USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 771 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 21:sc= 1.42 USER MOD Single : A 3 SER OG : rot 26:sc= 0.0755 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -23:sc= 0.853 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot -48:sc= 0.851 USER MOD Single : A 14 ASN : amide:sc= -0.553 K(o=-0.55,f=-2.2!) USER MOD Single : A 27 CYS SG : rot 100:sc= -4.76! USER MOD Single : A 28 SER OG : rot 70:sc= 0.00187 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -0.018 K(o=-0.018,f=-1.6!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.9!) USER MOD Single : A 46 MET CE :methyl 167:sc= -1.82 (180deg=-2.06) USER MOD Single : A 47 THR OG1 : rot -170:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.28) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -3.73! C(o=-3.7!,f=-5.7!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.409 X(o=-0.41,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 158:sc= -0.0599 (180deg=-0.339) USER MOD Single : A 77 HIS : no HD1:sc= -2.13 K(o=-2.1,f=-2.8!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.514 X(o=-0.51,f=-0.93) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.388) USER MOD Single : A 91 SER OG : rot 89:sc= 0.23 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.221 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 67:sc= 0.0167 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.987 -1.312 26.801 1.00 0.00 N ATOM 2 CA GLY A 1 -8.328 -0.469 25.671 1.00 0.00 C ATOM 3 C GLY A 1 -7.245 0.544 25.356 1.00 0.00 C ATOM 4 O GLY A 1 -6.061 0.207 25.324 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.759 -1.987 26.976 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.111 -1.833 26.593 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.846 -0.721 27.645 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.503 -1.094 24.795 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.261 0.054 25.880 1.00 0.00 H new ATOM 8 N SER A 2 -7.649 1.787 25.119 1.00 0.00 N ATOM 9 CA SER A 2 -6.704 2.850 24.798 1.00 0.00 C ATOM 10 C SER A 2 -5.643 2.357 23.819 1.00 0.00 C ATOM 11 O SER A 2 -4.608 1.828 24.224 1.00 0.00 O ATOM 12 CB SER A 2 -6.037 3.371 26.073 1.00 0.00 C ATOM 13 OG SER A 2 -5.290 2.348 26.710 1.00 0.00 O ATOM 0 H SER A 2 -8.625 2.083 25.143 1.00 0.00 H new ATOM 0 HA SER A 2 -7.256 3.664 24.328 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.381 4.207 25.829 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.797 3.751 26.756 1.00 0.00 H new ATOM 0 HG SER A 2 -5.084 1.642 26.062 1.00 0.00 H new ATOM 19 N SER A 3 -5.907 2.537 22.529 1.00 0.00 N ATOM 20 CA SER A 3 -4.978 2.106 21.492 1.00 0.00 C ATOM 21 C SER A 3 -5.029 3.049 20.292 1.00 0.00 C ATOM 22 O SER A 3 -5.062 2.609 19.144 1.00 0.00 O ATOM 23 CB SER A 3 -5.301 0.679 21.047 1.00 0.00 C ATOM 24 OG SER A 3 -4.665 -0.271 21.883 1.00 0.00 O ATOM 0 H SER A 3 -6.757 2.978 22.177 1.00 0.00 H new ATOM 0 HA SER A 3 -3.971 2.129 21.909 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.380 0.523 21.069 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.979 0.534 20.016 1.00 0.00 H new ATOM 0 HG SER A 3 -4.514 0.121 22.768 1.00 0.00 H new ATOM 30 N GLY A 4 -5.036 4.349 20.569 1.00 0.00 N ATOM 31 CA GLY A 4 -5.084 5.334 19.504 1.00 0.00 C ATOM 32 C GLY A 4 -4.624 6.705 19.961 1.00 0.00 C ATOM 33 O GLY A 4 -3.667 7.257 19.420 1.00 0.00 O ATOM 0 H GLY A 4 -5.009 4.738 21.512 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.457 5.001 18.677 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.103 5.404 19.124 1.00 0.00 H new ATOM 37 N SER A 5 -5.310 7.256 20.957 1.00 0.00 N ATOM 38 CA SER A 5 -4.971 8.573 21.482 1.00 0.00 C ATOM 39 C SER A 5 -5.086 9.637 20.396 1.00 0.00 C ATOM 40 O SER A 5 -4.133 9.898 19.663 1.00 0.00 O ATOM 41 CB SER A 5 -3.553 8.565 22.056 1.00 0.00 C ATOM 42 OG SER A 5 -3.252 9.798 22.689 1.00 0.00 O ATOM 0 H SER A 5 -6.104 6.811 21.417 1.00 0.00 H new ATOM 0 HA SER A 5 -5.677 8.813 22.277 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.452 7.750 22.773 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.835 8.378 21.258 1.00 0.00 H new ATOM 0 HG SER A 5 -2.341 9.767 23.049 1.00 0.00 H new ATOM 48 N SER A 6 -6.262 10.249 20.299 1.00 0.00 N ATOM 49 CA SER A 6 -6.507 11.282 19.299 1.00 0.00 C ATOM 50 C SER A 6 -6.110 10.798 17.908 1.00 0.00 C ATOM 51 O SER A 6 -5.618 9.683 17.744 1.00 0.00 O ATOM 52 CB SER A 6 -5.729 12.554 19.650 1.00 0.00 C ATOM 53 OG SER A 6 -4.355 12.414 19.334 1.00 0.00 O ATOM 0 H SER A 6 -7.060 10.047 20.901 1.00 0.00 H new ATOM 0 HA SER A 6 -7.574 11.504 19.296 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.146 13.401 19.106 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.841 12.771 20.712 1.00 0.00 H new ATOM 0 HG SER A 6 -4.121 11.463 19.306 1.00 0.00 H new ATOM 59 N GLY A 7 -6.328 11.646 16.909 1.00 0.00 N ATOM 60 CA GLY A 7 -5.989 11.288 15.543 1.00 0.00 C ATOM 61 C GLY A 7 -6.594 12.235 14.527 1.00 0.00 C ATOM 62 O GLY A 7 -7.717 12.708 14.701 1.00 0.00 O ATOM 0 H GLY A 7 -6.733 12.575 17.020 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.905 11.284 15.430 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.334 10.274 15.340 1.00 0.00 H new ATOM 66 N ASN A 8 -5.850 12.515 13.463 1.00 0.00 N ATOM 67 CA ASN A 8 -6.319 13.414 12.416 1.00 0.00 C ATOM 68 C ASN A 8 -6.302 12.723 11.056 1.00 0.00 C ATOM 69 O ASN A 8 -5.593 13.145 10.143 1.00 0.00 O ATOM 70 CB ASN A 8 -5.453 14.675 12.370 1.00 0.00 C ATOM 71 CG ASN A 8 -5.874 15.704 13.401 1.00 0.00 C ATOM 72 OD1 ASN A 8 -6.459 16.734 13.063 1.00 0.00 O ATOM 73 ND2 ASN A 8 -5.580 15.429 14.666 1.00 0.00 N ATOM 0 H ASN A 8 -4.918 12.132 13.303 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.346 13.695 12.648 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -4.411 14.403 12.537 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -5.512 15.117 11.375 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -5.840 16.083 15.404 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -5.094 14.563 14.900 1.00 0.00 H new ATOM 80 N SER A 9 -7.087 11.658 10.931 1.00 0.00 N ATOM 81 CA SER A 9 -7.159 10.905 9.683 1.00 0.00 C ATOM 82 C SER A 9 -7.207 11.845 8.483 1.00 0.00 C ATOM 83 O SER A 9 -6.330 11.833 7.617 1.00 0.00 O ATOM 84 CB SER A 9 -8.390 9.996 9.683 1.00 0.00 C ATOM 85 OG SER A 9 -8.039 8.662 10.010 1.00 0.00 O ATOM 0 H SER A 9 -7.682 11.297 11.677 1.00 0.00 H new ATOM 0 HA SER A 9 -6.262 10.291 9.605 1.00 0.00 H new ATOM 0 HB2 SER A 9 -9.121 10.369 10.400 1.00 0.00 H new ATOM 0 HB3 SER A 9 -8.864 10.021 8.702 1.00 0.00 H new ATOM 0 HG SER A 9 -8.843 8.102 10.005 1.00 0.00 H new ATOM 91 N PRO A 10 -8.255 12.679 8.428 1.00 0.00 N ATOM 92 CA PRO A 10 -8.444 13.643 7.339 1.00 0.00 C ATOM 93 C PRO A 10 -7.421 14.773 7.381 1.00 0.00 C ATOM 94 O PRO A 10 -7.038 15.235 8.456 1.00 0.00 O ATOM 95 CB PRO A 10 -9.853 14.186 7.587 1.00 0.00 C ATOM 96 CG PRO A 10 -10.080 13.999 9.047 1.00 0.00 C ATOM 97 CD PRO A 10 -9.338 12.748 9.425 1.00 0.00 C ATOM 0 HA PRO A 10 -8.317 13.182 6.359 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.927 15.237 7.306 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -10.595 13.646 6.999 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.713 14.856 9.612 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -11.143 13.904 9.267 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -8.946 12.805 10.441 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -9.982 11.870 9.380 1.00 0.00 H new ATOM 105 N ASP A 11 -6.983 15.213 6.207 1.00 0.00 N ATOM 106 CA ASP A 11 -6.006 16.290 6.110 1.00 0.00 C ATOM 107 C ASP A 11 -5.912 16.813 4.681 1.00 0.00 C ATOM 108 O ASP A 11 -6.395 16.177 3.742 1.00 0.00 O ATOM 109 CB ASP A 11 -4.633 15.807 6.580 1.00 0.00 C ATOM 110 CG ASP A 11 -4.445 15.964 8.076 1.00 0.00 C ATOM 111 OD1 ASP A 11 -4.606 17.096 8.578 1.00 0.00 O ATOM 112 OD2 ASP A 11 -4.134 14.955 8.745 1.00 0.00 O ATOM 0 H ASP A 11 -7.290 14.840 5.309 1.00 0.00 H new ATOM 0 HA ASP A 11 -6.337 17.104 6.755 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.508 14.759 6.309 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -3.856 16.366 6.058 1.00 0.00 H new ATOM 117 N THR A 12 -5.289 17.977 4.520 1.00 0.00 N ATOM 118 CA THR A 12 -5.135 18.585 3.205 1.00 0.00 C ATOM 119 C THR A 12 -3.754 18.301 2.626 1.00 0.00 C ATOM 120 O THR A 12 -3.129 19.175 2.027 1.00 0.00 O ATOM 121 CB THR A 12 -5.351 20.110 3.263 1.00 0.00 C ATOM 122 OG1 THR A 12 -5.286 20.664 1.944 1.00 0.00 O ATOM 123 CG2 THR A 12 -4.304 20.771 4.148 1.00 0.00 C ATOM 0 H THR A 12 -4.883 18.517 5.284 1.00 0.00 H new ATOM 0 HA THR A 12 -5.894 18.141 2.561 1.00 0.00 H new ATOM 0 HB THR A 12 -6.336 20.300 3.689 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.493 20.320 1.483 1.00 0.00 H new ATOM 0 HG21 THR A 12 -4.476 21.847 4.174 1.00 0.00 H new ATOM 0 HG22 THR A 12 -4.374 20.368 5.158 1.00 0.00 H new ATOM 0 HG23 THR A 12 -3.310 20.572 3.747 1.00 0.00 H new ATOM 131 N ALA A 13 -3.284 17.071 2.807 1.00 0.00 N ATOM 132 CA ALA A 13 -1.977 16.671 2.301 1.00 0.00 C ATOM 133 C ALA A 13 -1.921 15.167 2.052 1.00 0.00 C ATOM 134 O ALA A 13 -0.957 14.502 2.429 1.00 0.00 O ATOM 135 CB ALA A 13 -0.883 17.089 3.272 1.00 0.00 C ATOM 0 H ALA A 13 -3.789 16.335 3.300 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.814 17.177 1.349 1.00 0.00 H new ATOM 0 HB1 ALA A 13 0.087 16.783 2.880 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.900 18.172 3.395 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.051 16.612 4.237 1.00 0.00 H new ATOM 141 N ASN A 14 -2.963 14.638 1.419 1.00 0.00 N ATOM 142 CA ASN A 14 -3.034 13.212 1.123 1.00 0.00 C ATOM 143 C ASN A 14 -1.934 12.804 0.147 1.00 0.00 C ATOM 144 O ASN A 14 -1.868 13.306 -0.976 1.00 0.00 O ATOM 145 CB ASN A 14 -4.403 12.857 0.541 1.00 0.00 C ATOM 146 CG ASN A 14 -5.536 13.166 1.500 1.00 0.00 C ATOM 147 OD1 ASN A 14 -5.949 12.315 2.287 1.00 0.00 O ATOM 148 ND2 ASN A 14 -6.046 14.392 1.439 1.00 0.00 N ATOM 0 H ASN A 14 -3.770 15.175 1.101 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.891 12.666 2.055 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -4.555 13.409 -0.386 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.424 11.797 0.288 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -6.810 14.658 2.060 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.673 15.067 0.771 1.00 0.00 H new ATOM 155 N ASP A 15 -1.073 11.891 0.583 1.00 0.00 N ATOM 156 CA ASP A 15 0.024 11.414 -0.253 1.00 0.00 C ATOM 157 C ASP A 15 -0.162 9.943 -0.606 1.00 0.00 C ATOM 158 O ASP A 15 0.302 9.480 -1.647 1.00 0.00 O ATOM 159 CB ASP A 15 1.362 11.615 0.461 1.00 0.00 C ATOM 160 CG ASP A 15 1.786 13.070 0.498 1.00 0.00 C ATOM 161 OD1 ASP A 15 1.328 13.843 -0.368 1.00 0.00 O ATOM 162 OD2 ASP A 15 2.577 13.435 1.392 1.00 0.00 O ATOM 0 H ASP A 15 -1.113 11.466 1.510 1.00 0.00 H new ATOM 0 HA ASP A 15 0.023 11.993 -1.176 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.287 11.235 1.480 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.131 11.028 -0.042 1.00 0.00 H new ATOM 167 N GLY A 16 -0.845 9.211 0.270 1.00 0.00 N ATOM 168 CA GLY A 16 -1.079 7.797 0.032 1.00 0.00 C ATOM 169 C GLY A 16 -0.038 6.918 0.696 1.00 0.00 C ATOM 170 O GLY A 16 0.222 5.802 0.244 1.00 0.00 O ATOM 0 H GLY A 16 -1.240 9.571 1.139 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.068 7.528 0.403 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.079 7.607 -1.041 1.00 0.00 H new ATOM 174 N PHE A 17 0.561 7.420 1.770 1.00 