 0.723 1.00 0.00 H new ATOM 0 HA SER A 56 18.083 -21.385 3.434 1.00 0.00 H new ATOM 0 HB2 SER A 56 17.877 -18.627 2.269 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.109 -19.304 3.315 1.00 0.00 H new ATOM 0 HG SER A 56 19.870 -19.000 1.146 1.00 0.00 H new ATOM 856 N ASP A 57 16.358 -20.035 4.746 1.00 0.00 N ATOM 857 CA ASP A 57 15.208 -19.573 5.514 1.00 0.00 C ATOM 858 C ASP A 57 14.758 -18.194 5.040 1.00 0.00 C ATOM 859 O ASP A 57 13.595 -17.820 5.201 1.00 0.00 O ATOM 860 CB ASP A 57 15.547 -19.528 7.004 1.00 0.00 C ATOM 861 CG ASP A 57 15.330 -20.864 7.687 1.00 0.00 C ATOM 862 OD1 ASP A 57 15.712 -21.899 7.103 1.00 0.00 O ATOM 863 OD2 ASP A 57 14.778 -20.874 8.807 1.00 0.00 O ATOM 0 H ASP A 57 17.198 -20.197 5.301 1.00 0.00 H new ATOM 0 HA ASP A 57 14.391 -20.277 5.357 1.00 0.00 H new ATOM 0 HB2 ASP A 57 16.586 -19.224 7.128 1.00 0.00 H new ATOM 0 HB3 ASP A 57 14.933 -18.770 7.491 1.00 0.00 H new ATOM 868 N LEU A 58 15.685 -17.442 4.458 1.00 0.00 N ATOM 869 CA LEU A 58 15.384 -16.104 3.962 1.00 0.00 C ATOM 870 C LEU A 58 14.604 -16.171 2.653 1.00 0.00 C ATOM 871 O LEU A 58 13.924 -15.217 2.275 1.00 0.00 O ATOM 872 CB LEU A 58 16.677 -15.312 3.758 1.00 0.00 C ATOM 873 CG LEU A 58 17.325 -14.748 5.023 1.00 0.00 C ATOM 874 CD1 LEU A 58 18.162 -15.813 5.714 1.00 0.00 C ATOM 875 CD2 LEU A 58 18.176 -13.531 4.689 1.00 0.00 C ATOM 0 H LEU A 58 16.652 -17.736 4.318 1.00 0.00 H new ATOM 0 HA LEU A 58 14.768 -15.598 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 58 17.400 -15.958 3.260 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.469 -14.484 3.080 1.00 0.00 H new ATOM 0 HG LEU A 58 16.534 -14.437 5.706 1.00 0.00 H new ATOM 0 HD11 LEU A 58 18.615 -15.393 6.612 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.526 -16.655 5.988 1.00 0.00 H new ATOM 0 HD13 LEU A 58 18.946 -16.155 5.038 1.00 0.00 H new ATOM 0 HD21 LEU A 58 18.629 -13.143 5.601 1.00 0.00 H new ATOM 0 HD22 LEU A 58 18.960 -13.817 3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.549 -12.761 4.239 1.00 0.00 H new ATOM 887 N GLU A 59 14.705 -17.305 1.967 1.00 0.00 N ATOM 888 CA GLU A 59 14.007 -17.496 0.701 1.00 0.00 C ATOM 889 C GLU A 59 12.821 -18.441 0.871 1.00 0.00 C ATOM 890 O GLU A 59 11.924 -18.485 0.029 1.00 0.00 O ATOM 891 CB GLU A 59 14.965 -18.047 -0.357 1.00 0.00 C ATOM 892 CG GLU A 59 16.100 -17.098 -0.704 1.00 0.00 C ATOM 893 CD GLU A 59 15.728 -16.120 -1.802 1.00 0.00 C ATOM 894 OE1 GLU A 59 15.175 -16.565 -2.830 1.00 0.00 O ATOM 895 OE2 GLU A 59 15.990 -14.911 -1.633 1.00 0.00 O ATOM 0 H GLU A 59 15.263 -18.105 2.266 1.00 0.00 H new ATOM 0 HA GLU A 59 13.633 -16.527 0.372 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.385 -18.987 -0.000 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.402 -18.273 -1.263 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.390 -16.543 0.188 1.00 0.00 H new ATOM 0 HG3 GLU A 59 16.969 -17.676 -1.017 1.00 0.00 H new ATOM 902 N ARG A 60 12.825 -19.195 1.965 1.00 0.00 N ATOM 903 CA ARG A 60 11.751 -20.141 2.245 1.00 0.00 C ATOM 904 C ARG A 60 10.428 -19.413 2.462 1.00 0.00 C ATOM 905 O ARG A 60 10.241 -18.731 3.470 1.00 0.00 O ATOM 906 CB ARG A 60 12.092 -20.981 3.477 1.00 0.00 C ATOM 907 CG ARG A 60 11.329 -22.294 3.549 1.00 0.00 C ATOM 908 CD ARG A 60 11.967 -23.257 4.537 1.00 0.00 C ATOM 909 NE ARG A 60 11.074 -24.359 4.883 1.00 0.00 N ATOM 910 CZ ARG A 60 11.387 -25.313 5.753 1.00 0.00 C ATOM 911 NH1 ARG A 60 12.563 -25.298 6.364 1.00 0.00 N ATOM 912 NH2 ARG A 60 10.520 -26.284 6.015 1.00 0.00 N ATOM 0 H ARG A 60 13.560 -19.170 2.672 1.00 0.00 H new ATOM 0 HA ARG A 60 11.646 -20.799 1.383 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.161 -21.191 3.478 1.00 0.00 H new ATOM 0 HB3 ARG A 60 11.881 -20.398 4.374 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.297 -22.101 3.843 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.298 -22.753 2.561 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.887 -23.657 4.111 1.00 0.00 H new ATOM 0 HD3 ARG A 60 12.243 -22.717 5.442 1.00 0.00 H new ATOM 0 HE ARG A 60 10.160 -24.399 4.432 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.231 -24.553 6.167 1.00 0.00 H new ATOM 0 HH12 ARG A 60 12.800 -26.032 7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 60 9.613 -26.298 5.548 1.00 0.00 H new ATOM 0 HH22 ARG A 60 10.761 -27.016 6.683 1.00 0.00 H new ATOM 926 N VAL A 61 9.513 -19.561 1.510 1.00 0.00 N ATOM 927 CA VAL A 61 8.207 -18.918 1.597 1.00 0.00 C ATOM 928 C VAL A 61 7.215 -19.792 2.356 1.00 0.00 C ATOM 929 O VAL A 61 6.708 -20.781 1.826 1.00 0.00 O ATOM 930 CB VAL A 61 7.639 -18.610 0.199 1.00 0.00 C ATOM 931 CG1 VAL A 61 6.250 -18.001 0.310 1.00 0.00 C ATOM 932 CG2 VAL A 61 8.576 -17.687 -0.565 1.00 0.00 C ATOM 0 H VAL A 61 9.652 -20.121 0.669 1.00 0.00 H new ATOM 0 HA VAL A 61 8.350 -17.982 2.137 1.00 