USER MOD reduce.3.24.130724 H: found=0, std=0, add=569, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 569 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 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN :FLIP amide:sc= -2.49! C(o=-3.9!,f=-2.5!) USER MOD Single : A 11 THR OG1 : rot 49:sc= 0.295 USER MOD Single : A 23 GLN : amide:sc= -0.564 K(o=-0.56,f=-5.8!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 37 MET CE :methyl 179:sc= -2.29 (180deg=-2.35) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -125:sc= -0.94 (180deg=-3.39!) USER MOD Single : A 44 ASN : amide:sc= -0.321 X(o=-0.32,f=-0.024) USER MOD Single : A 56 SER OG : rot 66:sc= 0.164 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 67 LYS NZ :NH3+ -136:sc= -1.73! (180deg=-4.41!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.0256 X(o=-0.026,f=0) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0.011) USER MOD Single : A 78 TYR OH : rot 30:sc= -2.75! USER MOD Single : A 79 SER OG : rot -130:sc= -0.283 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N LEU A 8 8.442 -11.254 0.675 1.00 0.00 N ATOM 17 CA LEU A 8 9.025 -12.588 0.770 1.00 0.00 C ATOM 18 C LEU A 8 10.508 -12.560 0.414 1.00 0.00 C ATOM 19 O LEU A 8 11.017 -11.560 -0.091 1.00 0.00 O ATOM 20 CB LEU A 8 8.284 -13.556 -0.154 1.00 0.00 C ATOM 21 CG LEU A 8 8.188 -13.141 -1.623 1.00 0.00 C ATOM 22 CD1 LEU A 8 9.484 -13.455 -2.353 1.00 0.00 C ATOM 23 CD2 LEU A 8 7.013 -13.834 -2.297 1.00 0.00 C ATOM 0 HA LEU A 8 8.924 -12.930 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.778 -14.526 -0.103 1.00 0.00 H new ATOM 0 HB3 LEU A 8 7.273 -13.693 0.231 1.00 0.00 H new ATOM 0 HG LEU A 8 8.023 -12.064 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 8 9.396 -13.153 -3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 8 10.306 -12.912 -1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 8 9.681 -14.526 -2.301 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.960 -13.527 -3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.148 -14.914 -2.243 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.088 -13.558 -1.790 1.00 0.00 H new ATOM 35 N SER A 9 11.195 -13.667 0.680 1.00 0.00 N ATOM 36 CA SER A 9 12.620 -13.769 0.389 1.00 0.00 C ATOM 37 C SER A 9 12.870 -14.718 -0.779 1.00 0.00 C ATOM 38 O SER A 9 11.941 -15.329 -1.306 1.00 0.00 O ATOM 39 CB SER A 9 13.381 -14.253 1.626 1.00 0.00 C ATOM 40 OG SER A 9 13.789 -13.162 2.433 1.00 0.00 O ATOM 0 H SER A 9 10.788 -14.505 1.096 1.00 0.00 H new ATOM 0 HA SER A 9 12.981 -12.778 0.113 1.00 0.00 H new ATOM 0 HB2 SER A 9 12.747 -14.923 2.208 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.254 -14.828 1.318 1.00 0.00 H new ATOM 0 HG SER A 9 14.271 -13.498 3.217 1.00 0.00 H new ATOM 46 N ASN A 10 14.132 -14.836 -1.178 1.00 0.00 N ATOM 47 CA ASN A 10 14.505 -15.710 -2.285 1.00 0.00 C ATOM 48 C ASN A 10 14.749 -17.134 -1.795 1.00 0.00 C ATOM 49 O ASN A 10 14.211 -18.094 -2.346 1.00 0.00 O ATOM 50 CB ASN A 10 15.757 -15.177 -2.983 1.00 0.00 C ATOM 51 CG ASN A 10 15.793 -15.531 -4.457 1.00 0.00 C ATOM 52 OD1 ASN A 10 16.714 -16.411 -4.832 1.00 0.00 O flip ATOM 53 ND2 ASN A 10 15.001 -15.020 -5.249 1.00 0.00 N flip ATOM 0 H ASN A 10 14.913 -14.338 -0.752 1.00 0.00 H new ATOM 0 HA ASN A 10 13.680 -15.726 -2.997 1.00 0.00 H new ATOM 0 HB2 ASN A 10 15.798 -14.094 -2.871 1.00 0.00 H new ATOM 0 HB3 ASN A 10 16.643 -15.582 -2.493 1.00 0.00 H new ATOM 0 HD21 ASN A 10 14.309 -14.348 -4.917 1.00 0.00 H new ATOM 0 HD22 ASN A 10 15.036 -15.269 -6.238 1.00 0.00 H new ATOM 60 N THR A 11 15.566 -17.264 -0.754 1.00 0.00 N ATOM 61 CA THR A 11 15.883 -18.569 -0.189 1.00 0.00 C ATOM 62 C THR A 11 15.723 -18.566 1.327 1.00 0.00 C ATOM 63 O THR A 11 16.656 -18.234 2.058 1.00 0.00 O ATOM 64 CB THR A 11 17.319 -19.000 -0.541 1.00 0.00 C ATOM 65 OG1 THR A 11 18.234 -17.936 -0.254 1.00 0.00 O ATOM 66 CG2 THR A 11 17.424 -19.383 -2.010 1.00 0.00 C ATOM 0 H THR A 11 16.020 -16.480 -0.285 1.00 0.00 H new ATOM 0 HA THR A 11 15.181 -19.280 -0.624 1.00 0.00 H new ATOM 0 HB THR A 11 17.573 -19.870 0.064 1.00 0.00 H new ATOM 0 HG1 THR A 11 18.071 -17.599 0.652 1.00 0.00 H new ATOM 0 HG21 THR A 11 18.447 -19.684 -2.235 1.00 0.00 H new ATOM 0 HG22 THR A 11 16.748 -20.212 -2.219 1.00 0.00 H new ATOM 0 HG23 THR A 11 17.153 -18.528 -2.629 1.00 0.00 H new ATOM 74 N ARG A 12 14.535 -18.939 1.793 1.00 0.00 N ATOM 75 CA ARG A 12 14.254 -18.978 3.223 1.00 0.00 C ATOM 76 C ARG A 12 12.824 -19.442 3.482 1.00 0.00 C ATOM 77 O ARG A 12 11.864 -18.818 3.027 1.00 0.00 O ATOM 78 CB ARG A 12 14.475 -17.599 3.846 1.00 0.00 C ATOM 79 CG ARG A 12 15.236 -17.639 5.161 1.00 0.00 C ATOM 80 CD ARG A 12 15.318 -16.262 5.800 1.00 0.00 C ATOM 81 NE ARG A 12 15.931 -16.308 7.124 1.00 0.00 N ATOM 82 CZ ARG A 12 15.824 -15.332 8.019 1.00 0.00 C ATOM 83 NH1 ARG A 12 15.131 -14.239 7.732 1.00 0.00 N ATOM 84 NH2 ARG A 12 16.411 -15.448 9.203 1.00 0.00 N ATOM 0 H ARG A 12 13.752 -19.218 1.201 1.00 0.00 H new ATOM 0 HA ARG A 12 14.939 -19.690 3.684 1.00 0.00 H new ATOM 0 HB2 ARG A 12 15.021 -16.974 3.139 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.507 -17.125 4.010 1.00 0.00 H new ATOM 0 HG2 ARG A 12 14.745 -18.330 5.846 1.00 0.00 H new ATOM 0 HG3 ARG A 12 16.242 -18.022 4.989 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.895 -15.598 5.157 1.00 0.00 H new ATOM 0 HD3 ARG A 12 14.317 -15.839 5.879 1.00 0.00 H new ATOM 0 HE ARG A 12 16.472 -17.135 7.376 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.679 -14.146 6.823 1.00 0.00 H new ATOM 0 HH12 ARG A 12 15.050 -13.491 8.421 1.00 0.00 H new ATOM 0 HH21 ARG A 12 16.945 -16.287 9.427 1.00 0.00 H new ATOM 0 HH22 ARG A 12 16.328 -14.698 9.889 1.00 0.00 H new ATOM 98 N LEU A 13 12.688 -20.542 4.216 1.00 0.00 N ATOM 99 CA LEU A 13 11.375 -21.091 4.536 1.00 0.00 C ATOM 100 C LEU A 13 11.189 -21.212 6.045 1.00 0.00 C ATOM 101 O LEU A 13 11.970 -21.878 6.726 1.00 0.00 O ATOM 102 CB LEU A 13 11.198 -22.460 3.877 1.00 0.00 C ATOM 103 CG LEU A 13 11.898 -22.652 2.531 1.00 0.00 C ATOM 104 CD1 LEU A 13 11.525 -23.995 1.922 1.00 0.00 C ATOM 105 CD2 LEU A 13 11.546 -21.517 1.580 1.00 0.00 C ATOM 0 H LEU A 13 13.471 -21.071 4.600 1.00 0.00 H new ATOM 0 HA LEU A 13 10.619 -20.408 4.149 1.00 0.00 H new ATOM 0 HB2 LEU A 13 11.562 -23.222 4.566 1.00 0.00 H new ATOM 0 HB3 LEU A 13 10.132 -22.639 3.738 1.00 0.00 H new ATOM 0 HG LEU A 13 12.975 -22.639 2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.032 -24.114 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 13 11.828 -24.797 2.595 1.00 0.00 H new ATOM 0 HD13 LEU A 13 10.447 -24.038 1.769 1.00 0.00 H new ATOM 0 HD21 LEU A 13 12.053 -21.670 0.627 1.00 0.00 H new ATOM 0 HD22 LEU A 13 10.468 -21.499 1.419 1.00 0.00 H new ATOM 0 HD23 LEU A 13 11.864 -20.568 2.012 1.00 0.00 H new ATOM 117 N PHE A 14 10.148 -20.567 6.561 1.00 0.00 N ATOM 118 CA PHE A 14 9.858 -20.604 7.990 1.00 0.00 C ATOM 119 C PHE A 14 8.860 -21.712 8.314 1.00 0.00 C ATOM 120 O PHE A 14 7.733 -21.712 7.819 1.00 0.00 O ATOM 121 CB PHE A 14 9.308 -19.254 8.455 1.00 0.00 C ATOM 122 CG PHE A 14 8.578 -19.324 9.766 1.00 0.00 C ATOM 123 CD1 PHE A 14 9.277 -19.358 10.962 1.00 0.00 C ATOM 124 CD2 PHE A 14 7.194 -19.355 9.802 1.00 0.00 C ATOM 125 CE1 PHE A 14 8.608 -19.423 12.170 1.00 0.00 C ATOM 126 CE2 PHE A 14 6.519 -19.419 11.007 1.00 0.00 C ATOM 127 CZ PHE A 14 7.227 -19.453 12.192 1.00 0.00 C ATOM 0 H PHE A 14 9.491 -20.013 6.011 1.00 0.00 H new ATOM 0 HA PHE A 14 10.788 -20.811 8.519 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.132 -18.546 8.544 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.634 -18.863 7.693 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.357 -19.333 10.950 1.00 0.00 H new ATOM 0 HD2 PHE A 14 6.635 -19.329 8.878 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.164 -19.450 13.095 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.439 -19.442 11.021 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.702 -19.503 13.134 1.00 0.00 H new ATOM 137 N VAL A 15 9.283 -22.655 9.150 1.00 0.00 N ATOM 138 CA VAL A 15 8.427 -23.769 9.541 1.00 0.00 C ATOM 139 C VAL A 15 7.852 -23.556 10.937 1.00 0.00 C ATOM 140 O VAL A 15 8.327 -22.708 11.692 1.00 0.00 O ATOM 141 CB VAL A 15 9.196 -25.104 9.513 1.00 0.00 C ATOM 142 CG1 VAL A 15 8.233 -26.271 9.357 1.00 0.00 C ATOM 143 CG2 VAL A 15 10.228 -25.100 8.396 1.00 0.00 C ATOM 0 H VAL A 15 10.213 -22.670 9.569 1.00 0.00 H new ATOM 0 HA VAL A 15 7.612 -23.812 8.818 