0.00 N ATOM 175 CA PHE A 17 1.582 6.673 2.496 1.00 0.00 C ATOM 176 C PHE A 17 0.958 5.527 3.287 1.00 0.00 C ATOM 177 O PHE A 17 -0.173 5.630 3.765 1.00 0.00 O ATOM 178 CB PHE A 17 2.349 7.601 3.440 1.00 0.00 C ATOM 179 CG PHE A 17 3.784 7.807 3.042 1.00 0.00 C ATOM 180 CD1 PHE A 17 4.751 6.877 3.384 1.00 0.00 C ATOM 181 CD2 PHE A 17 4.163 8.932 2.327 1.00 0.00 C ATOM 182 CE1 PHE A 17 6.072 7.063 3.020 1.00 0.00 C ATOM 183 CE2 PHE A 17 5.481 9.123 1.960 1.00 0.00 C ATOM 184 CZ PHE A 17 6.437 8.188 2.308 1.00 0.00 C ATOM 0 H PHE A 17 0.357 8.341 2.157 1.00 0.00 H new ATOM 0 HA PHE A 17 2.276 6.253 1.768 1.00 0.00 H new ATOM 0 HB2 PHE A 17 1.847 8.568 3.474 1.00 0.00 H new ATOM 0 HB3 PHE A 17 2.315 7.189 4.449 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.470 5.996 3.942 1.00 0.00 H new ATOM 0 HD2 PHE A 17 3.420 9.667 2.054 1.00 0.00 H new ATOM 0 HE1 PHE A 17 6.817 6.330 3.292 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.764 10.003 1.401 1.00 0.00 H new ATOM 0 HZ PHE A 17 7.468 8.337 2.023 1.00 0.00 H new ATOM 194 N VAL A 18 1.703 4.435 3.423 1.00 0.00 N ATOM 195 CA VAL A 18 1.224 3.269 4.157 1.00 0.00 C ATOM 196 C VAL A 18 2.346 2.633 4.969 1.00 0.00 C ATOM 197 O VAL A 18 3.516 2.701 4.591 1.00 0.00 O ATOM 198 CB VAL A 18 0.631 2.213 3.207 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.504 2.809 2.387 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.712 1.643 2.301 1.00 0.00 C ATOM 0 H VAL A 18 2.641 4.333 3.035 1.00 0.00 H new ATOM 0 HA VAL A 18 0.443 3.618 4.832 1.00 0.00 H new ATOM 0 HB VAL A 18 0.225 1.398 3.807 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.911 2.048 1.721 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.289 3.163 3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.127 3.644 1.796 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.274 0.898 1.636 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.150 2.446 1.708 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.487 1.176 2.909 1.00 0.00 H new ATOM 210 N ARG A 19 1.982 2.013 6.087 1.00 0.00 N ATOM 211 CA ARG A 19 2.958 1.364 6.953 1.00 0.00 C ATOM 212 C ARG A 19 2.745 -0.147 6.977 1.00 0.00 C ATOM 213 O ARG A 19 1.617 -0.624 7.107 1.00 0.00 O ATOM 214 CB ARG A 19 2.864 1.925 8.373 1.00 0.00 C ATOM 215 CG ARG A 19 3.739 1.194 9.377 1.00 0.00 C ATOM 216 CD ARG A 19 3.328 1.505 10.808 1.00 0.00 C ATOM 217 NE ARG A 19 4.378 2.208 11.540 1.00 0.00 N ATOM 218 CZ ARG A 19 5.574 1.687 11.789 1.00 0.00 C ATOM 219 NH1 ARG A 19 5.870 0.466 11.365 1.00 0.00 N ATOM 220 NH2 ARG A 19 6.478 2.388 12.461 1.00 0.00 N ATOM 0 H ARG A 19 1.018 1.947 6.414 1.00 0.00 H new ATOM 0 HA ARG A 19 3.952 1.567 6.554 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.146 2.978 8.358 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.827 1.877 8.705 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.673 0.120 9.204 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.781 1.478 9.227 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.423 2.112 10.801 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.085 0.577 11.325 1.00 0.00 H new ATOM 0 HE ARG A 19 4.182 3.150 11.878 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.178 -0.075 10.846 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.789 0.068 11.558 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.255 3.328 12.787 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.396 1.987 12.652 1.00 0.00 H new ATOM 234 N LEU A 20 3.836 -0.894 6.850 1.00 0.00 N ATOM 235 CA LEU A 20 3.769 -2.352 6.856 1.00 0.00 C ATOM 236 C LEU A 20 4.405 -2.921 8.120 1.00 0.00 C ATOM 237 O LEU A 20 5.435 -2.430 8.583 1.00 0.00 O ATOM 238 CB LEU A 20 4.468 -2.919 5.620 1.00 0.00 C ATOM 239 CG LEU A 20 4.461 -2.028 4.377 1.00 0.00 C ATOM 240 CD1 LEU A 20 5.225 -2.691 3.241 1.00 0.00 C ATOM 241 CD2 LEU A 20 3.034 -1.716 3.952 1.00 0.00 C ATOM 0 H LEU A 20 4.777 -0.515 6.742 1.00 0.00 H new ATOM 0 HA LEU A 20 2.719 -2.643 6.837 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.504 -3.137 5.881 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.997 -3.868 5.365 1.00 0.00 H new ATOM 0 HG LEU A 20 4.958 -1.090 4.623 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.209 -2.043 2.365 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.257 -2.862 3.548 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.757 -3.644 2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 20 3.049 -1.081 3.066 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.511 -2.645 3.724 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.518 -1.198 4.761 1.00 0.00 H new ATOM 253 N ARG A 21 3.787 -3.960 8.672 1.00 0.00 N ATOM 254 CA ARG A 21 4.293 -4.597 9.881 1.00 0.00 C ATOM 255 C ARG A 21 4.275 -6.116 9.744 1.00 0.00 C ATOM 256 O ARG A 21 3.237 -6.712 9.463 1.00 0.00 O ATOM 257 CB ARG A 21 3.461 -4.172 11.094 1.00 0.00 C ATOM 258 CG ARG A 21 4.192 -3.228 12.034 1.00 0.00 C ATOM 259 CD ARG A 21 3.568 -3.229 13.420 1.00 0.00 C ATOM 260 NE ARG A 21 4.567 -3.055 14.470 1.00 0.00 N ATOM 261 CZ ARG A 21 5.114 -1.883 14.777 1.00 0.00 C ATOM 262 NH1 ARG A 21 4.759 -0.789 14.117 1.00 0.00 N ATOM 263 NH2 ARG A 21 6.017 -1.805 15.746 1.00 0.00 N ATOM 0 H ARG A 21 2.934 -4.379 8.300 1.00 0.00 H new ATOM 0 HA ARG A 21 5.324 -4.276 10.026 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.548 -3.689 10.746 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.161 -5.062 11.648 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.239 -3.522 12.105 1.00 0.00 H new ATOM 0 HG3 ARG A 21 4.172 -2.218 11.625 1.00 0.00 H new ATOM 0 HD2 ARG A 21 2.830 -2.430 13.486 1.00 0.00 H new ATOM 0 HD3 ARG A 21 3.036 -4.167 13.577 1.00 0.00 H new ATOM 0 HE ARG A 21 4.861 -3.877 14.997 1.00 0.00 H new ATOM 0 HH11 ARG A 21 4.065 -0.846 13.372 1.00 0.00 H new ATOM 0 HH12 ARG A 21 5.180 0.109 14.354 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.292 -2.645 16.256 1.00 0.00 H new ATOM 0 HH22 ARG A 21 6.436 -0.905 15.981 1.00 0.00 H new ATOM 277 N GLY A 22 5.433 -6.738 9.946 1.00 0.00 N ATOM 278 CA GLY A 22 5.529 -8.182 9.840 1.00 0.00 C ATOM 279 C GLY A 22 6.107 -8.628 8.512 1.00 0.00 C ATOM 280 O GLY A 22 5.694 -9.649 7.959 1.00 0.00 O ATOM 0 H GLY A 22 6.307 -6.267 10.181 1.00 0.00 H new ATOM 0 HA2 GLY A 22 6.152 -8.562 10.650 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.539 -8.619 9.967 1.00 0.00 H new ATOM 284 N LEU A 23 7.062 -7.863 7.996 1.00 0.00 N ATOM 285 CA LEU A 23 7.697 -8.185 6.723 1.00 0.00 C ATOM 286 C LEU A 23 8.544 -9.448 6.841 1.00 0.00 C ATOM 287 O LEU A 23 9.155 -9.721 7.875 1.00 0.00 O ATOM 288 CB LEU A 23 8.565 -7.016 6.253 1.00 0.00 C ATOM 289 CG LEU A 23 7.824 -5.722 5.918 1.00 0.00 C ATOM 290 CD1 LEU A 23 8.810 -4.592 5.663 1.00 0.00 C ATOM 291 CD2 LEU A 23 6.916 -5.924 4.713 1.00 0.00 C ATOM 0 H LEU A 23 7.414 -7.015 8.440 1.00 0.00 H new ATOM 0 HA LEU A 23 6.912 -8.364 5.988 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.299 -6.800 7.029 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.119 -7.333 5.369 1.00 0.00 H new ATOM 0 HG LEU A 23 7.205 -5.449 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.264 -3.679 5.426 1.00 0.00 H new ATOM 0 HD12 LEU A 23 9.417 -4.431 6.554 1.00 0.00 H new ATOM 0 HD13 LEU A 23 9.457 -4.855 4.826 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.396 -4.992 4.489 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.515 -6.222 3.852 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.186 -6.703 4.934 1.00 0.00 H new ATOM 303 N PRO A 24 8.587 -10.236 5.756 1.00 0.00 N ATOM 304 CA PRO A 24 9.359 -11.481 5.712 1.00 0.00 C ATOM 305 C PRO A 24 10.863 -11.231 5.710 1.00 0.00 C ATOM 306 O PRO A 24 11.313 -10.095 5.560 1.00 0.00 O ATOM 307 CB PRO A 24 8.922 -12.124 4.393 1.00 0.00 C ATOM 308 CG PRO A 24 8.476 -10.982 3.546 1.00 0.00 C ATOM 309 CD PRO A 24 7.884 -9.972 4.490 1.00 0.00 C ATOM 0 HA PRO A 24 9.176 -12.105 6.587 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.744 -12.667 3.926 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.115 -12.840 4.549 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.313 -10.556 2.993 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.740 -11.306 2.810 1.00 0.00 H new ATOM 0 HD2 PRO A 24 8.050 -8.952 4.143 1.00 0.00 H new ATOM 0 HD3 PRO A 24 6.807 -10.102 4.594 1.00 0.00 H new ATOM 317 N PHE A 25 11.637 -12.299 5.874 1.00 0.00 N ATOM 318 CA PHE A 25 13.091 -12.194 5.891 1.00 0.00 C ATOM 319 C PHE A 25 13.619 -11.733 4.536 1.00 0.00 C ATOM 320 O PHE A 25 13.274 -12.297 3.499 1.00 0.00 O ATOM 321 CB PHE A 25 13.716 -13.540 6.264 1.00 0.00 C ATOM 322 CG PHE A 25 14.242 -13.589 7.669 1.00 0.00 C ATOM 323 CD1 PHE A 25 15.190 -12.675 8.100 1.00 0.00 C ATOM 324 CD2 PHE A 25 13.789 -14.548 8.561 1.00 0.00 C ATOM 325 CE1 PHE A 25 15.676 -12.715 9.393 1.00 0.00 C ATOM 326 CE2 PHE A 25 14.272 -14.595 9.855 1.00 0.00 C ATOM 327 CZ PHE A 25 15.218 -13.677 10.271 1.00 0.00 C ATOM 0 H PHE A 25 11.281 -13.247 5.997 1.00 0.00 H new ATOM 0 HA PHE A 25 13.368 -11.452 6.640 1.00 0.00 H new ATOM 0 HB2 PHE A 25 12.971 -14.325 6.136 1.00 0.00 H new ATOM 0 HB3 PHE A 25 14.530 -13.757 5.572 1.00 0.00 H new ATOM 0 HD1 PHE A 25 15.554 -11.922 7.417 1.00 0.00 H new ATOM 0 HD2 PHE A 25 13.050 -15.267 8.241 1.00 0.00 H new ATOM 0 HE1 PHE A 25 16.413 -11.995 9.716 1.00 0.00 H new ATOM 0 HE2 PHE A 25 13.911 -15.348 10.540 1.00 0.00 H new ATOM 0 HZ PHE A 25 15.598 -13.712 11.281 1.00 0.00 H new ATOM 337 N GLY A 26 14.457 -10.702 4.554 1.00 0.00 N ATOM 338 CA GLY A 26 15.020 -10.182 3.322 1.00 0.00 C ATOM 339 C GLY A 26 14.005 -9.407 2.504 1.00 0.00 C ATOM 340 O GLY A 26 14.188 -9.208 1.302 1.00 0.00 O ATOM 0 H GLY A 26 14.756 -10.217 5.400 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.864 -9.534 3.557 1.00 0.00 H new ATOM 0 HA3 GLY A 26 15.408 -11.008 2.726 1.00 0.00 H new ATOM 344 N CYS A 27 12.933 -8.970 3.155 1.00 0.00 N ATOM 345 CA CYS A 27 11.883 -8.215 2.479 1.00 0.00 C ATOM 346 C CYS A 27 12.433 -6.913 1.906 1.00 0.00 C ATOM 347 O CYS A 27 13.070 -6.132 2.612 1.00 0.00 O ATOM 348 CB CYS A 27 10.737 -7.917 3.446 1.00 0.00 C ATOM 349 SG CYS A 27 9.397 -6.941 2.725 1.00 0.00 S ATOM 0 H CYS A 27 12.768 -9.125 4.149 1.00 0.00 H new ATOM 0 HA CYS A 27 11.505 -8.822 1.656 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.330 -8.860 3.811 1.00 0.00 H new ATOM 0 HB3 CYS A 27 11.134 -7.386 4.311 1.00 0.00 H new ATOM 0 HG CYS A 27 8.418 -7.728 2.391 1.00 0.00 H new ATOM 355 N SER A 28 12.184 -6.686 0.620 1.00 0.00 N ATOM 356 CA SER A 28 12.659 -5.481 -0.050 1.00 0.00 C ATOM 357 C SER A 28 11.652 -5.007 -1.094 1.00 0.00 C ATOM 358 O SER A 28 10.679 -5.699 -1.395 1.00 0.00 O ATOM 359 CB SER A 28 14.013 -5.741 -0.713 1.00 0.00 C ATOM 360 OG SER A 28 14.985 -6.123 0.245 1.00 0.00 O ATOM 0 H SER A 28 11.656 -7.321 0.021 1.00 0.00 H new ATOM 0 HA SER A 28 12.774 -4.699 0.701 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.910 -6.525 -1.463 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.345 -4.843 -1.234 1.00 0.00 H new ATOM 0 HG SER A 28 14.781 -7.022 0.577 1.00 0.00 H new ATOM 366 N LYS A 29 11.892 -3.821 -1.641 1.00 0.00 N ATOM 367 CA LYS A 29 11.008 -3.251 -2.652 1.00 0.00 C ATOM 368 C LYS A 29 10.697 -4.273 -3.740 1.00 0.00 C ATOM 369 O LYS A 29 9.544 -4.437 -4.138 1.00 0.00 O ATOM 370 CB LYS A 29 11.646 -2.006 -3.273 1.00 0.00 C ATOM 371 CG LYS A 29 11.655 -0.802 -2.350 1.00 0.00 C ATOM 372 CD LYS A 29 12.883 0.065 -2.574 1.00 0.00 C ATOM 373 CE LYS A 29 14.081 -0.453 -1.793 1.00 0.00 C ATOM 374 NZ LYS A 29 15.306 -0.522 -2.637 1.00 0.00 N ATOM 0 H LYS A 29 12.692 -3.235 -1.402 1.00 0.00 H new ATOM 0 HA LYS A 29 10.074 -2.969 -2.166 1.00 0.00 H new ATOM 0 HB2 LYS A 29 12.671 -2.239 -3.562 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.108 -1.749 -4.186 1.00 0.00 H new ATOM 0 HG2 LYS A 29 10.755 -0.209 -2.515 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.630 -1.137 -1.313 1.00 0.00 H new ATOM 0 HD2 LYS A 29 13.123 0.090 -3.637 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.666 1.090 -2.272 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.265 0.197 -0.938 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.856 -1.444 -1.