0.00 H new ATOM 0 HB VAL A 61 7.556 -19.545 -0.355 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.864 -17.790 -0.687 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.585 -18.701 0.815 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.304 -17.075 0.882 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.159 -17.480 -1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.693 -16.752 -0.017 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.549 -18.167 -0.676 1.00 0.00 H new ATOM 942 N THR A 62 6.939 -19.419 3.602 1.00 0.00 N ATOM 943 CA THR A 62 6.007 -20.168 4.435 1.00 0.00 C ATOM 944 C THR A 62 4.585 -19.641 4.280 1.00 0.00 C ATOM 945 O THR A 62 4.350 -18.658 3.577 1.00 0.00 O ATOM 946 CB THR A 62 6.406 -20.104 5.921 1.00 0.00 C ATOM 947 OG1 THR A 62 5.877 -18.916 6.521 1.00 0.00 O ATOM 948 CG2 THR A 62 7.919 -20.126 6.077 1.00 0.00 C ATOM 0 H THR A 62 7.348 -18.602 4.056 1.00 0.00 H new ATOM 0 HA THR A 62 6.046 -21.204 4.100 1.00 0.00 H new ATOM 0 HB THR A 62 5.992 -20.979 6.423 1.00 0.00 H new ATOM 0 HG1 THR A 62 6.134 -18.884 7.466 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.176 -20.080 7.135 1.00 0.00 H new ATOM 0 HG22 THR A 62 8.316 -21.046 5.647 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.350 -19.268 5.561 1.00 0.00 H new ATOM 956 N SER A 63 3.639 -20.300 4.941 1.00 0.00 N ATOM 957 CA SER A 63 2.238 -19.900 4.873 1.00 0.00 C ATOM 958 C SER A 63 2.045 -18.501 5.452 1.00 0.00 C ATOM 959 O SER A 63 1.310 -17.683 4.897 1.00 0.00 O ATOM 960 CB SER A 63 1.362 -20.902 5.628 1.00 0.00 C ATOM 961 OG SER A 63 1.532 -20.774 7.029 1.00 0.00 O ATOM 0 H SER A 63 3.817 -21.114 5.530 1.00 0.00 H new ATOM 0 HA SER A 63 1.940 -19.886 3.825 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.315 -20.742 5.369 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.615 -21.916 5.319 1.00 0.00 H new ATOM 0 HG SER A 63 0.960 -21.424 7.489 1.00 0.00 H new ATOM 967 N LEU A 64 2.709 -18.234 6.571 1.00 0.00 N ATOM 968 CA LEU A 64 2.611 -16.935 7.228 1.00 0.00 C ATOM 969 C LEU A 64 3.119 -15.824 6.314 1.00 0.00 C ATOM 970 O LEU A 64 2.523 -14.750 6.233 1.00 0.00 O ATOM 971 CB LEU A 64 3.407 -16.940 8.534 1.00 0.00 C ATOM 972 CG LEU A 64 3.509 -15.600 9.263 1.00 0.00 C ATOM 973 CD1 LEU A 64 2.126 -15.083 9.626 1.00 0.00 C ATOM 974 CD2 LEU A 64 4.373 -15.735 10.508 1.00 0.00 C ATOM 0 H LEU A 64 3.321 -18.900 7.043 1.00 0.00 H new ATOM 0 HA LEU A 64 1.561 -16.746 7.451 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.953 -17.665 9.210 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.416 -17.292 8.320 1.00 0.00 H new ATOM 0 HG LEU A 64 3.980 -14.879 8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.219 -14.129 10.144 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.538 -14.947 8.718 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.628 -15.802 10.276 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.435 -14.772 11.014 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.931 -16.470 11.180 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.374 -16.060 10.223 1.00 0.00 H new ATOM 986 N LYS A 65 4.224 -16.091 5.625 1.00 0.00 N ATOM 987 CA LYS A 65 4.812 -15.116 4.714 1.00 0.00 C ATOM 988 C LYS A 65 3.821 -14.726 3.622 1.00 0.00 C ATOM 989 O LYS A 65 3.738 -13.561 3.233 1.00 0.00 O ATOM 990 CB LYS A 65 6.087 -15.681 4.083 1.00 0.00 C ATOM 991 CG LYS A 65 7.341 -15.403 4.894 1.00 0.00 C ATOM 992 CD LYS A 65 8.578 -15.976 4.221 1.00 0.00 C ATOM 993 CE LYS A 65 9.747 -16.068 5.190 1.00 0.00 C ATOM 994 NZ LYS A 65 9.690 -17.310 6.010 1.00 0.00 N ATOM 0 H LYS A 65 4.730 -16.975 5.680 1.00 0.00 H new ATOM 0 HA LYS A 65 5.063 -14.224 5.288 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.975 -16.758 3.960 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.208 -15.257 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.461 -14.327 5.023 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.235 -15.834 5.890 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.353 -16.967 3.826 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.855 -15.350 3.373 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.684 -16.043 4.633 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.744 -15.198 5.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.351 -17.229 6.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.724 -17.443 6.