USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 994 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 119 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 121 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 73 HIS : no HE2:sc= -3.43! C(o=-3.8!,f=-16!) USER MOD Set 2.2: A 85 SER OG : rot -106:sc= -0.347 USER MOD Set 3.1: A 55 LYS NZ :NH3+ -167:sc= 1.22 (180deg=1.03) USER MOD Set 3.2: A 82 TYR OH : rot 172:sc= -4.98! USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 148:sc= -2.37! USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -1.11 K(o=-1.1,f=-6.6!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 160:sc=-0.00231 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -131:sc= -1.78! (180deg=-4.47!) USER MOD Single : A 29 ASN : amide:sc= -0.0762 K(o=-0.076,f=-2.2!) USER MOD Single : A 33 LYS NZ :NH3+ -152:sc= -0.11 (180deg=-0.859) USER MOD Single : A 37 GLN : amide:sc= -0.205 X(o=-0.2,f=-0.5) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 54:sc= -3.51! USER MOD Single : A 56 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.000755) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS :FLIP no HD1:sc= -1.78 F(o=-3.6!,f=-1.8) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.317 X(o=-0.32,f=0) USER MOD Single : A 80 HIS : no HE2:sc= -3.17! C(o=-3.2!,f=-3.8!) USER MOD Single : A 81 THR OG1 : rot 44:sc= 0.419 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 112:sc= 0.194 USER MOD Single : A 93 SER OG : rot 180:sc= -0.237 USER MOD Single : A 95 ASN : amide:sc= -0.0333 K(o=-0.033,f=-1.5!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 0:sc= -0.0997 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ -104:sc= -1.58 (180deg=-4.17!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.095 X(o=-0.095,f=-0.24) USER MOD Single : A 113 THR OG1 : rot 124:sc= -0.291 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -162:sc= 0.0313 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 HIS : no HD1:sc= 0.416 K(o=0.42,f=-3.7!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -2 K(o=-2,f=-2.7!) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 130:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -8.099 -1.047 17.413 1.00 0.00 N ATOM 9 CA VAL A 3 -6.957 -1.510 16.575 1.00 0.00 C ATOM 10 C VAL A 3 -6.026 -0.332 16.284 1.00 0.00 C ATOM 11 O VAL A 3 -6.464 0.744 15.930 1.00 0.00 O ATOM 12 CB VAL A 3 -7.489 -2.077 15.257 1.00 0.00 C ATOM 13 CG1 VAL A 3 -6.318 -2.376 14.321 1.00 0.00 C ATOM 14 CG2 VAL A 3 -8.264 -3.366 15.532 1.00 0.00 C ATOM 0 HA VAL A 3 -6.406 -2.285 17.108 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.151 -1.348 14.789 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -6.697 -2.780 13.382 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.766 -1.457 14.124 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -5.655 -3.104 14.788 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -8.643 -3.770 14.593 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -7.603 -4.095 16.000 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.099 -3.153 16.199 1.00 0.00 H new ATOM 24 N TYR A 4 -4.745 -0.527 16.429 1.00 0.00 N ATOM 25 CA TYR A 4 -3.786 0.581 16.160 1.00 0.00 C ATOM 26 C TYR A 4 -2.952 0.242 14.923 1.00 0.00 C ATOM 27 O TYR A 4 -2.490 -0.869 14.761 1.00 0.00 O ATOM 28 CB TYR A 4 -2.862 0.762 17.367 1.00 0.00 C ATOM 29 CG TYR A 4 -3.688 1.080 18.589 1.00 0.00 C ATOM 30 CD1 TYR A 4 -4.128 2.389 18.816 1.00 0.00 C ATOM 31 CD2 TYR A 4 -4.014 0.065 19.498 1.00 0.00 C ATOM 32 CE1 TYR A 4 -4.894 2.684 19.950 1.00 0.00 C ATOM 33 CE2 TYR A 4 -4.779 0.361 20.632 1.00 0.00 C ATOM 34 CZ TYR A 4 -5.219 1.670 20.858 1.00 0.00 C ATOM 35 OH TYR A 4 -5.974 1.961 21.976 1.00 0.00 O ATOM 0 H TYR A 4 -4.320 -1.407 16.722 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.337 1.505 15.985 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -2.281 -0.145 17.533 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.150 1.565 17.177 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -3.876 3.172 18.116 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.675 -0.946 19.324 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -5.234 3.694 20.124 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -5.030 -0.421 21.333 1.00 0.00 H new ATOM 0 HH TYR A 4 -6.110 1.144 22.501 1.00 0.00 H new ATOM 45 N THR A 5 -2.755 1.191 14.049 1.00 0.00 N ATOM 46 CA THR A 5 -1.952 0.921 12.824 1.00 0.00 C ATOM 47 C THR A 5 -0.503 1.352 13.058 1.00 0.00 C ATOM 48 O THR A 5 -0.239 2.402 13.611 1.00 0.00 O ATOM 49 CB THR A 5 -2.533 1.709 11.648 1.00 0.00 C ATOM 50 OG1 THR A 5 -3.912 1.393 11.506 1.00 0.00 O ATOM 51 CG2 THR A 5 -1.789 1.339 10.365 1.00 0.00 C ATOM 0 H THR A 5 -3.116 2.142 14.131 1.00 0.00 H new ATOM 0 HA THR A 5 -1.983 -0.145 12.598 1.00 0.00 H new ATOM 0 HB THR A 5 -2.420 2.777 11.834 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.394 2.176 11.167 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.204 1.901 9.529 1.00 0.00 H new ATOM 0 HG22 THR A 5 -0.732 1.580 10.475 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.900 0.271 10.175 1.00 0.00 H new ATOM 59 N TYR A 6 0.439 0.550 12.641 1.00 0.00 N ATOM 60 CA TYR A 6 1.870 0.915 12.839 1.00 0.00 C ATOM 61 C TYR A 6 2.561 1.019 11.478 1.00 0.00 C ATOM 62 O TYR A 6 2.394 0.176 10.621 1.00 0.00 O ATOM 63 CB TYR A 6 2.559 -0.161 13.681 1.00 0.00 C ATOM 64 CG TYR A 6 1.929 -0.209 15.053 1.00 0.00 C ATOM 65 CD1 TYR A 6 2.313 0.716 16.031 1.00 0.00 C ATOM 66 CD2 TYR A 6 0.963 -1.178 15.347 1.00 0.00 C ATOM 67 CE1 TYR A 6 1.730 0.672 17.303 1.00 0.00 C ATOM 68 CE2 TYR A 6 0.379 -1.222 16.619 1.00 0.00 C ATOM 69 CZ TYR A 6 0.763 -0.297 17.596 1.00 0.00 C ATOM 70 OH TYR A 6 0.188 -0.340 18.850 1.00 0.00 O ATOM 0 H TYR A 6 0.279 -0.342 12.172 1.00 0.00 H new ATOM 0 HA TYR A 6 1.934 1.874 13.353 1.00 0.00 H new ATOM 0 HB2 TYR A 6 2.469 -1.132 13.194 1.00 0.00 H new ATOM 0 HB3 TYR A 6 3.624 0.055 13.766 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.059 1.463 15.804 1.00 0.00 H new ATOM 0 HD2 TYR A 6 0.668 -1.892 14.593 1.00 0.00 H new ATOM 0 HE1 TYR A 6 2.026 1.385 18.058 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -0.367 -1.969 16.846 1.00 0.00 H new ATOM 0 HH TYR A 6 -0.464 -1.071 18.886 1.00 0.00 H new ATOM 80 N GLU A 7 3.336 2.049 11.273 1.00 0.00 N ATOM 81 CA GLU A 7 4.034 2.207 9.967 1.00 0.00 C ATOM 82 C GLU A 7 5.534 1.970 10.159 1.00 0.00 C ATOM 83 O GLU A 7 6.129 2.432 11.112 1.00 0.00 O ATOM 84 CB GLU A 7 3.806 3.622 9.434 1.00 0.00 C ATOM 85 CG GLU A 7 4.478 3.769 8.068 1.00 0.00 C ATOM 86 CD GLU A 7 4.337 5.214 7.583 1.00 0.00 C ATOM 87 OE1 GLU A 7 3.830 6.025 8.340 1.00 0.00 O ATOM 88 OE2 GLU A 7 4.739 5.484 6.463 1.00 0.00 O ATOM 0 H GLU A 7 3.515 2.787 11.954 1.00 0.00 H new ATOM 0 HA GLU A 7 3.639 1.483 9.254 1.00 0.00 H new ATOM 0 HB2 GLU A 7 2.738 3.822 9.349 1.00 0.00 H new ATOM 0 HB3 GLU A 7 4.213 4.354 10.131 1.00 0.00 H new ATOM 0 HG2 GLU A 7 5.532 3.499 8.138 1.00 0.00 H new ATOM 0 HG3 GLU A 7 4.021 3.087 7.351 1.00 0.00 H new ATOM 95 N ASN A 8 6.150 1.254 9.258 1.00 0.00 N ATOM 96 CA ASN A 8 7.611 0.988 9.388 1.00 0.00 C ATOM 97 C ASN A 8 8.359 1.688 8.251 1.00 0.00 C ATOM 98 O ASN A 8 7.836 1.866 7.169 1.00 0.00 O ATOM 99 CB ASN A 8 7.864 -0.519 9.314 1.00 0.00 C ATOM 100 CG ASN A 8 9.259 -0.830 9.858 1.00 0.00 C ATOM 101 OD1 ASN A 8 10.010 0.067 10.186 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.641 -2.073 9.968 1.00 0.00 N ATOM 0 H ASN A 8 5.705 0.842 8.438 1.00 0.00 H new ATOM 0 HA ASN A 8 7.966 1.369 10.346 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.110 -1.054 9.891 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.779 -0.862 8.283 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.570 -2.291 10.329 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.011 -2.826 9.693 1.00 0.00 H new ATOM 109 N GLU A 9 9.578 2.088 8.486 1.00 0.00 N ATOM 110 CA GLU A 9 10.355 2.778 7.418 1.00 0.00 C ATOM 111 C GLU A 9 11.760 2.177 7.337 1.00 0.00 C ATOM 112 O GLU A 9 12.418 1.974 8.338 1.00 0.00 O ATOM 113 CB GLU A 9 10.460 4.270 7.746 1.00 0.00 C ATOM 114 CG GLU A 9 9.057 4.879 7.805 1.00 0.00 C ATOM 115 CD GLU A 9 9.164 6.384 8.054 1.00 0.00 C ATOM 116 OE1 GLU A 9 10.257 6.840 8.349 1.00 0.00 O ATOM 117 OE2 GLU A 9 8.151 7.056 7.944 1.00 0.00 O ATOM 0 H GLU A 9 10.070 1.967 9.371 1.00 0.00 H new ATOM 0 HA GLU A 9 9.848 2.649 6.462 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.969 4.409 8.700 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.057 4.779 6.989 1.00 0.00 H new ATOM 0 HG2 GLU A 9 8.528 4.691 6.871 1.00 0.00 H new ATOM 0 HG3 GLU A 9 8.478 4.408 8.600 1.00 0.00 H new ATOM 124 N PHE A 10 12.226 1.893 6.151 1.00 0.00 N ATOM 125 CA PHE A 10 13.590 1.307 6.007 1.00 0.00 C ATOM 126 C PHE A 10 14.074 1.487 4.566 1.00 0.00 C ATOM 127 O PHE A 10 13.367 1.195 3.623 1.00 0.00 O ATOM 128 CB PHE A 10 13.543 -0.185 6.345 