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.100 -0.880 -2.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 15.139 -1.162 -3.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 15.536 0.428 -2.994 1.00 0.00 H new ATOM 388 N GLU A 30 11.732 -4.959 -4.216 1.00 0.00 N ATOM 389 CA GLU A 30 11.566 -5.966 -5.257 1.00 0.00 C ATOM 390 C GLU A 30 10.354 -6.848 -4.974 1.00 0.00 C ATOM 391 O GLU A 30 9.644 -7.259 -5.892 1.00 0.00 O ATOM 392 CB GLU A 30 12.825 -6.828 -5.368 1.00 0.00 C ATOM 393 CG GLU A 30 13.870 -6.261 -6.314 1.00 0.00 C ATOM 394 CD GLU A 30 13.950 -7.026 -7.621 1.00 0.00 C ATOM 395 OE1 GLU A 30 12.933 -7.075 -8.343 1.00 0.00 O ATOM 396 OE2 GLU A 30 15.032 -7.574 -7.922 1.00 0.00 O ATOM 0 H GLU A 30 12.693 -4.836 -3.897 1.00 0.00 H new ATOM 0 HA GLU A 30 11.403 -5.450 -6.203 1.00 0.00 H new ATOM 0 HB2 GLU A 30 13.267 -6.940 -4.378 1.00 0.00 H new ATOM 0 HB3 GLU A 30 12.544 -7.825 -5.707 1.00 0.00 H new ATOM 0 HG2 GLU A 30 13.638 -5.217 -6.522 1.00 0.00 H new ATOM 0 HG3 GLU A 30 14.845 -6.280 -5.826 1.00 0.00 H new ATOM 403 N GLU A 31 10.125 -7.136 -3.696 1.00 0.00 N ATOM 404 CA GLU A 31 9.001 -7.971 -3.292 1.00 0.00 C ATOM 405 C GLU A 31 7.746 -7.129 -3.081 1.00 0.00 C ATOM 406 O GLU A 31 6.633 -7.573 -3.366 1.00 0.00 O ATOM 407 CB GLU A 31 9.338 -8.733 -2.009 1.00 0.00 C ATOM 408 CG GLU A 31 10.170 -9.982 -2.244 1.00 0.00 C ATOM 409 CD GLU A 31 9.357 -11.257 -2.118 1.00 0.00 C ATOM 410 OE1 GLU A 31 8.761 -11.681 -3.129 1.00 0.00 O ATOM 411 OE2 GLU A 31 9.318 -11.829 -1.008 1.00 0.00 O ATOM 0 H GLU A 31 10.703 -6.803 -2.924 1.00 0.00 H new ATOM 0 HA GLU A 31 8.808 -8.687 -4.091 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.877 -8.069 -1.333 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.411 -9.013 -1.509 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.615 -9.936 -3.238 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.991 -10.007 -1.528 1.00 0.00 H new ATOM 418 N ILE A 32 7.933 -5.913 -2.580 1.00 0.00 N ATOM 419 CA ILE A 32 6.818 -5.008 -2.332 1.00 0.00 C ATOM 420 C ILE A 32 6.173 -4.560 -3.639 1.00 0.00 C ATOM 421 O ILE A 32 5.000 -4.837 -3.892 1.00 0.00 O ATOM 422 CB ILE A 32 7.266 -3.766 -1.540 1.00 0.00 C ATOM 423 CG1 ILE A 32 7.872 -4.180 -0.197 1.00 0.00 C ATOM 424 CG2 ILE A 32 6.092 -2.821 -1.329 1.00 0.00 C ATOM 425 CD1 ILE A 32 8.445 -3.023 0.590 1.00 0.00 C ATOM 0 H ILE A 32 8.847 -5.531 -2.338 1.00 0.00 H new ATOM 0 HA ILE A 32 6.088 -5.561 -1.741 1.00 0.00 H new ATOM 0 HB ILE A 32 8.030 -3.243 -2.115 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.106 -4.672 0.402 1.00 0.00 H new ATOM 0 HG13 ILE A 32 8.659 -4.914 -0.373 1.00 0.00 H new ATOM 0 HG21 ILE A 32 6.424 -1.948 -0.768 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.702 -2.504 -2.296 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.308 -3.334 -0.772 1.00 0.00 H new ATOM 0 HD11 ILE A 32 8.857 -3.391 1.530 1.00 0.00 H new ATOM 0 HD12 ILE A 32 9.234 -2.544 0.011 1.00 0.00 H new ATOM 0 HD13 ILE A 32 7.657 -2.299 0.798 1.00 0.00 H new ATOM 437 N VAL A 33 6.947 -3.867 -4.467 1.00 0.00 N ATOM 438 CA VAL A 33 6.453 -3.381 -5.750 1.00 0.00 C ATOM 439 C VAL A 33 5.446 -4.354 -6.355 1.00 0.00 C ATOM 440 O VAL A 33 4.394 -3.946 -6.847 1.00 0.00 O ATOM 441 CB VAL A 33 7.604 -3.164 -6.749 1.00 0.00 C ATOM 442 CG1 VAL A 33 7.062 -3.004 -8.162 1.00 0.00 C ATOM 443 CG2 VAL A 33 8.436 -1.955 -6.349 1.00 0.00 C ATOM 0 H VAL A 33 7.920 -3.629 -4.272 1.00 0.00 H new ATOM 0 HA VAL A 33 5.963 -2.426 -5.559 1.00 0.00 H new ATOM 0 HB VAL A 33 8.249 -4.043 -6.730 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.890 -2.852 -8.854 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.513 -3.902 -8.445 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.394 -2.143 -8.200 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.245 -1.817 -7.066 1.00 0.00 H new ATOM 0 HG22 VAL A 33 7.805 -1.066 -6.338 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.855 -2.114 -5.356 1.00 0.00 H new ATOM 453 N GLN A 34 5.777 -5.641 -6.314 1.00 0.00 N ATOM 454 CA GLN A 34 4.901 -6.672 -6.858 1.00 0.00 C ATOM 455 C GLN A 34 3.737 -6.952 -5.913 1.00 0.00 C ATOM 456 O GLN A 34 2.590 -7.068 -6.343 1.00 0.00 O ATOM 457 CB GLN A 34 5.689 -7.959 -7.110 1.00 0.00 C ATOM 458 CG GLN A 34 6.089 -8.152 -8.564 1.00 0.00 C ATOM 459 CD GLN A 34 4.934 -8.617 -9.429 1.00 0.00 C ATOM 460 OE1 GLN A 34 3.902 -9.059 -8.923 1.00 0.00 O ATOM 461 NE2 GLN A 34 5.102 -8.520 -10.743 1.00 0.00 N ATOM 0 H GLN A 34 6.645 -5.994 -5.910 1.00 0.00 H new ATOM 0 HA GLN A 34 4.498 -6.309 -7.804 1.00 0.00 H new ATOM 0 HB2 GLN A 34 6.587 -7.952 -6.492 1.00 0.00 H new ATOM 0 HB3 GLN A 34 5.089 -8.811 -6.791 1.00 0.00 H new ATOM 0 HG2 GLN A 34 6.478 -7.213 -8.958 1.00 0.00 H new ATOM 0 HG3 GLN A 34 6.897 -8.881 -8.621 1.00 0.00 H new ATOM 0 HE21 GLN A 34 5.974 -8.148 -11.120 1.00 0.00 H new ATOM 0 HE22 GLN A 34 4.359 -8.818 -11.375 1.00 0.00 H new ATOM 470 N PHE A 35 4.041 -7.058 -4.623 1.00 0.00 N ATOM 471 CA PHE A 35 3.019 -7.326 -3.618 1.00 0.00 C ATOM 472 C PHE A 35 1.825 -6.392 -3.794 1.00 0.00 C ATOM 473 O PHE A 35 0.716 -6.695 -3.353 1.00 0.00 O ATOM 474 CB PHE A 35 3.603 -7.165 -2.213 1.00 0.00 C ATOM 475 CG PHE A 35 2.560 -6.995 -1.146 1.00 0.00 C ATOM 476 CD1 PHE A 35 1.845 -8.086 -0.677 1.00 0.00 C ATOM 477 CD2 PHE A 35 2.293 -5.745 -0.613 1.00 0.00 C ATOM 478 CE1 PHE A 35 0.884 -7.931 0.306 1.00 0.00 C ATOM 479 CE2 PHE A 35 1.334 -5.584 0.370 1.00 0.00 C ATOM 480 CZ PHE A 35 0.627 -6.680 0.828 1.00 0.00 C ATOM 0 H PHE A 35 4.985 -6.963 -4.250 1.00 0.00 H new ATOM 0 HA PHE A 35 2.677 -8.353 -3.748 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.212 -8.038 -1.979 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.267 -6.301 -2.201 1.00 0.00 H new ATOM 0 HD1 PHE A 35 2.040 -9.067 -1.083 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.841 -4.885 -0.970 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.335 -8.789 0.665 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.138 -4.604 0.779 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.125 -6.557 1.593 1.00 0.00 H new ATOM 490 N PHE A 36 2.060 -5.256 -4.440 1.00 0.00 N ATOM 491 CA PHE A 36 1.005 -4.276 -4.674 1.00 0.00 C ATOM 492 C PHE A 36 0.607 -4.246 -6.147 1.00 0.00 C ATOM 493 O PHE A 36 0.269 -3.194 -6.688 1.00 0.00 O ATOM 494 CB PHE A 36 1.463 -2.886 -4.229 1.00 0.00 C ATOM 495 CG PHE A 36 1.465 -2.704 -2.738 1.00 0.00 C ATOM 496 CD1 PHE A 36 0.309 -2.904 -2.001 1.00 0.00 C ATOM 497 CD2 PHE A 36 2.624 -2.334 -2.074 1.00 0.00 C ATOM 498 CE1 PHE A 36 0.308 -2.738 -0.628 1.00 0.00 C ATOM 499 CE2 PHE A 36 2.628 -2.167 -0.701 1.00 0.00 C ATOM 500 CZ PHE A 36 1.469 -2.368 0.022 1.00 0.00 C ATOM 0 H PHE A 36 2.972 -4.990 -4.811 1.00 0.00 H new ATOM 0 HA PHE A 36 0.135 -4.569 -4.087 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.468 -2.704 -4.611 1.00 0.00 H new ATOM 0 HB3 PHE A 36 0.811 -2.137 -4.678 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.602 -3.193 -2.504 1.00 0.00 H new ATOM 0 HD2 PHE A 36 3.533 -2.174 -2.634 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -0.600 -2.898 -0.065 1.00 0.00 H new ATOM 0 HE2 PHE A 36 3.538 -1.879 -0.195 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.470 -2.236 1.094 1.00 0.00 H new ATOM 510 N SER A 37 0.653 -5.408 -6.790 1.00 0.00 N ATOM 511 CA SER A 37 0.302 -5.515 -8.202 1.00 0.00 C ATOM 512 C SER A 37 -0.998 -4.772 -8.496 1.00 0.00 C ATOM 513 O SER A 37 -1.906 -4.734 -7.667 1.00 0.00 O ATOM 514 CB SER A 37 0.164 -6.985 -8.605 1.00 0.00 C ATOM 515 OG SER A 37 -1.097 -7.503 -8.221 1.00 0.00 O ATOM 0 H SER A 37 0.930 -6.289 -6.356 1.00 0.00 H new ATOM 0 HA SER A 37 1.102 -5.059 -8.785 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.288 -7.083 -9.684 1.00 0.00 H new ATOM 0 HB3 SER A 37 0.958 -7.569 -8.139 1.00 0.00 H new ATOM 0 HG SER A 37 -1.161 -8.443 -8.491 1.00 0.00 H new ATOM 521 N GLY A 38 -1.078 -4.182 -9.684 1.00 0.00 N ATOM 522 CA GLY A 38 -2.269 -3.447 -10.069 1.00 0.00 C ATOM 523 C GLY A 38 -2.242 -2.008 -9.591 1.00 0.00 C ATOM 524 O GLY A 38 -2.861 -1.133 -10.197 1.00 0.00 O ATOM 0 H GLY A 38 -0.339 -4.200 -10.387 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.368 -3.464 -11.154 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.148 -3.946 -9.661 1.00 0.00 H new ATOM 528 N LEU A 39 -1.526 -1.763 -8.500 1.00 0.00 N ATOM 529 CA LEU A 39 -1.421 -0.420 -7.940 1.00 0.00 C ATOM 530 C LEU A 39 -0.201 0.309 -8.495 1.00 0.00 C ATOM 531 O LEU A 39 0.778 -0.318 -8.895 1.00 0.00 O ATOM 532 CB LEU A 39 -1.338 -0.488 -6.414 1.00 0.00 C ATOM 533 CG LEU A 39 -2.493 -1.201 -5.710 1.00 0.00 C ATOM 534 CD1 LEU A 39 -2.029 -1.791 -4.386 1.00 0.00 C ATOM 535 CD2 LEU A 39 -3.656 -0.245 -5.490 1.00 0.00 C ATOM 0 H LEU A 39 -1.009 -2.476 -7.985 1.00 0.00 H new ATOM 0 HA LEU A 39 -2.314 0.136 -8.225 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.409 -0.989 -6.143 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -1.276 0.529 -6.028 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.834 -2.016 -6.349 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.864 -2.294 -3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.229 -2.509 -4.568 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.661 -0.993 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.469 -0.770 -4.988 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.328 0.591 -4.872 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.006 0.130 -6.452 1.00 0.00 H new ATOM 547 N GLU A 40 -0.269 1.637 -8.512 1.00 0.00 N ATOM 548 CA GLU A 40 0.830 2.451 -9.017 1.00 0.00 C ATOM 549 C GLU A 40 1.520 3.198 -7.880 1.00 0.00 C ATOM 550 O GLU A 40 0.907 4.026 -7.205 1.00 0.00 O ATOM 551 CB GLU A 40 0.320 3.446 -10.061 1.00 0.00 C ATOM 552 CG GLU A 40 1.226 4.652 -10.246 1.00 0.00 C ATOM 553 CD GLU A 40 0.875 5.461 -11.480 1.00 0.00 C ATOM 554 OE1 GLU A 40 -0.305 5.840 -11.626 1.00 0.00 O ATOM 555 OE2 GLU A 40 1.783 5.716 -12.299 1.00 0.00 O ATOM 0 H GLU A 40 -1.073 2.171 -8.182 1.00 0.00 H new ATOM 0 HA GLU A 40 1.556 1.786 -9.485 1.00 0.00 H new ATOM 0 HB2 GLU A 40 0.212 2.933 -11.017 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.673 3.789 -9.769 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.158 5.291 -9.366 1.00 0.00 H new ATOM 0 HG3 GLU A 40 2.261 4.317 -10.318 1.00 0.00 H new ATOM 562 N ILE A 41 2.798 2.901 -7.674 1.00 0.00 N ATOM 563 CA ILE A 41 3.572 3.544 -6.619 1.00 0.00 C ATOM 564 C ILE A 41 4.615 4.492 -7.203 1.00 0.00 C ATOM 565 O ILE A 41 5.072 4.310 -8.331 1.00 0.00 O ATOM 566 CB ILE A 41 4.280 2.507 -5.727 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.287 1.438 -5.264 1.00 0.00 C ATOM 568 CG2 ILE A 41 4.926 3.191 -4.532 1.00 0.00 C ATOM 569 CD1 ILE A 41 3.925 0.092 -5.004 1.00 0.00 C ATOM 0 H ILE A 41 3.320 2.219 -8.224 1.00 0.00 H new ATOM 0 HA ILE A 41 2.867 4.112 -6.012 1.00 0.00 H new ATOM 0 HB ILE A 41 5.063 2.021 -6.310 