1.00 0.00 H new ATOM 0 HB VAL A 15 9.721 -25.222 10.461 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.794 -27.206 9.339 1.00 0.00 H new ATOM 0 HG12 VAL A 15 7.536 -26.282 10.195 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.678 -26.163 8.425 1.00 0.00 H new ATOM 0 HG21 VAL A 15 10.762 -26.050 8.391 1.00 0.00 H new ATOM 0 HG22 VAL A 15 9.727 -24.960 7.438 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.936 -24.287 8.558 1.00 0.00 H new ATOM 153 N ARG A 16 6.825 -24.330 11.272 1.00 0.00 N ATOM 154 CA ARG A 16 6.184 -24.226 12.577 1.00 0.00 C ATOM 155 C ARG A 16 7.031 -24.896 13.655 1.00 0.00 C ATOM 156 O ARG A 16 8.000 -25.599 13.369 1.00 0.00 O ATOM 157 CB ARG A 16 4.793 -24.861 12.538 1.00 0.00 C ATOM 158 CG ARG A 16 4.722 -26.216 13.224 1.00 0.00 C ATOM 159 CD ARG A 16 3.468 -26.978 12.826 1.00 0.00 C ATOM 160 NE ARG A 16 2.506 -27.059 13.921 1.00 0.00 N ATOM 161 CZ ARG A 16 1.644 -26.091 14.215 1.00 0.00 C ATOM 162 NH1 ARG A 16 1.625 -24.975 13.499 1.00 0.00 N ATOM 163 NH2 ARG A 16 0.799 -26.239 15.227 1.00 0.00 N ATOM 0 H ARG A 16 6.419 -25.036 10.658 1.00 0.00 H new ATOM 0 HA ARG A 16 6.086 -23.168 12.822 1.00 0.00 H new ATOM 0 HB2 ARG A 16 4.081 -24.185 13.012 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.483 -24.973 11.499 1.00 0.00 H new ATOM 0 HG2 ARG A 16 5.603 -26.803 12.964 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.738 -26.079 14.305 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.003 -26.489 11.970 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.741 -27.984 12.508 1.00 0.00 H new ATOM 0 HE ARG A 16 2.495 -27.904 14.492 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.273 -24.858 12.720 1.00 0.00 H new ATOM 0 HH12 ARG A 16 0.962 -24.234 13.727 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.811 -27.096 15.780 1.00 0.00 H new ATOM 0 HH22 ARG A 16 0.138 -25.496 15.452 1.00 0.00 H new ATOM 177 N PRO A 17 6.658 -24.675 14.924 1.00 0.00 N ATOM 178 CA PRO A 17 7.370 -25.248 16.070 1.00 0.00 C ATOM 179 C PRO A 17 7.179 -26.758 16.174 1.00 0.00 C ATOM 180 O PRO A 17 6.052 -27.247 16.257 1.00 0.00 O ATOM 181 CB PRO A 17 6.734 -24.545 17.271 1.00 0.00 C ATOM 182 CG PRO A 17 5.375 -24.152 16.804 1.00 0.00 C ATOM 183 CD PRO A 17 5.513 -23.847 15.338 1.00 0.00 C ATOM 0 HA PRO A 17 8.448 -25.102 15.995 1.00 0.00 H new ATOM 0 HB2 PRO A 17 6.680 -25.208 18.135 1.00 0.00 H new ATOM 0 HB3 PRO A 17 7.316 -23.674 17.574 1.00 0.00 H new ATOM 0 HG2 PRO A 17 4.658 -24.956 16.969 1.00 0.00 H new ATOM 0 HG3 PRO A 17 5.011 -23.282 17.351 1.00 0.00 H new ATOM 0 HD2 PRO A 17 4.609 -24.106 14.787 1.00 0.00 H new ATOM 0 HD3 PRO A 17 5.699 -22.787 15.164 1.00 0.00 H new ATOM 191 N PHE A 18 8.287 -27.491 16.171 1.00 0.00 N ATOM 192 CA PHE A 18 8.242 -28.946 16.265 1.00 0.00 C ATOM 193 C PHE A 18 8.377 -29.402 17.714 1.00 0.00 C ATOM 194 O PHE A 18 8.889 -28.682 18.573 1.00 0.00 O ATOM 195 CB PHE A 18 9.353 -29.568 15.417 1.00 0.00 C ATOM 196 CG PHE A 18 9.204 -29.303 13.946 1.00 0.00 C ATOM 197 CD1 PHE A 18 9.587 -28.086 13.405 1.00 0.00 C ATOM 198 CD2 PHE A 18 8.681 -30.270 13.103 1.00 0.00 C ATOM 199 CE1 PHE A 18 9.452 -27.838 12.052 1.00 0.00 C ATOM 200 CE2 PHE A 18 8.544 -30.029 11.749 1.00 0.00 C ATOM 201 CZ PHE A 18 8.929 -28.811 11.223 1.00 0.00 C ATOM 0 H PHE A 18 9.227 -27.102 16.105 1.00 0.00 H new ATOM 0 HA PHE A 18 7.276 -29.279 15.886 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.315 -29.181 15.752 1.00 0.00 H new ATOM 0 HB3 PHE A 18 9.367 -30.645 15.584 1.00 0.00 H new ATOM 0 HD1 PHE A 18 9.996 -27.322 14.049 1.00 0.00 H new ATOM 0 HD2 PHE A 18 8.377 -31.224 13.509 1.00 0.00 H new ATOM 0 HE1 PHE A 18 9.755 -26.885 11.644 1.00 0.00 H new ATOM 0 HE2 PHE A 18 8.136 -30.792 11.103 1.00 0.00 H new ATOM 0 HZ PHE A 18 8.821 -28.620 10.166 1.00 0.00 H new ATOM 211 N PRO A 19 7.907 -30.626 17.996 1.00 0.00 N ATOM 212 CA PRO A 19 7.964 -31.206 19.341 1.00 0.00 C ATOM 213 C PRO A 19 9.388 -31.549 19.764 1.00 0.00 C ATOM 214 O PRO A 19 10.355 -31.060 19.180 1.00 0.00 O ATOM 215 CB PRO A 19 7.122 -32.478 19.214 1.00 0.00 C ATOM 216 CG PRO A 19 7.197 -32.839 17.770 1.00 0.00 C ATOM 217 CD PRO A 19 7.284 -31.538 17.022 1.00 0.00 C ATOM 0 HA PRO A 19 7.602 -30.513 20.100 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.515 -33.277 19.843 1.00 0.00 H new ATOM 0 HB3 PRO A 19 6.092 -32.304 19.526 1.00 0.00 H new ATOM 0 HG2 PRO A 19 8.067 -33.464 17.569 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.319 -33.407 17.464 1.00 0.00 H new ATOM 0 HD2 PRO A 19 7.886 -31.633 16.118 1.00 0.00 H new ATOM 0 HD3 PRO A 19 6.300 -31.185 16.713 1.00 0.00 H new ATOM 225 N LEU A 20 9.510 -32.393 20.783 1.00 0.00 N ATOM 226 CA LEU A 20 10.817 -32.802 21.285 1.00 0.00 C ATOM 227 C LEU A 20 11.685 -33.352 20.158 1.00 0.00 C ATOM 228 O LEU A 20 12.909 -33.416 20.279 1.00 0.00 O ATOM 229 CB LEU A 20 10.657 -33.857 22.382 1.00 0.00 C ATOM 230 CG LEU A 20 9.762 -35.049 22.040 1.00 0.00 C ATOM 231 CD1 LEU A 20 10.585 -36.180 21.443 1.00 0.00 C ATOM 232 CD2 LEU A 20 9.015 -35.527 23.277 1.00 0.00 C ATOM 0 H LEU A 20 8.720 -32.807 21.277 1.00 0.00 H new ATOM 0 HA LEU A 20 11.309 -31.924 21.703 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.646 -34.234 22.643 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.256 -33.370 23.271 1.00 0.00 H new ATOM 0 HG LEU A 20 9.030 -34.729 21.299 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.932 -37.020 21.206 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.074 -35.833 20.533 1.00 0.00 H new ATOM 0 HD13 LEU A 20 11.340 -36.499 22.162 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.383 -36.376 23.015 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.732 -35.830 24.040 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.395 -34.718 23.663 1.00 0.00 H new ATOM 244 N ASP A 21 11.045 -33.745 19.063 1.00 0.00 N ATOM 245 CA ASP A 21 11.759 -34.286 17.912 1.00 0.00 C ATOM 246 C ASP A 21 12.163 -33.173 16.951 1.00 0.00 C ATOM 247 O ASP A 21 12.376 -33.412 15.762 1.00 0.00 O ATOM 248 CB ASP A 21 10.892 -35.315 17.185 1.00 0.00 C ATOM 249 CG ASP A 21 10.885 -36.662 17.881 1.00 0.00 C ATOM 250 OD1 ASP A 21 11.970 -37.265 18.017 1.00 0.00 O ATOM 251 OD2 ASP A 21 9.795 -37.113 18.290 1.00 0.00 O ATOM 0 H ASP A 21 10.033 -33.699 18.948 1.00 0.00 H new ATOM 0 HA ASP A 21 12.664 -34.775 18.274 1.00 0.00 H new ATOM 0 HB2 ASP A 21 9.871 -34.940 17.115 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.257 -35.438 16.165 1.00 0.00 H new ATOM 256 N VAL A 22 12.265 -31.955 17.473 1.00 0.00 N ATOM 257 CA VAL A 22 12.644 -30.804 16.661 1.00 0.00 C ATOM 258 C VAL A 22 14.139 -30.809 16.364 1.00 0.00 C ATOM 259 O VAL A 22 14.938 -30.291 17.143 1.00 0.00 O ATOM 260 CB VAL A 22 12.275 -29.480 17.358 1.00 0.00 C ATOM 261 CG1 VAL A 22 12.827 -29.450 18.775 1.00 0.00 C ATOM 262 CG2 VAL A 22 12.785 -28.295 16.552 1.00 0.00 C ATOM 0 H VAL A 22 12.091 -31.739 18.455 1.00 0.00 H new ATOM 0 HA VAL A 22 12.090 -30.881 15.725 1.00 0.00 H new ATOM 0 HB VAL A 22 11.189 -29.410 17.417 1.00 0.00 H new ATOM 0 HG11 VAL A 22 12.556 -28.508 19.251 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.408 -30.278 19.346 1.00 0.00 H new ATOM 0 HG13 VAL A 22 13.913 -29.542 18.745 1.00 0.00 H new ATOM 0 HG21 VAL A 22 12.516 -27.368 17.058 1.00 0.00 H new ATOM 0 HG22 VAL A 22 13.869 -28.357 16.460 1.00 0.00 H new ATOM 0 HG23 VAL A 22 12.336 -28.310 15.559 1.00 0.00 H new ATOM 272 N GLN A 23 14.509 -31.398 15.231 1.00 0.00 N ATOM 273 CA GLN A 23 15.909 -31.471 14.830 1.00 0.00 C ATOM 274 C GLN A 23 16.044 -31.414 13.312 1.00 0.00 C ATOM 275 O GLN A 23 15.070 -31.605 12.586 1.00 0.00 O ATOM 276 CB GLN A 23 16.548 -32.755 15.363 1.00 0.00 C ATOM 277 CG GLN A 23 15.847 -34.021 14.899 1.00 0.00 C ATOM 278 CD GLN A 23 16.304 -35.252 15.656 1.00 0.00 C ATOM 279 OE1 GLN A 23 16.671 -36.263 15.057 1.00 0.00 O ATOM 280 NE2 GLN A 23 16.284 -35.173 16.982 1.00 0.00 N ATOM 0 H GLN A 23 13.859 -31.831 14.575 1.00 0.00 H new ATOM 0 HA GLN A 23 16.428 -30.612 15.255 1.00 0.00 H new ATOM 0 HB2 GLN A 23 17.591 -32.790 15.047 1.00 0.00 H new ATOM 0 HB3 GLN A 23 16.546 -32.727 16.453 1.00 0.00 H new ATOM 0 HG2 GLN A 23 14.771 -33.902 15.023 1.00 0.00 H new ATOM 0 HG3 GLN A 23 16.032 -34.165 13.834 1.00 0.00 H new ATOM 0 HE21 GLN A 23 15.972 -34.315 17.437 1.00 0.00 H new ATOM 0 HE22 GLN A 23 16.580 -35.970 17.545 1.00 0.00 H new ATOM 289 N GLU A 24 17.259 -31.148 12.841 1.00 0.00 N ATOM 290 CA GLU A 24 17.520 -31.065 11.409 1.00 0.00 C ATOM 291 C GLU A 24 17.289 -32.414 10.734 1.00 0.00 C ATOM 292 O GLU A 24 17.095 -32.488 9.521 1.00 0.00 O ATOM 293 CB GLU A 24 18.955 -30.596 11.156 1.00 0.00 C ATOM 294 CG GLU A 24 20.009 -31.593 11.606 1.00 0.00 C ATOM 295 CD GLU A 24 21.391 -31.258 11.079 1.00 0.00 C ATOM 296 OE1 GLU A 24 21.686 -31.617 9.920 1.00 0.00 O ATOM 297 OE2 GLU A 24 22.177 -30.637 11.824 1.00 0.00 O ATOM 0 H GLU A 24 18.076 -30.987 13.429 1.00 0.00 H new ATOM 0 HA GLU A 24 16.827 -30.341 10.981 1.00 0.00 H new ATOM 0 HB2 GLU A 24 19.082 -30.401 10.091 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.116 -29.651 11.674 1.00 0.00 H new ATOM 0 HG2 GLU A 24 20.036 -31.620 12.695 1.00 0.00 H new ATOM 0 HG3 GLU A 24 19.728 -32.591 11.269 1.00 0.00 H new ATOM 304 N SER A 25 17.311 -33.479 11.529 1.00 0.00 N ATOM 305 CA SER A 25 17.108 -34.826 11.009 1.00 0.00 C ATOM 306 C SER A 25 15.793 -34.919 10.241 1.00 0.00 C ATOM 307 O SER A 25 15.765 -35.352 9.089 1.00 0.00 O ATOM 308 CB SER A 25 17.117 -35.843 12.152 1.00 0.00 C ATOM 309 OG SER A 25 17.404 -37.145 11.673 1.00 0.00 O ATOM 0 H SER A 25 17.467 -33.435 12.536 1.00 0.00 H new ATOM 0 HA SER A 25 17.925 -35.052 10.324 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.860 -35.553 12.895 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.149 -35.841 12.652 1.00 0.00 H new ATOM 0 HG SER A 25 17.406 -37.776 12.423 1.00 0.00 H new ATOM 315 N GLU A 26 14.706 -34.510 10.888 1.00 0.00 N ATOM 316 CA GLU A 26 13.388 -34.548 10.266 1.00 0.00 C ATOM 317 C GLU A 26 13.301 -33.551 9.114 1.00 0.00 C ATOM 318 O GLU A 26 12.669 -33.821 8.091 1.00 0.00 O ATOM 319 CB GLU A 26 12.303 -34.243 11.301 1.00 0.00 C ATOM 320 CG GLU A 26 12.601 -33.023 12.155 1.00 0.00 C ATOM 321 CD GLU A 26 11.344 -32.337 12.653 1.00 0.00 C ATOM 322 OE1 GLU A 26 10.356 -32.284 11.891 1.00 0.00 O ATOM 323 OE2 GLU A 26 11.348 -31.854 13.804 1.00 0.00 O ATOM 0 H GLU A 26 14.712 -34.149 11.842 1.00 0.00 H new ATOM 0 HA GLU A 26 13.231 -35.551 9.869 1.00 0.00 H new ATOM 0 HB2 GLU A 26 11.354 -34.092 10.786 1.00 0.00 H new ATOM 0 HB3 GLU A 26 12.179 -35.109 11.951 1.00 0.00 H new ATOM 0 HG2 GLU A 26 13.210 -33.322 13.009 1.00 0.00 H new ATOM 0 HG3 GLU A 26 13.192 -32.314 11.575 1.00 0.00 H new ATOM 330 N LEU A 27 13.939 -32.399 9.286 1.00 0.00 N ATOM 331 CA LEU A 27 13.935 -31.361 8.262 1.00 0.00 C ATOM 332 C LEU A 27 14.661 -31.832 7.006 1.00 0.00 C ATOM 333 O LEU A 27 14.286 -31.477 5.890 1.00 0.00 O ATOM 334 CB LEU A 27 14.590 -30.086 8.796 1.00 0.00 C ATOM 335 CG LEU A 27 13.968 -29.491 10.059 1.00 0.00 C ATOM 336 CD1 LEU A 27 14.150 -27.981 10.083 1.00 0.00 C ATOM 337 CD2 LEU A 27 12.492 -29.853 10.149 1.00 0.00 C ATOM 0 H LEU A 27 14.466 -32.160 10.126 1.00 0.00 H new ATOM 0 HA LEU A 27 12.898 -31.147 8.001 1.00 0.00 H new ATOM 0 HB2 LEU A 27 15.640 -30.298 8.997 1.00 0.00 H new ATOM 0 HB3 LEU A 27 14.562 -29.331 8.011 1.00 0.00 H new ATOM 0 HG LEU A 27 14.478 -29.912 10.925 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.701 -27.575 10.989 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.213 -27.742 10.067 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.666 -27.542 9.210 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.066 -29.421 11.054 1.00 0.00 H new ATOM 0 HD22 LEU A 27 11.967 -29.460 9.278 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.384 -30.937 10.179 1.00 0.00 H new ATOM 349 N ASN A 28 15.703 -32.635 7.197 1.00 0.00 N ATOM 350 CA ASN A 28 16.481 -33.157 6.080 1.00 0.00 C ATOM 351 C ASN A 28 15.712 -34.249 5.343 1.00 0.00 C ATOM 352 O ASN A 28 15.673 -34.272 4.113 1.00 0.00 O ATOM 353 CB ASN A 28 17.820 -33.707 6.576 1.00 0.00 C ATOM 354 CG ASN A 28 18.927 -32.672 6.522 1.00 0.00 C ATOM 355 OD1 ASN A 28 19.736 -32.660 5.594 1.00 0.00 O ATOM 356 ND2 ASN A 28 18.967 -31.796 7.519 1.00 0.00 N ATOM 0 H ASN A 28 16.028 -32.938 8.115 1.00 0.00 H new ATOM 0 HA ASN A 28 16.667 -32.337 5.386 1.00 0.00 H new ATOM 0 HB2 ASN A 28 17.707 -34.061 7.601 1.00 0.00 H new ATOM 0 HB3 ASN A 28 18.102 -34.568 5.971 1.00 0.00 H new ATOM 0 HD21 ASN A 28 19.689 -31.076 7.536 1.00 0.00 H new ATOM 0 HD22 ASN A 28 18.276 -31.843 8.268 1.00 0.00 H new ATOM 363 N GLU A 29 15.100 -35.151 6.105 1.00 0.00 N ATOM 364 CA GLU A 29 14.331 -36.245 5.523 1.00 0.00 C ATOM 365 C GLU A 29 13.016 -35.737 4.940 1.00 0.00 C ATOM 366 O GLU A 29 12.400 -36.397 4.103 1.00 0.00 O ATOM 367 CB GLU A 29 14.054 -37.319 6.578 1.00 0.00 C ATOM 368 CG GLU A 29 12.911 -36.969 7.516 1.00 0.00 C ATOM 369 CD GLU A 29 12.671 -38.036 8.566 1.00 0.00 C ATOM 370 OE1 GLU A 29 13.538 -38.205 9.449 1.00 0.00 O ATOM 371 OE2 GLU A 29 11.616 -38.703 8.506 1.00 0.00 O ATOM 0 H GLU A 29 15.122 -35.146 7.125 1.00 0.00 H new ATOM 0 HA GLU A 29 14.920 -36.681 4.716 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.826 -38.259 6.076 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.958 -37.482 7.165 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.128 -36.021 8.009 1.00 0.00 H new ATOM 0 HG3 GLU A 29 12.000 -36.825 6.935 1.00 0.00 H new ATOM 378 N ILE A 30 12.592 -34.560 5.390 1.00 0.00 N ATOM 379 CA ILE A 30 11.351 -33.963 4.913 1.00 0.00 C ATOM 380 C ILE A 30 11.606 -33.034 3.730 1.00 0.00 C ATOM 381 O ILE A 30 11.039 -33.213 2.652 1.00 0.00 O ATOM 382 CB ILE A 30 10.641 -33.173 6.028 1.00 0.00 C ATOM 383 CG1 ILE A 30 10.047 -34.131 7.062 1.00 0.00 C ATOM 384 CG2 ILE A 30 9.558 -32.282 5.439 1.00 0.00 C ATOM 385 CD1 ILE A 30 9.732 -33.470 8.387 1.00 0.00 C ATOM 0 H ILE A 30 13.090 -34.002 6.084 1.00 0.00 H new ATOM 0 HA ILE A 30 10.708 -34.784 4.595 1.00 0.00 H new ATOM 0 HB ILE A 30 11.374 -32.539 6.527 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.135 -34.569 6.658 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.746 -34.950 7.231 1.00 0.00 H new ATOM 0 HG21 ILE A 30 9.065 -31.730 6.240 1.00 0.00 H new ATOM 0 HG22 ILE A 30 10.007 -31.579 4.737 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.824 -32.897 4.918 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.314 -34.208 9.072 1.00 0.00 H new ATOM 0 HD12 ILE A 30 10.646 -33.056 8.813 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.009 -32.669 8.231 1.00 0.00 H new ATOM 397 N PHE A 31 12.465 -32.042 3.940 1.00 0.00 N ATOM 398 CA PHE A 31 12.797 -31.085 2.891 1.00 0.00 C ATOM 399 C PHE A 31 13.875 -31.643 1.966 1.00 0.00 C ATOM 400 O PHE A 31 14.279 -30.994 1.002 1.00 0.00 O ATOM 401 CB PHE A 31 13.271 -29.766 3.506 1.00 0.00 C ATOM 402 CG PHE A 31 12.197 -29.037 4.262 1.00 0.00 C ATOM 403 CD1 PHE A 31 11.736 -29.520 5.475 1.00 0.00 C ATOM 404 CD2 PHE A 31 11.648 -27.869 3.758 1.00 0.00 C ATOM 405 CE1 PHE A 31 10.748 -28.852 6.174 1.00 0.00 C ATOM 406 CE2 PHE A 31 10.660 -27.196 4.451 1.00 0.00 C ATOM 407 CZ PHE A 31 10.209 -27.689 5.660 1.00 0.00 C ATOM 0 H PHE A 31 12.943 -31.880 4.826 1.00 0.00 H new ATOM 0 HA PHE A 31 11.897 -30.902 2.303 1.00 0.00 H new ATOM 0 HB2 PHE A 31 14.105 -29.967 4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 31 13.649 -29.120 2.714 1.00 0.00 H new ATOM 0 HD1 PHE A 31 12.154 -30.430 5.880 1.00 0.00 H new ATOM 0 HD2 PHE A 31 11.996 -27.480 2.813 1.00 0.00 H new ATOM 0 HE1 PHE A 31 10.398 -29.239 7.120 1.00 0.00 H new ATOM 0 HE2 PHE A 31 10.241 -26.286 4.048 1.00 0.00 H new ATOM 0 HZ PHE A 31 9.436 -27.166 6.203 1.00 0.00 H new ATOM 417 N GLY A 32 14.336 -32.853 2.267 1.00 0.00 N ATOM 418 CA GLY A 32 15.363 -33.479 1.455 1.00 0.00 C ATOM 419 C GLY A 32 14.976 -33.558 -0.009 1.00 0.00 C ATOM 420 O GLY A 32 15.657 -33.021 -0.882 1.00 0.00 O ATOM 0 H GLY A 32 14.017 -33.411 3.059 1.00 0.00 H new ATOM 0 HA2 GLY A 32 16.292 -32.917 1.552 1.00 0.00 H new ATOM 0 HA3 GLY A 32 15.557 -34.483 1.831 1.00 0.00 H new ATOM 424 N PRO A 33 13.858 -34.242 -0.294 1.00 0.00 N ATOM 425 CA PRO A 33 13.358 -34.407 -1.661 1.00 0.00 C ATOM 426 C PRO A 33 12.824 -33.102 -2.244 1.00 0.00 C ATOM 427 O PRO A 33 11.654 -33.009 -2.615 1.00 0.00 O ATOM 428 CB PRO A 33 12.225 -35.425 -1.505 1.00 0.00 C ATOM 429 CG PRO A 33 11.772 -35.273 -0.094 1.00 0.00 C ATOM 430 CD PRO A 33 12.997 -34.908 0.698 1.00 0.00 C ATOM 0 HA PRO A 33 14.144 -34.725 -2.346 1.00 0.00 H new ATOM 0 HB2 PRO A 33 11.414 -35.225 -2.205 1.00 0.00 H new ATOM 0 HB3 PRO A 33 12.574 -36.439 -1.702 1.00 0.00 H new ATOM 0 HG2 PRO A 33 11.009 -34.499 -0.011 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.330 -36.198 0.276 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.755 -34.246 1.530 