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.954 -18.126 5.422 1.00 0.00 H new ATOM 1008 N VAL A 66 3.071 -15.708 3.131 1.00 0.00 N ATOM 1009 CA VAL A 66 2.084 -15.466 2.086 1.00 0.00 C ATOM 1010 C VAL A 66 0.984 -14.531 2.574 1.00 0.00 C ATOM 1011 O VAL A 66 0.528 -13.655 1.838 1.00 0.00 O ATOM 1012 CB VAL A 66 1.447 -16.782 1.601 1.00 0.00 C ATOM 1013 CG1 VAL A 66 0.441 -16.512 0.492 1.00 0.00 C ATOM 1014 CG2 VAL A 66 2.520 -17.754 1.134 1.00 0.00 C ATOM 0 H VAL A 66 3.128 -16.678 3.440 1.00 0.00 H new ATOM 0 HA VAL A 66 2.611 -14.998 1.255 1.00 0.00 H new ATOM 0 HB VAL A 66 0.916 -17.238 2.437 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.002 -17.453 0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.345 -15.856 0.866 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.945 -16.033 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.051 -18.678 0.795 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.081 -17.309 0.312 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.197 -17.972 1.960 1.00 0.00 H new ATOM 1024 N TYR A 67 0.563 -14.721 3.819 1.00 0.00 N ATOM 1025 CA TYR A 67 -0.486 -13.895 4.405 1.00 0.00 C ATOM 1026 C TYR A 67 -0.027 -12.447 4.541 1.00 0.00 C ATOM 1027 O TYR A 67 -0.805 -11.516 4.340 1.00 0.00 O ATOM 1028 CB TYR A 67 -0.891 -14.444 5.774 1.00 0.00 C ATOM 1029 CG TYR A 67 -2.161 -13.833 6.321 1.00 0.00 C ATOM 1030 CD1 TYR A 67 -3.361 -13.942 5.629 1.00 0.00 C ATOM 1031 CD2 TYR A 67 -2.161 -13.147 7.529 1.00 0.00 C ATOM 1032 CE1 TYR A 67 -4.524 -13.385 6.124 1.00 0.00 C ATOM 1033 CE2 TYR A 67 -3.320 -12.587 8.032 1.00 0.00 C ATOM 1034 CZ TYR A 67 -4.499 -12.708 7.326 1.00 0.00 C ATOM 1035 OH TYR A 67 -5.655 -12.152 7.823 1.00 0.00 O ATOM 0 H TYR A 67 0.932 -15.440 4.442 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.349 -13.922 3.740 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -1.020 -15.524 5.699 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.080 -14.269 6.481 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.385 -14.471 4.688 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.240 -13.050 8.084 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.448 -13.479 5.573 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.303 -12.057 8.973 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.465 -11.712 8.678 1.00 0.00 H new ATOM 1045 N ASN A 68 1.245 -12.266 4.884 1.00 0.00 N ATOM 1046 CA ASN A 68 1.810 -10.931 5.048 1.00 0.00 C ATOM 1047 C ASN A 68 1.813 -10.176 3.722 1.00 0.00 C ATOM 1048 O ASN A 68 1.457 -8.999 3.666 1.00 0.00 O ATOM 1049 CB ASN A 68 3.234 -11.022 5.599 1.00 0.00 C ATOM 1050 CG ASN A 68 3.267 -11.034 7.115 1.00 0.00 C ATOM 1051 OD1 ASN A 68 2.969 -10.029 7.762 1.00 0.00 O ATOM 1052 ND2 ASN A 68 3.631 -12.174 7.690 1.00 0.00 N ATOM 0 H ASN A 68 1.903 -13.026 5.054 1.00 0.00 H new ATOM 0 HA ASN A 68 1.188 -10.384 5.756 1.00 0.00 H new ATOM 0 HB2 ASN A 68 3.710 -11.927 5.221 1.00 0.00 H new ATOM 0 HB3 ASN A 68 3.817 -10.178 5.232 1.00 0.00 H new ATOM 0 HD21 ASN A 68 3.672 -12.242 8.707 1.00 0.00 H new ATOM 0 HD22 ASN A 68 3.869 -12.982 7.115 1.00 0.00 H new ATOM 1059 N TRP A 69 2.216 -10.861 2.658 1.00 0.00 N ATOM 1060 CA TRP A 69 2.265 -10.255 1.333 1.00 0.00 C ATOM 1061 C TRP A 69 0.861 -9.951 0.821 1.00 0.00 C ATOM 1062 O TRP A 69 0.600 -8.863 0.307 1.00 0.00 O ATOM 1063 CB TRP A 69 2.989 -11.181 0.353 1.00 0.00 C ATOM 1064 CG TRP A 69 3.077 -10.623 -1.036 1.00 0.00 C ATOM 1065 CD1 TRP A 69 4.150 -9.995 -1.600 1.00 0.00 C ATOM 1066 CD2 TRP A 69 2.051 -10.643 -2.034 1.00 0.00 C ATOM 1067 NE1 TRP A 69 3.853 -9.622 -2.889 1.00 0.00 N ATOM 1068 CE2 TRP A 69 2.571 -10.009 -3.179 1.00 0.00 C ATOM 1069 CE3 TRP A 69 0.744 -11.136 -2.073 1.00 0.00 C ATOM 1070 CZ2 TRP A 69 1.829 -9.856 -4.347 1.00 0.00 C ATOM 1071 CZ3 TRP A 69 0.008 -10.982 -3.232 1.00 0.00 C ATOM 1072 CH2 TRP A 69 0.552 -10.348 -4.357 1.00 0.00 C ATOM 0 H TRP A 69 2.513 -11.836 2.687 1.00 0.00 H new ATOM 0 HA TRP A 69 2.815 -9.317 1.410 1.00 0.00 H new ATOM 0 HB2 TRP A 69 3.996 -11.375 0.724 1.00 0.00 H new ATOM 0 HB3 TRP A 69 2.471 -12.140 0.320 1.00 0.00 H new ATOM 0 HD1 TRP A 69 5.094 -9.817 -1.106 1.00 0.00 H new ATOM 0 HE1 TRP A 69 4.484 -9.136 -3.526 1.00 0.00 H new ATOM 0 HE3 TRP A 69 0.317 -11.629 -1.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 2.246 -9.366 -5.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -1.004 -11.357 -3.272 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -0.048 -10.246 -5.249 1.00 0.00 H new ATOM 1083 N PHE A 70 -0.039 -10.917 0.966 1.00 0.00 N ATOM 1084 CA PHE A 70 -1.417 -10.752 0.518 1.00 0.00 C ATOM 1085 C PHE A 70 -2.084 -9.580 1.232 1.00 0.00 C ATOM 1086 O PHE A 70 -2.728 -8.741 0.603 1.00 0.00 O ATOM 1087 CB PHE A 70 -2.213 -12.034 0.765 1.00 0.00 C ATOM 1088 CG PHE A 70 -2.177 -12.994 -0.390 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -0.985 -13.582 -0.782 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -3.335 -13.309 -1.084 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -0.948 -14.466 -1.844 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -3.304 -14.192 -2.146 1.00 0.00 C ATOM 1093 CZ PHE A 70 -2.109 -14.771 -2.527 1.00 0.00 C ATOM 0 H PHE A 70 0.161 -11.823 1.390 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.402 -10.543 -0.552 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.820 -12.531 1.652 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -3.250 -11.773 0.978 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.074 -13.347 -0.251 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.272 -12.859 -0.791 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -0.012 -14.918 -2.139 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.213 -14.429 -2.678 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.083 -15.461 -3.357 1.00 0.00 H new ATOM 1103 N ALA A 71 -1.925 -9.530 2.550 1.00 0.00 N ATOM 1104 CA ALA A 71 -2.510 -8.461 3.351 1.00 0.00 C ATOM 1105 C ALA A 71 -2.025 -7.094 2.879 1.00 0.00 C ATOM 1106 O ALA A 71 -2.784 -6.126 2.870 1.00 0.00 O ATOM 1107 CB ALA A 71 -2.179 -8.662 4.822 1.00 0.00 C ATOM 0 H ALA A 71 -1.396 -10.217 3.086 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.592 -8.497 3.226 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.622 -7.857 5.408 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.580 -9.618 5.158 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.097 -8.655 4.956 1.00 0.00 H new ATOM 1113 N ASN A 72 -0.757 -7.023 2.489 1.00 0.00 N ATOM 1114 CA ASN A 72 -0.170 -5.774 2.018 1.00 0.00 C ATOM 1115 C ASN A 72 -0.836 -5.315 0.725 1.00 0.00 C ATOM 1116 O ASN A 72 -1.009 -4.118 0.495 1.00 0.00 O ATOM 1117 CB ASN A 72 1.334 -5.943 1.798 1.00 0.00 C ATOM 1118 CG ASN A 72 2.091 -4.638 1.950 1.00 0.00 C ATOM 1119 OD1 ASN A 72 1.926 -3.716 1.151 1.00 0.00 O ATOM 1120 ND2 ASN A 72 2.927 -4.555 2.978 1.00 0.00 N ATOM 0 H ASN A 72 -0.116 -7.816 2.490 1.00 0.00 H new ATOM 0 HA ASN A 72 -0.335 -5.014 2.781 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.723 -6.671 2.510 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.509 -6.348 0.801 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.464 -3.702 3.131 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.032 -5.345 3.615 1.00 0.00 H new ATOM 1127 N ARG A 73 -1.208 -6.274 -0.116 1.00 0.00 N ATOM 1128 CA ARG A 73 -1.854 -5.968 -1.387 1.00 0.00 C ATOM 1129 C ARG A 73 -3.269 -5.442 -1.164 1.00 0.00 C ATOM 1130 O ARG A 73 -3.699 -4.492 -1.819 1.00 0.00 O ATOM 1131 CB ARG A 73 -1.895 -7.213 -2.275 1.00 0.00 C ATOM 1132 CG ARG A 73 -2.885 -7.109 -3.424 1.00 0.00 C ATOM 1133 CD ARG A 73 -2.424 -6.103 -4.467 1.00 0.00 C ATOM 1134 NE ARG A 73 -3.486 -5.768 -5.411 1.00 0.00 N ATOM 1135 CZ ARG A 73 -3.266 -5.218 -6.600 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -2.029 -4.944 -6.989 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -4.285 -4.942 -7.404 1.00 0.00 N ATOM 0 H ARG A 73 -1.073 -7.270 0.060 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.271 -5.194 -1.886 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -0.899 -7.393 -2.680 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -2.151 -8.077 -1.663 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.008 -8.087 -3.889 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.861 -6.814 -3.039 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -2.082 -5.196 -3.969 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.571 -6.509 -5.010 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.450 -5.967 -5.143 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.243 -5.155 -6.375 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -1.863 -4.522 -7.903 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.239 -5.152 -7.109 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -4.115 -4.520 -8.317 1.00 0.00 H new ATOM 1151 N ARG A 74 -3.988 -6.067 -0.237 1.00 0.00 N ATOM 1152 CA ARG A 74 -5.355 -5.663 0.070 1.00 0.00 C ATOM 1153 C ARG A 74 -5.393 -4.232 0.599 1.00 0.00 C ATOM 1154 O ARG A 74 -6.219 -3.423 0.176 1.00 0.00 O ATOM 1155 CB ARG A 74 -5.972 -6.614 1.097 1.00 0.00 C ATOM 1156 CG ARG A 74 -5.911 -8.076 0.685 1.00 0.00 C ATOM 1157 CD ARG A 74 -7.081 -8.864 1.255 1.00 0.00 C ATOM 1158 NE ARG A 74 -6.778 -9.418 2.572 1.00 0.00 N ATOM 1159 CZ ARG A 74 -6.017 -10.490 2.761 1.00 0.00 C ATOM 1160 NH1 ARG A 74 -5.485 -11.121 1.723 1.00 0.00 N ATOM 1161 NH2 ARG A 74 -5.788 -10.934 3.990 1.00 0.00 N ATOM 0 H ARG A 74 -3.647 -6.855 0.314 1.00 0.00 H new ATOM 0 HA ARG A 74 -5.936 -5.707 -0.851 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.456 -6.492 2.049 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.013 -6.334 1.260 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.917 -8.149 -0.403 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -4.974 -8.514 1.029 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.954 -8.216 1.327 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.340 -9.673 0.572 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.172 -8.956 3.392 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.660 -10.783 0.777 