1.00 0.00 C ATOM 129 CG PHE A 10 14.907 -0.794 6.118 1.00 0.00 C ATOM 130 CD1 PHE A 10 15.844 -0.818 7.158 1.00 0.00 C ATOM 131 CD2 PHE A 10 15.234 -1.333 4.868 1.00 0.00 C ATOM 132 CE1 PHE A 10 17.109 -1.383 6.947 1.00 0.00 C ATOM 133 CE2 PHE A 10 16.498 -1.897 4.658 1.00 0.00 C ATOM 134 CZ PHE A 10 17.435 -1.922 5.697 1.00 0.00 C ATOM 0 H PHE A 10 11.722 2.041 5.277 1.00 0.00 H new ATOM 0 HA PHE A 10 14.275 1.813 6.687 1.00 0.00 H new ATOM 0 HB2 PHE A 10 13.238 -0.325 7.382 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.801 -0.687 5.724 1.00 0.00 H new ATOM 0 HD1 PHE A 10 15.592 -0.401 8.122 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.511 -1.314 4.066 1.00 0.00 H new ATOM 0 HE1 PHE A 10 17.832 -1.403 7.749 1.00 0.00 H new ATOM 0 HE2 PHE A 10 16.750 -2.313 3.694 1.00 0.00 H new ATOM 0 HZ PHE A 10 18.410 -2.357 5.534 1.00 0.00 H new ATOM 144 N THR A 11 15.275 1.966 4.391 1.00 0.00 N ATOM 145 CA THR A 11 15.804 2.163 3.012 1.00 0.00 C ATOM 146 C THR A 11 16.693 0.978 2.632 1.00 0.00 C ATOM 147 O THR A 11 17.212 0.282 3.481 1.00 0.00 O ATOM 148 CB THR A 11 16.627 3.454 2.960 1.00 0.00 C ATOM 149 OG1 THR A 11 17.887 3.235 3.580 1.00 0.00 O ATOM 150 CG2 THR A 11 15.880 4.566 3.698 1.00 0.00 C ATOM 0 H THR A 11 15.912 2.229 5.143 1.00 0.00 H new ATOM 0 HA THR A 11 14.972 2.233 2.311 1.00 0.00 H new ATOM 0 HB THR A 11 16.779 3.748 1.921 1.00 0.00 H new ATOM 0 HG1 THR A 11 18.416 4.059 3.546 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.466 5.485 3.661 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.913 4.733 3.223 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.728 4.274 4.737 1.00 0.00 H new ATOM 158 N SER A 12 16.873 0.740 1.361 1.00 0.00 N ATOM 159 CA SER A 12 17.728 -0.401 0.929 1.00 0.00 C ATOM 160 C SER A 12 18.233 -0.153 -0.494 1.00 0.00 C ATOM 161 O SER A 12 17.887 0.827 -1.124 1.00 0.00 O ATOM 162 CB SER A 12 16.910 -1.694 0.963 1.00 0.00 C ATOM 163 OG SER A 12 15.924 -1.657 -0.057 1.00 0.00 O ATOM 0 H SER A 12 16.464 1.287 0.603 1.00 0.00 H new ATOM 0 HA SER A 12 18.579 -0.492 1.604 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.564 -2.554 0.820 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.436 -1.812 1.938 1.00 0.00 H new ATOM 0 HG SER A 12 15.622 -2.568 -0.254 1.00 0.00 H new ATOM 169 N ASP A 13 19.049 -1.034 -1.005 1.00 0.00 N ATOM 170 CA ASP A 13 19.577 -0.850 -2.387 1.00 0.00 C ATOM 171 C ASP A 13 18.528 -1.315 -3.402 1.00 0.00 C ATOM 172 O ASP A 13 17.424 -1.672 -3.047 1.00 0.00 O ATOM 173 CB ASP A 13 20.853 -1.676 -2.561 1.00 0.00 C ATOM 174 CG ASP A 13 21.732 -1.036 -3.638 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.330 -0.016 -4.172 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.791 -1.578 -3.910 1.00 0.00 O ATOM 0 H ASP A 13 19.373 -1.874 -0.525 1.00 0.00 H new ATOM 0 HA ASP A 13 19.800 0.204 -2.551 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.396 -1.729 -1.617 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.602 -2.699 -2.842 1.00 0.00 H new ATOM 181 N ILE A 14 18.868 -1.310 -4.663 1.00 0.00 N ATOM 182 CA ILE A 14 17.892 -1.749 -5.699 1.00 0.00 C ATOM 183 C ILE A 14 16.700 -0.789 -5.713 1.00 0.00 C ATOM 184 O ILE A 14 16.209 -0.382 -4.679 1.00 0.00 O ATOM 185 CB ILE A 14 17.406 -3.163 -5.375 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.587 -4.007 -4.885 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.811 -3.800 -6.632 1.00 0.00 C ATOM 188 CD1 ILE A 14 18.347 -4.424 -3.434 1.00 0.00 C ATOM 0 H ILE A 14 19.779 -1.021 -5.019 1.00 0.00 H new ATOM 0 HA ILE A 14 18.373 -1.746 -6.677 1.00 0.00 H new ATOM 0 HB ILE A 14 16.644 -3.116 -4.597 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.703 -4.890 -5.514 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.513 -3.437 -4.962 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.465 -4.807 -6.400 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.971 -3.199 -6.982 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.572 -3.848 -7.411 1.00 0.00 H new ATOM 0 HD11 ILE A 14 19.187 -5.025 -3.084 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.252 -3.535 -2.811 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.430 -5.010 -3.371 1.00 0.00 H new ATOM 200 N PRO A 15 16.233 -0.418 -6.914 1.00 0.00 N ATOM 201 CA PRO A 15 15.100 0.501 -7.073 1.00 0.00 C ATOM 202 C PRO A 15 13.772 -0.142 -6.655 1.00 0.00 C ATOM 203 O PRO A 15 13.569 -1.331 -6.799 1.00 0.00 O ATOM 204 CB PRO A 15 15.093 0.808 -8.570 1.00 0.00 C ATOM 205 CG PRO A 15 15.759 -0.367 -9.202 1.00 0.00 C ATOM 206 CD PRO A 15 16.774 -0.866 -8.210 1.00 0.00 C ATOM 0 HA PRO A 15 15.203 1.386 -6.446 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.077 0.935 -8.943 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.630 1.731 -8.787 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.032 -1.144 -9.438 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.239 -0.084 -10.139 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.876 -1.951 -8.250 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.762 -0.446 -8.400 1.00 0.00 H new ATOM 214 N ALA A 16 12.873 0.648 -6.132 1.00 0.00 N ATOM 215 CA ALA A 16 11.551 0.116 -5.688 1.00 0.00 C ATOM 216 C ALA A 16 11.034 -0.960 -6.655 1.00 0.00 C ATOM 217 O ALA A 16 10.653 -2.035 -6.236 1.00 0.00 O ATOM 218 CB ALA A 16 10.542 1.264 -5.630 1.00 0.00 C ATOM 0 H ALA A 16 12.999 1.650 -5.992 1.00 0.00 H new ATOM 0 HA ALA A 16 11.673 -0.335 -4.703 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.574 0.882 -5.306 1.00 0.00 H new ATOM 0 HB2 ALA A 16 10.889 2.018 -4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.443 1.712 -6.619 1.00 0.00 H new ATOM 224 N PRO A 17 10.995 -0.665 -7.967 1.00 0.00 N ATOM 225 CA PRO A 17 10.493 -1.616 -8.974 1.00 0.00 C ATOM 226 C PRO A 17 11.344 -2.889 -9.069 1.00 0.00 C ATOM 227 O PRO A 17 10.828 -3.988 -9.023 1.00 0.00 O ATOM 228 CB PRO A 17 10.566 -0.824 -10.281 1.00 0.00 C ATOM 229 CG PRO A 17 11.606 0.211 -10.025 1.00 0.00 C ATOM 230 CD PRO A 17 11.433 0.601 -8.586 1.00 0.00 C ATOM 0 HA PRO A 17 9.492 -1.970 -8.727 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.840 -1.464 -11.120 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.605 -0.371 -10.526 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.606 -0.183 -10.208 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.476 1.070 -10.683 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.362 0.967 -8.149 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.691 1.391 -8.465 1.00 0.00 H new ATOM 238 N LYS A 18 12.634 -2.760 -9.203 1.00 0.00 N ATOM 239 CA LYS A 18 13.488 -3.979 -9.303 1.00 0.00 C ATOM 240 C LYS A 18 13.299 -4.842 -8.053 1.00 0.00 C ATOM 241 O LYS A 18 13.285 -6.054 -8.121 1.00 0.00 O ATOM 242 CB LYS A 18 14.957 -3.572 -9.427 1.00 0.00 C ATOM 243 CG LYS A 18 15.211 -3.010 -10.828 1.00 0.00 C ATOM 244 CD LYS A 18 16.701 -2.710 -10.998 1.00 0.00 C ATOM 245 CE LYS A 18 16.916 -1.900 -12.278 1.00 0.00 C ATOM 246 NZ LYS A 18 17.114 -2.828 -13.427 1.00 0.00 N ATOM 0 H LYS A 18 13.132 -1.871 -9.248 1.00 0.00 H new ATOM 0 HA LYS A 18 13.197 -4.550 -10.185 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.204 -2.825 -8.673 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.601 -4.433 -9.246 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.885 -3.726 -11.583 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.627 -2.102 -10.978 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.071 -2.154 -10.137 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.267 -3.640 -11.044 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.056 -1.255 -12.462 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.784 -1.250 -12.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.260 -2.277 -14.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.947 -3.425 -13.