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.796 1.780 -4.353 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.511 1.323 -6.021 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.422 2.446 -3.911 1.00 0.00 H new ATOM 0 HG22 ILE A 41 5.659 3.918 -4.881 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.160 3.700 -3.946 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.162 -0.616 -4.679 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.392 -0.272 -5.919 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.682 0.192 -4.226 1.00 0.00 H new ATOM 581 N VAL A 42 4.988 5.503 -6.424 1.00 0.00 N ATOM 582 CA VAL A 42 5.980 6.478 -6.863 1.00 0.00 C ATOM 583 C VAL A 42 7.392 5.916 -6.748 1.00 0.00 C ATOM 584 O VAL A 42 7.673 5.040 -5.929 1.00 0.00 O ATOM 585 CB VAL A 42 5.888 7.778 -6.042 1.00 0.00 C ATOM 586 CG1 VAL A 42 4.598 8.520 -6.358 1.00 0.00 C ATOM 587 CG2 VAL A 42 5.990 7.477 -4.555 1.00 0.00 C ATOM 0 H VAL A 42 4.619 5.668 -5.488 1.00 0.00 H new ATOM 0 HA VAL A 42 5.766 6.700 -7.908 1.00 0.00 H new ATOM 0 HB VAL A 42 6.724 8.421 -6.317 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.551 9.436 -5.768 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.572 8.770 -7.419 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.745 7.887 -6.114 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.923 8.407 -3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.176 6.815 -4.261 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.944 6.994 -4.346 1.00 0.00 H new ATOM 597 N PRO A 43 8.304 6.430 -7.587 1.00 0.00 N ATOM 598 CA PRO A 43 9.703 5.994 -7.598 1.00 0.00 C ATOM 599 C PRO A 43 10.458 6.438 -6.351 1.00 0.00 C ATOM 600 O PRO A 43 10.369 7.593 -5.938 1.00 0.00 O ATOM 601 CB PRO A 43 10.276 6.677 -8.842 1.00 0.00 C ATOM 602 CG PRO A 43 9.413 7.873 -9.050 1.00 0.00 C ATOM 603 CD PRO A 43 8.038 7.476 -8.589 1.00 0.00 C ATOM 0 HA PRO A 43 9.792 4.908 -7.612 1.00 0.00 H new ATOM 0 HB2 PRO A 43 11.318 6.962 -8.693 1.00 0.00 H new ATOM 0 HB3 PRO A 43 10.248 6.013 -9.706 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.784 8.726 -8.482 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.403 8.169 -10.099 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.500 8.319 -8.156 1.00 0.00 H new ATOM 0 HD3 PRO A 43 7.431 7.099 -9.412 1.00 0.00 H new ATOM 611 N ASN A 44 11.202 5.512 -5.754 1.00 0.00 N ATOM 612 CA ASN A 44 11.973 5.808 -4.552 1.00 0.00 C ATOM 613 C ASN A 44 11.056 6.218 -3.404 1.00 0.00 C ATOM 614 O ASN A 44 11.479 6.895 -2.469 1.00 0.00 O ATOM 615 CB ASN A 44 12.986 6.921 -4.833 1.00 0.00 C ATOM 616 CG ASN A 44 14.319 6.381 -5.312 1.00 0.00 C ATOM 617 OD1 ASN A 44 14.488 5.175 -5.485 1.00 0.00 O ATOM 618 ND2 ASN A 44 15.276 7.277 -5.529 1.00 0.00 N ATOM 0 H ASN A 44 11.287 4.550 -6.083 1.00 0.00 H new ATOM 0 HA ASN A 44 12.507 4.904 -4.261 1.00 0.00 H new ATOM 0 HB2 ASN A 44 12.580 7.597 -5.585 1.00 0.00 H new ATOM 0 HB3 ASN A 44 13.139 7.507 -3.927 1.00 0.00 H new ATOM 0 HD21 ASN A 44 16.195 6.974 -5.852 1.00 0.00 H new ATOM 0 HD22 ASN A 44 15.092 8.268 -5.372 1.00 0.00 H new ATOM 625 N GLY A 45 9.796 5.801 -3.483 1.00 0.00 N ATOM 626 CA GLY A 45 8.838 6.133 -2.445 1.00 0.00 C ATOM 627 C GLY A 45 8.652 5.008 -1.446 1.00 0.00 C ATOM 628 O GLY A 45 7.552 4.798 -0.936 1.00 0.00 O ATOM 0 H GLY A 45 9.422 5.239 -4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.171 7.029 -1.921 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.878 6.370 -2.903 1.00 0.00 H new ATOM 632 N MET A 46 9.730 4.282 -1.168 1.00 0.00 N ATOM 633 CA MET A 46 9.679 3.171 -0.224 1.00 0.00 C ATOM 634 C MET A 46 10.779 3.300 0.825 1.00 0.00 C ATOM 635 O MET A 46 11.931 3.592 0.500 1.00 0.00 O ATOM 636 CB MET A 46 9.816 1.839 -0.963 1.00 0.00 C ATOM 637 CG MET A 46 8.679 1.563 -1.934 1.00 0.00 C ATOM 638 SD MET A 46 9.178 1.745 -3.657 1.00 0.00 S ATOM 639 CE MET A 46 7.985 0.684 -4.469 1.00 0.00 C ATOM 0 H MET A 46 10.648 4.443 -1.582 1.00 0.00 H new ATOM 0 HA MET A 46 8.714 3.199 0.281 1.00 0.00 H new ATOM 0 HB2 MET A 46 10.759 1.831 -1.509 1.00 0.00 H new ATOM 0 HB3 MET A 46 9.864 1.031 -0.233 1.00 0.00 H new ATOM 0 HG2 MET A 46 8.306 0.552 -1.773 1.00 0.00 H new ATOM 0 HG3 MET A 46 7.854 2.244 -1.725 1.00 0.00 H new ATOM 0 HE1 MET A 46 8.009 0.865 -5.544 1.00 0.00 H new ATOM 0 HE2 MET A 46 8.232 -0.359 -4.271 1.00 0.00 H new ATOM 0 HE3 MET A 46 6.987 0.900 -4.087 1.00 0.00 H new ATOM 649 N THR A 47 10.417 3.077 2.085 1.00 0.00 N ATOM 650 CA THR A 47 11.373 3.169 3.182 1.00 0.00 C ATOM 651 C THR A 47 11.430 1.868 3.972 1.00 0.00 C ATOM 652 O THR A 47 10.400 1.340 4.394 1.00 0.00 O ATOM 653 CB THR A 47 11.020 4.323 4.139 1.00 0.00 C ATOM 654 OG1 THR A 47 11.250 5.582 3.496 1.00 0.00 O ATOM 655 CG2 THR A 47 11.848 4.242 5.413 1.00 0.00 C ATOM 0 H THR A 47 9.469 2.832 2.371 1.00 0.00 H new ATOM 0 HA THR A 47 12.349 3.362 2.736 1.00 0.00 H new ATOM 0 HB THR A 47 9.966 4.237 4.402 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.176 6.304 4.155 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.581 5.067 6.073 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.650 3.296 5.916 1.00 0.00 H new ATOM 0 HG23 THR A 47 12.907 4.305 5.163 1.00 0.00 H new ATOM 663 N LEU A 48 12.639 1.354 4.171 1.00 0.00 N ATOM 664 CA LEU A 48 12.830 0.113 4.913 1.00 0.00 C ATOM 665 C LEU A 48 13.944 0.260 5.945 1.00 0.00 C ATOM 666 O LEU A 48 15.125 0.075 5.650 1.00 0.00 O ATOM 667 CB LEU A 48 13.158 -1.033 3.953 1.00 0.00 C ATOM 668 CG LEU A 48 11.973 -1.885 3.497 1.00 0.00 C ATOM 669 CD1 LEU A 48 11.926 -1.964 1.979 1.00 0.00 C ATOM 670 CD2 LEU A 48 12.053 -3.279 4.103 1.00 0.00 C ATOM 0 H LEU A 48 13.501 1.778 3.829 1.00 0.00 H new ATOM 0 HA LEU A 48 11.902 -0.113 5.437 1.00 0.00 H new ATOM 0 HB2 LEU A 48 13.640 -0.614 3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.886 -1.686 4.434 1.00 0.00 H new ATOM 0 HG LEU A 48 11.055 -1.412 3.845 1.00 0.00 H new ATOM 0 HD11 LEU A 48 11.076 -2.574 1.673 1.00 0.00 H new ATOM 0 HD12 LEU A 48 11.820 -0.961 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 48 12.848 -2.413 1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 48 11.202 -3.871 3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.978 -3.761 3.786 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.037 -3.205 5.190 1.00 0.00 H new ATOM 682 N PRO A 49 13.561 0.602 7.184 1.00 0.00 N ATOM 683 CA PRO A 49 14.512 0.779 8.285 1.00 0.00 C ATOM 684 C PRO A 49 15.133 -0.539 8.734 1.00 0.00 C ATOM 685 O PRO A 49 14.755 -1.609 8.256 1.00 0.00 O ATOM 686 CB PRO A 49 13.653 1.374 9.404 1.00 0.00 C ATOM 687 CG PRO A 49 12.269 0.911 9.105 1.00 0.00 C ATOM 688 CD PRO A 49 12.171 0.840 7.606 1.00 0.00 C ATOM 0 HA PRO A 49 15.356 1.406 7.997 1.00 0.00 H new ATOM 0 HB2 PRO A 49 13.983 1.028 10.383 1.00 0.00 H new ATOM 0 HB3 PRO A 49 13.713 2.462 9.413 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.078 -0.063 9.555 1.00 0.00 H new ATOM 0 HG3 PRO A 49 11.530 1.601 9.512 1.00 0.00 H new ATOM 0 HD2 PRO A 49 11.510 0.035 7.284 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.776 1.765 7.185 1.00 0.00 H new ATOM 696 N VAL A 50 16.086 -0.455 9.656 1.00 0.00 N ATOM 697 CA VAL A 50 16.759 -1.643 10.171 1.00 0.00 C ATOM 698 C VAL A 50 17.056 -1.504 11.660 1.00 0.00 C ATOM 699 O VAL A 50 16.651 -0.531 12.296 1.00 0.00 O ATOM 700 CB VAL A 50 18.075 -1.914 9.419 1.00 0.00 C ATOM 701 CG1 VAL A 50 17.808 -2.132 7.937 1.00 0.00 C ATOM 702 CG2 VAL A 50 19.054 -0.769 9.630 1.00 0.00 C ATOM 0 H VAL A 50 16.410 0.423 10.062 1.00 0.00 H new ATOM 0 HA VAL A 50 16.082 -2.483 10.015 1.00 0.00 H new ATOM 0 HB VAL A 50 18.522 -2.823 9.821 1.00 0.00 H new ATOM 0 HG11 VAL A 50 18.750 -2.322 7.422 1.00 0.00 H new ATOM 0 HG12 VAL A 50 17.145 -2.988 7.809 1.00 0.00 H new ATOM 0 HG13 VAL A 50 17.338 -1.243 7.517 1.00 0.00 H new ATOM 0 HG21 VAL A 50 19.979 -0.977 9.092 1.00 0.00 H new ATOM 0 HG22 VAL A 50 18.617 0.157 9.256 1.00 0.00 H new ATOM 0 HG23 VAL A 50 19.269 -0.665 10.694 1.00 0.00 H new ATOM 712 N ASP A 51 17.766 -2.483 12.209 1.00 0.00 N ATOM 713 CA ASP A 51 18.120 -2.470 13.624 1.00 0.00 C ATOM 714 C ASP A 51 19.447 -1.749 13.846 1.00 0.00 C ATOM 715 O ASP A 51 19.972 -1.102 12.939 1.00 0.00 O ATOM 716 CB ASP A 51 18.206 -3.899 14.164 1.00 0.00 C ATOM 717 CG ASP A 51 16.992 -4.280 14.987 1.00 0.00 C ATOM 718 OD1 ASP A 51 16.431 -3.393 15.665 1.00 0.00 O ATOM 719 OD2 ASP A 51 16.601 -5.465 14.952 1.00 0.00 O ATOM 0 H ASP A 51 18.108 -3.296 11.696 1.00 0.00 H new ATOM 0 HA ASP A 51 17.340 -1.932 14.163 1.00 0.00 H new ATOM 0 HB2 ASP A 51 18.309 -4.594 13.330 1.00 0.00 H new ATOM 0 HB3 ASP A 51 19.102 -4.000 14.776 1.00 0.00 H new ATOM 724 N PHE A 52 19.981 -1.864 15.056 1.00 0.00 N ATOM 725 CA PHE A 52 21.244 -1.220 15.399 1.00 0.00 C ATOM 726 C PHE A 52 22.402 -1.855 14.633 1.00 0.00 C ATOM 727 O PHE A 52 23.469 -1.258 14.494 1.00 0.00 O ATOM 728 CB PHE A 52 21.500 -1.318 16.904 1.00 0.00 C ATOM 729 CG PHE A 52 20.245 -1.466 17.716 1.00 0.00 C ATOM 730 CD1 PHE A 52 19.478 -0.358 18.037 1.00 0.00 C ATOM 731 CD2 PHE A 52 19.834 -2.712 18.160 1.00 0.00 C ATOM 732 CE1 PHE A 52 18.322 -0.490 18.784 1.00 0.00 C ATOM 733 CE2 PHE A 52 18.680 -2.851 18.907 1.00 0.00 C ATOM 734 CZ PHE A 52 17.924 -1.738 19.220 1.00 0.00 C ATOM 0 H PHE A 52 19.559 -2.397 15.816 1.00 0.00 H new ATOM 0 HA PHE A 52 21.176 -0.169 15.117 1.00 0.00 H new ATOM 0 HB2 PHE A 52 22.152 -2.169 17.099 1.00 0.00 H new ATOM 0 HB3 PHE A 52 22.033 -0.426 17.233 1.00 0.00 H new ATOM 0 HD1 PHE A 52 19.787 0.620 17.700 1.00 0.00 H new ATOM 0 HD2 PHE A 52 20.422 -3.585 17.919 1.00 0.00 H new ATOM 0 HE1 PHE A 52 17.732 0.381 19.026 1.00 0.00 H new ATOM 0 HE2 PHE A 52 18.369 -3.828 19.246 1.00 0.00 H new ATOM 0 HZ PHE A 52 17.022 -1.844 19.805 1.00 0.00 H new ATOM 744 N GLN A 53 22.182 -3.069 14.139 1.00 0.00 N ATOM 745 CA GLN A 53 23.207 -3.786 13.388 1.00 0.00 C ATOM 746 C GLN A 53 23.005 -3.608 11.887 1.00 0.00 C ATOM 747 O GLN A 53 23.961 -3.654 11.113 1.00 0.00 O ATOM 748 CB GLN A 53 23.184 -5.273 13.745 1.00 0.00 C ATOM 749 CG GLN A 53 23.749 -5.576 15.124 1.00 0.00 C ATOM 750 CD GLN A 53 25.101 -4.929 15.355 1.00 0.00 C ATOM 751 OE1 GLN A 53 26.112 -5.361 14.802 1.00 0.00 O ATOM 752 NE2 GLN A 53 25.126 -3.886 16.176 1.00 0.00 N ATOM 0 H GLN A 53 21.304 -3.577 14.245 1.00 0.00 H new ATOM 0 HA GLN A 53 24.178 -3.370 13.658 1.00 0.00 H new ATOM 0 HB2 GLN A 53 22.157 -5.634 13.695 1.00 0.00 H new ATOM 0 HB3 GLN A 53 23.754 -5.826 12.998 1.00 0.00 H new ATOM 0 HG2 GLN A 53 23.049 -5.228 15.884 1.00 0.00 H new ATOM 0 HG3 GLN A 53 23.841 -6.655 15.246 1.00 0.00 H new ATOM 0 HE21 GLN A 53 24.264 -3.561 16.613 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.007 -3.410 16.369 1.00 0.00 H new ATOM 761 N GLY A 54 21.756 -3.405 11.481 1.00 0.00 N ATOM 762 CA GLY A 54 21.452 -3.224 10.074 1.00 0.00 C ATOM 763 C GLY A 54 20.499 -4.278 9.547 1.00 0.00 C ATOM 764 O GLY A 54 20.538 -4.626 8.366 1.00 0.00 O ATOM 0 H GLY A 54 20.948 -3.363 12.102 1.00 0.00 H new ATOM 0 HA2 GLY A 54 21.016 -2.236 9.924 1.00 0.00 H new ATOM 0 HA3 GLY A 54 22.377 -3.255 9.499 1.00 0.00 H new ATOM 768 N ARG A 55 19.639 -4.787 10.423 1.00 0.00 N ATOM 769 CA ARG A 55 18.673 -5.809 10.039 1.00 0.00 C ATOM 770 C ARG A 55 17.258 -5.237 10.012 1.00 0.00 C ATOM 771 O ARG A 55 16.758 -4.744 11.022 1.00 0.00 O ATOM 772 CB ARG A 55 18.738 -6.992 11.008 1.00 0.00 C ATOM 773 CG ARG A 55 20.074 -7.714 10.998 1.00 0.00 C ATOM 774 CD ARG A 55 20.088 -8.875 11.979 1.00 0.00 C ATOM 775 NE ARG A 55 21.188 -9.800 11.719 1.00 0.00 N ATOM 776 CZ ARG A 55 21.218 -10.634 