1.00 0.00 H new ATOM 0 HD3 PRO A 33 13.479 -35.789 1.122 1.00 0.00 H new ATOM 438 N PHE A 34 13.690 -32.097 -2.322 1.00 0.00 N ATOM 439 CA PHE A 34 13.305 -30.797 -2.859 1.00 0.00 C ATOM 440 C PHE A 34 14.498 -30.103 -3.511 1.00 0.00 C ATOM 441 O PHE A 34 14.377 -29.514 -4.584 1.00 0.00 O ATOM 442 CB PHE A 34 12.730 -29.913 -1.751 1.00 0.00 C ATOM 443 CG PHE A 34 11.303 -30.231 -1.410 1.00 0.00 C ATOM 444 CD1 PHE A 34 10.376 -30.477 -2.411 1.00 0.00 C ATOM 445 CD2 PHE A 34 10.887 -30.285 -0.089 1.00 0.00 C ATOM 446 CE1 PHE A 34 9.061 -30.769 -2.100 1.00 0.00 C ATOM 447 CE2 PHE A 34 9.573 -30.577 0.228 1.00 0.00 C ATOM 448 CZ PHE A 34 8.660 -30.820 -0.779 1.00 0.00 C ATOM 0 H PHE A 34 14.662 -32.158 -2.020 1.00 0.00 H new ATOM 0 HA PHE A 34 12.540 -30.958 -3.619 1.00 0.00 H new ATOM 0 HB2 PHE A 34 13.342 -30.022 -0.856 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.798 -28.869 -2.058 1.00 0.00 H new ATOM 0 HD1 PHE A 34 10.685 -30.440 -3.445 1.00 0.00 H new ATOM 0 HD2 PHE A 34 11.598 -30.097 0.702 1.00 0.00 H new ATOM 0 HE1 PHE A 34 8.348 -30.957 -2.889 1.00 0.00 H new ATOM 0 HE2 PHE A 34 9.261 -30.615 1.261 1.00 0.00 H new ATOM 0 HZ PHE A 34 7.634 -31.050 -0.534 1.00 0.00 H new ATOM 458 N GLY A 35 15.651 -30.178 -2.853 1.00 0.00 N ATOM 459 CA GLY A 35 16.849 -29.553 -3.382 1.00 0.00 C ATOM 460 C GLY A 35 17.947 -29.434 -2.345 1.00 0.00 C ATOM 461 O GLY A 35 17.767 -29.777 -1.176 1.00 0.00 O ATOM 0 H GLY A 35 15.777 -30.660 -1.963 1.00 0.00 H new ATOM 0 HA2 GLY A 35 17.215 -30.134 -4.229 1.00 0.00 H new ATOM 0 HA3 GLY A 35 16.601 -28.561 -3.760 1.00 0.00 H new ATOM 465 N PRO A 36 19.119 -28.939 -2.771 1.00 0.00 N ATOM 466 CA PRO A 36 20.274 -28.766 -1.886 1.00 0.00 C ATOM 467 C PRO A 36 20.062 -27.651 -0.868 1.00 0.00 C ATOM 468 O PRO A 36 20.247 -26.474 -1.176 1.00 0.00 O ATOM 469 CB PRO A 36 21.407 -28.402 -2.849 1.00 0.00 C ATOM 470 CG PRO A 36 20.724 -27.799 -4.028 1.00 0.00 C ATOM 471 CD PRO A 36 19.405 -28.511 -4.151 1.00 0.00 C ATOM 0 HA PRO A 36 20.470 -29.659 -1.293 1.00 0.00 H new ATOM 0 HB2 PRO A 36 22.104 -27.699 -2.393 1.00 0.00 H new ATOM 0 HB3 PRO A 36 21.983 -29.283 -3.133 1.00 0.00 H new ATOM 0 HG2 PRO A 36 20.578 -26.728 -3.889 1.00 0.00 H new ATOM 0 HG3 PRO A 36 21.321 -27.924 -4.931 1.00 0.00 H new ATOM 0 HD2 PRO A 36 18.627 -27.852 -4.537 1.00 0.00 H new ATOM 0 HD3 PRO A 36 19.469 -29.361 -4.830 1.00 0.00 H new ATOM 479 N MET A 37 19.675 -28.029 0.345 1.00 0.00 N ATOM 480 CA MET A 37 19.439 -27.060 1.409 1.00 0.00 C ATOM 481 C MET A 37 20.728 -26.329 1.773 1.00 0.00 C ATOM 482 O MET A 37 21.667 -26.928 2.297 1.00 0.00 O ATOM 483 CB MET A 37 18.867 -27.757 2.645 1.00 0.00 C ATOM 484 CG MET A 37 17.716 -28.699 2.334 1.00 0.00 C ATOM 485 SD MET A 37 18.034 -30.388 2.880 1.00 0.00 S ATOM 486 CE MET A 37 18.220 -31.223 1.306 1.00 0.00 C ATOM 0 H MET A 37 19.518 -29.000 0.616 1.00 0.00 H new ATOM 0 HA MET A 37 18.717 -26.328 1.047 1.00 0.00 H new ATOM 0 HB2 MET A 37 19.662 -28.318 3.136 1.00 0.00 H new ATOM 0 HB3 MET A 37 18.526 -27.001 3.353 1.00 0.00 H new ATOM 0 HG2 MET A 37 16.810 -28.330 2.815 1.00 0.00 H new ATOM 0 HG3 MET A 37 17.530 -28.697 1.260 1.00 0.00 H new ATOM 0 HE1 MET A 37 18.439 -32.277 1.477 1.00 0.00 H new ATOM 0 HE2 MET A 37 17.296 -31.133 0.735 1.00 0.00 H new ATOM 0 HE3 MET A 37 19.038 -30.768 0.747 1.00 0.00 H new ATOM 496 N LYS A 38 20.766 -25.031 1.492 1.00 0.00 N ATOM 497 CA LYS A 38 21.939 -24.217 1.790 1.00 0.00 C ATOM 498 C LYS A 38 22.191 -24.157 3.294 1.00 0.00 C ATOM 499 O LYS A 38 23.336 -24.082 3.737 1.00 0.00 O ATOM 500 CB LYS A 38 21.758 -22.803 1.236 1.00 0.00 C ATOM 501 CG LYS A 38 22.957 -21.900 1.468 1.00 0.00 C ATOM 502 CD LYS A 38 24.081 -22.204 0.493 1.00 0.00 C ATOM 503 CE LYS A 38 25.017 -23.273 1.036 1.00 0.00 C ATOM 504 NZ LYS A 38 26.435 -23.008 0.669 1.00 0.00 N ATOM 0 H LYS A 38 19.998 -24.520 1.058 1.00 0.00 H new ATOM 0 HA LYS A 38 22.803 -24.680 1.312 1.00 0.00 H new ATOM 0 HB2 LYS A 38 21.561 -22.864 0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 38 20.879 -22.351 1.696 1.00 0.00 H new ATOM 0 HG2 LYS A 38 22.655 -20.858 1.363 1.00 0.00 H new ATOM 0 HG3 LYS A 38 23.316 -22.026 2.489 1.00 0.00 H new ATOM 0 HD2 LYS A 38 23.661 -22.535 -0.456 1.00 0.00 H new ATOM 0 HD3 LYS A 38 24.645 -21.293 0.291 1.00 0.00 H new ATOM 0 HE2 LYS A 38 24.925 -23.319 2.121 1.00 0.00 H new ATOM 0 HE3 LYS A 38 24.718 -24.247 0.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 27.040 -23.759 1.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 26.528 -22.990 -0.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 26.729 -22.090 1.059 1.00 0.00 H new ATOM 518 N GLU A 39 21.113 -24.192 4.072 1.00 0.00 N ATOM 519 CA GLU A 39 21.220 -24.142 5.525 1.00 0.00 C ATOM 520 C GLU A 39 19.890 -24.504 6.181 1.00 0.00 C ATOM 521 O GLU A 39 18.843 -24.495 5.533 1.00 0.00 O ATOM 522 CB GLU A 39 21.662 -22.749 5.979 1.00 0.00 C ATOM 523 CG GLU A 39 22.866 -22.765 6.906 1.00 0.00 C ATOM 524 CD GLU A 39 23.644 -21.464 6.874 1.00 0.00 C ATOM 525 OE1 GLU A 39 23.077 -20.445 6.426 1.00 0.00 O ATOM 526 OE2 GLU A 39 24.818 -21.464 7.297 1.00 0.00 O ATOM 0 H GLU A 39 20.157 -24.255 3.721 1.00 0.00 H new ATOM 0 HA GLU A 39 21.969 -24.871 5.834 1.00 0.00 H new ATOM 0 HB2 GLU A 39 21.898 -22.148 5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 39 20.830 -22.260 6.486 1.00 0.00 H new ATOM 0 HG2 GLU A 39 22.532 -22.960 7.925 1.00 0.00 H new ATOM 0 HG3 GLU A 39 23.526 -23.586 6.624 1.00 0.00 H new ATOM 533 N VAL A 40 19.940 -24.822 7.470 1.00 0.00 N ATOM 534 CA VAL A 40 18.741 -25.187 8.215 1.00 0.00 C ATOM 535 C VAL A 40 18.860 -24.785 9.681 1.00 0.00 C ATOM 536 O VAL A 40 19.945 -24.827 10.261 1.00 0.00 O ATOM 537 CB VAL A 40 18.466 -26.700 8.130 1.00 0.00 C ATOM 538 CG1 VAL A 40 17.861 -27.058 6.781 1.00 0.00 C ATOM 539 CG2 VAL A 40 19.743 -27.488 8.377 1.00 0.00 C ATOM 0 H VAL A 40 20.798 -24.834 8.021 1.00 0.00 H new ATOM 0 HA VAL A 40 17.910 -24.648 7.760 1.00 0.00 H new ATOM 0 HB VAL A 40 17.747 -26.965 8.905 1.00 0.00 H new ATOM 0 HG11 VAL A 40 17.674 -28.131 6.739 1.00 0.00 H new ATOM 0 HG12 VAL A 40 16.922 -26.520 6.649 1.00 0.00 H new ATOM 0 HG13 VAL A 40 18.553 -26.780 5.986 1.00 0.00 H new ATOM 0 HG21 VAL A 40 19.530 -28.555 8.313 1.00 0.00 H new ATOM 0 HG22 VAL A 40 20.486 -27.221 7.626 1.00 0.00 H new ATOM 0 HG23 VAL A 40 20.129 -27.254 9.369 1.00 0.00 H new ATOM 549 N LYS A 41 17.738 -24.395 10.275 1.00 0.00 N ATOM 550 CA LYS A 41 17.714 -23.986 11.674 1.00 0.00 C ATOM 551 C LYS A 41 16.497 -24.564 12.390 1.00 0.00 C ATOM 552 O LYS A 41 15.382 -24.521 11.869 1.00 0.00 O ATOM 553 CB LYS A 41 17.705 -22.460 11.781 1.00 0.00 C ATOM 554 CG LYS A 41 18.727 -21.781 10.885 1.00 0.00 C ATOM 555 CD LYS A 41 18.158 -21.501 9.504 1.00 0.00 C ATOM 556 CE LYS A 41 17.969 -20.009 9.271 1.00 0.00 C ATOM 557 NZ LYS A 41 17.226 -19.364 10.389 1.00 0.00 N ATOM 0 H LYS A 41 16.832 -24.353 9.809 1.00 0.00 H new ATOM 0 HA LYS A 41 18.613 -24.372 12.154 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.711 -22.092 11.527 1.00 0.00 H new ATOM 0 HB3 LYS A 41 17.896 -22.176 12.816 1.00 0.00 H new ATOM 0 HG2 LYS A 41 19.050 -20.846 11.343 1.00 0.00 H new ATOM 0 HG3 LYS A 41 19.610 -22.413 10.794 1.00 0.00 H new ATOM 0 HD2 LYS A 41 18.826 -21.907 8.745 1.00 0.00 H new ATOM 0 HD3 LYS A 41 17.202 -22.012 9.393 1.00 0.00 H new ATOM 0 HE2 LYS A 41 18.943 -19.532 9.159 1.00 0.00 H new ATOM 0 HE3 LYS A 41 17.429 -19.853 8.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 16.396 -18.864 10.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 16.915 -20.091 11.