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.901 -11.944 1.871 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.197 -10.452 4.791 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.203 -11.757 4.134 1.00 0.00 H new ATOM 1175 N LYS A 75 -4.493 -3.927 1.529 1.00 0.00 N ATOM 1176 CA LYS A 75 -4.422 -2.594 2.116 1.00 0.00 C ATOM 1177 C LYS A 75 -3.896 -1.581 1.105 1.00 0.00 C ATOM 1178 O LYS A 75 -4.295 -0.417 1.115 1.00 0.00 O ATOM 1179 CB LYS A 75 -3.524 -2.608 3.355 1.00 0.00 C ATOM 1180 CG LYS A 75 -2.043 -2.713 3.031 1.00 0.00 C ATOM 1181 CD LYS A 75 -1.192 -2.655 4.288 1.00 0.00 C ATOM 1182 CE LYS A 75 -1.412 -3.877 5.167 1.00 0.00 C ATOM 1183 NZ LYS A 75 -2.554 -3.688 6.104 1.00 0.00 N ATOM 0 H LYS A 75 -3.803 -4.585 1.892 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.430 -2.299 2.408 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.698 -1.699 3.930 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.809 -3.446 3.991 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.850 -3.647 2.503 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.758 -1.903 2.360 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.139 -2.588 4.013 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.433 -1.753 4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.598 -4.748 4.538 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.505 -4.083 5.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.256 -3.936 7.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.861 -2.695 6.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.344 -4.301 5.817 1.00 0.00 H new ATOM 1197 N GLU A 76 -3.001 -2.032 0.233 1.00 0.00 N ATOM 1198 CA GLU A 76 -2.422 -1.163 -0.785 1.00 0.00 C ATOM 1199 C GLU A 76 -3.476 -0.745 -1.807 1.00 0.00 C ATOM 1200 O GLU A 76 -3.525 0.413 -2.225 1.00 0.00 O ATOM 1201 CB GLU A 76 -1.263 -1.870 -1.492 1.00 0.00 C ATOM 1202 CG GLU A 76 0.063 -1.743 -0.762 1.00 0.00 C ATOM 1203 CD GLU A 76 0.807 -0.471 -1.121 1.00 0.00 C ATOM 1204 OE1 GLU A 76 1.466 -0.448 -2.181 1.00 0.00 O ATOM 1205 OE2 GLU A 76 0.729 0.502 -0.341 1.00 0.00 O ATOM 0 H GLU A 76 -2.661 -2.993 0.211 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.045 -0.268 -0.290 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.507 -2.926 -1.604 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.156 -1.459 -2.496 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.115 -1.764 0.313 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.688 -2.604 -0.999 1.00 0.00 H new ATOM 1212 N ILE A 77 -4.316 -1.694 -2.204 1.00 0.00 N ATOM 1213 CA ILE A 77 -5.368 -1.424 -3.176 1.00 0.00 C ATOM 1214 C ILE A 77 -6.531 -0.677 -2.532 1.00 0.00 C ATOM 1215 O ILE A 77 -7.087 0.252 -3.119 1.00 0.00 O ATOM 1216 CB ILE A 77 -5.897 -2.725 -3.809 1.00 0.00 C ATOM 1217 CG1 ILE A 77 -6.569 -3.599 -2.748 1.00 0.00 C ATOM 1218 CG2 ILE A 77 -4.764 -3.482 -4.486 1.00 0.00 C ATOM 1219 CD1 ILE A 77 -7.099 -4.907 -3.290 1.00 0.00 C ATOM 0 H ILE A 77 -4.289 -2.657 -1.868 1.00 0.00 H new ATOM 0 HA ILE A 77 -4.926 -0.803 -3.956 1.00 0.00 H new ATOM 0 HB ILE A 77 -6.640 -2.468 -4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.852 -3.808 -1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -7.391 -3.042 -2.297 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.153 -4.399 -4.929 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.326 -2.860 -5.266 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -4.001 -3.730 -3.749 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -7.562 -5.475 -2.483 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -7.840 -4.707 -4.064 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.278 -5.484 -3.715 1.00 0.00 H new ATOM 1231 N LYS A 78 -6.894 -1.087 -1.322 1.00 0.00 N ATOM 1232 CA LYS A 78 -7.989 -0.455 -0.595 1.00 0.00 C ATOM 1233 C LYS A 78 -7.615 0.963 -0.174 1.00 0.00 C ATOM 1234 O LYS A 78 -8.455 1.863 -0.179 1.00 0.00 O ATOM 1235 CB LYS A 78 -8.357 -1.284 0.637 1.00 0.00 C ATOM 1236 CG LYS A 78 -7.475 -1.007 1.842 1.00 0.00 C ATOM 1237 CD LYS A 78 -8.038 0.114 2.699 1.00 0.00 C ATOM 1238 CE LYS A 78 -7.001 0.640 3.680 1.00 0.00 C ATOM 1239 NZ LYS A 78 -7.559 1.706 4.558 1.00 0.00 N ATOM 0 H LYS A 78 -6.445 -1.855 -0.823 1.00 0.00 H new ATOM 0 HA LYS A 78 -8.851 -0.403 -1.260 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.395 -1.083 0.903 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.292 -2.342 0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -7.381 -1.913 2.441 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -6.472 -0.742 1.507 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.380 0.927 2.058 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -8.908 -0.247 3.247 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.633 -0.181 4.295 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.147 1.033 3.