10.686 1.00 0.00 C ATOM 777 NH1 ARG A 55 20.214 -10.659 9.820 1.00 0.00 N ATOM 778 NH2 ARG A 55 22.255 -11.445 10.517 1.00 0.00 N ATOM 0 H ARG A 55 19.592 -4.508 11.403 1.00 0.00 H new ATOM 0 HA ARG A 55 18.926 -6.154 9.037 1.00 0.00 H new ATOM 0 HB2 ARG A 55 18.535 -6.635 12.018 1.00 0.00 H new ATOM 0 HB3 ARG A 55 17.949 -7.701 10.756 1.00 0.00 H new ATOM 0 HG2 ARG A 55 20.282 -8.083 9.994 1.00 0.00 H new ATOM 0 HG3 ARG A 55 20.869 -7.013 11.251 1.00 0.00 H new ATOM 0 HD2 ARG A 55 20.171 -8.490 12.995 1.00 0.00 H new ATOM 0 HD3 ARG A 55 19.141 -9.412 11.918 1.00 0.00 H new ATOM 0 HE ARG A 55 21.976 -9.806 12.366 1.00 0.00 H new ATOM 0 HH11 ARG A 55 19.416 -10.037 9.946 1.00 0.00 H new ATOM 0 HH12 ARG A 55 20.240 -11.301 9.028 1.00 0.00 H new ATOM 0 HH21 ARG A 55 23.029 -11.428 11.181 1.00 0.00 H new ATOM 0 HH22 ARG A 55 22.278 -12.085 9.723 1.00 0.00 H new ATOM 792 N SER A 56 16.620 -5.307 8.848 1.00 0.00 N ATOM 793 CA SER A 56 15.265 -4.792 8.688 1.00 0.00 C ATOM 794 C SER A 56 14.436 -5.042 9.944 1.00 0.00 C ATOM 795 O SER A 56 14.509 -6.113 10.548 1.00 0.00 O ATOM 796 CB SER A 56 14.589 -5.444 7.480 1.00 0.00 C ATOM 797 OG SER A 56 14.276 -4.481 6.489 1.00 0.00 O ATOM 0 H SER A 56 17.019 -5.715 8.003 1.00 0.00 H new ATOM 0 HA SER A 56 15.329 -3.716 8.524 1.00 0.00 H new ATOM 0 HB2 SER A 56 15.246 -6.204 7.058 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.678 -5.951 7.799 1.00 0.00 H new ATOM 0 HG SER A 56 13.847 -4.923 5.727 1.00 0.00 H new ATOM 803 N THR A 57 13.648 -4.045 10.334 1.00 0.00 N ATOM 804 CA THR A 57 12.806 -4.154 11.518 1.00 0.00 C ATOM 805 C THR A 57 11.415 -4.663 11.160 1.00 0.00 C ATOM 806 O THR A 57 10.429 -4.312 11.805 1.00 0.00 O ATOM 807 CB THR A 57 12.675 -2.800 12.240 1.00 0.00 C ATOM 808 OG1 THR A 57 11.976 -1.867 11.409 1.00 0.00 O ATOM 809 CG2 THR A 57 14.044 -2.242 12.598 1.00 0.00 C ATOM 0 H THR A 57 13.576 -3.152 9.846 1.00 0.00 H new ATOM 0 HA THR A 57 13.290 -4.868 12.185 1.00 0.00 H new ATOM 0 HB THR A 57 12.113 -2.958 13.161 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.895 -1.009 11.876 1.00 0.00 H new ATOM 0 HG21 THR A 57 13.925 -1.285 13.107 1.00 0.00 H new ATOM 0 HG22 THR A 57 14.561 -2.941 13.255 1.00 0.00 H new ATOM 0 HG23 THR A 57 14.628 -2.099 11.689 1.00 0.00 H new ATOM 817 N GLY A 58 11.342 -5.495 10.124 1.00 0.00 N ATOM 818 CA GLY A 58 10.067 -6.040 9.698 1.00 0.00 C ATOM 819 C GLY A 58 9.042 -4.960 9.412 1.00 0.00 C ATOM 820 O GLY A 58 7.847 -5.237 9.328 1.00 0.00 O ATOM 0 H GLY A 58 12.144 -5.801 9.573 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.214 -6.643 8.802 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.683 -6.706 10.471 1.00 0.00 H new ATOM 824 N GLU A 59 9.512 -3.725 9.263 1.00 0.00 N ATOM 825 CA GLU A 59 8.626 -2.599 8.988 1.00 0.00 C ATOM 826 C GLU A 59 9.066 -1.856 7.729 1.00 0.00 C ATOM 827 O GLU A 59 10.236 -1.892 7.351 1.00 0.00 O ATOM 828 CB GLU A 59 8.600 -1.639 10.177 1.00 0.00 C ATOM 829 CG GLU A 59 7.926 -2.215 11.411 1.00 0.00 C ATOM 830 CD GLU A 59 8.491 -1.654 12.701 1.00 0.00 C ATOM 831 OE1 GLU A 59 8.849 -0.458 12.719 1.00 0.00 O ATOM 832 OE2 GLU A 59 8.573 -2.409 13.692 1.00 0.00 O ATOM 0 H GLU A 59 10.500 -3.479 9.328 1.00 0.00 H new ATOM 0 HA GLU A 59 7.622 -2.991 8.826 1.00 0.00 H new ATOM 0 HB2 GLU A 59 9.623 -1.359 10.429 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.083 -0.725 9.884 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.857 -2.007 11.367 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.040 -3.299 11.410 1.00 0.00 H new ATOM 839 N ALA A 60 8.118 -1.184 7.085 1.00 0.00 N ATOM 840 CA ALA A 60 8.407 -0.431 5.870 1.00 0.00 C ATOM 841 C ALA A 60 7.294 0.564 5.564 1.00 0.00 C ATOM 842 O ALA A 60 6.136 0.346 5.921 1.00 0.00 O ATOM 843 CB ALA A 60 8.608 -1.379 4.697 1.00 0.00 C ATOM 0 H ALA A 60 7.144 -1.145 7.384 1.00 0.00 H new ATOM 0 HA ALA A 60 9.327 0.131 6.030 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.823 -0.803 3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 60 9.443 -2.047 4.908 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.703 -1.966 4.545 1.00 0.00 H new ATOM 849 N PHE A 61 7.651 1.660 4.901 1.00 0.00 N ATOM 850 CA PHE A 61 6.682 2.690 4.547 1.00 0.00 C ATOM 851 C PHE A 61 6.635 2.898 3.037 1.00 0.00 C ATOM 852 O PHE A 61 7.631 3.274 2.419 1.00 0.00 O ATOM 853 CB PHE A 61 7.029 4.008 5.245 1.00 0.00 C ATOM 854 CG PHE A 61 6.986 3.922 6.744 1.00 0.00 C ATOM 855 CD1 PHE A 61 5.778 3.994 7.420 1.00 0.00 C ATOM 856 CD2 PHE A 61 8.151 3.770 7.476 1.00 0.00 C ATOM 857 CE1 PHE A 61 5.735 3.917 8.799 1.00 0.00 C ATOM 858 CE2 PHE A 61 8.115 3.692 8.856 1.00 0.00 C ATOM 859 CZ PHE A 61 6.905 3.764 9.518 1.00 0.00 C ATOM 0 H PHE A 61 8.605 1.857 4.598 1.00 0.00 H new ATOM 0 HA PHE A 61 5.699 2.358 4.880 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.026 4.322 4.936 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.334 4.780 4.913 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.860 4.112 6.863 1.00 0.00 H new ATOM 0 HD2 PHE A 61 9.100 3.712 6.963 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.788 3.976 9.314 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.031 3.575 9.415 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.873 3.701 10.596 1.00 0.00 H new ATOM 869 N VAL A 62 5.469 2.651 2.447 1.00 0.00 N ATOM 870 CA VAL A 62 5.291 2.810 1.009 1.00 0.00 C ATOM 871 C VAL A 62 4.455 4.045 0.693 1.00 0.00 C ATOM 872 O VAL A 62 3.482 4.340 1.385 1.00 0.00 O ATOM 873 CB VAL A 62 4.616 1.573 0.386 1.00 0.00 C ATOM 874 CG1 VAL A 62 4.570 1.698 -1.129 1.00 0.00 C ATOM 875 CG2 VAL A 62 5.343 0.304 0.803 1.00 0.00 C ATOM 0 H VAL A 62 4.634 2.340 2.943 1.00 0.00 H new ATOM 0 HA VAL A 62 6.285 2.927 0.578 1.00 0.00 H new ATOM 0 HB VAL A 62 3.591 1.514 0.753 1.00 0.00 H new ATOM 0 HG11 VAL A 62 4.090 0.816 -1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 62 4.002 2.587 -1.404 1.00 0.00 H new ATOM 0 HG13 VAL A 62 5.585 1.781 -1.518 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.853 -0.560 0.354 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.378 0.350 0.465 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.319 0.211 1.889 1.00 0.00 H new ATOM 885 N GLN A 63 4.842 4.762 -0.358 1.00 0.00 N ATOM 886 CA GLN A 63 4.129 5.966 -0.765 1.00 0.00 C ATOM 887 C GLN A 63 3.488 5.781 -2.136 1.00 0.00 C ATOM 888 O GLN A 63 4.173 5.780 -3.159 1.00 0.00 O ATOM 889 CB GLN A 63 5.079 7.165 -0.790 1.00 0.00 C ATOM 890 CG GLN A 63 4.366 8.503 -0.894 1.00 0.00 C ATOM 891 CD GLN A 63 5.326 9.676 -0.906 1.00 0.00 C ATOM 892 OE1 GLN A 63 6.522 9.517 -0.655 1.00 0.00 O ATOM 893 NE2 GLN A 63 4.809 10.863 -1.201 1.00 0.00 N ATOM 0 H GLN A 63 5.645 4.529 -0.942 1.00 0.00 H new ATOM 0 HA GLN A 63 3.340 6.153 -0.037 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.687 7.156 0.115 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.762 7.060 -1.633 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.765 8.521 -1.803 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.678 8.610 -0.055 1.00 0.00 H new ATOM 0 HE21 GLN A 63 3.813 10.950 -1.402 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.408 11.688 -1.226 1.00 0.00 H new ATOM 902 N PHE A 64 2.168 5.624 -2.151 1.00 0.00 N ATOM 903 CA PHE A 64 1.434 5.436 -3.398 1.00 0.00 C ATOM 904 C PHE A 64 1.357 6.741 -4.184 1.00 0.00 C ATOM 905 O PHE A 64 1.717 7.804 -3.681 1.00 0.00 O ATOM 906 CB PHE A 64 0.024 4.916 -3.110 1.00 0.00 C ATOM 907 CG PHE A 64 -0.016 3.457 -2.755 1.00 0.00 C ATOM 908 CD1 PHE A 64 0.187 2.488 -3.724 1.00 0.00 C ATOM 909 CD2 PHE A 64 -0.254 3.055 -1.450 1.00 0.00 C ATOM 910 CE1 PHE A 64 0.149 1.145 -3.400 1.00 0.00 C ATOM 911 CE2 PHE A 64 -0.292 1.713 -1.119 1.00 0.00 C ATOM 912 CZ PHE A 64 -0.088 0.757 -2.096 1.00 0.00 C ATOM 0 H PHE A 64 1.585 5.623 -1.314 1.00 0.00 H new ATOM 0 HA PHE A 64 1.969 4.701 -4.000 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.407 5.493 -2.292 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.603 5.086 -3.985 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.377 2.786 -4.745 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.412 3.799 -0.683 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.305 0.400 -4.166 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.481 1.412 -0.099 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.114 -0.292 -1.840 1.00 0.00 H new ATOM 922 N ALA A 65 0.885 6.650 -5.423 1.00 0.00 N ATOM 923 CA ALA A 65 0.758 7.822 -6.280 1.00 0.00 C ATOM 924 C ALA A 65 -0.245 8.817 -5.705 1.00 0.00 C ATOM 925 O ALA A 65 -0.083 10.029 -5.848 1.00 0.00 O ATOM 926 CB ALA A 65 0.346 7.407 -7.685 1.00 0.00 C ATOM 0 H ALA A 65 0.584 5.777 -5.856 1.00 0.00 H new ATOM 0 HA ALA A 65 1.730 8.313 -6.328 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.255 8.293 -8.314 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.100 6.741 -8.103 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -0.613 6.890 -7.645 1.00 0.00 H new ATOM 932 N SER A 66 -1.281 8.297 -5.054 1.00 0.00 N ATOM 933 CA SER A 66 -2.312 9.141 -4.462 1.00 0.00 C ATOM 934 C SER A 66 -3.105 8.370 -3.410 1.00 0.00 C ATOM 935 O SER A 66 -2.926 7.164 -3.244 1.00 0.00 O ATOM 936 CB SER A 66 -3.256 9.666 -5.544 1.00 0.00 C ATOM 937 OG SER A 66 -3.452 11.064 -5.416 1.00 0.00 O ATOM 0 H SER A 66 -1.428 7.296 -4.923 1.00 0.00 H new ATOM 0 HA SER A 66 -1.822 9.986 -3.978 1.00 0.00 H new ATOM 0 HB2 SER A 66 -2.846 9.442 -6.529 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.215 9.153 -5.474 1.00 0.00 H new ATOM 0 HG SER A 66 -4.058 11.375 -6.121 1.00 0.00 H new ATOM 943 N GLN A 67 -3.980 9.078 -2.703 1.00 0.00 N ATOM 944 CA GLN A 67 -4.801 8.462 -1.666 1.00 0.00 C ATOM 945 C GLN A 67 -5.708 7.387 -2.258 1.00 0.00 C ATOM 946 O GLN A 67 -5.780 6.272 -1.744 1.00 0.00 O ATOM 947 CB GLN A 67 -5.642 9.522 -0.954 1.00 0.00 C ATOM 948 CG GLN A 67 -5.657 9.372 0.558 1.00 0.00 C ATOM 949 CD GLN A 67 -6.836 8.558 1.052 1.00 0.00 C ATOM 950 OE1 GLN A 67 -7.975 9.026 1.046 1.00 0.00 O ATOM 951 NE2 GLN A 67 -6.570 7.330 1.484 1.00 0.00 N ATOM 0 H GLN A 67 -4.139 10.078 -2.829 1.00 0.00 H new ATOM 0 HA GLN A 67 -4.136 7.992 -0.942 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -5.258 10.510 -1.209 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.665 9.472 -1.326 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -4.731 8.896 0.881 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.685 10.360 1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -5.611 6.981 1.472 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -7.324 6.736 1.828 1.00 0.00 H new ATOM 960 N GLU A 68 -6.398 7.733 -3.340 1.00 0.00 N ATOM 961 CA GLU A 68 -7.302 6.798 -3.999 1.00 0.00 C ATOM 962 C GLU A 68 -6.631 5.441 -4.198 1.00 0.00 C ATOM 963 O GLU A 68 -7.241 4.396 -3.968 1.00 0.00 O ATOM 964 CB GLU A 68 -7.755 7.358 -5.349 1.00 0.00 C ATOM 965 CG GLU A 68 -6.657 8.085 -6.107 1.00 0.00 C ATOM 966 CD GLU A 68 -7.011 8.326 -7.561 1.00 0.00 C ATOM 967 OE1 GLU A 68 -7.741 9.299 -7.840 1.00 0.00 O ATOM 968 OE2 GLU A 68 -6.560 7.539 -8.420 1.00 0.00 O ATOM 0 H GLU A 68 -6.348 8.653 -3.778 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.174 6.663 -3.359 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -8.129 6.540 -5.965 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -8.588 8.043 -5.188 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -6.458 9.041 -5.622 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -5.737 7.503 -6.053 1.00 0.00 H new ATOM 975 N ILE A 69 -5.374 5.468 -4.628 1.00 0.00 N ATOM 