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.848 -18.686 10.873 1.00 0.00 H new ATOM 571 N ILE A 42 16.719 -25.102 13.584 1.00 0.00 N ATOM 572 CA ILE A 42 15.639 -25.685 14.371 1.00 0.00 C ATOM 573 C ILE A 42 15.703 -25.220 15.821 1.00 0.00 C ATOM 574 O ILE A 42 16.594 -25.615 16.574 1.00 0.00 O ATOM 575 CB ILE A 42 15.684 -27.224 14.335 1.00 0.00 C ATOM 576 CG1 ILE A 42 17.128 -27.711 14.196 1.00 0.00 C ATOM 577 CG2 ILE A 42 14.830 -27.753 13.192 1.00 0.00 C ATOM 578 CD1 ILE A 42 17.576 -27.873 12.761 1.00 0.00 C ATOM 0 H ILE A 42 17.636 -25.146 14.028 1.00 0.00 H new ATOM 0 HA ILE A 42 14.704 -25.346 13.924 1.00 0.00 H new ATOM 0 HB ILE A 42 15.280 -27.606 15.272 1.00 0.00 H new ATOM 0 HG12 ILE A 42 17.791 -27.005 14.697 1.00 0.00 H new ATOM 0 HG13 ILE A 42 17.232 -28.666 14.710 1.00 0.00 H new ATOM 0 HG21 ILE A 42 14.872 -28.842 13.180 1.00 0.00 H new ATOM 0 HG22 ILE A 42 13.798 -27.431 13.330 1.00 0.00 H new ATOM 0 HG23 ILE A 42 15.207 -27.365 12.246 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.609 -28.221 12.739 1.00 0.00 H new ATOM 0 HD12 ILE A 42 16.937 -28.601 12.260 1.00 0.00 H new ATOM 0 HD13 ILE A 42 17.505 -26.914 12.247 1.00 0.00 H new ATOM 590 N LEU A 43 14.750 -24.379 16.209 1.00 0.00 N ATOM 591 CA LEU A 43 14.695 -23.860 17.572 1.00 0.00 C ATOM 592 C LEU A 43 13.349 -24.169 18.218 1.00 0.00 C ATOM 593 O LEU A 43 12.320 -24.208 17.545 1.00 0.00 O ATOM 594 CB LEU A 43 14.941 -22.350 17.574 1.00 0.00 C ATOM 595 CG LEU A 43 16.154 -21.866 16.778 1.00 0.00 C ATOM 596 CD1 LEU A 43 16.001 -20.398 16.413 1.00 0.00 C ATOM 597 CD2 LEU A 43 17.434 -22.091 17.569 1.00 0.00 C ATOM 0 H LEU A 43 14.005 -24.042 15.599 1.00 0.00 H new ATOM 0 HA LEU A 43 15.477 -24.350 18.153 1.00 0.00 H new ATOM 0 HB2 LEU A 43 14.053 -21.857 17.180 1.00 0.00 H new ATOM 0 HB3 LEU A 43 15.055 -22.022 18.607 1.00 0.00 H new ATOM 0 HG LEU A 43 16.214 -22.444 15.856 1.00 0.00 H new ATOM 0 HD11 LEU A 43 16.873 -20.071 15.847 1.00 0.00 H new ATOM 0 HD12 LEU A 43 15.105 -20.265 15.807 1.00 0.00 H new ATOM 0 HD13 LEU A 43 15.915 -19.804 17.323 1.00 0.00 H new ATOM 0 HD21 LEU A 43 18.287 -21.741 16.988 1.00 0.00 H new ATOM 0 HD22 LEU A 43 17.383 -21.539 18.508 1.00 0.00 H new ATOM 0 HD23 LEU A 43 17.550 -23.154 17.779 1.00 0.00 H new ATOM 609 N ASN A 44 13.364 -24.385 19.530 1.00 0.00 N ATOM 610 CA ASN A 44 12.143 -24.688 20.268 1.00 0.00 C ATOM 611 C ASN A 44 11.156 -23.528 20.187 1.00 0.00 C ATOM 612 O ASN A 44 11.190 -22.612 21.008 1.00 0.00 O ATOM 613 CB ASN A 44 12.471 -24.993 21.731 1.00 0.00 C ATOM 614 CG ASN A 44 11.551 -26.045 22.322 1.00 0.00 C ATOM 615 OD1 ASN A 44 10.917 -25.822 23.354 1.00 0.00 O ATOM 616 ND2 ASN A 44 11.475 -27.199 21.670 1.00 0.00 N ATOM 0 H ASN A 44 14.207 -24.356 20.103 1.00 0.00 H new ATOM 0 HA ASN A 44 11.682 -25.565 19.815 1.00 0.00 H new ATOM 0 HB2 ASN A 44 13.504 -25.334 21.806 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.394 -24.077 22.316 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.873 -27.944 22.021 1.00 0.00 H new ATOM 0 HD22 ASN A 44 12.018 -27.340 20.818 1.00 0.00 H new ATOM 623 N GLY A 45 10.276 -23.576 19.192 1.00 0.00 N ATOM 624 CA GLY A 45 9.290 -22.524 19.022 1.00 0.00 C ATOM 625 C GLY A 45 9.127 -22.111 17.573 1.00 0.00 C ATOM 626 O GLY A 45 8.095 -21.560 17.189 1.00 0.00 O ATOM 0 H GLY A 45 10.228 -24.324 18.500 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.330 -22.864 19.410 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.583 -21.656 19.613 1.00 0.00 H new ATOM 630 N PHE A 46 10.148 -22.376 16.765 1.00 0.00 N ATOM 631 CA PHE A 46 10.115 -22.026 15.350 1.00 0.00 C ATOM 632 C PHE A 46 11.258 -22.699 14.596 1.00 0.00 C ATOM 633 O PHE A 46 12.310 -22.983 15.167 1.00 0.00 O ATOM 634 CB PHE A 46 10.198 -20.508 15.176 1.00 0.00 C ATOM 635 CG PHE A 46 10.821 -19.804 16.348 1.00 0.00 C ATOM 636 CD1 PHE A 46 12.122 -20.087 16.732 1.00 0.00 C ATOM 637 CD2 PHE A 46 10.105 -18.859 17.065 1.00 0.00 C ATOM 638 CE1 PHE A 46 12.698 -19.441 17.809 1.00 0.00 C ATOM 639 CE2 PHE A 46 10.676 -18.209 18.143 1.00 0.00 C ATOM 640 CZ PHE A 46 11.974 -18.501 18.516 1.00 0.00 C ATOM 0 H PHE A 46 11.009 -22.832 17.066 1.00 0.00 H new ATOM 0 HA PHE A 46 9.171 -22.381 14.936 1.00 0.00 H new ATOM 0 HB2 PHE A 46 10.775 -20.284 14.279 1.00 0.00 H new ATOM 0 HB3 PHE A 46 9.195 -20.113 15.016 1.00 0.00 H new ATOM 0 HD1 PHE A 46 12.693 -20.821 16.183 1.00 0.00 H new ATOM 0 HD2 PHE A 46 9.090 -18.628 16.778 1.00 0.00 H new ATOM 0 HE1 PHE A 46 13.713 -19.671 18.098 1.00 0.00 H new ATOM 0 HE2 PHE A 46 10.108 -17.473 18.693 1.00 0.00 H new ATOM 0 HZ PHE A 46 12.422 -17.995 19.359 1.00 0.00 H new ATOM 650 N ALA A 47 11.042 -22.951 13.309 1.00 0.00 N ATOM 651 CA ALA A 47 12.053 -23.589 12.475 1.00 0.00 C ATOM 652 C ALA A 47 12.281 -22.802 11.189 1.00 0.00 C ATOM 653 O ALA A 47 11.397 -22.081 10.726 1.00 0.00 O ATOM 654 CB ALA A 47 11.647 -25.020 12.156 1.00 0.00 C ATOM 0 H ALA A 47 10.176 -22.723 12.821 1.00 0.00 H new ATOM 0 HA ALA A 47 12.990 -23.604 13.031 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.411 -25.485 11.533 1.00 0.00 H new ATOM 0 HB2 ALA A 47 11.543 -25.584 13.083 1.00 0.00 H new ATOM 0 HB3 ALA A 47 10.696 -25.018 11.624 1.00 0.00 H new ATOM 660 N PHE A 48 13.471 -22.945 10.616 1.00 0.00 N ATOM 661 CA PHE A 48 13.815 -22.246 9.384 1.00 0.00 C ATOM 662 C PHE A 48 14.622 -23.148 8.454 1.00 0.00 C ATOM 663 O PHE A 48 15.374 -24.011 8.906 1.00 0.00 O ATOM 664 CB PHE A 48 14.611 -20.977 9.697 1.00 0.00 C ATOM 665 CG PHE A 48 13.889 -20.027 10.610 1.00 0.00 C ATOM 666 CD1 PHE A 48 13.847 -20.254 11.976 1.00 0.00 C ATOM 667 CD2 PHE A 48 13.251 -18.907 10.101 1.00 0.00 C ATOM 668 CE1 PHE A 48 13.183 -19.382 12.818 1.00 0.00 C ATOM 669 CE2 PHE A 48 12.587 -18.031 10.939 1.00 0.00 C ATOM 670 CZ PHE A 48 12.552 -18.269 12.299 1.00 0.00 C ATOM 0 H PHE A 48 14.214 -23.539 10.985 1.00 0.00 H new ATOM 0 HA PHE A 48 12.888 -21.971 8.882 1.00 0.00 H new ATOM 0 HB2 PHE A 48 15.560 -21.256 10.154 1.00 0.00 H new ATOM 0 HB3 PHE A 48 14.845 -20.465 8.764 1.00 0.00 H new ATOM 0 HD1 PHE A 48 14.339 -21.123 12.388 1.00 0.00 H new ATOM 0 HD2 PHE A 48 13.273 -18.717 9.038 1.00 0.00 H new ATOM 0 HE1 PHE A 48 13.158 -19.571 13.881 1.00 0.00 H new ATOM 0 HE2 PHE A 48 12.096 -17.160 10.530 1.00 0.00 H new ATOM 0 HZ PHE A 48 12.032 -17.586 12.955 1.00 0.00 H new ATOM 680 N VAL A 49 14.458 -22.941 7.151 1.00 0.00 N ATOM 681 CA VAL A 49 15.170 -23.734 6.156 1.00 0.00 C ATOM 682 C VAL A 49 15.508 -22.899 4.926 1.00 0.00 C ATOM 683 O VAL A 49 14.617 -22.458 4.201 1.00 0.00 O ATOM 684 CB VAL A 49 14.346 -24.960 5.720 1.00 0.00 C ATOM 685 CG1 VAL A 49 15.089 -25.754 4.657 1.00 0.00 C ATOM 686 CG2 VAL A 49 14.019 -25.836 6.920 1.00 0.00 C ATOM 0 H VAL A 49 13.839 -22.231 6.760 1.00 0.00 H new ATOM 0 HA VAL A 49 16.093 -24.074 6.625 1.00 0.00 H new ATOM 0 HB VAL A 49 13.409 -24.610 5.288 1.00 0.00 H new ATOM 0 HG11 VAL A 49 14.491 -26.616 4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 49 15.266 -25.121 3.788 1.00 0.00 H new ATOM 0 HG13 VAL A 49 16.043 -26.095 5.058 1.00 0.00 H new ATOM 0 HG21 VAL A 49 13.436 -26.698 6.594 1.00 0.00 H new ATOM 0 HG22 VAL A 49 14.944 -26.178 7.384 1.00 0.00 H new ATOM 0 HG23 VAL A 49 13.442 -25.261 7.644 1.00 0.00 H new ATOM 696 N GLU A 50 16.800 -22.687 4.698 1.00 0.00 N ATOM 697 CA GLU A 50 17.255 -21.904 3.555 1.00 0.00 C ATOM 698 C GLU A 50 17.784 -22.812 2.449 1.00 0.00 C ATOM 699 O GLU A 50 18.821 -23.458 2.603 1.00 0.00 O ATOM 700 CB GLU A 50 18.343 -20.918 3.984 1.00 0.00 C ATOM 701 CG GLU A 50 18.990 -20.181 2.823 1.00 0.00 C ATOM 702 CD GLU A 50 19.469 -18.795 3.206 1.00 0.00 C ATOM 703 OE1 GLU A 50 18.817 -18.155 4.057 1.00 0.00 O ATOM 704 OE2 GLU A 50 20.498 -18.350 2.655 1.00 0.00 O ATOM 0 H GLU A 50 17.550 -23.046 5.289 1.00 0.00 H new ATOM 0 HA GLU A 50 16.402 -21.347 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 50 17.911 -20.189 4.670 1.00 0.00 H new ATOM 0 HB3 GLU A 50 19.113 -21.457 4.535 1.00 0.00 H new ATOM 0 HG2 GLU A 50 19.834 -20.763 2.453 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.275 -20.101 2.005 1.00 0.00 H new ATOM 711 N PHE A 51 17.063 -22.857 1.333 1.00 0.00 N ATOM 712 CA PHE A 51 17.458 -23.687 0.201 1.00 0.00 C ATOM 713 C PHE A 51 18.504 -22.978 -0.655 1.00 0.00 C ATOM 714 O PHE A 51 18.519 -21.751 -0.743 1.00 0.00 O ATOM 715 CB PHE A 51 16.238 -24.038 -0.652 1.00 0.00 C ATOM 716 CG PHE A 51 15.563 -25.314 -0.236 1.00 0.00 C ATOM 717 CD1 PHE A 51 16.168 -26.540 -0.465 1.00 0.00 C ATOM 718 CD2 PHE A 51 14.324 -25.288 0.384 1.00 0.00 C ATOM 719 CE1 PHE A 51 15.548 -27.715 -0.084 1.00 0.00 C ATOM 720 CE2 PHE A 51 13.700 -26.460 0.767 1.00 0.00 C ATOM 721 CZ PHE A 51 14.314 -27.675 0.534 1.00 0.00 C ATOM 0 H PHE A 51 16.203 -22.329 1.189 1.00 0.00 H new ATOM 0 HA PHE A 51 17.896 -24.606 0.592 1.00 0.00 H new ATOM 0 HB2 PHE A 51 15.519 -23.221 -0.597 1.00 0.00 H new ATOM 0 HB3 PHE A 51 16.545 -24.122 -1.694 1.00 0.00 H new ATOM 0 HD1 PHE A 51 17.134 -26.577 -0.946 1.00 0.00 H new ATOM 0 HD2 PHE A 51 13.840 -24.340 0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 51 16.029 -28.664 -0.270 1.00 0.00 H new ATOM 0 HE2 PHE A 51 12.734 -26.426 1.248 1.00 0.00 H new ATOM 0 HZ PHE A 51 13.830 -28.592 0.835 1.00 0.00 H new ATOM 731 N GLU A 52 19.376 -23.761 -1.283 1.00 0.00 N ATOM 732 CA GLU A 52 