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.822 2.038 5.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.887 2.501 3.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.358 1.324 5.103 1.00 0.00 H new ATOM 1253 N ARG A 79 -6.351 1.154 0.189 1.00 0.00 N ATOM 1254 CA ARG A 79 -5.867 2.462 0.612 1.00 0.00 C ATOM 1255 C ARG A 79 -6.058 3.497 -0.493 1.00 0.00 C ATOM 1256 O ARG A 79 -6.189 4.691 -0.224 1.00 0.00 O ATOM 1257 CB ARG A 79 -4.390 2.382 1.001 1.00 0.00 C ATOM 1258 CG ARG A 79 -3.792 3.720 1.403 1.00 0.00 C ATOM 1259 CD ARG A 79 -3.204 4.450 0.206 1.00 0.00 C ATOM 1260 NE ARG A 79 -2.512 5.675 0.597 1.00 0.00 N ATOM 1261 CZ ARG A 79 -1.321 5.690 1.186 1.00 0.00 C ATOM 1262 NH1 ARG A 79 -0.694 4.552 1.451 1.00 0.00 N ATOM 1263 NH2 ARG A 79 -0.756 6.845 1.512 1.00 0.00 N ATOM 0 H ARG A 79 -5.644 0.419 0.199 1.00 0.00 H new ATOM 0 HA ARG A 79 -6.448 2.772 1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.278 1.681 1.828 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -3.824 1.978 0.162 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.561 4.339 1.866 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -3.016 3.562 2.152 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -2.509 3.791 -0.314 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -4.000 4.693 -0.498 1.00 0.00 H new ATOM 0 HE ARG A 79 -2.968 6.568 0.408 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -1.126 3.662 1.203 1.00 0.00 H new ATOM 0 HH12 ARG A 79 0.220 4.567 1.903 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -1.236 7.722 1.311 1.00 0.00 H new ATOM 0 HH22 ARG A 79 0.158 6.856 1.964 1.00 0.00 H new ATOM 1277 N ARG A 80 -6.070 3.030 -1.738 1.00 0.00 N ATOM 1278 CA ARG A 80 -6.243 3.914 -2.884 1.00 0.00 C ATOM 1279 C ARG A 80 -7.722 4.176 -3.151 1.00 0.00 C ATOM 1280 O ARG A 80 -8.100 5.258 -3.599 1.00 0.00 O ATOM 1281 CB ARG A 80 -5.588 3.307 -4.126 1.00 0.00 C ATOM 1282 CG ARG A 80 -5.154 4.341 -5.152 1.00 0.00 C ATOM 1283 CD ARG A 80 -4.320 3.712 -6.258 1.00 0.00 C ATOM 1284 NE ARG A 80 -3.998 4.670 -7.312 1.00 0.00 N ATOM 1285 CZ ARG A 80 -3.285 4.363 -8.391 1.00 0.00 C ATOM 1286 NH1 ARG A 80 -2.824 3.131 -8.556 1.00 0.00 N ATOM 1287 NH2 ARG A 80 -3.034 5.290 -9.306 1.00 0.00 N ATOM 0 H ARG A 80 -5.962 2.045 -1.978 1.00 0.00 H new ATOM 0 HA ARG A 80 -5.760 4.864 -2.655 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -4.719 2.724 -3.820 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -6.288 2.615 -4.594 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -6.034 4.818 -5.584 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -4.577 5.124 -4.660 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -3.397 3.315 -5.835 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -4.863 2.870 -6.687 1.00 0.00 H new ATOM 0 HE ARG A 80 -4.339 5.627 -7.215 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -3.016 2.416 -7.854 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -2.277 2.898 -9.385 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -3.388 6.238 -9.182 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -2.487 5.054 -10.134 1.00 0.00 H new ATOM 1301 N ALA A 81 -8.554 3.177 -2.873 1.00 0.00 N ATOM 1302 CA ALA A 81 -9.991 3.300 -3.082 1.00 0.00 C ATOM 1303 C ALA A 81 -10.639 4.119 -1.972 1.00 0.00 C ATOM 1304 O ALA A 81 -11.788 4.544 -2.091 1.00 0.00 O ATOM 1305 CB ALA A 81 -10.631 1.922 -3.167 1.00 0.00 C ATOM 0 H ALA A 81 -8.257 2.274 -2.503 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.153 3.823 -4.025 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.704 2.028 -3.323 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.196 1.370 -4.000 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.451 1.380 -2.239 1.00 0.00 H new ATOM 1311 N ASN A 82 -9.896 4.336 -0.892 1.00 0.00 N ATOM 1312 CA ASN A 82 -10.399 5.104 0.241 1.00 0.00 C ATOM 1313 C ASN A 82 -9.830 6.520 0.235 1.00 0.00 C ATOM 1314 O ASN A 82 -10.576 7.500 0.233 1.00 0.00 O ATOM 1315 CB ASN A 82 -10.045 4.405 1.555 1.00 0.00 C ATOM 1316 CG ASN A 82 -10.850 4.935 2.727 1.00 0.00 C ATOM 1317 OD1 ASN A 82 -12.081 4.898 2.716 1.00 0.00 O ATOM 1318 ND2 ASN A 82 -10.157 5.430 3.745 1.00 0.00 N ATOM 0 H ASN A 82 -8.943 3.991 -0.777 1.00 0.00 H new ATOM 0 HA ASN A 82 -11.483 5.168 0.152 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -10.220 3.334 1.452 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -8.982 4.536 1.759 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -10.644 5.800 4.561 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -9.138 5.440 3.711 1.00 0.00 H new ATOM 1325 N ILE A 83 -8.505 6.618 0.232 1.00 0.00 N ATOM 1326 CA ILE A 83 -7.836 7.913 0.224 1.00 0.00 C ATOM 1327 C ILE A 83 -8.657 8.961 0.968 1.00 0.00 C ATOM 1328 O ILE A 83 -8.763 10.106 0.531 1.00 0.00 O ATOM 