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 16.273 -3.430 -13.536 1.00 0.00 H new ATOM 260 N LEU A 19 13.154 -4.228 -6.911 1.00 0.00 N ATOM 261 CA LEU A 19 12.968 -5.018 -5.660 1.00 0.00 C ATOM 262 C LEU A 19 11.507 -5.462 -5.540 1.00 0.00 C ATOM 263 O LEU A 19 11.208 -6.491 -4.968 1.00 0.00 O ATOM 264 CB LEU A 19 13.335 -4.152 -4.453 1.00 0.00 C ATOM 265 CG LEU A 19 13.261 -4.997 -3.178 1.00 0.00 C ATOM 266 CD1 LEU A 19 14.127 -6.248 -3.343 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.773 -4.176 -1.992 1.00 0.00 C ATOM 0 H LEU A 19 13.156 -3.215 -6.789 1.00 0.00 H new ATOM 0 HA LEU A 19 13.611 -5.897 -5.691 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.339 -3.746 -4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.654 -3.304 -4.380 1.00 0.00 H new ATOM 0 HG LEU A 19 12.227 -5.292 -2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 19 14.074 -6.849 -2.435 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.764 -6.833 -4.188 1.00 0.00 H new ATOM 0 HD13 LEU A 19 15.161 -5.954 -3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.721 -4.777 -1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.807 -3.881 -2.173 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.157 -3.285 -1.873 1.00 0.00 H new ATOM 279 N PHE A 20 10.594 -4.693 -6.068 1.00 0.00 N ATOM 280 CA PHE A 20 9.155 -5.072 -5.977 1.00 0.00 C ATOM 281 C PHE A 20 8.907 -6.359 -6.770 1.00 0.00 C ATOM 282 O PHE A 20 8.067 -7.162 -6.417 1.00 0.00 O ATOM 283 CB PHE A 20 8.292 -3.947 -6.554 1.00 0.00 C ATOM 284 CG PHE A 20 6.837 -4.342 -6.483 1.00 0.00 C ATOM 285 CD1 PHE A 20 6.081 -4.027 -5.347 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.242 -5.023 -7.553 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.731 -4.392 -5.282 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.892 -5.388 -7.486 1.00 0.00 C ATOM 289 CZ PHE A 20 4.136 -5.072 -6.351 1.00 0.00 C ATOM 0 H PHE A 20 10.782 -3.819 -6.558 1.00 0.00 H new ATOM 0 HA PHE A 20 8.893 -5.235 -4.932 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.457 -3.025 -5.996 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.576 -3.750 -7.588 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.539 -3.503 -4.521 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.825 -5.266 -8.429 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.148 -4.149 -4.406 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.434 -5.914 -8.311 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.094 -5.353 -6.300 1.00 0.00 H new ATOM 299 N LYS A 21 9.627 -6.557 -7.839 1.00 0.00 N ATOM 300 CA LYS A 21 9.425 -7.790 -8.653 1.00 0.00 C ATOM 301 C LYS A 21 9.797 -9.021 -7.822 1.00 0.00 C ATOM 302 O LYS A 21 9.047 -9.973 -7.737 1.00 0.00 O ATOM 303 CB LYS A 21 10.311 -7.728 -9.898 1.00 0.00 C ATOM 304 CG LYS A 21 9.787 -6.645 -10.843 1.00 0.00 C ATOM 305 CD LYS A 21 10.647 -6.613 -12.108 1.00 0.00 C ATOM 306 CE LYS A 21 10.265 -7.784 -13.014 1.00 0.00 C ATOM 307 NZ LYS A 21 10.981 -9.013 -12.569 1.00 0.00 N ATOM 0 H LYS A 21 10.345 -5.920 -8.184 1.00 0.00 H new ATOM 0 HA LYS A 21 8.379 -7.859 -8.953 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.341 -7.511 -9.614 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.316 -8.694 -10.402 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.747 -6.845 -11.102 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.811 -5.674 -10.349 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.503 -5.670 -12.635 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.703 -6.673 -11.844 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.188 -7.946 -12.981 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.522 -7.556 -14.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.431 -9.469 -13.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.709 -8.757 -11.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.303 -9.672 -12.135 1.00 0.00 H new ATOM 321 N ALA A 22 10.951 -9.012 -7.213 1.00 0.00 N ATOM 322 CA ALA A 22 11.369 -10.185 -6.393 1.00 0.00 C ATOM 323 C ALA A 22 10.681 -10.131 -5.028 1.00 0.00 C ATOM 324 O ALA A 22 10.629 -11.108 -4.309 1.00 0.00 O ATOM 325 CB ALA A 22 12.886 -10.158 -6.201 1.00 0.00 C ATOM 0 H ALA A 22 11.622 -8.244 -7.247 1.00 0.00 H new ATOM 0 HA ALA A 22 11.083 -11.104 -6.905 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.192 -11.015 -5.602 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.377 -10.201 -7.173 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.172 -9.238 -5.691 1.00 0.00 H new ATOM 331 N PHE A 23 10.152 -8.994 -4.664 1.00 0.00 N ATOM 332 CA PHE A 23 9.470 -8.880 -3.343 1.00 0.00 C ATOM 333 C PHE A 23 8.010 -9.320 -3.483 1.00 0.00 C ATOM 334 O PHE A 23 7.324 -9.545 -2.505 1.00 0.00 O ATOM 335 CB PHE A 23 9.521 -7.429 -2.865 1.00 0.00 C ATOM 336 CG PHE A 23 8.876 -7.325 -1.504 1.00 0.00 C ATOM 337 CD1 PHE A 23 7.489 -7.170 -1.397 1.00 0.00 C ATOM 338 CD2 PHE A 23 9.665 -7.384 -0.349 1.00 0.00 C ATOM 339 CE1 PHE A 23 6.891 -7.074 -0.135 1.00 0.00 C ATOM 340 CE2 PHE A 23 9.067 -7.288 0.914 1.00 0.00 C ATOM 341 CZ PHE A 23 7.680 -7.133 1.021 1.00 0.00 C ATOM 0 H PHE A 23 10.163 -8.141 -5.223 1.00 0.00 H new ATOM 0 HA PHE A 23 9.975 -9.519 -2.618 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.555 -7.087 -2.816 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.004 -6.783 -3.575 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.880 -7.124 -2.288 1.00 0.00 H new ATOM 0 HD2 PHE A 23 10.735 -7.504 -0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.821 -6.954 -0.053 1.00 0.00 H new ATOM 0 HE2 PHE A 23 9.676 -7.334 1.805 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.218 -7.059 1.995 1.00 0.00 H new ATOM 351 N VAL A 24 7.531 -9.446 -4.690 1.00 0.00 N ATOM 352 CA VAL A 24 6.117 -9.871 -4.888 1.00 0.00 C ATOM 353 C VAL A 24 6.080 -11.121 -5.769 1.00 0.00 C ATOM 354 O VAL A 24 5.578 -12.155 -5.377 1.00 0.00 O ATOM 355 CB VAL A 24 5.336 -8.744 -5.567 1.00 0.00 C ATOM 356 CG1 VAL A 24 3.901 -9.206 -5.830 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.316 -7.515 -4.655 1.00 0.00 C ATOM 0 H VAL A 24 8.057 -9.273 -5.547 1.00 0.00 H new ATOM 0 HA VAL A 24 5.665 -10.094 -3.921 1.00 0.00 H new ATOM 0 HB VAL A 24 5.815 -8.488 -6.512 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.343 -8.404 -6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.914 -10.082 -6.479 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.422 -9.462 -4.885 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.760 -6.712 -5.139 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.836 -7.771 -3.710 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.338 -7.186 -4.466 1.00 0.00 H new ATOM 367 N LEU A 25 6.609 -11.035 -6.959 1.00 0.00 N ATOM 368 CA LEU A 25 6.605 -12.218 -7.864 1.00 0.00 C ATOM 369 C LEU A 25 7.482 -13.320 -7.265 1.00 0.00 C ATOM 370 O LEU A 25 7.150 -14.489 -7.318 1.00 0.00 O ATOM 371 CB LEU A 25 7.156 -11.816 -9.234 1.00 0.00 C ATOM 372 CG LEU A 25 6.111 -10.980 -9.977 1.00 0.00 C ATOM 373 CD1 LEU A 25 6.102 -9.557 -9.416 1.00 0.00 C ATOM 374 CD2 LEU A 25 6.456 -10.939 -11.467 1.00 0.00 C ATOM 0 H LEU A 25 7.044 -10.196 -7.343 1.00 0.00 H new ATOM 0 HA LEU A 25 5.585 -12.585 -7.977 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.077 -11.245 -9.115 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.405 -12.705 -9.813 1.00 0.00 H new ATOM 0 HG LEU A 25 5.126 -11.428 -9.844 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.358 -8.962 -9.945 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.856 -9.586 -8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.086 -9.108 -9.548 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.712 -10.344 -11.996 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.441 -10.491 -11.600 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.461 -11.953 -11.867 1.00 0.00 H new ATOM 386 N ASP A 26 8.598 -12.958 -6.695 1.00 0.00 N ATOM 387 CA ASP A 26 9.494 -13.985 -6.092 1.00 0.00 C ATOM 388 C ASP A 26 9.249 -14.053 -4.584 1.00 0.00 C ATOM 389 O ASP A 26 10.009 -14.648 -3.848 1.00 0.00 O ATOM 390 CB ASP A 26 10.952 -13.603 -6.354 1.00 0.00 C ATOM 391 CG ASP A 26 11.176 -13.436 -7.859 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.347 -13.911 -8.617 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.171 -12.834 -8.226 1.00 0.00 O ATOM 0 H ASP A 26 8.928 -11.996 -6.621 1.00 0.00 H new ATOM 0 HA ASP A 26 9.286 -14.957 -6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.195 -12.676 -5.835 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.617 -14.372 -5.960 1.00 0.00 H new ATOM 398 N ALA A 27 8.191 -13.447 -4.118 1.00 0.00 N ATOM 399 CA ALA A 27 7.898 -13.476 -2.657 1.00 0.00 C ATOM 400 C ALA A 27 7.486 -14.891 -2.244 1.00 0.00 C ATOM 401 O ALA A 27 7.874 -15.382 -1.203 1.00 0.00 O ATOM 402 CB ALA A 27 6.759 -12.503 -2.346 1.00 0.00 C ATOM 0 H ALA A 27 7.517 -12.933 -4.686 1.00 0.00 H new ATOM 0 HA ALA A 27 8.790 -13.182 -2.103 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.544 -12.524 -1.278 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.052 -11.494 -2.638 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.868 -12.797 -2.901 1.00 0.00 H new ATOM 408 N ASP A 28 6.700 -15.550 -3.051 1.00 0.00 N ATOM 409 CA ASP A 28 6.262 -16.931 -2.701 1.00 0.00 C ATOM 410 C ASP A 28 7.479 -17.856 -2.640 1.00 0.00 C ATOM 411 O ASP A 28 7.541 -18.762 -1.833 1.00 0.00 O ATOM 412 CB ASP A 28 5.289 -17.441 -3.767 1.00 0.00 C ATOM 413 CG ASP A 28 4.013 -16.597 -3.740 1.00 0.00 C ATOM 414 OD1 ASP A 28 3.801 -15.910 -2.754 1.00 0.00 O ATOM 415 OD2 ASP A 28 3.269 -16.652 -4.705 1.00 0.00 O ATOM 0 H ASP A 28 6.342 -15.192 -3.937 1.00 0.00 H new ATOM 0 HA ASP A 28 5.768 -16.919 -1.730 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.752 -17.388 -4.752 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.049 -18.488 -3.584 1.00 0.00 H new ATOM 420 N ASN A 29 8.449 -17.636 -3.487 1.00 0.00 N ATOM 421 CA ASN A 29 9.659 -18.505 -3.475 1.00 0.00 C ATOM 422 C ASN A 