20.426 -23.207 -2.130 1.00 0.00 C ATOM 733 C GLU A 52 19.854 -22.729 -3.462 1.00 0.00 C ATOM 734 O GLU A 52 20.569 -22.159 -4.286 1.00 0.00 O ATOM 735 CB GLU A 52 21.516 -24.252 -2.377 1.00 0.00 C ATOM 736 CG GLU A 52 22.719 -23.709 -3.131 1.00 0.00 C ATOM 737 CD GLU A 52 24.031 -24.013 -2.432 1.00 0.00 C ATOM 738 OE1 GLU A 52 24.210 -25.162 -1.978 1.00 0.00 O ATOM 739 OE2 GLU A 52 24.878 -23.100 -2.341 1.00 0.00 O ATOM 0 H GLU A 52 19.376 -24.779 -1.221 1.00 0.00 H new ATOM 0 HA GLU A 52 20.862 -22.352 -1.613 1.00 0.00 H new ATOM 0 HB2 GLU A 52 21.848 -24.652 -1.419 1.00 0.00 H new ATOM 0 HB3 GLU A 52 21.090 -25.083 -2.939 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.738 -24.136 -4.134 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.614 -22.630 -3.246 1.00 0.00 H new ATOM 746 N GLU A 53 18.562 -22.966 -3.664 1.00 0.00 N ATOM 747 CA GLU A 53 17.895 -22.560 -4.896 1.00 0.00 C ATOM 748 C GLU A 53 16.513 -21.983 -4.602 1.00 0.00 C ATOM 749 O GLU A 53 15.679 -22.632 -3.972 1.00 0.00 O ATOM 750 CB GLU A 53 17.770 -23.750 -5.849 1.00 0.00 C ATOM 751 CG GLU A 53 18.968 -23.923 -6.768 1.00 0.00 C ATOM 752 CD GLU A 53 19.260 -22.679 -7.585 1.00 0.00 C ATOM 753 OE1 GLU A 53 18.534 -22.434 -8.572 1.00 0.00 O ATOM 754 OE2 GLU A 53 20.214 -21.951 -7.238 1.00 0.00 O ATOM 0 H GLU A 53 17.957 -23.437 -2.991 1.00 0.00 H new ATOM 0 HA GLU A 53 18.500 -21.786 -5.369 1.00 0.00 H new ATOM 0 HB2 GLU A 53 17.637 -24.660 -5.264 1.00 0.00 H new ATOM 0 HB3 GLU A 53 16.873 -23.626 -6.455 1.00 0.00 H new ATOM 0 HG2 GLU A 53 19.845 -24.176 -6.172 1.00 0.00 H new ATOM 0 HG3 GLU A 53 18.787 -24.761 -7.441 1.00 0.00 H new ATOM 761 N ALA A 54 16.281 -20.758 -5.062 1.00 0.00 N ATOM 762 CA ALA A 54 15.001 -20.093 -4.850 1.00 0.00 C ATOM 763 C ALA A 54 13.840 -20.995 -5.254 1.00 0.00 C ATOM 764 O ALA A 54 12.842 -21.093 -4.541 1.00 0.00 O ATOM 765 CB ALA A 54 14.951 -18.785 -5.626 1.00 0.00 C ATOM 0 H ALA A 54 16.962 -20.206 -5.584 1.00 0.00 H new ATOM 0 HA ALA A 54 14.904 -19.876 -3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 54 13.990 -18.299 -5.459 1.00 0.00 H new ATOM 0 HB2 ALA A 54 15.753 -18.130 -5.286 1.00 0.00 H new ATOM 0 HB3 ALA A 54 15.074 -18.988 -6.690 1.00 0.00 H new ATOM 771 N GLU A 55 13.978 -21.650 -6.403 1.00 0.00 N ATOM 772 CA GLU A 55 12.938 -22.543 -6.901 1.00 0.00 C ATOM 773 C GLU A 55 12.616 -23.628 -5.878 1.00 0.00 C ATOM 774 O GLU A 55 11.454 -23.851 -5.538 1.00 0.00 O ATOM 775 CB GLU A 55 13.374 -23.183 -8.221 1.00 0.00 C ATOM 776 CG GLU A 55 12.251 -23.900 -8.950 1.00 0.00 C ATOM 777 CD GLU A 55 11.352 -22.950 -9.716 1.00 0.00 C ATOM 778 OE1 GLU A 55 10.864 -21.974 -9.109 1.00 0.00 O ATOM 779 OE2 GLU A 55 11.136 -23.182 -10.924 1.00 0.00 O ATOM 0 H GLU A 55 14.798 -21.579 -7.005 1.00 0.00 H new ATOM 0 HA GLU A 55 12.038 -21.952 -7.072 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.783 -22.410 -8.872 1.00 0.00 H new ATOM 0 HB3 GLU A 55 14.178 -23.892 -8.023 1.00 0.00 H new ATOM 0 HG2 GLU A 55 12.678 -24.627 -9.641 1.00 0.00 H new ATOM 0 HG3 GLU A 55 11.653 -24.458 -8.229 1.00 0.00 H new ATOM 786 N SER A 56 13.654 -24.302 -5.393 1.00 0.00 N ATOM 787 CA SER A 56 13.482 -25.367 -4.412 1.00 0.00 C ATOM 788 C SER A 56 12.731 -24.860 -3.185 1.00 0.00 C ATOM 789 O SER A 56 11.873 -25.553 -2.639 1.00 0.00 O ATOM 790 CB SER A 56 14.843 -25.929 -3.995 1.00 0.00 C ATOM 791 OG SER A 56 14.709 -27.220 -3.427 1.00 0.00 O ATOM 0 H SER A 56 14.622 -24.130 -5.663 1.00 0.00 H new ATOM 0 HA SER A 56 12.894 -26.161 -4.873 1.00 0.00 H new ATOM 0 HB2 SER A 56 15.502 -25.976 -4.862 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.312 -25.258 -3.275 1.00 0.00 H new ATOM 0 HG SER A 56 14.392 -27.847 -4.110 1.00 0.00 H new ATOM 797 N ALA A 57 13.061 -23.646 -2.757 1.00 0.00 N ATOM 798 CA ALA A 57 12.417 -23.044 -1.596 1.00 0.00 C ATOM 799 C ALA A 57 10.955 -22.719 -1.886 1.00 0.00 C ATOM 800 O ALA A 57 10.060 -23.125 -1.146 1.00 0.00 O ATOM 801 CB ALA A 57 13.164 -21.790 -1.169 1.00 0.00 C ATOM 0 H ALA A 57 13.771 -23.060 -3.197 1.00 0.00 H new ATOM 0 HA ALA A 57 12.446 -23.766 -0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 57 12.672 -21.351 -0.301 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.191 -22.048 -0.912 1.00 0.00 H new ATOM 0 HB3 ALA A 57 13.165 -21.071 -1.988 1.00 0.00 H new ATOM 807 N ALA A 58 10.722 -21.982 -2.967 1.00 0.00 N ATOM 808 CA ALA A 58 9.369 -21.603 -3.355 1.00 0.00 C ATOM 809 C ALA A 58 8.468 -22.828 -3.475 1.00 0.00 C ATOM 810 O ALA A 58 7.270 -22.760 -3.200 1.00 0.00 O ATOM 811 CB ALA A 58 9.392 -20.833 -4.667 1.00 0.00 C ATOM 0 H ALA A 58 11.452 -21.636 -3.589 1.00 0.00 H new ATOM 0 HA ALA A 58 8.962 -20.959 -2.575 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.375 -20.556 -4.944 1.00 0.00 H new ATOM 0 HB2 ALA A 58 9.994 -19.932 -4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 58 9.824 -21.458 -5.448 1.00 0.00 H new ATOM 817 N LYS A 59 9.052 -23.947 -3.887 1.00 0.00 N ATOM 818 CA LYS A 59 8.304 -25.189 -4.043 1.00 0.00 C ATOM 819 C LYS A 59 8.020 -25.827 -2.687 1.00 0.00 C ATOM 820 O LYS A 59 6.870 -26.104 -2.349 1.00 0.00 O ATOM 821 CB LYS A 59 9.078 -26.168 -4.928 1.00 0.00 C ATOM 822 CG LYS A 59 8.838 -25.967 -6.414 1.00 0.00 C ATOM 823 CD LYS A 59 7.408 -26.311 -6.798 1.00 0.00 C ATOM 824 CE LYS A 59 7.241 -26.388 -8.308 1.00 0.00 C ATOM 825 NZ LYS A 59 5.833 -26.678 -8.696 1.00 0.00 N ATOM 0 H LYS A 59 10.042 -24.020 -4.119 1.00 0.00 H new ATOM 0 HA LYS A 59 7.353 -24.953 -4.520 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.144 -26.065 -4.724 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.799 -27.187 -4.658 1.00 0.00 H new ATOM 0 HG2 LYS A 59 9.049 -24.931 -6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 59 9.529 -26.590 -6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 59 7.129 -27.265 -6.351 1.00 0.00 H new ATOM 0 HD3 LYS A 59 6.730 -25.559 -6.394 1.00 0.00 H new ATOM 0 HE2 LYS A 59 7.555 -25.445 -8.757 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.895 -27.164 -8.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.761 -26.722 -9.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 5.542 -27.590 -8.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 5.212 -25.925 -8.338 1.00 0.00 H new ATOM 839 N ALA A 60 9.077 -26.057 -1.914 1.00 0.00 N ATOM 840 CA ALA A 60 8.941 -26.659 -0.593 1.00 0.00 C ATOM 841 C ALA A 60 7.906 -25.916 0.245 1.00 0.00 C ATOM 842 O ALA A 60 7.213 -26.516 1.068 1.00 0.00 O ATOM 843 CB ALA A 60 10.285 -26.677 0.119 1.00 0.00 C ATOM 0 H ALA A 60 10.037 -25.836 -2.180 1.00 0.00 H new ATOM 0 HA ALA A 60 8.597 -27.685 -0.722 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.169 -27.129 1.104 1.00 0.00 H new ATOM 0 HB2 ALA A 60 10.998 -27.258 -0.465 1.00 0.00 H new ATOM 0 HB3 ALA A 60 10.652 -25.657 0.229 1.00 0.00 H new ATOM 849 N ILE A 61 7.807 -24.608 0.031 1.00 0.00 N ATOM 850 CA ILE A 61 6.856 -23.784 0.767 1.00 0.00 C ATOM 851 C ILE A 61 5.420 -24.205 0.471 1.00 0.00 C ATOM 852 O ILE A 61 4.577 -24.239 1.367 1.00 0.00 O ATOM 853 CB ILE A 61 7.022 -22.292 0.427 1.00 0.00 C ATOM 854 CG1 ILE A 61 8.381 -21.784 0.912 1.00 0.00 C ATOM 855 CG2 ILE A 61 5.895 -21.478 1.045 1.00 0.00 C ATOM 856 CD1 ILE A 61 8.910 -20.613 0.114 1.00 0.00 C ATOM 0 H ILE A 61 8.373 -24.097 -0.646 1.00 0.00 H new ATOM 0 HA ILE A 61 7.065 -23.932 1.827 1.00 0.00 H new ATOM 0 HB ILE A 61 6.976 -22.175 -0.656 1.00 0.00 H new ATOM 0 HG12 ILE A 61 8.298 -21.492 1.959 1.00 0.00 H new ATOM 0 HG13 ILE A 61 9.102 -22.600 0.865 1.00 0.00 H new ATOM 0 HG21 ILE A 61 6.027 -20.425 0.795 1.00 0.00 H new ATOM 0 HG22 ILE A 61 4.939 -21.826 0.655 1.00 0.00 H new ATOM 0 HG23 ILE A 61 5.911 -21.599 2.128 1.00 0.00 H new ATOM 0 HD11 ILE A 61 9.876 -20.307 0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 61 9.026 -20.906 -0.929 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.209 -19.781 0.181 1.00 0.00 H new ATOM 868 N GLU A 62 5.151 -24.525 -0.790 1.00 0.00 N ATOM 869 CA GLU A 62 3.817 -24.944 -1.204 1.00 0.00 C ATOM 870 C GLU A 62 3.640 -26.449 -1.025 1.00 0.00 C ATOM 871 O GLU A 62 2.518 -26.944 -0.921 1.00 0.00 O ATOM 872 CB GLU A 62 3.566 -24.559 -2.663 1.00 0.00 C ATOM 873 CG GLU A 62 2.647 -25.521 -3.397 1.00 0.00 C ATOM 874 CD GLU A 62 2.111 -24.943 -4.692 1.00 0.00 C ATOM 875 OE1 GLU A 62 2.923 -24.457 -5.507 1.00 0.00 O ATOM 876 OE2 GLU A 62 0.879 -24.975 -4.891 1.00 0.00 O ATOM 0 H GLU A 62 5.839 -24.502 -1.543 1.00 0.00 H new ATOM 0 HA GLU A 