1329 CB ILE A 83 -7.577 8.405 -1.212 1.00 0.00 C ATOM 1330 CG1 ILE A 83 -6.769 7.366 -1.992 1.00 0.00 C ATOM 1331 CG2 ILE A 83 -6.851 9.742 -1.192 1.00 0.00 C ATOM 1332 CD1 ILE A 83 -5.288 7.399 -1.688 1.00 0.00 C ATOM 0 H ILE A 83 -7.874 5.817 0.235 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.880 7.777 0.730 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.536 8.542 -1.711 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.156 6.372 -1.766 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.916 7.530 -3.059 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -6.675 10.076 -2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.460 10.479 -0.669 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -5.896 9.630 -0.678 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.779 6.636 -2.276 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -4.886 8.380 -1.941 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.130 7.205 -0.627 1.00 0.00 H new ATOM 1344 N ALA A 84 -9.236 8.560 2.095 1.00 0.00 N ATOM 1345 CA ALA A 84 -10.045 9.465 2.902 1.00 0.00 C ATOM 1346 C ALA A 84 -9.213 10.107 4.007 1.00 0.00 C ATOM 1347 O ALA A 84 -9.229 9.656 5.152 1.00 0.00 O ATOM 1348 CB ALA A 84 -11.232 8.723 3.497 1.00 0.00 C ATOM 0 H ALA A 84 -9.160 7.614 2.470 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.415 10.259 2.253 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.827 9.411 4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.847 8.317 2.694 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.874 7.909 4.127 1.00 0.00 H new ATOM 1354 N ALA A 85 -8.485 11.163 3.656 1.00 0.00 N ATOM 1355 CA ALA A 85 -7.648 11.868 4.618 1.00 0.00 C ATOM 1356 C ALA A 85 -8.460 12.316 5.828 1.00 0.00 C ATOM 1357 O ALA A 85 -9.422 13.072 5.696 1.00 0.00 O ATOM 1358 CB ALA A 85 -6.977 13.063 3.958 1.00 0.00 C ATOM 0 H ALA A 85 -8.459 11.548 2.712 1.00 0.00 H new ATOM 0 HA ALA A 85 -6.878 11.179 4.965 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.355 13.580 4.688 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -6.356 12.720 3.130 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -7.739 13.746 3.582 1.00 0.00 H new ATOM 1364 N ILE A 86 -8.067 11.844 7.007 1.00 0.00 N ATOM 1365 CA ILE A 86 -8.759 12.197 8.240 1.00 0.00 C ATOM 1366 C ILE A 86 -8.259 13.529 8.789 1.00 0.00 C ATOM 1367 O ILE A 86 -9.043 14.347 9.271 1.00 0.00 O ATOM 1368 CB ILE A 86 -8.580 11.110 9.317 1.00 0.00 C ATOM 1369 CG1 ILE A 86 -8.865 9.727 8.729 1.00 0.00 C ATOM 1370 CG2 ILE A 86 -9.491 11.386 10.504 1.00 0.00 C ATOM 1371 CD1 ILE A 86 -7.674 9.109 8.032 1.00 0.00 C ATOM 0 H ILE A 86 -7.273 11.216 7.134 1.00 0.00 H new ATOM 0 HA ILE A 86 -9.818 12.283 7.995 1.00 0.00 H new ATOM 0 HB ILE A 86 -7.547 11.130 9.665 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -9.193 9.062 9.528 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -9.690 9.805 8.021 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -9.353 10.610 11.257 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -9.244 12.356 10.934 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -10.529 11.390 10.173 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -7.949 8.130 7.640 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -7.358 9.753 7.211 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -6.854 8.998 8.742 1.00 0.00 H new ATOM 1383 N LEU A 87 -6.950 13.740 8.712 1.00 0.00 N ATOM 1384 CA LEU A 87 -6.344 14.974 9.199 1.00 0.00 C ATOM 1385 C LEU A 87 -7.120 16.192 8.709 1.00 0.00 C ATOM 1386 O LEU A 87 -7.148 16.481 7.514 1.00 0.00 O ATOM 1387 CB LEU A 87 -4.887 15.065 8.742 1.00 0.00 C ATOM 1388 CG LEU A 87 -3.936 15.815 9.676 1.00 0.00 C ATOM 1389 CD1 LEU A 87 -4.466 17.210 9.969 1.00 0.00 C ATOM 1390 CD2 LEU A 87 -3.733 15.037 10.968 1.00 0.00 C ATOM 0 H LEU A 87 -6.288 13.072 8.317 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.376 14.960 10.288 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.506 14.053 8.605 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.863 15.550 7.766 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.971 15.912 9.179 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.776 17.729 10.635 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.559 17.767 9.037 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.443 17.135 10.446 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.054 15.586 11.620 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.692 14.908 11.469 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.308 14.059 10.741 1.00 0.00 H new ATOM 1402 N GLU A 88 -7.746 16.903 9.642 1.00 0.00 N ATOM 1403 CA GLU A 88 -8.521 18.091 9.304 1.00 0.00 C ATOM 1404 C GLU A 88 -7.675 19.353 9.451 1.00 0.00 C ATOM 1405 O GLU A 88 -7.427 19.821 10.563 1.00 0.00 O ATOM 1406 CB GLU A 88 -9.761 18.189 10.195 