976 CA ILE A 69 -4.621 4.241 -4.857 1.00 0.00 C ATOM 977 C ILE A 69 -4.241 3.574 -3.540 1.00 0.00 C ATOM 978 O ILE A 69 -4.181 2.348 -3.447 1.00 0.00 O ATOM 979 CB ILE A 69 -3.341 4.510 -5.670 1.00 0.00 C ATOM 980 CG1 ILE A 69 -3.695 5.066 -7.051 1.00 0.00 C ATOM 981 CG2 ILE A 69 -2.519 3.237 -5.801 1.00 0.00 C ATOM 982 CD1 ILE A 69 -2.491 5.518 -7.847 1.00 0.00 C ATOM 0 H ILE A 69 -4.856 6.325 -4.825 1.00 0.00 H new ATOM 0 HA ILE A 69 -5.270 3.575 -5.425 1.00 0.00 H new ATOM 0 HB ILE A 69 -2.743 5.253 -5.142 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.228 4.301 -7.616 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.378 5.907 -6.931 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -1.618 3.444 -6.378 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.241 2.880 -4.809 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.108 2.474 -6.309 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -2.817 5.900 -8.814 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.970 6.305 -7.303 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.817 4.675 -7.998 1.00 0.00 H new ATOM 994 N ALA A 70 -3.988 4.390 -2.521 1.00 0.00 N ATOM 995 CA ALA A 70 -3.619 3.878 -1.207 1.00 0.00 C ATOM 996 C ALA A 70 -4.715 2.985 -0.637 1.00 0.00 C ATOM 997 O ALA A 70 -4.458 1.847 -0.244 1.00 0.00 O ATOM 998 CB ALA A 70 -3.327 5.030 -0.256 1.00 0.00 C ATOM 0 H ALA A 70 -4.032 5.407 -2.581 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.718 3.275 -1.319 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.053 4.634 0.722 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -2.504 5.627 -0.650 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.215 5.655 -0.158 1.00 0.00 H new ATOM 1004 N GLU A 71 -5.936 3.507 -0.596 1.00 0.00 N ATOM 1005 CA GLU A 71 -7.071 2.755 -0.073 1.00 0.00 C ATOM 1006 C GLU A 71 -7.136 1.364 -0.697 1.00 0.00 C ATOM 1007 O GLU A 71 -7.349 0.369 -0.003 1.00 0.00 O ATOM 1008 CB GLU A 71 -8.376 3.507 -0.339 1.00 0.00 C ATOM 1009 CG GLU A 71 -8.705 4.550 0.716 1.00 0.00 C ATOM 1010 CD GLU A 71 -10.064 4.330 1.351 1.00 0.00 C ATOM 1011 OE1 GLU A 71 -10.185 3.419 2.196 1.00 0.00 O ATOM 1012 OE2 GLU A 71 -11.007 5.070 1.002 1.00 0.00 O ATOM 0 H GLU A 71 -6.165 4.447 -0.918 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.937 2.646 1.003 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.312 3.994 -1.312 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.194 2.789 -0.395 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -7.939 4.531 1.491 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.676 5.541 0.263 1.00 0.00 H new ATOM 1019 N LYS A 72 -6.951 1.303 -2.011 1.00 0.00 N ATOM 1020 CA LYS A 72 -6.988 0.035 -2.731 1.00 0.00 C ATOM 1021 C LYS A 72 -5.970 -0.947 -2.156 1.00 0.00 C ATOM 1022 O LYS A 72 -6.201 -2.155 -2.139 1.00 0.00 O ATOM 1023 CB LYS A 72 -6.711 0.261 -4.218 1.00 0.00 C ATOM 1024 CG LYS A 72 -7.657 1.256 -4.869 1.00 0.00 C ATOM 1025 CD LYS A 72 -7.707 1.074 -6.376 1.00 0.00 C ATOM 1026 CE LYS A 72 -6.823 2.086 -7.089 1.00 0.00 C ATOM 1027 NZ LYS A 72 -6.954 1.991 -8.569 1.00 0.00 N ATOM 0 H LYS A 72 -6.774 2.117 -2.600 1.00 0.00 H new ATOM 0 HA LYS A 72 -7.984 -0.392 -2.615 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.687 0.614 -4.339 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.783 -0.692 -4.741 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.657 1.134 -4.454 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.336 2.271 -4.635 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.386 0.064 -6.633 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.735 1.179 -6.722 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.088 3.092 -6.765 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.783 1.924 -6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -6.336 2.697 -9.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -6.676 1.039 -8.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.941 2.171 -8.842 1.00 0.00 H new ATOM 1041 N ALA A 73 -4.845 -0.418 -1.687 1.00 0.00 N ATOM 1042 CA ALA A 73 -3.794 -1.246 -1.109 1.00 0.00 C ATOM 1043 C ALA A 73 -4.104 -1.593 0.344 1.00 0.00 C ATOM 1044 O ALA A 73 -3.640 -2.608 0.864 1.00 0.00 O ATOM 1045 CB ALA A 73 -2.450 -0.541 -1.210 1.00 0.00 C ATOM 0 H ALA A 73 -4.638 0.581 -1.696 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.747 -2.176 -1.675 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -1.675 -1.171 -0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.217 -0.351 -2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.494 0.405 -0.671 1.00 0.00 H new ATOM 1051 N LEU A 74 -4.890 -0.742 0.994 1.00 0.00 N ATOM 1052 CA LEU A 74 -5.262 -0.957 2.388 1.00 0.00 C ATOM 1053 C LEU A 74 -6.004 -2.279 2.556 1.00 0.00 C ATOM 1054 O LEU A 74 -5.825 -2.983 3.552 1.00 0.00 O ATOM 1055 CB LEU A 74 -6.133 0.196 2.889 1.00 0.00 C ATOM 1056 CG LEU A 74 -5.421 1.263 3.721 1.00 0.00 C ATOM 1057 CD1 LEU A 74 -6.358 2.423 4.017 1.00 0.00 C ATOM 1058 CD2 LEU A 74 -4.887 0.663 5.014 1.00 0.00 C ATOM 0 H LEU A 74 -5.282 0.103 0.578 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.347 -0.996 2.979 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.590 0.681 2.026 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.944 -0.221 3.486 1.00 0.00 H new ATOM 0 HG LEU A 74 -4.578 1.643 3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.833 3.172 4.610 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -6.691 2.870 3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.222 2.060 4.573 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -4.383 1.437 5.593 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.714 0.255 5.595 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -4.180 -0.133 4.781 1.00 0.00 H new ATOM 1070 N LYS A 75 -6.836 -2.614 1.576 1.00 0.00 N ATOM 1071 CA LYS A 75 -7.603 -3.853 1.611 1.00 0.00 C ATOM 1072 C LYS A 75 -6.678 -5.065 1.624 1.00 0.00 C ATOM 1073 O LYS A 75 -7.092 -6.172 1.970 1.00 0.00 O ATOM 1074 CB LYS A 75 -8.544 -3.929 0.407 1.00 0.00 C ATOM 1075 CG LYS A 75 -9.510 -2.761 0.315 1.00 0.00 C ATOM 1076 CD LYS A 75 -10.894 -3.141 0.815 1.00 0.00 C ATOM 1077 CE LYS A 75 -11.986 -2.449 0.013 1.00 0.00 C ATOM 1078 NZ LYS A 75 -12.307 -1.102 0.561 1.00 0.00 N ATOM 0 H LYS A 75 -6.996 -2.043 0.746 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.194 -3.859 2.527 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.950 -3.971 -0.506 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.113 -4.857 0.459 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.128 -1.925 0.900 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -9.576 -2.423 -0.719 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.022 -4.221 0.749 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.988 -2.873 1.867 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.668 -2.353 -1.025 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.885 -3.066 0.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.055 -0.663 -0.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.634 -1.196 1.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.456 -0.505 0.535 1.00 0.00 H new ATOM 1092 N LYS A 76 -5.422 -4.850 1.248 1.00 0.00 N ATOM 1093 CA LYS A 76 -4.437 -5.924 1.218 1.00 0.00 C ATOM 1094 C LYS A 76 -3.810 -6.126 2.595 1.00 0.00 C ATOM 1095 O LYS A 76 -2.639 -6.489 2.707 1.00 0.00 O ATOM 1096 CB LYS A 76 -3.346 -5.615 0.190 1.00 0.00 C ATOM 1097 CG LYS A 76 -3.887 -5.266 -1.185 1.00 0.00 C ATOM 1098 CD LYS A 76 -2.808 -4.672 -2.075 1.00 0.00 C ATOM 1099 CE LYS A 76 -1.847 -5.740 -2.574 1.00 0.00 C ATOM 1100 NZ LYS A 76 -1.984 -5.969 -4.039 1.00 0.00 N ATOM 0 H LYS A 76 -5.062 -3.940 0.959 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.948 -6.843 0.932 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.740 -4.785 0.554 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.686 -6.478 0.103 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -4.295 -6.161 -1.654 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.708 -4.556 -1.084 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.271 -4.172 -2.925 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.255 -3.913 -1.521 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.823 -5.442 -2.347 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.033 -6.673 -2.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.110 -6.396 -4.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.784 -6.609 -4.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.154 -5.062 -4.518 1.00 0.00 H new ATOM 1114 N HIS A 77 -4.599 -5.890 3.639 1.00 0.00 N ATOM 1115 CA HIS A 77 -4.121 -6.048 5.007 1.00 0.00 C ATOM 1116 C HIS A 77 -4.030 -7.523 5.384 1.00 0.00 C ATOM 1117 O HIS A 77 -4.775 -8.355 4.866 1.00 0.00 O ATOM 1118 CB HIS A 77 -5.049 -5.318 5.980 1.00 0.00 C ATOM 1119 CG HIS A 77 -4.874 -5.743 7.406 1.00 0.00 C ATOM 1120 ND1 HIS A 77 -4.013 -5.111 8.279 1.00 0.00 N ATOM 1121 CD2 HIS A 77 -5.457 -6.740 8.111 1.00 0.00 C ATOM 1122 CE1 HIS A 77 -4.072 -5.704 9.458 1.00 0.00 C ATOM 1123 NE2 HIS A 77 -4.943 -6.695 9.383 1.00 0.00 N ATOM 0 H HIS A 77 -5.571 -5.589 3.563 1.00 0.00 H new ATOM 0 HA HIS A 77 -3.124 -5.613 5.070 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -4.870 -4.245 5.904 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -6.083 -5.491 5.682 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.191 -7.441 7.741 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -3.505 -5.426 10.334 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -5.193 -7.324 10.146 1.00 0.00 H new ATOM 1131 N LYS A 78 -3.109 -7.842 6.288 1.00 0.00 N ATOM 1132 CA LYS A 78 -2.919 -9.217 6.735 1.00 0.00 C ATOM 1133 C LYS A 78 -2.445 -10.101 5.586 1.00 0.00 C ATOM 1134 O LYS A 78 -2.336 -11.318 5.732 1.00 0.00 O ATOM 1135 CB LYS A 78 -4.222 -9.772 7.315 1.00 0.00 C ATOM 1136 CG LYS A 78 -4.226 -9.853 8.832 1.00 0.00 C ATOM 1137 CD LYS A 78 -3.156 -10.804 9.342 1.00 0.00 C ATOM 1138 CE LYS A 78 -3.316 -11.076 10.830 1.00 0.00 C ATOM 1139 NZ LYS A 78 -2.021 -11.442 11.468 1.00 0.00 N ATOM 0 H LYS A 78 -2.482 -7.166 6.725 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.154 -9.218 7.511 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -5.051 -9.143 6.991 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.397 -10.767 6.906 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -4.061 -8.860 9.251 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -5.205 -10.186 9.177 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.210 -11.743 8.791 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.170 -10.380 9.152 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -3.725 -10.192 11.319 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -4.034 -11.883 10.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.171 -11.620 12.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -1.643 -12.300 11.