29 10.736 -17.869 -2.595 1.00 0.00 C ATOM 423 O ASN A 29 11.499 -18.551 -1.940 1.00 0.00 O ATOM 424 CB ASN A 29 10.191 -18.658 -4.900 1.00 0.00 C ATOM 425 CG ASN A 29 11.085 -19.897 -4.980 1.00 0.00 C ATOM 426 OD1 ASN A 29 11.293 -20.575 -3.993 1.00 0.00 O ATOM 427 ND2 ASN A 29 11.627 -20.224 -6.122 1.00 0.00 N ATOM 0 H ASN A 29 8.455 -16.893 -4.185 1.00 0.00 H new ATOM 0 HA ASN A 29 9.397 -19.485 -3.077 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.362 -18.749 -5.601 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.755 -17.770 -5.186 1.00 0.00 H new ATOM 0 HD21 ASN A 29 12.225 -21.048 -6.185 1.00 0.00 H new ATOM 0 HD22 ASN A 29 11.453 -19.655 -6.951 1.00 0.00 H new ATOM 434 N LEU A 30 10.805 -16.566 -2.573 1.00 0.00 N ATOM 435 CA LEU A 30 11.834 -15.891 -1.735 1.00 0.00 C ATOM 436 C LEU A 30 11.448 -16.010 -0.260 1.00 0.00 C ATOM 437 O LEU A 30 12.268 -16.317 0.583 1.00 0.00 O ATOM 438 CB LEU A 30 11.917 -14.413 -2.122 1.00 0.00 C ATOM 439 CG LEU A 30 13.110 -13.767 -1.412 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.410 -14.373 -1.945 1.00 0.00 C ATOM 441 CD2 LEU A 30 13.105 -12.260 -1.675 1.00 0.00 C ATOM 0 H LEU A 30 10.194 -15.941 -3.099 1.00 0.00 H new ATOM 0 HA LEU A 30 12.802 -16.364 -1.897 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.026 -14.314 -3.202 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.995 -13.901 -1.846 1.00 0.00 H new ATOM 0 HG LEU A 30 13.037 -13.949 -0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.260 -13.913 -1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.414 -15.447 -1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.484 -14.191 -3.017 1.00 0.00 H new ATOM 0 HD21 LEU A 30 13.954 -11.800 -1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 30 13.178 -12.078 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU A 30 12.179 -11.828 -1.296 1.00 0.00 H new ATOM 453 N ILE A 31 10.206 -15.772 0.061 1.00 0.00 N ATOM 454 CA ILE A 31 9.771 -15.872 1.482 1.00 0.00 C ATOM 455 C ILE A 31 10.336 -17.156 2.100 1.00 0.00 C ATOM 456 O ILE A 31 11.018 -17.117 3.105 1.00 0.00 O ATOM 457 CB ILE A 31 8.239 -15.886 1.548 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.709 -14.468 1.320 1.00 0.00 C ATOM 459 CG2 ILE A 31 7.784 -16.380 2.923 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.267 -14.536 0.814 1.00 0.00 C ATOM 0 H ILE A 31 9.474 -15.513 -0.600 1.00 0.00 H new ATOM 0 HA ILE A 31 10.144 -15.014 2.041 1.00 0.00 H new ATOM 0 HB ILE A 31 7.852 -16.553 0.778 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.753 -13.898 2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.335 -13.947 0.596 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.695 -16.388 2.965 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.161 -17.389 3.090 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.172 -15.715 3.695 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.890 -13.526 0.652 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.236 -15.090 -0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.645 -15.041 1.553 1.00 0.00 H new ATOM 472 N PRO A 32 10.050 -18.317 1.487 1.00 0.00 N ATOM 473 CA PRO A 32 10.536 -19.613 1.983 1.00 0.00 C ATOM 474 C PRO A 32 12.052 -19.756 1.811 1.00 0.00 C ATOM 475 O PRO A 32 12.703 -20.481 2.537 1.00 0.00 O ATOM 476 CB PRO A 32 9.815 -20.629 1.098 1.00 0.00 C ATOM 477 CG PRO A 32 9.503 -19.881 -0.153 1.00 0.00 C ATOM 478 CD PRO A 32 9.233 -18.464 0.268 1.00 0.00 C ATOM 0 HA PRO A 32 10.342 -19.741 3.048 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.444 -21.496 0.896 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.908 -20.998 1.576 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.337 -19.928 -0.854 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.637 -20.310 -0.658 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.527 -17.751 -0.503 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.175 -18.298 0.469 1.00 0.00 H new ATOM 486 N LYS A 33 12.617 -19.072 0.855 1.00 0.00 N ATOM 487 CA LYS A 33 14.088 -19.170 0.637 1.00 0.00 C ATOM 488 C LYS A 33 14.825 -18.455 1.771 1.00 0.00 C ATOM 489 O LYS A 33 15.850 -18.907 2.241 1.00 0.00 O ATOM 490 CB LYS A 33 14.450 -18.515 -0.697 1.00 0.00 C ATOM 491 CG LYS A 33 15.810 -19.033 -1.169 1.00 0.00 C ATOM 492 CD LYS A 33 15.897 -18.913 -2.692 1.00 0.00 C ATOM 493 CE LYS A 33 17.338 -19.164 -3.142 1.00 0.00 C ATOM 494 NZ LYS A 33 18.222 -18.095 -2.594 1.00 0.00 N ATOM 0 H LYS A 33 12.124 -18.449 0.215 1.00 0.00 H new ATOM 0 HA LYS A 33 14.381 -20.220 0.620 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.686 -18.737 -1.442 1.00 0.00 H new ATOM 0 HB3 LYS A 33 14.481 -17.431 -0.585 1.00 0.00 H new ATOM 0 HG2 LYS A 33 16.612 -18.461 -0.701 1.00 0.00 H new ATOM 0 HG3 LYS A 33 15.941 -20.072 -0.867 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.227 -19.632 -3.163 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.573 -17.921 -3.008 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.674 -20.142 -2.796 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.394 -19.175 -4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 19.038 -17.961 -3.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.688 -17.205 -2.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.557 -18.372 -1.649 1.00 0.00 H new ATOM 508 N ILE A 34 14.311 -17.340 2.215 1.00 0.00 N ATOM 509 CA ILE A 34 14.983 -16.597 3.317 1.00 0.00 C ATOM 510 C ILE A 34 14.969 -17.445 4.590 1.00 0.00 C ATOM 511 O ILE A 34 15.794 -17.279 5.466 1.00 0.00 O ATOM 512 CB ILE A 34 14.242 -15.281 3.569 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.167 -14.481 2.267 1.00 0.00 C ATOM 514 CG2 ILE A 34 14.995 -14.469 4.625 1.00 0.00 C ATOM 515 CD1 ILE A 34 13.333 -13.218 2.491 1.00 0.00 C ATOM 0 H ILE A 34 13.455 -16.912 1.862 1.00 0.00 H new ATOM 0 HA ILE A 34 16.015 -16.385 3.036 1.00 0.00 H new ATOM 0 HB ILE A 34 13.233 -15.492 3.923 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.170 -14.213 1.934 1.00 0.00 H new ATOM 0 HG13 ILE A 34 13.722 -15.089 1.479 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.469 -13.531 4.806 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.049 -15.040 5.552 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.003 -14.257 4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 34 13.280 -12.648 1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.327 -13.497 2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 34 13.798 -12.608 3.266 1.00 0.00 H new ATOM 527 N ALA A 35 14.039 -18.353 4.701 1.00 0.00 N ATOM 528 CA ALA A 35 13.974 -19.210 5.919 1.00 0.00 C ATOM 529 C ALA A 35 13.185 -20.484 5.606 1.00 0.00 C ATOM 530 O ALA A 35 12.060 -20.648 6.033 1.00 0.00 O ATOM 531 CB ALA A 35 13.280 -18.443 7.046 1.00 0.00 C ATOM 0 H ALA A 35 13.321 -18.539 4.001 1.00 0.00 H new ATOM 0 HA ALA A 35 14.984 -19.476 6.230 1.00 0.00 H new ATOM 0 HB1 ALA A 35 13.232 -19.069 7.937 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.843 -17.537 7.269 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.270 -18.176 6.736 1.00 0.00 H new ATOM 537 N PRO A 36 13.795 -21.402 4.841 1.00 0.00 N ATOM 538 CA PRO A 36 13.156 -22.668 4.461 1.00 0.00 C ATOM 539 C PRO A 36 13.012 -23.616 5.656 1.00 0.00 C ATOM 540 O PRO A 36 12.093 -24.407 5.726 1.00 0.00 O ATOM 541 CB PRO A 36 14.122 -23.262 3.437 1.00 0.00 C ATOM 542 CG PRO A 36 15.443 -22.657 3.771 1.00 0.00 C ATOM 543 CD PRO A 36 15.154 -21.276 4.286 1.00 0.00 C ATOM 0 HA PRO A 36 12.146 -22.517 4.079 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.155 -24.349 3.507 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.820 -23.017 2.419 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.964 -23.251 4.522 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.086 -22.618 2.892 1.00 0.00 H new ATOM 0 HD2 PRO A 36 15.873 -20.971 5.046 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.197 -20.532 3.490 1.00 0.00 H new ATOM 551 N GLN A 37 13.914 -23.542 6.597 1.00 0.00 N ATOM 552 CA GLN A 37 13.826 -24.439 7.784 1.00 0.00 C ATOM 553 C GLN A 37 12.701 -23.960 8.703 1.00 0.00 C ATOM 554 O GLN A 37 12.185 -24.707 9.510 1.00 0.00 O ATOM 555 CB GLN A 37 15.153 -24.410 8.545 1.00 0.00 C ATOM 556 CG GLN A 37 16.279 -24.883 7.623 1.00 0.00 C ATOM 557 CD GLN A 37 16.027 -26.334 7.212 1.00 0.00 C ATOM 558 OE1 GLN A 37 15.724 -27.169 8.041 1.00 0.00 O ATOM 559 NE2 GLN A 37 16.140 -26.672 5.956 1.00 0.00 N ATOM 0 H GLN A 37 14.707 -22.900 6.595 1.00 0.00 H new ATOM 0 HA GLN A 37 13.618 -25.457 7.455 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.359 -23.400 8.900 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.095 -25.051 9.424 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.331 -24.247 6.739 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.239 -24.800 8.132 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.394 -25.971 5.260 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.974 -27.637 5.671 1.00 0.00 H new ATOM 568 N ALA A 38 12.315 -22.718 8.586 1.00 0.00 N ATOM 569 CA ALA A 38 11.223 -22.193 9.453 1.00 0.00 C ATOM 570 C ALA A 38 9.884 -22.770 8.988 1.00 0.00 C ATOM 571 O ALA A 38 9.053 -23.155 9.786 1.00 0.00 O ATOM 572 CB ALA A 38 11.182 -20.667 9.355 1.00 0.00 C ATOM 0 H ALA A 38 12.709 -22.045 7.928 1.00 0.00 H new ATOM 0 HA ALA A 38 11.407 -22.485 10.487 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.383 -20.283 9.989 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.136 -20.256 9.684 1.00 0.00 H new ATOM 0 HB3 ALA A 38 10.998 -20.374 8.322 1.00 0.00 H new ATOM 578 N VAL A 39 9.669 -22.831 7.703 1.00 0.00 N ATOM 579 CA VAL A 39 8.386 -23.383 7.187 1.00 0.00 C ATOM 580 C VAL A 39 8.677 -24.498 6.180 1.00 0.00 C ATOM 581 O VAL A 39 9.707 -24.510 5.534 1.00 0.00 O ATOM 582 CB VAL A 39 7.593 -22.269 6.501 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.402 -21.106 7.475 1.00 0.00 C ATOM 584 CG2 VAL A 39 8.359 -21.783 5.269 1.00 0.00 C ATOM 0 H VAL A 39 10.327 -22.522 6.988 1.00 0.00 H new ATOM 0 HA VAL A 39 7.804 -23.787 8.016 1.00 0.00 H new ATOM 0 HB VAL A 39 6.619 -22.651 6.196 1.00 0.00 H new ATOM 0 HG11 VAL A 39 6.837 -20.312 6.987 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.857 -21.452 8.353 1.00 0.00 H new ATOM 0 HG13 VAL A 39 8.376 -20.724 7.780 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.795 -20.989 4.779 1.00 0.00 H new ATOM 0 HG22 VAL A 39 9.333 -21.401 5.574 1.00 0.00 H new ATOM 0 HG23 VAL A 39 8.495 -22.612 4.575 1.00 0.00 H new ATOM 594 N LYS A 40 7.779 -25.434 6.042 1.00 0.00 N ATOM 595 CA LYS A 40 8.005 -26.548 5.078 1.00 0.00 C ATOM 596 C LYS A 40 7.845 -26.026 3.648 1.00 0.00 C ATOM 597 O LYS A 40 8.625 -26.341 2.771 1.00 0.00 O ATOM 598 CB LYS A 40 6.984 -27.659 5.332 1.00 0.00 C ATOM 599 CG LYS A 40 7.328 -28.877 4.473 1.00 0.00 C ATOM 600 CD LYS A 40 6.280 -29.969 4.692 1.00 0.00 C ATOM 601 CE LYS A 40 6.698 -31.235 3.941 1.00 0.00 C ATOM 602 NZ LYS A 40 5.482 -32.002 3.545 1.00 0.00 N ATOM 0 H LYS A 40 6.898 -25.476 6.555 1.00 0.00 H new ATOM 0 HA LYS A 40 9.012 -26.943 5.210 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.985 -27.933 6.387 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.980 -27.306 5.095 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.360 -28.595 3.421 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.318 -29.251 4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.178 -30.182 5.756 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.306 -29.629 4.340 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.279 -30.971 3.057 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.340 -31.850 4.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.765 -32.863 3.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.945 -32.265 4.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.886 -31.414 2.928 1.00 0.00 H new ATOM 616 N CYS A 41 6.840 -25.229 3.406 1.00 0.00 N ATOM 617 CA CYS A 41 6.632 -24.690 2.033 1.00 0.00 C ATOM 618 C CYS A 41 5.361 -23.838 2.004 1.00 0.00 C ATOM 619 O CYS A 41 4.311 -24.256 2.451 1.00 0.00 O ATOM 620 CB CYS A 41 6.489 -25.851 1.047 1.00 0.00 C ATOM 621 SG CYS A 41 7.348 -25.443 -0.493 1.00 0.00 S ATOM 0 H CYS A 41 6.155 -24.928 4.099 1.00 0.00 H new ATOM 0 HA CYS A 41 7.487 -24.075 1.751 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.905 -26.762 1.478 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.435 -26.045 0.848 1.00 0.00 H new ATOM 0 HG CYS A 41 7.229 -26.430 -1.331 1.00 0.00 H new ATOM 627 N ALA A 42 5.446 -22.644 1.481 1.00 0.00 N ATOM 628 CA ALA A 42 4.242 -21.769 1.424 1.00 0.00 C ATOM 629 C ALA A 42 3.410 -22.125 0.190 1.00 0.00 C ATOM 630 O ALA A 42 3.901 -22.125 -0.922 1.00 0.00 O ATOM 631 CB ALA A 42 4.679 -20.304 1.339 1.00 0.00 C ATOM 0 H ALA A 42 6.297 -22.238 1.091 1.00 0.00 H new ATOM 0 HA ALA A 42 3.642 -21.918 2.322 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.798 -19.663 1.297 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.271 -20.049 2.218 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.279 -20.155 0.441 1.00 0.00 H new ATOM 637 N GLU A 43 2.155 -22.429 0.375 1.00 0.00 N ATOM 638 CA GLU A 43 1.295 -22.785 -0.788 1.00 0.00 C ATOM 639 C GLU A 43 0.122 -21.805 -0.876 1.00 0.00 C ATOM 640 O GLU A 43 -0.326 -21.267 0.116 1.00 0.00 O ATOM 641 CB GLU A 43 0.758 -24.206 -0.608 1.00 0.00 C ATOM 642 CG GLU A 43 1.928 -25.187 -0.517 1.00 0.00 C ATOM 643 CD GLU A 43 2.750 -25.123 -1.806 1.00 0.00 C ATOM 644 OE1 GLU A 43 2.240 -24.603 -2.785 1.00 0.00 O ATOM 645 OE2 GLU A 43 3.876 -25.595 -1.792 1.00 0.00 O ATOM 0 H GLU A 43 1.688 -22.446 1.282 1.00 0.00 H new ATOM 0 HA GLU A 43 1.883 -22.731 -1.704 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.150 -24.264 0.295 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.112 -24.471 -1.445 1.00 0.00 H new ATOM 0 HG2 GLU A 43 2.556 -24.942 0.340 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.556 -26.200 -0.360 1.00 0.00 H new ATOM 652 N ILE A 44 -0.377 -21.569 -2.059 1.00 0.00 N ATOM 653 CA ILE A 44 -1.520 -20.626 -2.211 1.00 0.00 C ATOM 654 C ILE A 44 -2.797 -21.417 -2.505 1.00 0.00 C ATOM 655 O ILE A 44 -2.899 -22.102 -3.503 1.00 0.00 O ATOM 656 CB ILE A 44 -1.238 -19.664 -3.368 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.117 -18.986 -3.149 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.336 -18.600 -3.427 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.439 -18.091 -4.348 1.00 0.00 C ATOM 0 H ILE A 44 -0.042 -21.989 -2.926 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.648 -20.058 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.220 -20.220 -4.306 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.096 -18.393 -2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.896 -19.738 -3.023 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.135 -17.915 -4.251 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.301 -19.082 -3.583 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.355 -18.044 -2.490 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.404 -17.608 -4.193 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.478 -18.696 -5.254 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.335 -17.331 -4.453 1.00 0.00 H new ATOM 671 N LEU A 45 -3.773 -21.327 -1.642 1.00 0.00 N ATOM 672 CA LEU A 45 -5.041 -22.076 -1.873 1.00 0.00 C ATOM 673 C LEU A 45 -5.703 -21.576 -3.158 1.00 0.00 C ATOM 674 O LEU A 45 -6.159 -22.352 -3.974 1.00 0.00 O ATOM 675 CB LEU A 45 -5.986 -21.851 -0.691 1.00 0.00 C ATOM 676 CG LEU A 45 -7.231 -22.724 -0.861 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.881 -24.179 -0.540 1.00 0.00 C ATOM 678 CD2 LEU A 45 -8.328 -22.241 0.089 1.00 0.00 C ATOM 0 H LEU A 45 -3.747 -20.768 -0.789 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.823 -23.140 -1.968 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.482 -22.096 0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.270 -20.800 -0.634 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.586 -22.654 -1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.767 -24.802 -0.661 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.100 -24.524 -1.218 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.526 -24.249 0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -9.215 -22.863 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.975 -22.310 1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.578 -21.205 -0.140 1.00 0.00 H new ATOM 690 N GLU A 46 -5.760 -20.286 -3.345 1.00 0.00 N ATOM 691 CA GLU A 46 -6.392 -19.739 -4.578 1.00 0.00 C ATOM 692 C GLU A 46 -5.906 -18.306 -4.809 1.00 0.00 C ATOM 693 O GLU A 46 -5.504 -17.622 -3.889 1.00 0.00 O ATOM 694 CB GLU A 46 -7.914 -19.741 -4.415 1.00 0.00 C ATOM 695 CG GLU A 46 -8.420 -21.185 -4.369 1.00 0.00 C ATOM 696 CD GLU A 46 -9.950 -21.191 -4.408 1.00 0.00 C ATOM 697 OE1 GLU A 46 -10.528 -20.117 -4.367 1.00 0.00 O ATOM 698 OE2 GLU A 46 -10.516 -22.268 -4.478 1.00 0.00 O ATOM 0 H GLU A 46 -5.396 -19.587 -2.697 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.117 -20.358 -5.432 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.193 -19.217 -3.501 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.380 -19.207 -5.243 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.022 -21.748 -5.213 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.067 -21.677 -3.463 1.00 0.00 H new ATOM 705 N GLY A 47 -5.941 -17.849 -6.030 1.00 0.00 N ATOM 706 CA GLY A 47 -5.480 -16.462 -6.318 1.00 0.00 C ATOM 707 C GLY A 47 -4.095 -16.510 -6.965 1.00 0.00 C ATOM 708 O GLY A 47 -3.806 -15.780 -7.893 1.00 0.00 O ATOM 0 H GLY A 47 -6.269 -18.375 -6.840 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.186 -15.963 -6.982 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -5.443 -15.881 -5.397 1.00 0.00 H new ATOM 712 N ASP A 48 -3.234 -17.364 -6.482 1.00 0.00 N