1.00 0.00 C ATOM 1407 CG GLU A 88 -10.600 19.429 9.935 1.00 0.00 C ATOM 1408 CD GLU A 88 -11.891 19.436 10.732 1.00 0.00 C ATOM 1409 OE1 GLU A 88 -11.871 19.899 11.891 1.00 0.00 O ATOM 1410 OE2 GLU A 88 -12.922 18.979 10.194 1.00 0.00 O ATOM 0 H GLU A 88 -7.732 16.677 10.637 1.00 0.00 H new ATOM 0 HA GLU A 88 -8.835 18.004 8.264 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.379 17.304 10.042 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.449 18.184 11.239 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -10.018 20.316 10.185 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.833 19.490 8.872 1.00 0.00 H new ATOM 1417 N SER A 89 -7.234 19.898 8.322 1.00 0.00 N ATOM 1418 CA SER A 89 -6.412 21.103 8.324 1.00 0.00 C ATOM 1419 C SER A 89 -6.937 22.116 9.337 1.00 0.00 C ATOM 1420 O SER A 89 -8.144 22.320 9.459 1.00 0.00 O ATOM 1421 CB SER A 89 -6.382 21.728 6.929 1.00 0.00 C ATOM 1422 OG SER A 89 -5.460 21.056 6.088 1.00 0.00 O ATOM 0 H SER A 89 -7.432 19.524 7.394 1.00 0.00 H new ATOM 0 HA SER A 89 -5.398 20.821 8.609 1.00 0.00 H new ATOM 0 HB2 SER A 89 -7.378 21.687 6.488 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.109 22.781 7.005 1.00 0.00 H new ATOM 0 HG SER A 89 -5.461 21.474 5.202 1.00 0.00 H new ATOM 1428 N SER A 90 -6.019 22.749 10.062 1.00 0.00 N ATOM 1429 CA SER A 90 -6.388 23.738 11.067 1.00 0.00 C ATOM 1430 C SER A 90 -6.151 25.154 10.548 1.00 0.00 C ATOM 1431 O SER A 90 -5.141 25.781 10.862 1.00 0.00 O ATOM 1432 CB SER A 90 -5.588 23.514 12.352 1.00 0.00 C ATOM 1433 OG SER A 90 -6.050 22.368 13.046 1.00 0.00 O ATOM 0 H SER A 90 -5.015 22.594 9.971 1.00 0.00 H new ATOM 0 HA SER A 90 -7.450 23.621 11.283 1.00 0.00 H new ATOM 0 HB2 SER A 90 -4.532 23.396 12.111 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.672 24.391 12.994 1.00 0.00 H new ATOM 0 HG SER A 90 -5.522 22.245 13.862 1.00 0.00 H new ATOM 1439 N GLY A 91 -7.092 25.650 9.750 1.00 0.00 N ATOM 1440 CA GLY A 91 -6.969 26.987 9.200 1.00 0.00 C ATOM 1441 C GLY A 91 -7.362 27.050 7.737 1.00 0.00 C ATOM 1442 O GLY A 91 -7.146 26.110 6.973 1.00 0.00 O ATOM 0 H GLY A 91 -7.937 25.150 9.475 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.597 27.671 9.771 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -5.940 27.329 9.312 1.00 0.00 H new ATOM 1446 N PRO A 92 -7.955 28.182 7.329 1.00 0.00 N ATOM 1447 CA PRO A 92 -8.393 28.391 5.945 1.00 0.00 C ATOM 1448 C PRO A 92 -7.220 28.543 4.983 1.00 0.00 C ATOM 1449 O PRO A 92 -6.207 29.157 5.316 1.00 0.00 O ATOM 1450 CB PRO A 92 -9.195 29.692 6.020 1.00 0.00 C ATOM 1451 CG PRO A 92 -8.644 30.410 7.203 1.00 0.00 C ATOM 1452 CD PRO A 92 -8.244 29.344 8.185 1.00 0.00 C ATOM 0 HA PRO A 92 -8.964 27.544 5.565 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -9.079 30.281 5.110 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.260 29.494 6.138 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -7.788 31.024 6.923 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -9.388 31.079 7.635 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.372 29.641 8.767 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.043 29.131 8.895 1.00 0.00 H new ATOM 1460 N SER A 93 -7.365 27.980 3.787 1.00 0.00 N ATOM 1461 CA SER A 93 -6.315 28.050 2.777 1.00 0.00 C ATOM 1462 C SER A 93 -6.377 29.374 2.021 1.00 0.00 C ATOM 1463 O SER A 93 -7.413 29.736 1.464 1.00 0.00 O ATOM 1464 CB SER A 93 -6.443 26.883 1.796 1.00 0.00 C ATOM 1465 OG SER A 93 -7.517 27.090 0.895 1.00 0.00 O ATOM 0 H SER A 93 -8.199 27.471 3.494 1.00 0.00 H new ATOM 0 HA SER A 93 -5.352 27.985 3.284 1.00 0.00 H new ATOM 0 HB2 SER A 93 -5.513 26.769 1.239 1.00 0.00 H new ATOM 0 HB3 SER A 93 -6.600 25.956 2.347 1.00 0.00 H new ATOM 0 HG SER A 93 -7.640 28.051 0.748 1.00 0.00 H new ATOM 1471 N SER A 94 -5.259 30.092 2.007 1.00 0.00 N ATOM 1472 CA SER A 94 -5.185 31.378 1.323 1.00 0.00 C ATOM 1473 C SER A 94 -5.153 31.187 -0.191 1.00 0.00 C ATOM 1474 O SER A 94 -4.091 30.995 -0.781 1.00 0.00 O ATOM 1475 CB SER A 94 -3.946 32.151 1.777 1.00 0.00 C ATOM 1476 OG SER A 94 -4.134 33.548 1.630 1.00 0.00 O ATOM 0 H SER A 94 -4.392 29.805 2.461 1.00 0.00 H new ATOM 0 HA SER A 94 -6.076 31.950 1.581 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.730 31.918 2.820 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.082 31.834 1.194 1.00 0.00 H new ATOM 0 HG SER A 94 -3.329 34.020 1.929 1.00 0.00 H new ATOM 1482 N GLY A 95 -6.326 31.242 -0.813 1.00 0.00 N ATOM 1483 CA GLY A 95 -6.411 31.074 -2.252 1.00 0.00 C ATOM 1484 C GLY A 95 -6.213 32.376 -3.001 1.00 0.00 C ATOM 1485 O GLY A 95 -5.123 32.949 -2.986 1.00 0.00 O ATOM 0 H GLY A 95 -7.219 31.400 -0.346 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -5.659 30.354 -2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -7.384 30.655 -2.509 1.00 0.00 H new TER 1489 GLY A 95