62 3.091 -24.432 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.133 -23.559 -2.697 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.521 -24.511 -3.187 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.188 -26.442 -3.612 1.00 0.00 H new ATOM 0 HG3 GLU A 62 1.812 -25.786 -2.749 1.00 0.00 H new ATOM 883 N GLU A 63 4.756 -27.171 -0.993 1.00 0.00 N ATOM 884 CA GLU A 63 4.724 -28.619 -0.829 1.00 0.00 C ATOM 885 C GLU A 63 4.581 -28.997 0.643 1.00 0.00 C ATOM 886 O GLU A 63 3.564 -29.555 1.056 1.00 0.00 O ATOM 887 CB GLU A 63 5.993 -29.248 -1.407 1.00 0.00 C ATOM 888 CG GLU A 63 6.216 -28.929 -2.875 1.00 0.00 C ATOM 889 CD GLU A 63 5.728 -30.033 -3.793 1.00 0.00 C ATOM 890 OE1 GLU A 63 5.884 -31.218 -3.432 1.00 0.00 O ATOM 891 OE2 GLU A 63 5.189 -29.711 -4.873 1.00 0.00 O ATOM 0 H GLU A 63 5.693 -26.777 -1.078 1.00 0.00 H new ATOM 0 HA GLU A 63 3.859 -29.001 -1.370 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.853 -28.902 -0.834 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.941 -30.330 -1.283 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.701 -28.001 -3.123 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.279 -28.760 -3.049 1.00 0.00 H new ATOM 898 N VAL A 64 5.607 -28.689 1.430 1.00 0.00 N ATOM 899 CA VAL A 64 5.597 -28.995 2.855 1.00 0.00 C ATOM 900 C VAL A 64 4.335 -28.459 3.523 1.00 0.00 C ATOM 901 O VAL A 64 3.694 -29.155 4.311 1.00 0.00 O ATOM 902 CB VAL A 64 6.830 -28.406 3.565 1.00 0.00 C ATOM 903 CG1 VAL A 64 6.907 -28.900 5.001 1.00 0.00 C ATOM 904 CG2 VAL A 64 8.100 -28.756 2.804 1.00 0.00 C ATOM 0 H VAL A 64 6.456 -28.227 1.104 1.00 0.00 H new ATOM 0 HA VAL A 64 5.620 -30.081 2.945 1.00 0.00 H new ATOM 0 HB VAL A 64 6.732 -27.321 3.585 1.00 0.00 H new ATOM 0 HG11 VAL A 64 7.785 -28.473 5.486 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.010 -28.594 5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.982 -29.987 5.008 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.962 -28.332 3.320 1.00 0.00 H new ATOM 0 HG22 VAL A 64 8.206 -29.840 2.751 1.00 0.00 H new ATOM 0 HG23 VAL A 64 8.044 -28.348 1.795 1.00 0.00 H new ATOM 914 N HIS A 65 3.984 -27.218 3.202 1.00 0.00 N ATOM 915 CA HIS A 65 2.798 -26.588 3.770 1.00 0.00 C ATOM 916 C HIS A 65 1.575 -27.486 3.608 1.00 0.00 C ATOM 917 O HIS A 65 1.204 -27.851 2.493 1.00 0.00 O ATOM 918 CB HIS A 65 2.544 -25.236 3.104 1.00 0.00 C ATOM 919 CG HIS A 65 1.262 -24.589 3.530 1.00 0.00 C ATOM 920 ND1 HIS A 65 0.919 -24.397 4.852 1.00 0.00 N ATOM 921 CD2 HIS A 65 0.238 -24.088 2.801 1.00 0.00 C ATOM 922 CE1 HIS A 65 -0.262 -23.808 4.917 1.00 0.00 C ATOM 923 NE2 HIS A 65 -0.696 -23.608 3.686 1.00 0.00 N ATOM 0 H HIS A 65 4.504 -26.629 2.552 1.00 0.00 H new ATOM 0 HA HIS A 65 2.974 -26.433 4.834 1.00 0.00 H new ATOM 0 HB2 HIS A 65 3.373 -24.566 3.333 1.00 0.00 H new ATOM 0 HB3 HIS A 65 2.532 -25.370 2.022 1.00 0.00 H new ATOM 0 HD2 HIS A 65 0.168 -24.069 1.723 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -0.784 -23.536 5.823 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -1.581 -23.168 3.433 1.00 0.00 H new ATOM 931 N GLY A 66 0.953 -27.840 4.728 1.00 0.00 N ATOM 932 CA GLY A 66 -0.220 -28.693 4.688 1.00 0.00 C ATOM 933 C GLY A 66 0.113 -30.150 4.937 1.00 0.00 C ATOM 934 O GLY A 66 -0.745 -31.023 4.805 1.00 0.00 O ATOM 0 H GLY A 66 1.241 -27.551 5.663 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.937 -28.355 5.436 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -0.703 -28.595 3.716 1.00 0.00 H new ATOM 938 N LYS A 67 1.365 -30.416 5.297 1.00 0.00 N ATOM 939 CA LYS A 67 1.812 -31.778 5.565 1.00 0.00 C ATOM 940 C LYS A 67 1.475 -32.189 6.995 1.00 0.00 C ATOM 941 O LYS A 67 0.860 -31.428 7.742 1.00 0.00 O ATOM 942 CB LYS A 67 3.319 -31.897 5.331 1.00 0.00 C ATOM 943 CG LYS A 67 3.691 -32.149 3.880 1.00 0.00 C ATOM 944 CD LYS A 67 4.715 -33.264 3.752 1.00 0.00 C ATOM 945 CE LYS A 67 6.066 -32.847 4.312 1.00 0.00 C ATOM 946 NZ LYS A 67 6.831 -34.010 4.841 1.00 0.00 N ATOM 0 H LYS A 67 2.088 -29.706 5.410 1.00 0.00 H new ATOM 0 HA LYS A 67 1.290 -32.447 4.880 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.804 -30.981 5.668 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.710 -32.709 5.944 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.796 -32.409 3.314 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.091 -31.235 3.442 1.00 0.00 H new ATOM 0 HD2 LYS A 67 4.359 -34.149 4.279 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.824 -33.540 2.703 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.647 -32.355 3.531 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.919 -32.117 5.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.256 -33.759 5.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.190 -34.819 4.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.582 -34.266 4.169 1.00 0.00 H new ATOM 960 N SER A 68 1.883 -33.397 7.370 1.00 0.00 N ATOM 961 CA SER A 68 1.622 -33.911 8.710 1.00 0.00 C ATOM 962 C SER A 68 2.914 -34.377 9.374 1.00 0.00 C ATOM 963 O SER A 68 3.850 -34.811 8.701 1.00 0.00 O ATOM 964 CB SER A 68 0.620 -35.065 8.650 1.00 0.00 C ATOM 965 OG SER A 68 1.132 -36.146 7.890 1.00 0.00 O ATOM 0 H SER A 68 2.396 -34.038 6.765 1.00 0.00 H new ATOM 0 HA SER A 68 1.199 -33.103 9.307 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.390 -35.404 9.660 1.00 0.00 H new ATOM 0 HB3 SER A 68 -0.314 -34.717 8.210 1.00 0.00 H new ATOM 0 HG SER A 68 0.473 -36.871 7.868 1.00 0.00 H new ATOM 971 N PHE A 69 2.958 -34.284 10.699 1.00 0.00 N ATOM 972 CA PHE A 69 4.135 -34.695 11.455 1.00 0.00 C ATOM 973 C PHE A 69 3.850 -34.680 12.954 1.00 0.00 C ATOM 974 O PHE A 69 3.249 -33.740 13.474 1.00 0.00 O ATOM 975 CB PHE A 69 5.316 -33.776 11.140 1.00 0.00 C ATOM 976 CG PHE A 69 6.601 -34.206 11.789 1.00 0.00 C ATOM 977 CD1 PHE A 69 7.210 -35.397 11.427 1.00 0.00 C ATOM 978 CD2 PHE A 69 7.198 -33.421 12.762 1.00 0.00 C ATOM 979 CE1 PHE A 69 8.392 -35.796 12.022 1.00 0.00 C ATOM 980 CE2 PHE A 69 8.380 -33.815 13.360 1.00 0.00 C ATOM 981 CZ PHE A 69 8.977 -35.004 12.991 1.00 0.00 C ATOM 0 H PHE A 69 2.192 -33.928 11.271 1.00 0.00 H new ATOM 0 HA PHE A 69 4.388 -35.714 11.161 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.459 -33.738 10.060 1.00 0.00 H new ATOM 0 HB3 PHE A 69 5.075 -32.764 11.465 1.00 0.00 H new ATOM 0 HD1 PHE A 69 6.756 -36.021 10.671 1.00 0.00 H new ATOM 0 HD2 PHE A 69 6.735 -32.491 13.056 1.00 0.00 H new ATOM 0 HE1 PHE A 69 8.858 -36.726 11.730 1.00 0.00 H new ATOM 0 HE2 PHE A 69 8.837 -33.193 14.116 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.900 -35.314 13.459 1.00 0.00 H new ATOM 991 N ALA A 70 4.285 -35.730 13.644 1.00 0.00 N ATOM 992 CA ALA A 70 4.079 -35.838 15.083 1.00 0.00 C ATOM 993 C ALA A 70 2.604 -35.689 15.438 1.00 0.00 C ATOM 994 O ALA A 70 2.257 -35.065 16.440 1.00 0.00 O ATOM 995 CB ALA A 70 4.908 -34.793 15.815 1.00 0.00 C ATOM 0 H ALA A 70 4.782 -36.518 13.229 1.00 0.00 H new ATOM 0 HA ALA A 70 4.404 -36.829 15.398 1.00 0.00 H new ATOM 0 HB1 ALA A 70 4.744 -34.885 16.889 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.964 -34.947 15.594 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.610 -33.797 15.487 1.00 0.00 H new ATOM 1001 N ASN A 71 1.739 -36.266 14.610 1.00 0.00 N ATOM 1002 CA ASN A 71 0.300 -36.197 14.837 1.00 0.00 C ATOM 1003 C ASN A 71 -0.177 -34.748 14.861 1.00 0.00 C ATOM 1004 O ASN A 71 -1.124 -34.408 15.571 1.00 0.00 O ATOM 1005 CB ASN A 71 -0.064 -36.887 16.153 1.00 0.00 C ATOM 1006 CG ASN A 71 -0.199 -38.390 16.000 1.00 0.00 C ATOM 1007 OD1 ASN A 71 -1.289 -38.943 16.138 1.00 0.00 O ATOM 1008 ND2 ASN A 71 0.913 -39.057 15.713 1.00 0.00 N ATOM 0 H ASN A 71 2.010 -36.787 13.776 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.198 -36.712 14.015 1.00 0.00 H new ATOM 0 HB2 ASN A 71 0.700 -36.668 16.899 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.002 -36.477 16.528 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.885 -40.070 15.598 1.00 0.00 H new ATOM 0 HD22 ASN A 71 1.795 -38.556 15.608 1.00 0.00 H new ATOM 1015 N GLN A 72 0.484 -33.900 14.081 1.00 0.00 N ATOM 1016 CA GLN A 72 0.127 -32.487 14.013 1.00 0.00 C ATOM 1017 C GLN A 72 0.360 -31.934 12.611 1.00 0.00 C ATOM 1018 O GLN A 72 1.300 -32.316 11.914 1.00 0.00 O ATOM 1019 CB GLN A 72 0.939 -31.685 15.031 1.00 0.00 C ATOM 1020 CG GLN A 72 0.604 -32.020 16.476 1.00 0.00 C ATOM 1021 CD GLN A 72 1.597 -31.429 17.457 1.00 0.00 C ATOM 1022 OE1 GLN A 72 2.533 -32.100 