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.343 -10.662 11.350 1.00 0.00 H new ATOM 1153 N GLU A 79 -2.163 -9.481 4.445 1.00 0.00 N ATOM 1154 CA GLU A 79 -1.699 -10.214 3.273 1.00 0.00 C ATOM 1155 C GLU A 79 -0.274 -10.719 3.475 1.00 0.00 C ATOM 1156 O GLU A 79 0.670 -9.934 3.549 1.00 0.00 O ATOM 1157 CB GLU A 79 -1.764 -9.323 2.029 1.00 0.00 C ATOM 1158 CG GLU A 79 -3.180 -8.973 1.604 1.00 0.00 C ATOM 1159 CD GLU A 79 -3.997 -10.196 1.234 1.00 0.00 C ATOM 1160 OE1 GLU A 79 -4.627 -10.784 2.137 1.00 0.00 O ATOM 1161 OE2 GLU A 79 -4.006 -10.564 0.041 1.00 0.00 O ATOM 0 H GLU A 79 -2.248 -8.474 4.307 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.354 -11.074 3.132 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.214 -8.402 2.223 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -1.260 -9.828 1.204 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -3.677 -8.440 2.414 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.142 -8.294 0.752 1.00 0.00 H new ATOM 1168 N ARG A 80 -0.128 -12.038 3.565 1.00 0.00 N ATOM 1169 CA ARG A 80 1.180 -12.649 3.762 1.00 0.00 C ATOM 1170 C ARG A 80 1.933 -12.761 2.438 1.00 0.00 C ATOM 1171 O ARG A 80 1.330 -12.985 1.388 1.00 0.00 O ATOM 1172 CB ARG A 80 1.030 -14.035 4.392 1.00 0.00 C ATOM 1173 CG ARG A 80 0.306 -15.034 3.505 1.00 0.00 C ATOM 1174 CD ARG A 80 1.268 -16.052 2.912 1.00 0.00 C ATOM 1175 NE ARG A 80 0.871 -16.461 1.568 1.00 0.00 N ATOM 1176 CZ ARG A 80 1.552 -17.335 0.835 1.00 0.00 C ATOM 1177 NH1 ARG A 80 2.658 -17.888 1.314 1.00 0.00 N ATOM 1178 NH2 ARG A 80 1.128 -17.657 -0.380 1.00 0.00 N ATOM 0 H ARG A 80 -0.899 -12.702 3.505 1.00 0.00 H new ATOM 0 HA ARG A 80 1.753 -12.011 4.435 1.00 0.00 H new ATOM 0 HB2 ARG A 80 2.019 -14.425 4.631 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.489 -13.940 5.334 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.459 -15.550 4.085 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.206 -14.505 2.702 1.00 0.00 H new ATOM 0 HD2 ARG A 80 2.271 -15.627 2.880 1.00 0.00 H new ATOM 0 HD3 ARG A 80 1.313 -16.928 3.559 1.00 0.00 H new ATOM 0 HE ARG A 80 0.025 -16.054 1.170 1.00 0.00 H new ATOM 0 HH11 ARG A 80 2.988 -17.643 2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 80 3.179 -18.559 0.749 1.00 0.00 H new ATOM 0 HH21 ARG A 80 0.278 -17.233 -0.753 1.00 0.00 H new ATOM 0 HH22 ARG A 80 1.652 -18.328 -0.942 1.00 0.00 H new ATOM 1192 N ILE A 81 3.250 -12.602 2.498 1.00 0.00 N ATOM 1193 CA ILE A 81 4.084 -12.686 1.304 1.00 0.00 C ATOM 1194 C ILE A 81 5.072 -13.843 1.405 1.00 0.00 C ATOM 1195 O ILE A 81 6.198 -13.673 1.870 1.00 0.00 O ATOM 1196 CB ILE A 81 4.864 -11.379 1.070 1.00 0.00 C ATOM 1197 CG1 ILE A 81 3.895 -10.216 0.843 1.00 0.00 C ATOM 1198 CG2 ILE A 81 5.807 -11.529 -0.114 1.00 0.00 C ATOM 1199 CD1 ILE A 81 4.519 -8.856 1.074 1.00 0.00 C ATOM 0 H ILE A 81 3.763 -12.414 3.359 1.00 0.00 H new ATOM 0 HA ILE A 81 3.414 -12.856 0.461 1.00 0.00 H new ATOM 0 HB ILE A 81 5.459 -11.164 1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 81 3.515 -10.264 -0.178 1.00 0.00 H new ATOM 0 HG13 ILE A 81 3.039 -10.332 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.351 -10.597 -0.266 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.515 -12.334 0.084 1.00 0.00 H new ATOM 0 HG23 ILE A 81 5.232 -11.764 -1.010 1.00 0.00 H new ATOM 0 HD11 ILE A 81 3.775 -8.079 0.895 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.874 -8.789 2.102 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.357 -8.720 0.391 1.00 0.00 H new ATOM 1211 N GLY A 82 4.642 -15.021 0.962 1.00 0.00 N ATOM 1212 CA GLY A 82 5.502 -16.189 1.008 1.00 0.00 C ATOM 1213 C GLY A 82 5.225 -17.066 2.214 1.00 0.00 C ATOM 1214 O GLY A 82 5.152 -18.290 2.097 1.00 0.00 O ATOM 0 H GLY A 82 3.714 -15.187 0.572 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.365 -16.774 0.098 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.544 -15.869 1.027 1.00 0.00 H new ATOM 1218 N HIS A 83 5.072 -16.439 3.376 1.00 0.00 N ATOM 1219 CA HIS A 83 4.803 -17.170 4.609 1.00 0.00 C ATOM 1220 C HIS A 83 4.899 -16.246 5.820 1.00 0.00 C ATOM 1221 O HIS A 83 5.363 -16.651 6.886 1.00 0.00 O ATOM 1222 CB HIS A 83 5.783 -18.334 4.762 1.00 0.00 C ATOM 1223 CG HIS A 83 7.192 -17.981 4.397 1.00 0.00 C ATOM 1224 ND1 HIS A 83 7.889 -16.953 4.996 1.00 0.00 N ATOM 1225 CD2 HIS A 83 8.035 -18.528 3.491 1.00 0.00 C ATOM 1226 CE1 HIS A 83 9.100 -16.882 4.472 1.00 0.00 C ATOM 1227 NE2 HIS A 83 9.215 -17.827 3.556 1.00 0.00 N ATOM 0 H HIS A 83 5.130 -15.427 3.490 1.00 0.00 H new ATOM 0 HA HIS A 83 3.788 -17.565 4.554 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.760 -18.684 5.794 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.451 -19.163 4.137 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.820 -19.361 2.838 1.00 0.00 H new ATOM 0 HE1 HIS A 83 9.866 -16.172 4.746 1.00 0.00 H new ATOM 0 HE2 HIS A 83 10.044 -18.007 2.990 1.00 0.00 H new ATOM 1235 N ARG A 84 4.458 -15.005 5.648 1.00 0.00 N ATOM 1236 CA ARG A 84 4.496 -14.024 6.727 1.00 0.00 C ATOM 1237 C ARG A 84 3.444 -12.940 6.512 1.00 0.00 C ATOM 1238 O ARG A 84 3.603 -12.065 5.661 1.00 0.00 O ATOM 1239 CB ARG A 84 5.885 -13.390 6.819 1.00 0.00 C ATOM 1240 CG ARG A 84 6.700 -13.881 8.006 1.00 0.00 C ATOM 1241 CD ARG A 84 6.480 -13.007 9.231 1.00 0.00 C ATOM 1242 NE ARG A 84 7.370 -13.373 10.330 1.00 0.00 N ATOM 1243 CZ ARG A 84 7.164 -14.416 11.125 1.00 0.00 C ATOM 1244 NH1 ARG A 84 6.106 -15.194 10.945 1.00 0.00 N ATOM 1245 NH2 ARG A 84 8.020 -14.685 12.104 1.00 0.00 N ATOM 0 H ARG A 84 4.070 -14.654 4.772 1.00 0.00 H new ATOM 0 HA ARG A 84 4.277 -14.540 7.662 1.00 0.00 H new ATOM 0 HB2 ARG A 84 6.433 -13.600 5.901 1.00 0.00 H new ATOM 0 HB3 ARG A 84 5.778 -12.307 6.885 1.00 0.00 H new ATOM 0 HG2 ARG A 84 6.425 -14.910 8.237 1.00 0.00 H new ATOM 0 HG3 ARG A 84 7.758 -13.885 7.746 1.00 0.00 H new ATOM 0 HD2 ARG A 84 6.642 -11.962 8.965 1.00 0.00 H new ATOM 0 HD3 ARG A 84 5.444 -13.095 9.558 1.00 0.00 H new ATOM 0 HE ARG A 84 8.195 -12.796 10.496 1.00 0.00 H new ATOM 0 HH11 ARG A 84 5.447 -14.992 10.193 1.00 0.00 H new ATOM 0 HH12 ARG A 84 5.951 -15.994 11.558 1.00 0.00 H new ATOM 0 HH21 ARG A 84 8.836 -14.090 12.245 1.00 0.00 H new ATOM 0 HH22 ARG A 84 7.861 -15.487 12.714 1.00 0.00 H new ATOM 1259 N TYR A 85 2.369 -13.004 7.290 1.00 0.00 N ATOM 1260 CA TYR A 85 1.289 -12.030 7.183 1.00 0.00 C ATOM 1261 C TYR A 85 1.829 -10.606 7.276 1.00 0.00 C ATOM 1262 O TYR A 85 2.700 -10.313 8.095 1.00 0.00 O ATOM 1263 CB TYR A 85 0.252 -12.266 8.282 1.00 0.00 C ATOM 1264 CG TYR A 85 -0.400 -13.629 8.216 1.00 0.00 C ATOM 1265 CD1 TYR A 85 -1.276 -13.954 7.188 1.00 0.00 C ATOM 1266 CD2 TYR A 85 -0.140 -14.592 9.184 1.00 0.00 C ATOM 1267 CE1 TYR A 85 -1.874 -15.198 7.125 1.00 0.00 C ATOM 1268 CE2 TYR A 85 -0.733 -15.839 9.128 1.00 0.00 C ATOM 1269 CZ TYR A 85 -1.598 -16.137 8.097 1.00 0.00 C ATOM 1270 OH TYR A 85 -2.191 -17.377 8.038 1.00 0.00 O ATOM 0 H TYR A 85 2.222 -13.720 8.001 1.00 0.00 H new ATOM 0 HA TYR A 85 0.814 -12.157 6.210 1.00 0.00 H new ATOM 0 HB2 TYR A 85 0.731 -12.148 9.254 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -0.520 -11.499 8.213 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.493 -13.222 6.425 1.00 0.00 H new ATOM 0 HD2 TYR A 85 0.537 -14.362 9.994 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.554 -15.434 6.319 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -0.520 -16.576 9.888 1.00 0.00 H new ATOM 0 HH TYR A 85 -1.890 -17.920 8.796 1.00 0.00 H new ATOM 1280 N ILE A 86 1.305 -9.725 6.431 1.00 0.00 N ATOM 1281 CA ILE A 86 1.733 -8.332 6.418 1.00 0.00 C ATOM 1282 C ILE A 86 0.630 -7.414 6.935 1.00 0.00 C ATOM 1283 O ILE A 86 -0.496 -7.441 6.440 1.00 0.00 O ATOM 1284 CB ILE A 86 2.138 -7.881 5.001 1.00 0.00 C ATOM 1285 CG1 ILE A 86 2.979 -8.961 4.319 1.00 0.00 C ATOM 1286 CG2 ILE A 86 2.902 -6.566 5.063 1.00 0.00 C ATOM 1287 CD1 ILE A 86 4.448 -8.894 4.670 1.00 0.00 C ATOM 0 H ILE A 86 0.583 -9.951 5.746 1.00 0.00 H new ATOM 0 HA ILE A 86 2.600 -8.261 7.075 1.00 0.00 H new ATOM 0 HB ILE A 86 1.234 -7.726 4.412 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.592 -9.941 4.597 1.00 0.00 H new ATOM 0 HG13 ILE A 86 2.867 -8.869 3.239 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.182 -6.260 4.055 1.00 0.00 H new ATOM 0 HG22 ILE A 86 2.271 -5.800 5.513 1.00 0.00 H new ATOM 0 HG23 ILE A 86 3.801 -6.696 5.665 1.00 0.00 H new ATOM 0 HD11 ILE A 86 4.983 -9.689 4.151 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.851 -7.928 4.367 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.571 -9.017 5.746 1.00 0.00 H new ATOM 1299 N GLU A 87 0.964 -6.602 7.934 1.00 0.00 N ATOM 1300 CA GLU A 87 0.003 -5.675 8.518 1.00 0.00 C ATOM 1301 C GLU A 87 0.160 -4.279 7.921 1.00 0.00 C ATOM 1302 O GLU A 87 1.159 -3.600 8.160 1.00 0.00 O ATOM 1303 CB GLU A 87 0.177 -5.615 10.037 1.00 0.00 C ATOM 1304 CG GLU A 87 -0.290 -6.872 10.753 1.00 0.00 C ATOM 1305 CD GLU A 87 0.290 -6.996 12.149 1.00 0.00 C ATOM 1306 OE1 GLU A 87 -0.081 -6.182 13.020 1.00 0.00 O ATOM 1307 OE2 GLU A 87 1.115 -7.908 12.370 1.00 0.00 O ATOM 0 H GLU A 87 1.892 -6.568 8.355 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.999 -6.038 8.288 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.229 -5.445 10.267 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.376 -4.759 10.424 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.378 -6.868 10.814 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.007 -7.746 10.167 1.00 0.00 H new ATOM 1314 N ILE A 88 -0.832 -3.860 7.143 1.00 0.00 N ATOM 1315 CA ILE A 88 -0.804 -2.546 6.513 1.00 0.00 C ATOM 1316 C ILE A 88 -1.615 -1.534 7.315 1.00 0.00 C ATOM 1317 O ILE A 88 -2.723 -1.825 7.764 1.00 0.00 O ATOM 1318 CB ILE A 88 -1.352 -2.600 5.075 1.00 0.00 C ATOM 1319 CG1 ILE A 88 -0.487 -3.520 4.210 1.00 0.00 C ATOM 1320 CG2 ILE A 88 -1.408 -1.202 4.476 1.00 0.00 C ATOM 1321 CD1 ILE A 88 -1.265 -4.249 3.137 1.00 0.00 C ATOM 0 H ILE A 88 -1.665 -4.411 6.934 1.00 0.00 H new ATOM 0 HA ILE A 88 0.239 -2.232 6.485 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.364 -3.004 5.103 1.00 0.00 H new ATOM 0 HG12 ILE A 88 0.299 -2.929 3.739 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.005 -4.252 4.851 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.797 -1.257 3.459 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.061 -0.573 5.081 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.406 -0.774 4.458 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.588 -4.882 2.563 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -2.034 -4.867 3.601 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.735 -3.524 2.472 1.00 0.00 H new ATOM 1333 N PHE A 89 -1.054 -0.342 7.492 1.00 0.00 N ATOM 1334 CA PHE A 89 -1.723 0.715 8.240 1.00 0.00 C ATOM 1335 C PHE A 89 -1.486 2.076 7.591 1.00 0.00 C ATOM 1336 O PHE A 89 -0.347 2.525 7.463 1.00 0.00 O ATOM 1337 CB PHE A 89 -1.232 0.735 9.688 1.00 0.00 C ATOM 1338 CG PHE A 89 -1.481 -0.550 10.424 1.00 0.00 C ATOM 1339 CD1 PHE A 89 -2.772 -1.011 10.620 1.00 0.00 C ATOM 1340 CD2 PHE A 89 -0.425 -1.296 10.921 1.00 0.00 C ATOM 1341 CE1 PHE A 89 -3.006 -2.194 11.296 1.00 0.00 C ATOM 1342 CE2 PHE A 89 -0.652 -2.479 11.598 1.00 0.00 C ATOM 1343 CZ PHE A 89 -1.945 -2.928 11.786 1.00 0.00 C ATOM 0 H PHE A 89 -0.137 -0.084 7.127 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.793 0.510 8.230 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.163 0.948 9.698 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.725 1.550 10.219 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.606 -0.440 10.240 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.588 -0.949 10.778 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.018 -2.543 11.440 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.180 -3.052 11.980 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.125 -3.852 12.316 1.00 0.00 H new ATOM 1353 N LYS A 90 -2.569 2.728 7.182 1.00 0.00 N ATOM 1354 CA LYS A 90 -2.481 4.037 6.547 1.00 0.00 C ATOM 1355 C LYS A 90 -1.525 4.949 7.310 1.00 0.00 C ATOM 1356 O LYS A 90 -1.659 5.131 8.520 1.00 0.00 O ATOM 1357 CB LYS A 90 -3.866 4.683 6.469 1.00 0.00 C ATOM 1358 CG LYS A 90 -4.190 5.265 5.104 1.00 0.00 C ATOM 1359 CD LYS A 90 -3.331 6.482 4.799 1.00 0.00 C ATOM 1360 CE LYS A 90 -3.728 7.127 3.480 1.00 0.00 C ATOM 1361 NZ LYS A 90 -3.511 8.600 3.494 1.00 0.00 N ATOM 0 H LYS A 90 -3.519 2.370 7.279 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.094 3.898 5.537 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -4.620 3.939 6.725 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.932 5.474 7.217 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -4.033 4.506 4.337 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -5.243 5.543 5.067 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.429 7.209 5.605 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.282 6.188 4.761 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.149 6.683 2.670 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.778 6.917 3.