ATOM 713 CA ASP A 48 -1.868 -17.459 -7.070 1.00 0.00 C ATOM 714 C ASP A 48 -1.161 -16.110 -6.937 1.00 0.00 C ATOM 715 O ASP A 48 -0.437 -15.688 -7.817 1.00 0.00 O ATOM 716 CB ASP A 48 -1.975 -17.837 -8.549 1.00 0.00 C ATOM 717 CG ASP A 48 -2.519 -19.262 -8.672 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.574 -19.944 -7.663 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.872 -19.646 -9.776 1.00 0.00 O ATOM 0 H ASP A 48 -3.418 -18.000 -5.706 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.296 -18.222 -6.541 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.633 -17.139 -9.067 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.997 -17.767 -9.025 1.00 0.00 H new ATOM 724 N GLY A 49 -1.365 -15.428 -5.844 1.00 0.00 N ATOM 725 CA GLY A 49 -0.705 -14.106 -5.656 1.00 0.00 C ATOM 726 C GLY A 49 -1.586 -13.006 -6.253 1.00 0.00 C ATOM 727 O GLY A 49 -1.099 -12.031 -6.790 1.00 0.00 O ATOM 0 H GLY A 49 -1.961 -15.729 -5.073 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.539 -13.918 -4.595 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.273 -14.104 -6.137 1.00 0.00 H new ATOM 731 N GLY A 50 -2.879 -13.155 -6.163 1.00 0.00 N ATOM 732 CA GLY A 50 -3.789 -12.117 -6.726 1.00 0.00 C ATOM 733 C GLY A 50 -4.681 -11.564 -5.613 1.00 0.00 C ATOM 734 O GLY A 50 -4.443 -11.792 -4.443 1.00 0.00 O ATOM 0 H GLY A 50 -3.345 -13.950 -5.725 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.207 -11.312 -7.174 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.402 -12.546 -7.519 1.00 0.00 H new ATOM 738 N PRO A 51 -5.730 -10.820 -5.991 1.00 0.00 N ATOM 739 CA PRO A 51 -6.669 -10.227 -5.030 1.00 0.00 C ATOM 740 C PRO A 51 -7.535 -11.292 -4.351 1.00 0.00 C ATOM 741 O PRO A 51 -8.137 -12.124 -5.001 1.00 0.00 O ATOM 742 CB PRO A 51 -7.541 -9.318 -5.896 1.00 0.00 C ATOM 743 CG PRO A 51 -7.462 -9.913 -7.262 1.00 0.00 C ATOM 744 CD PRO A 51 -6.084 -10.500 -7.384 1.00 0.00 C ATOM 0 HA PRO A 51 -6.154 -9.704 -4.224 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.569 -9.292 -5.534 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -7.174 -8.292 -5.889 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.225 -10.679 -7.398 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.632 -9.155 -8.027 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -6.079 -11.389 -8.015 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -5.382 -9.792 -7.825 1.00 0.00 H new ATOM 752 N GLY A 52 -7.602 -11.273 -3.048 1.00 0.00 N ATOM 753 CA GLY A 52 -8.427 -12.284 -2.330 1.00 0.00 C ATOM 754 C GLY A 52 -7.721 -13.641 -2.375 1.00 0.00 C ATOM 755 O GLY A 52 -8.337 -14.678 -2.231 1.00 0.00 O ATOM 0 H GLY A 52 -7.121 -10.601 -2.450 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.581 -11.976 -1.296 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.412 -12.359 -2.790 1.00 0.00 H new ATOM 759 N THR A 53 -6.431 -13.641 -2.574 1.00 0.00 N ATOM 760 CA THR A 53 -5.687 -14.930 -2.628 1.00 0.00 C ATOM 761 C THR A 53 -5.494 -15.468 -1.208 1.00 0.00 C ATOM 762 O THR A 53 -5.303 -14.719 -0.272 1.00 0.00 O ATOM 763 CB THR A 53 -4.318 -14.703 -3.276 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.498 -14.194 -4.590 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.555 -16.026 -3.337 1.00 0.00 C ATOM 0 H THR A 53 -5.861 -12.805 -2.701 1.00 0.00 H new ATOM 0 HA THR A 53 -6.254 -15.651 -3.217 1.00 0.00 H new ATOM 0 HB THR A 53 -3.748 -13.987 -2.684 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.071 -13.399 -4.557 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.581 -15.863 -3.798 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.418 -16.414 -2.328 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.121 -16.746 -3.929 1.00 0.00 H new ATOM 773 N ILE A 54 -5.543 -16.762 -1.043 1.00 0.00 N ATOM 774 CA ILE A 54 -5.362 -17.345 0.316 1.00 0.00 C ATOM 775 C ILE A 54 -4.085 -18.187 0.343 1.00 0.00 C ATOM 776 O ILE A 54 -3.887 -19.059 -0.480 1.00 0.00 O ATOM 777 CB ILE A 54 -6.564 -18.229 0.656 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.850 -17.407 0.549 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.417 -18.764 2.082 1.00 0.00 C ATOM 780 CD1 ILE A 54 -9.057 -18.312 0.803 1.00 0.00 C ATOM 0 H ILE A 54 -5.700 -17.439 -1.789 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.283 -16.542 1.049 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.609 -19.065 -0.043 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.834 -16.592 1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.923 -16.954 -0.440 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.273 -19.394 2.324 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.502 -19.351 2.158 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.371 -17.929 2.781 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -9.973 -17.726 0.727 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -9.075 -19.111 0.062 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.984 -18.744 1.801 1.00 0.00 H new ATOM 792 N LYS A 55 -3.216 -17.934 1.283 1.00 0.00 N ATOM 793 CA LYS A 55 -1.953 -18.720 1.360 1.00 0.00 C ATOM 794 C LYS A 55 -1.927 -19.520 2.664 1.00 0.00 C ATOM 795 O LYS A 55 -2.499 -19.122 3.660 1.00 0.00 O ATOM 796 CB LYS A 55 -0.756 -17.768 1.323 1.00 0.00 C ATOM 797 CG LYS A 55 -0.809 -16.932 0.043 1.00 0.00 C ATOM 798 CD LYS A 55 0.450 -16.068 -0.054 1.00 0.00 C ATOM 799 CE LYS A 55 0.357 -15.167 -1.286 1.00 0.00 C ATOM 800 NZ LYS A 55 1.694 -14.573 -1.569 1.00 0.00 N ATOM 0 H LYS A 55 -3.326 -17.217 2.000 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.900 -19.404 0.513 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.769 -17.116 2.197 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.174 -18.335 1.362 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.883 -17.584 -0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.697 -16.300 0.045 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.558 -15.462 0.845 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.335 -16.702 -0.120 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.014 -15.743 -2.146 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.375 -14.377 -1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.592 -13.800 -2.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.102 -14.200 -0.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.323 -15.304 -1.959 1.00 0.00 H new ATOM 814 N LYS A 56 -1.266 -20.645 2.667 1.00 0.00 N ATOM 815 CA LYS A 56 -1.202 -21.469 3.906 1.00 0.00 C ATOM 816 C LYS A 56 0.244 -21.900 4.156 1.00 0.00 C ATOM 817 O LYS A 56 0.868 -22.529 3.325 1.00 0.00 O ATOM 818 CB LYS A 56 -2.082 -22.711 3.740 1.00 0.00 C ATOM 819 CG LYS A 56 -2.109 -23.496 5.054 1.00 0.00 C ATOM 820 CD LYS A 56 -3.036 -24.705 4.905 1.00 0.00 C ATOM 821 CE LYS A 56 -2.406 -25.716 3.945 1.00 0.00 C ATOM 822 NZ LYS A 56 -1.409 -26.545 4.681 1.00 0.00 N ATOM 0 H LYS A 56 -0.767 -21.029 1.864 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.559 -20.881 4.752 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.093 -22.418 3.458 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.696 -23.339 2.937 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.103 -23.825 5.315 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.455 -22.856 5.866 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.206 -25.168 5.877 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -4.008 -24.387 4.528 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.178 -26.354 3.514 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.923 -25.196 3.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.692 -26.899 4.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.947 -25.966 5.