17.892 1.00 0.00 O ATOM 1023 NE2 GLN A 72 1.397 -30.165 17.812 1.00 0.00 N ATOM 0 H GLN A 72 1.270 -34.166 13.487 1.00 0.00 H new ATOM 0 HA GLN A 72 -0.933 -32.394 14.249 1.00 0.00 H new ATOM 0 HB2 GLN A 72 2.000 -31.867 14.861 1.00 0.00 H new ATOM 0 HB3 GLN A 72 0.767 -30.622 14.864 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -0.395 -31.650 16.709 1.00 0.00 H new ATOM 0 HG3 GLN A 72 0.579 -33.103 16.598 1.00 0.00 H new ATOM 0 HE21 GLN A 72 0.608 -29.646 17.427 1.00 0.00 H new ATOM 0 HE22 GLN A 72 2.032 -29.713 18.470 1.00 0.00 H new ATOM 1032 N PRO A 73 -0.517 -31.012 12.185 1.00 0.00 N ATOM 1033 CA PRO A 73 -0.428 -30.387 10.862 1.00 0.00 C ATOM 1034 C PRO A 73 0.767 -29.447 10.745 1.00 0.00 C ATOM 1035 O PRO A 73 0.940 -28.541 11.561 1.00 0.00 O ATOM 1036 CB PRO A 73 -1.738 -29.602 10.752 1.00 0.00 C ATOM 1037 CG PRO A 73 -2.135 -29.328 12.162 1.00 0.00 C ATOM 1038 CD PRO A 73 -1.662 -30.510 12.962 1.00 0.00 C ATOM 0 HA PRO A 73 -0.289 -31.124 10.071 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.599 -28.677 10.193 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -2.502 -30.178 10.230 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -1.681 -28.405 12.523 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -3.215 -29.206 12.247 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.367 -30.220 13.971 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.442 -31.265 13.062 1.00 0.00 H new ATOM 1046 N LEU A 74 1.589 -29.667 9.725 1.00 0.00 N ATOM 1047 CA LEU A 74 2.768 -28.838 9.500 1.00 0.00 C ATOM 1048 C LEU A 74 2.406 -27.572 8.731 1.00 0.00 C ATOM 1049 O LEU A 74 1.366 -27.509 8.075 1.00 0.00 O ATOM 1050 CB LEU A 74 3.831 -29.627 8.733 1.00 0.00 C ATOM 1051 CG LEU A 74 4.672 -30.600 9.561 1.00 0.00 C ATOM 1052 CD1 LEU A 74 5.699 -31.298 8.684 1.00 0.00 C ATOM 1053 CD2 LEU A 74 5.356 -29.870 10.708 1.00 0.00 C ATOM 0 H LEU A 74 1.461 -30.412 9.041 1.00 0.00 H new ATOM 0 HA LEU A 74 3.168 -28.548 10.472 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.337 -30.189 7.941 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.503 -28.918 8.249 1.00 0.00 H new ATOM 0 HG LEU A 74 4.009 -31.357 9.981 1.00 0.00 H new ATOM 0 HD11 LEU A 74 6.288 -31.986 9.291 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.188 -31.853 7.897 1.00 0.00 H new ATOM 0 HD13 LEU A 74 6.358 -30.556 8.234 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.950 -30.577 11.287 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.006 -29.092 10.308 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.602 -29.417 11.352 1.00 0.00 H new ATOM 1065 N GLU A 75 3.271 -26.566 8.815 1.00 0.00 N ATOM 1066 CA GLU A 75 3.042 -25.302 8.125 1.00 0.00 C ATOM 1067 C GLU A 75 4.364 -24.621 7.784 1.00 0.00 C ATOM 1068 O GLU A 75 5.230 -24.456 8.643 1.00 0.00 O ATOM 1069 CB GLU A 75 2.185 -24.374 8.987 1.00 0.00 C ATOM 1070 CG GLU A 75 2.020 -22.980 8.404 1.00 0.00 C ATOM 1071 CD GLU A 75 0.858 -22.224 9.018 1.00 0.00 C ATOM 1072 OE1 GLU A 75 -0.257 -22.784 9.060 1.00 0.00 O ATOM 1073 OE2 GLU A 75 1.064 -21.073 9.455 1.00 0.00 O ATOM 0 H GLU A 75 4.136 -26.602 9.354 1.00 0.00 H new ATOM 0 HA GLU A 75 2.513 -25.515 7.196 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.200 -24.822 9.119 1.00 0.00 H new ATOM 0 HB3 GLU A 75 2.634 -24.294 9.977 1.00 0.00 H new ATOM 0 HG2 GLU A 75 2.939 -22.414 8.559 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.870 -23.056 7.327 1.00 0.00 H new ATOM 1080 N VAL A 76 4.512 -24.227 6.523 1.00 0.00 N ATOM 1081 CA VAL A 76 5.727 -23.564 6.066 1.00 0.00 C ATOM 1082 C VAL A 76 5.400 -22.366 5.182 1.00 0.00 C ATOM 1083 O VAL A 76 4.466 -22.408 4.381 1.00 0.00 O ATOM 1084 CB VAL A 76 6.636 -24.531 5.286 1.00 0.00 C ATOM 1085 CG1 VAL A 76 8.034 -23.950 5.139 1.00 0.00 C ATOM 1086 CG2 VAL A 76 6.683 -25.888 5.972 1.00 0.00 C ATOM 0 H VAL A 76 3.805 -24.356 5.799 1.00 0.00 H new ATOM 0 HA VAL A 76 6.254 -23.222 6.957 1.00 0.00 H new ATOM 0 HB VAL A 76 6.219 -24.668 4.288 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.662 -24.648 4.585 1.00 0.00 H new ATOM 0 HG12 VAL A 76 7.980 -23.004 4.600 1.00 0.00 H new ATOM 0 HG13 VAL A 76 8.463 -23.781 6.126 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.330 -26.559 5.407 1.00 0.00 H new ATOM 0 HG22 VAL A 76 7.075 -25.771 6.982 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.678 -26.307 6.019 1.00 0.00 H new ATOM 1096 N VAL A 77 6.176 -21.297 5.331 1.00 0.00 N ATOM 1097 CA VAL A 77 5.971 -20.087 4.545 1.00 0.00 C ATOM 1098 C VAL A 77 7.300 -19.438 4.176 1.00 0.00 C ATOM 1099 O VAL A 77 8.357 -19.846 4.660 1.00 0.00 O ATOM 1100 CB VAL A 77 5.106 -19.063 5.305 1.00 0.00 C ATOM 1101 CG1 VAL A 77 3.772 -19.679 5.698 1.00 0.00 C ATOM 1102 CG2 VAL A 77 5.846 -18.547 6.529 1.00 0.00 C ATOM 0 H VAL A 77 6.953 -21.245 5.990 1.00 0.00 H new ATOM 0 HA VAL A 77 5.451 -20.386 3.635 1.00 0.00 H new ATOM 0 HB VAL A 77 4.908 -18.218 4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.174 -18.941 6.234 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.239 -19.996 4.801 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.945 -20.542 6.341 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.221 -17.825 7.054 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.075 -19.380 7.194 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.773 -18.066 6.218 1.00 0.00 H new ATOM 1112 N TYR A 78 7.241 -18.426 3.318 1.00 0.00 N ATOM 1113 CA TYR A 78 8.441 -17.722 2.882 1.00 0.00 C ATOM 1114 C TYR A 78 9.010 -16.866 4.010 1.00 0.00 C ATOM 1115 O TYR A 78 8.508 -15.778 4.293 1.00 0.00 O ATOM 1116 CB TYR A 78 8.130 -16.845 1.669 1.00 0.00 C ATOM 1117 CG TYR A 78 8.775 -17.330 0.390 1.00 0.00 C ATOM 1118 CD1 TYR A 78 10.153 -17.487 0.300 1.00 0.00 C ATOM 1119 CD2 TYR A 78 8.007 -17.632 -0.728 1.00 0.00 C ATOM 1120 CE1 TYR A 78 10.746 -17.929 -0.867 1.00 0.00 C ATOM 1121 CE2 TYR A 78 8.592 -18.076 -1.898 1.00 0.00 C ATOM 1122 CZ TYR A 78 9.962 -18.222 -1.963 1.00 0.00 C ATOM 1123 OH TYR A 78 10.549 -18.664 -3.126 1.00 0.00 O ATOM 0 H TYR A 78 6.375 -18.075 2.910 1.00 0.00 H new ATOM 0 HA TYR A 78 9.187 -18.466 2.603 1.00 0.00 H new ATOM 0 HB2 TYR A 78 7.050 -16.804 1.528 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.464 -15.827 1.872 1.00 0.00 H new ATOM 0 HD1 TYR A 78 10.770 -17.260 1.156 1.00 0.00 H new ATOM 0 HD2 TYR A 78 6.934 -17.518 -0.681 1.00 0.00 H new ATOM 0 HE1 TYR A 78 11.818 -18.044 -0.921 1.00 0.00 H new ATOM 0 HE2 TYR A 78 7.980 -18.308 -2.757 1.00 0.00 H new ATOM 0 HH TYR A 78 11.369 -19.156 -2.912 1.00 0.00 H new ATOM 1133 N SER A 79 10.061 -17.367 4.651 1.00 0.00 N ATOM 1134 CA SER A 79 10.698 -16.651 5.751 1.00 0.00 C ATOM 1135 C SER A 79 11.268 -15.319 5.274 1.00 0.00 C ATOM 1136 O SER A 79 12.212 -15.282 4.483 1.00 0.00 O ATOM 1137 CB SER A 79 11.808 -17.504 6.367 1.00 0.00 C ATOM 1138 OG SER A 79 11.962 -17.221 7.747 1.00 0.00 O ATOM 0 H SER A 79 10.490 -18.265 4.428 1.00 0.00 H new ATOM 0 HA SER A 79 9.941 -16.451 6.509 1.00 0.00 H new ATOM 0 HB2 SER A 79 11.576 -18.561 6.233 1.00 0.00 H new ATOM 0 HB3 SER A 79 12.747 -17.315 5.847 1.00 0.00 H new ATOM 0 HG SER A 79 12.908 -17.055 7.943 1.00 0.00 H new ATOM 1144 N LYS A 80 10.689 -14.226 5.760 1.00 0.00 N ATOM 1145 CA LYS A 80 11.139 -12.891 5.386 1.00 0.00 C ATOM 1146 C LYS A 80 12.495 -12.578 6.012 1.00 0.00 C ATOM 1147 O LYS A 80 12.697 -12.778 7.210 1.00 0.00 O ATOM 1148 CB LYS A 80 10.111 -11.844 5.820 1.00 0.00 C ATOM 1149 CG LYS A 80 8.698 -12.149 5.355 1.00 0.00 C ATOM 1150 CD LYS A 80 7.801 -12.542 6.516 1.00 0.00 C ATOM 1151 CE LYS A 80 6.970 -11.364 7.002 1.00 0.00 C ATOM 1152 NZ LYS A 80 7.747 -10.474 7.909 1.00 0.00 N ATOM 0 H LYS A 80 9.907 -14.239 6.414 1.00 0.00 H new ATOM 0 HA LYS A 80 11.244 -12.861 4.301 1.00 0.00 H new ATOM 0 HB2 LYS A 80 10.118 -11.769 6.907 1.00 0.00 H new ATOM 0 HB3 LYS A 80 10.410 -10.871 5.431 1.00 0.00 H new ATOM 0 HG2 LYS A 80 8.283 -11.275 4.853 1.00 0.00 H new ATOM 0 HG3 LYS A 80 8.721 -12.956 4.623 1.00 0.00 H new ATOM 0 HD2 LYS A 80 7.140 -13.353 6.208 1.00 0.00 H new ATOM 0 HD3 LYS A 80 8.411 -12.921 7.336 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.617 -10.790 6.145 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.087 -11.733 7.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.146 -9.684 8.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 8.062 -11.015 8.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 8.576 -10.101 7.403 1.00 0.00 H new