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.327 8.933 2.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.359 9.072 3.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.695 8.825 4.098 1.00 0.00 H new ATOM 1375 N SER A 91 -0.561 5.520 6.595 1.00 0.00 N ATOM 1376 CA SER A 91 0.417 6.412 7.206 1.00 0.00 C ATOM 1377 C SER A 91 0.592 7.678 6.374 1.00 0.00 C ATOM 1378 O SER A 91 -0.128 7.900 5.401 1.00 0.00 O ATOM 1379 CB SER A 91 1.763 5.699 7.357 1.00 0.00 C ATOM 1380 OG SER A 91 2.632 6.425 8.209 1.00 0.00 O ATOM 0 H SER A 91 -0.436 5.381 5.592 1.00 0.00 H new ATOM 0 HA SER A 91 0.049 6.694 8.192 1.00 0.00 H new ATOM 0 HB2 SER A 91 1.605 4.699 7.760 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.226 5.578 6.378 1.00 0.00 H new ATOM 0 HG SER A 91 2.497 6.137 9.136 1.00 0.00 H new ATOM 1386 N SER A 92 1.552 8.509 6.767 1.00 0.00 N ATOM 1387 CA SER A 92 1.820 9.757 6.061 1.00 0.00 C ATOM 1388 C SER A 92 3.321 9.996 5.929 1.00 0.00 C ATOM 1389 O SER A 92 4.128 9.278 6.518 1.00 0.00 O ATOM 1390 CB SER A 92 1.167 10.931 6.794 1.00 0.00 C ATOM 1391 OG SER A 92 0.206 11.574 5.973 1.00 0.00 O ATOM 0 H SER A 92 2.157 8.341 7.571 1.00 0.00 H new ATOM 0 HA SER A 92 1.394 9.679 5.061 1.00 0.00 H new ATOM 0 HB2 SER A 92 0.690 10.574 7.707 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.932 11.648 7.094 1.00 0.00 H new ATOM 0 HG SER A 92 -0.198 12.319 6.465 1.00 0.00 H new ATOM 1397 N ARG A 93 3.686 11.010 5.152 1.00 0.00 N ATOM 1398 CA ARG A 93 5.089 11.344 4.941 1.00 0.00 C ATOM 1399 C ARG A 93 5.774 11.677 6.263 1.00 0.00 C ATOM 1400 O ARG A 93 6.815 11.113 6.594 1.00 0.00 O ATOM 1401 CB ARG A 93 5.215 12.525 3.977 1.00 0.00 C ATOM 1402 CG ARG A 93 6.639 13.035 3.821 1.00 0.00 C ATOM 1403 CD ARG A 93 7.115 12.927 2.380 1.00 0.00 C ATOM 1404 NE ARG A 93 8.544 13.200 2.255 1.00 0.00 N ATOM 1405 CZ ARG A 93 9.258 12.899 1.176 1.00 0.00 C ATOM 1406 NH1 ARG A 93 8.678 12.318 0.135 1.00 0.00 N ATOM 1407 NH2 ARG A 93 10.554 13.179 1.136 1.00 0.00 N ATOM 0 H ARG A 93 3.030 11.615 4.658 1.00 0.00 H new ATOM 0 HA ARG A 93 5.582 10.475 4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 93 4.836 12.227 3.000 1.00 0.00 H new ATOM 0 HB3 ARG A 93 4.583 13.340 4.330 1.00 0.00 H new ATOM 0 HG2 ARG A 93 6.692 14.074 4.146 1.00 0.00 H new ATOM 0 HG3 ARG A 93 7.304 12.464 4.469 1.00 0.00 H new ATOM 0 HD2 ARG A 93 6.902 11.927 2.002 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.556 13.628 1.760 1.00 0.00 H new ATOM 0 HE ARG A 93 9.020 13.646 3.039 1.00 0.00 H new ATOM 0 HH11 ARG A 93 7.682 12.101 0.162 1.00 0.00 H new ATOM 0 HH12 ARG A 93 9.228 12.088 -0.693 1.00 0.00 H new ATOM 0 HH21 ARG A 93 11.004 13.626 1.935 1.00 0.00 H new ATOM 0 HH22 ARG A 93 11.101 12.947 0.307 1.00 0.00 H new ATOM 1421 N ALA A 94 5.181 12.600 7.014 1.00 0.00 N ATOM 1422 CA ALA A 94 5.732 13.008 8.300 1.00 0.00 C ATOM 1423 C ALA A 94 6.013 11.799 9.186 1.00 0.00 C ATOM 1424 O ALA A 94 7.109 11.654 9.724 1.00 0.00 O ATOM 1425 CB ALA A 94 4.783 13.969 9.000 1.00 0.00 C ATOM 0 H ALA A 94 4.319 13.079 6.753 1.00 0.00 H new ATOM 0 HA ALA A 94 6.678 13.518 8.116 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.207 14.265 9.959 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.637 14.853 8.379 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.824 13.478 9.164 1.00 0.00 H new ATOM 1431 N GLU A 95 5.014 10.934 9.332 1.00 0.00 N ATOM 1432 CA GLU A 95 5.154 9.737 10.155 1.00 0.00 C ATOM 1433 C GLU A 95 6.486 9.044 9.882 1.00 0.00 C ATOM 1434 O GLU A 95 7.232 8.726 10.807 1.00 0.00 O ATOM 1435 CB GLU A 95 3.998 8.771 9.888 1.00 0.00 C ATOM 1436 CG GLU A 95 3.006 8.677 11.034 1.00 0.00 C ATOM 1437 CD GLU A 95 3.205 7.432 11.878 1.00 0.00 C ATOM 1438 OE1 GLU A 95 2.993 6.319 11.353 1.00 0.00 O ATOM 1439 OE2 GLU A 95 3.572 7.573 13.063 1.00 0.00 O ATOM 0 H GLU A 95 4.100 11.039 8.892 1.00 0.00 H new ATOM 0 HA GLU A 95 5.130 10.040 11.202 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.471 9.088 8.988 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.403 7.779 9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.103 9.559 11.667 1.00 0.00 H new ATOM 0 HG3 GLU A 95 1.992 8.682 10.633 1.00 0.00 H new ATOM 1446 N VAL A 96 6.776 8.812 8.606 1.00 0.00 N ATOM 1447 CA VAL A 96 8.017 8.157 8.212 1.00 0.00 C ATOM 1448 C VAL A 96 9.227 8.861 8.815 1.00 0.00 C ATOM 1449 O VAL A 96 9.629 9.930 8.354 1.00 0.00 O ATOM 1450 CB VAL A 96 8.170 8.119 6.679 1.00 0.00 C ATOM 1451 CG1 VAL A 96 9.468 7.430 6.288 1.00 0.00 C ATOM 1452 CG2 VAL A 96 6.975 7.427 6.042 1.00 0.00 C ATOM 0 H VAL A 96 6.168 9.068 7.828 1.00 0.00 H new ATOM 0 HA VAL A 96 7.969 7.136 8.591 1.00 0.00 H new ATOM 0 HB VAL A 96 8.207 9.144 6.309 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.558 7.413 5.202 1.00 0.00 H new ATOM 0 HG12 VAL A 96 10.311 7.974 6.714 1.00 0.00 H new ATOM 0 HG13 VAL A 96 9.466 6.408 6.668 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.100 7.409 4.959 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.904 6.406 6.416 1.00 0.00 H new ATOM 0 HG23 VAL A 96 6.064 7.970 6.293 1.00 0.00 H new ATOM 1462 N ARG A 97 9.803 8.256 9.848 1.00 0.00 N ATOM 1463 CA ARG A 97 10.967 8.827 10.515 1.00 0.00 C ATOM 1464 C ARG A 97 12.161 8.888 9.567 1.00 0.00 C ATOM 1465 O ARG A 97 12.090 8.423 8.430 1.00 0.00 O ATOM 1466 CB ARG A 97 11.327 8.002 11.752 1.00 0.00 C ATOM 1467 CG ARG A 97 11.597 6.537 11.450 1.00 0.00 C ATOM 1468 CD ARG A 97 10.325 5.707 11.532 1.00 0.00 C ATOM 1469 NE ARG A 97 10.550 4.425 12.195 1.00 0.00 N ATOM 1470 CZ ARG A 97 10.592 4.277 13.514 1.00 0.00 C ATOM 1471 NH1 ARG A 97 10.427 5.326 14.308 1.00 0.00 N ATOM 1472 NH2 ARG A 97 10.801 3.077 14.042 1.00 0.00 N ATOM 0 H ARG A 97 9.483 7.371 10.241 1.00 0.00 H new ATOM 0 HA ARG A 97 10.717 9.842 10.823 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.209 8.436 12.223 1.00 0.00 H new ATOM 0 HB3 ARG A 97 10.513 8.071 12.474 1.00 0.00 H new ATOM 0 HG2 ARG A 97 12.030 6.444 10.454 1.00 0.00 H new ATOM 0 HG3 ARG A 97 12.332 6.149 12.155 1.00 0.00 H new ATOM 0 HD2 ARG A 97 9.562 6.266 12.073 1.00 0.00 H new ATOM 0 HD3 ARG A 97 9.940 5.533 10.527 1.00 0.00 H new ATOM 0 HE ARG A 97 10.682 3.598 11.613 1.00 0.00 H new ATOM 0 HH11 ARG A 97 10.267 6.250 13.906 1.00 0.00 H new ATOM 0 HH12 ARG A 97 10.460 5.209 15.321 1.00 0.00 H new ATOM 0 HH21 ARG A 97 10.929 2.268 13.434 1.00 0.00 H new ATOM 0 HH22 ARG A 97 10.833 2.964 15.055 1.00 0.00 H new ATOM 1486 N THR A 98 13.259 9.468 10.043 1.00 0.00 N ATOM 1487 CA THR A 98 14.467 9.593 9.238 1.00 0.00 C ATOM 1488 C THR A 98 15.526 8.586 9.675 1.00 0.00 C ATOM 1489 O THR A 98 16.100 7.876 8.849 1.00 0.00 O ATOM 1490 CB THR A 98 15.058 11.013 9.329 1.00 0.00 C ATOM 1491 OG1 THR A 98 15.552 11.255 10.650 1.00 0.00 O ATOM 1492 CG2 THR A 98 14.011 12.057 8.974 1.00 0.00 C ATOM 0 H THR A 98 13.336 9.858 10.982 1.00 0.00 H new ATOM 0 HA THR A 98 14.181 9.391 8.206 1.00 0.00 H new ATOM 0 HB THR A 98 15.879 11.087 8.616 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.927 12.159 10.698 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.451 13.052 9.045 1.00 0.00 H new ATOM 0 HG22 THR A 98 13.659 11.888 7.956 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.172 11.981 9.666 1.00 0.00 H new ATOM 1500 N SER A 99 15.778 8.528 10.978 1.00 0.00 N ATOM 1501 CA SER A 99 16.770 7.610 11.525 1.00 0.00 C ATOM 1502 C SER A 99 18.091 7.724 10.770 1.00 0.00 C ATOM 1503 O SER A 99 18.211 8.498 9.821 1.00 0.00 O ATOM 1504 CB SER A 99 16.255 6.171 11.459 1.00 0.00 C ATOM 1505 OG SER A 99 15.238 5.948 12.420 1.00 0.00 O ATOM 0 H SER A 99 15.309 9.106 11.675 1.00 0.00 H new ATOM 0 HA SER A 99 16.943 7.880 12.567 1.00 0.00 H new ATOM 0 HB2 SER A 99 15.868 5.966 10.461 1.00 0.00 H new ATOM 0 HB3 SER A 99 17.079 5.478 11.630 1.00 0.00 H new ATOM 0 HG SER A 99 14.925 5.022 12.356 1.00 0.00 H new ATOM 1511 N GLY A 100 19.080 6.946 11.199 1.00 0.00 N ATOM 1512 CA GLY A 100 20.380 6.976 10.554 1.00 0.00 C ATOM 1513 C GLY A 100 21.047 5.615 10.534 1.00 0.00 C ATOM 1514 O GLY A 100 20.884 4.806 11.447 1.00 0.00 O ATOM 0 H GLY A 100 19.004 6.296 11.981 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.267 7.337 9.532 1.00 0.00 H new ATOM 0 HA3 GLY A 100 21.024 7.686 11.074 1.00 0.00 H new ATOM 1518 N PRO A 101 21.819 5.346 9.470 1.00 0.00 N ATOM 1519 CA PRO A 101 22.528 4.073 9.309 1.00 0.00 C ATOM 1520 C PRO A 101 23.674 3.917 10.303 1.00 0.00 C ATOM 1521 O PRO A 101 24.783 4.398 10.067 1.00 0.00 O ATOM 1522 CB PRO A 101 23.068 4.146 7.878 1.00 0.00 C ATOM 1523 CG PRO A 101 23.182 5.603 7.590 1.00 0.00 C ATOM 1524 CD PRO A 101 22.060 6.263 8.343 1.00 0.00 C ATOM 0 HA PRO A 101 21.876 3.218 9.491 1.00 0.00 H new ATOM 0 HB2 PRO A 101 24.034 3.649 7.794 1.00 0.00 H new ATOM 0 HB3 PRO A 101 22.395 3.655 7.175 1.00 0.00 H new ATOM 0 HG2 PRO A 101 24.149 5.990 7.912 1.00 0.00 H new ATOM 0 HG3 PRO A 101 23.101 5.797 6.520 1.00 0.00 H new ATOM 0 HD2 PRO A 101 22.339 7.259 8.688 1.00 0.00 H new ATOM 0 HD3 PRO A 101 21.172 6.378 7.721 1.00 0.00 H new ATOM 1532 N SER A 102 23.400 3.244 11.415 1.00 0.00 N ATOM 1533 CA SER A 102 24.408 3.028 12.446 1.00 0.00 C ATOM 1534 C SER A 102 25.661 2.389 11.856 1.00 0.00 C ATOM 1535 O SER A 102 26.777 2.850 12.095 1.00 0.00 O ATOM 1536 CB SER A 102 23.846 2.142 13.561 1.00 0.00 C ATOM 1537 OG SER A 102 22.950 2.866 14.385 1.00 0.00 O ATOM 0 H SER A 102 22.488 2.839 11.625 1.00 0.00 H new ATOM 0 HA SER A 102 24.679 3.998 12.864 1.00 0.00 H new ATOM 0 HB2 SER A 102 23.332 1.285 13.125 1.00 0.00 H new ATOM 0 HB3 SER A 102 24.664 1.750 14.165 1.00 0.00 H new ATOM 0 HG SER A 102 22.604 2.277 15.088 1.00 0.00 H new ATOM 1543 N SER A 103 25.468 1.324 11.086 1.00 0.00 N ATOM 1544 CA SER A 103 26.582 0.617 10.464 1.00 0.00 C ATOM 1545 C SER A 103 26.083 -0.562 9.635 1.00 0.00 C ATOM 1546 O SER A 103 24.893 -0.871 9.629 1.00 0.00 O ATOM 1547 CB SER A 103 27.562 0.128 11.531 1.00 0.00 C ATOM 1548 OG SER A 103 28.826 0.752 11.388 1.00 0.00 O ATOM 0 H SER A 103 24.550 0.931 10.877 1.00 0.00 H new ATOM 0 HA SER A 103 27.096 1.312 9.800 1.00 0.00 H new ATOM 0 HB2 SER A 103 27.160 0.338 12.522 1.00 0.00 H new ATOM 0 HB3 SER A 103 27.676 -0.953 11.456 1.00 0.00 H new ATOM 0 HG SER A 103 28.742 1.709 11.581 1.00 0.00 H new ATOM 1554 N GLY A 104 27.005 -1.218 8.936 1.00 0.00 N ATOM 1555 CA GLY A 104 26.640 -2.356 8.113 1.00 0.00 C ATOM 1556 C GLY A 104 27.619 -2.590 6.980 1.00 0.00 C ATOM 1557 O GLY A 104 28.825 -2.406 7.145 1.00 0.00 O ATOM 0 H GLY A 104 27.997 -0.982 8.925 1.00 0.00 H new ATOM 0 HA2 GLY A 104 26.589 -3.249 8.736 1.00 0.00 H new ATOM 0 HA3 GLY A 104 25.643 -2.198 7.701 1.00 0.00 H new TER 1561 GLY A 104