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.891 -27.350 5.131 1.00 0.00 H new ATOM 836 N ILE A 57 0.785 -21.565 5.296 1.00 0.00 N ATOM 837 CA ILE A 57 2.191 -21.955 5.597 1.00 0.00 C ATOM 838 C ILE A 57 2.208 -22.966 6.745 1.00 0.00 C ATOM 839 O ILE A 57 1.532 -22.801 7.741 1.00 0.00 O ATOM 840 CB ILE A 57 2.990 -20.713 6.000 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.834 -19.634 4.926 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.467 -21.081 6.142 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.218 -18.274 5.510 1.00 0.00 C ATOM 0 H ILE A 57 0.314 -21.038 6.031 1.00 0.00 H new ATOM 0 HA ILE A 57 2.639 -22.405 4.711 1.00 0.00 H new ATOM 0 HB ILE A 57 2.617 -20.334 6.952 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.466 -19.865 4.069 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.805 -19.610 4.566 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.036 -20.197 6.429 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.579 -21.849 6.908 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.841 -21.460 5.191 1.00 0.00 H new ATOM 0 HD11 ILE A 57 3.107 -17.505 4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.567 -18.043 6.354 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.254 -18.303 5.848 1.00 0.00 H new ATOM 855 N THR A 58 2.978 -24.012 6.615 1.00 0.00 N ATOM 856 CA THR A 58 3.039 -25.032 7.699 1.00 0.00 C ATOM 857 C THR A 58 4.464 -25.105 8.251 1.00 0.00 C ATOM 858 O THR A 58 5.423 -25.189 7.509 1.00 0.00 O ATOM 859 CB THR A 58 2.638 -26.399 7.138 1.00 0.00 C ATOM 860 OG1 THR A 58 1.330 -26.318 6.588 1.00 0.00 O ATOM 861 CG2 THR A 58 2.660 -27.440 8.258 1.00 0.00 C ATOM 0 H THR A 58 3.567 -24.204 5.805 1.00 0.00 H new ATOM 0 HA THR A 58 2.353 -24.753 8.499 1.00 0.00 H new ATOM 0 HB THR A 58 3.342 -26.693 6.360 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.072 -27.192 6.227 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.374 -28.412 7.857 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.664 -27.502 8.678 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.957 -27.149 9.039 1.00 0.00 H new ATOM 869 N PHE A 59 4.613 -25.075 9.548 1.00 0.00 N ATOM 870 CA PHE A 59 5.978 -25.143 10.141 1.00 0.00 C ATOM 871 C PHE A 59 6.261 -26.570 10.612 1.00 0.00 C ATOM 872 O PHE A 59 5.480 -27.165 11.329 1.00 0.00 O ATOM 873 CB PHE A 59 6.065 -24.187 11.333 1.00 0.00 C ATOM 874 CG PHE A 59 5.955 -22.762 10.844 1.00 0.00 C ATOM 875 CD1 PHE A 59 4.756 -22.304 10.285 1.00 0.00 C ATOM 876 CD2 PHE A 59 7.051 -21.898 10.952 1.00 0.00 C ATOM 877 CE1 PHE A 59 4.655 -20.982 9.832 1.00 0.00 C ATOM 878 CE2 PHE A 59 6.951 -20.577 10.500 1.00 0.00 C ATOM 879 CZ PHE A 59 5.751 -20.120 9.940 1.00 0.00 C ATOM 0 H PHE A 59 3.849 -25.006 10.221 1.00 0.00 H new ATOM 0 HA PHE A 59 6.714 -24.856 9.390 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.267 -24.401 12.044 1.00 0.00 H new ATOM 0 HB3 PHE A 59 7.008 -24.330 11.860 1.00 0.00 H new ATOM 0 HD1 PHE A 59 3.909 -22.969 10.203 1.00 0.00 H new ATOM 0 HD2 PHE A 59 7.975 -22.251 11.385 1.00 0.00 H new ATOM 0 HE1 PHE A 59 3.731 -20.629 9.399 1.00 0.00 H new ATOM 0 HE2 PHE A 59 7.797 -19.911 10.583 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.672 -19.101 9.591 1.00 0.00 H new ATOM 974 N TYR A 67 1.193 -23.128 12.461 1.00 0.00 N ATOM 975 CA TYR A 67 1.004 -22.835 11.013 1.00 0.00 C ATOM 976 C TYR A 67 0.316 -21.477 10.852 1.00 0.00 C ATOM 977 O TYR A 67 -0.534 -21.104 11.635 1.00 0.00 O ATOM 978 CB TYR A 67 0.138 -23.926 10.381 1.00 0.00 C ATOM 979 CG TYR A 67 -1.287 -23.784 10.862 1.00 0.00 C ATOM 980 CD1 TYR A 67 -1.689 -24.393 12.058 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.208 -23.043 10.111 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.009 -24.262 12.501 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.529 -22.912 10.555 1.00 0.00 C ATOM 984 CZ TYR A 67 -3.930 -23.522 11.750 1.00 0.00 C ATOM 985 OH TYR A 67 -5.233 -23.391 12.188 1.00 0.00 O ATOM 0 HA TYR A 67 1.974 -22.810 10.517 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.175 -23.850 9.294 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.525 -24.910 10.645 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.979 -24.964 12.638 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.899 -22.573 9.189 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.318 -24.732 13.423 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.239 -22.340 9.976 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.739 -22.846 11.550 1.00 0.00 H new ATOM 995 N VAL A 68 0.677 -20.738 9.838 1.00 0.00 N ATOM 996 CA VAL A 68 0.046 -19.406 9.621 1.00 0.00 C ATOM 997 C VAL A 68 -0.400 -19.282 8.163 1.00 0.00 C ATOM 998 O VAL A 68 0.133 -19.930 7.283 1.00 0.00 O ATOM 999 CB VAL A 68 1.061 -18.304 9.937 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.369 -16.941 9.877 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.635 -18.523 11.338 1.00 0.00 C ATOM 0 H VAL A 68 1.383 -21.000 9.150 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.820 -19.304 10.276 1.00 0.00 H new ATOM 0 HB VAL A 68 1.869 -18.335 9.206 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.091 -16.156 10.102 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.039 -16.784 8.878 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.439 -16.911 10.608 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.357 -17.738 11.562 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.828 -18.493 12.070 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.129 -19.494 11.381 1.00 0.00 H new ATOM 1011 N LYS A 69 -1.373 -18.453 7.900 1.00 0.00 N ATOM 1012 CA LYS A 69 -1.854 -18.285 6.500 1.00 0.00 C ATOM 1013 C LYS A 69 -1.774 -16.808 6.111 1.00 0.00 C ATOM 1014 O LYS A 69 -1.825 -15.932 6.952 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.303 -18.761 6.396 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.391 -20.231 6.812 1.00 0.00 C ATOM 1017 CD LYS A 69 -4.789 -20.766 6.496 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.810 -20.098 7.420 1.00 0.00 C ATOM 1019 NZ LYS A 69 -7.187 -20.370 6.917 1.00 0.00 N ATOM 0 H LYS A 69 -1.856 -17.884 8.595 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.231 -18.875 5.828 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.943 -18.153 7.035 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.664 -18.639 5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -2.638 -20.816 6.284 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.183 -20.332 7.877 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.040 -20.566 5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.815 -21.848 6.629 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.701 -20.478 8.436 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.632 -19.023 7.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -7.882 -19.916 7.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.287 -19.987 5.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.354 -21.396 6.900 1.00 0.00 H new ATOM 1033 N HIS A 70 -1.651 -16.522 4.845 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.571 -15.100 4.410 1.00 0.00 C ATOM 1035 C HIS A 70 -2.682 -14.813 3.398 1.00 0.00 C ATOM 1036 O HIS A 70 -3.105 -15.684 2.665 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.210 -14.840 3.761 1.00 0.00 C ATOM 1038 CG HIS A 70 0.869 -14.943 4.804 1.00 0.00 C ATOM 1039 ND1 HIS A 70 0.834 -14.841 6.173 1.00 0.00 N flip ATOM 1040 CD2 HIS A 70 2.193 -15.185 4.476 1.00 0.00 C flip ATOM 1041 CE1 HIS A 70 2.115 -15.016 6.688 1.00 0.00 C flip ATOM 1042 NE2 HIS A 70 2.896 -15.220 5.623 1.00 0.00 N flip ATOM 0 H HIS A 70 -1.602 -17.210 4.094 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.691 -14.448 5.276 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.031 -15.562 2.964 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.196 -13.851 3.304 1.00 0.00 H new ATOM 0 HD2 HIS A 70 2.589 -15.321 3.480 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.414 -14.992 7.726 1.00 0.00 H new ATOM 0 HE2 HIS A 70 3.902 -15.382 5.673 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.157 -13.600 3.353 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.241 -13.262 2.387 1.00 0.00 C ATOM 1052 C LYS A 71 -3.888 -11.964 1.659 1.00 0.00 C ATOM 1053 O LYS A 71 -3.410 -11.019 2.253 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.560 -13.080 3.140 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.700 -12.907 2.135 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.013 -12.675 2.886 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.174 -12.664 1.890 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.282 -11.826 2.430 1.00 0.00 N ATOM 0 H LYS A 71 -2.843 -12.829 3.942 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.345 -14.070 1.663 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.750 -13.944 3.777 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.501 -12.209 3.793 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.492 -12.064 1.475 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.781 -13.793 1.505 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.164 -13.459 3.628 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.974 -11.729 3.426 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.840 -12.270 0.930 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.525 -13.681 1.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.072 -11.818 1.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.606 -12.221 3.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.942 -10.854 2.577 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.122 -11.910 0.378 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.800 -10.672 -0.383 1.00 0.00 C ATOM 1074 C ILE A 72 -5.091 -9.911 -0.688 1.00 0.00 C ATOM 1075 O ILE A 72 -6.012 -10.442 -1.278 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.104 -11.047 -1.693 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.930 -11.980 -1.396 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.591 -9.781 -2.379 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.205 -12.320 -2.699 1.00 0.00 C ATOM 0 H ILE A 72 -4.522 -12.669 -0.174 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.139 -10.040 0.211 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.812 -11.552 -2.350 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.241 -11.504 -0.698 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.288 -12.892 -0.918 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.095 -10.048 -3.312 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.429 -9.117 -2.591 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.883 -9.274 -1.724 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.368 -12.985 -2.487 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.896 -12.813 -3.382 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.833 -11.404 -3.158 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.167 -8.671 -0.290 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.399 -7.879 -0.556 1.00 0.00 C ATOM 1093 C HIS A 73 -6.278 -7.190 -1.917 1.00 0.00 C ATOM 1094 O HIS A 73 -7.264 -6.915 -2.573 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.574 -6.823 0.537 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.798 -7.504 1.859 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.970 -8.182 2.151 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -6.009 -7.618 2.976 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.855 -8.671 3.400 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.679 -8.357 3.948 1.00 0.00 N ATOM 0 H HIS A 73 -4.429 -8.173 0.208 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.263 -8.543 -0.560 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.690 -6.187 0.588 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.419 -6.176 0.301 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.774 -8.291 1.532 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -5.020 -7.199 3.085 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.621 -9.247 3.898 1.00 0.00 H new ATOM 1108 N SER A 74 -5.079 -6.911 -2.348 1.00 0.00 N ATOM 1109 CA SER A 74 -4.900 -6.241 -3.667 1.00 0.00 C ATOM 1110 C SER A 74 -3.411 -6.002 -3.926 1.00 0.00 C ATOM 1111 O SER A 74 -2.620 -5.887 -3.011 1.00 0.00 O ATOM 1112 CB SER A 74 -5.635 -4.899 -3.662 1.00 0.00 C ATOM 1113 OG SER A 74 -4.939 -3.982 -2.832 1.00 0.00 O ATOM 0 H SER A 74 -4.216 -7.118 -1.845 1.00 0.00 H new ATOM 0 HA SER A 74 -5.307 -6.878 -4.452 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.705 -4.507 -4.677 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.655 -5.032 -3.300 1.00 0.00 H new ATOM 0 HG SER A 74 -5.408 -3.122 -2.830 1.00 0.00 H new ATOM 1119 N ILE A 75 -3.025 -5.926 -5.170 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.590 -5.693 -5.497 1.00 0.00 C ATOM 1121 C ILE A 75 -1.487 -4.648 -6.610 1.00 0.00 C ATOM 1122 O ILE A 75 -2.294 -4.615 -7.518 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.954 -7.002 -5.967 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.545 -7.400 -7.322 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.238 -8.105 -4.944 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.790 -8.611 -7.871 1.00 0.00 C ATOM 0 H ILE A 75 -3.643 -6.015 -5.976 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.068 -5.335 -4.610 1.00 0.00 H new ATOM 0 HB ILE A 75 0.123 -6.866 -6.066 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.604 -7.636 -7.214 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.474 -6.566 -8.021 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.785 -9.038 -5.279 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.817 -7.823 -3.979 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.315 -8.240 -4.844 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.210 -8.895 -8.836 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.263 -8.358 -7.994 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.884 -9.444 -7.175 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.505 -3.792 -6.547 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.358 -2.751 -7.604 1.00 0.00 C ATOM 1140 C ASP A 76 1.031 -2.858 -8.237 1.00 0.00 C ATOM 1141 O ASP A 76 1.993 -2.302 -7.745 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.529 -1.365 -6.982 1.00 0.00 C ATOM 1143 CG ASP A 76 -1.965 -1.207 -6.479 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.791 -2.028 -6.838 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.213 -0.266 -5.742 1.00 0.00 O ATOM 0 H ASP A 76 0.201 -3.768 -5.811 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.119 -2.902 -8.370 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.173 -1.235 -6.158 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.303 -0.594 -7.718 1.00 0.00 H new ATOM 1150 N LYS A 77 1.143 -3.567 -9.326 1.00 0.00 N ATOM 1151 CA LYS A 77 2.470 -3.705 -9.991 1.00 0.00 C ATOM 1152 C LYS A 77 2.900 -2.346 -10.546 1.00 0.00 C ATOM 1153 O LYS A 77 4.062 -1.993 -10.517 1.00 0.00 O ATOM 1154 CB LYS A 77 2.366 -4.716 -11.134 1.00 0.00 C ATOM 1155 CG LYS A 77 2.065 -6.102 -10.563 1.00 0.00 C ATOM 1156 CD LYS A 77 2.084 -7.134 -11.693 1.00 0.00 C ATOM 1157 CE LYS A 77 1.613 -8.487 -11.156 1.00 0.00 C ATOM 1158 NZ LYS A 77 0.802 -9.179 -12.197 1.00 0.00 N ATOM 0 H LYS A 77 0.374 -4.056 -9.784 1.00 0.00 H new ATOM 0 HA LYS A 77 3.207 -4.054 -9.268 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.579 -4.418 -11.827 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.297 -4.738 -11.700 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.804 -6.363 -9.805 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.092 -6.102 -10.073 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.437 -6.809 -12.508 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.091 -7.223 -12.102 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.471 -9.100 -10.881 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.020 -8.345 -10.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.481 -10.099 -11.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.024 -8.595 -12.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.382 -9.327 -13.048 1.00 0.00 H new ATOM 1172 N VAL A 78 1.971 -1.580 -11.048 1.00 0.00 N ATOM 1173 CA VAL A 78 2.326 -0.243 -11.602 1.00 0.00 C ATOM 1174 C VAL A 78 2.717 0.692 -10.456 1.00 0.00 C ATOM 1175 O VAL A 78 3.676 1.433 -10.544 1.00 0.00 O ATOM 1176 CB VAL A 78 1.122 0.337 -12.345 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.408 1.793 -12.719 1.00 0.00 C ATOM 1178 CG2 VAL A 78 0.867 -0.476 -13.616 1.00 0.00 C ATOM 0 H VAL A 78 0.981 -1.822 -11.099 1.00 0.00 H new ATOM 0 HA VAL A 78 3.163 -0.344 -12.292 1.00 0.00 H new ATOM 0 HB VAL A 78 0.242 0.292 -11.703 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.550 2.208 -13.249 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.590 2.372 -11.814 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.288 1.838 -13.361 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.009 -0.063 -14.146 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.746 -0.432 -14.259 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.664 -1.513 -13.350 1.00 0.00 H new ATOM 1188 N ASN A 79 1.981 0.663 -9.379 1.00 0.00 N ATOM 1189 CA ASN A 79 2.309 1.549 -8.227 1.00 0.00 C ATOM 1190 C ASN A 79 3.308 0.841 -7.308 1.00 0.00 C ATOM 1191 O ASN A 79 3.609 1.308 -6.227 1.00 0.00 O ATOM 1192 CB ASN A 79 1.033 1.862 -7.443 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.006 2.478 -8.382 1.00 0.00 C ATOM 1194 OD1 ASN A 79 0.237 3.502 -8.989 1.00 0.00 O ATOM 1195 ND2 ASN A 79 -1.164 1.893 -8.528 1.00 0.00 N ATOM 0 H ASN A 79 1.166 0.064 -9.247 1.00 0.00 H new ATOM 0 HA ASN A 79 2.746 2.477 -8.596 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.637 0.951 -6.993 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.255 2.550 -6.627 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.864 2.296 -9.151 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.369 1.033 -8.019 1.00 0.00 H new ATOM 1202 N HIS A 80 3.822 -0.282 -7.727 1.00 0.00 N ATOM 1203 CA HIS A 80 4.799 -1.017 -6.875 1.00 0.00 C ATOM 1204 C HIS A 80 4.271 -1.084 -5.441 1.00 0.00 C ATOM 1205 O HIS A 80 4.973 -0.781 -4.496 1.00 0.00 O ATOM 1206 CB HIS A 80 6.142 -0.284 -6.890 1.00 0.00 C ATOM 1207 CG HIS A 80 6.569 -0.052 -8.314 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.316 1.139 -8.975 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.230 -0.849 -9.215 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.820 1.027 -10.218 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.388 -0.165 -10.416 1.00 0.00 N ATOM 0 H HIS A 80 3.608 -0.722 -8.622 1.00 0.00 H new ATOM 0 HA HIS A 80 4.933 -2.027 -7.262 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.055 0.667 -6.365 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.895 -0.871 -6.364 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.836 1.952 -8.590 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.575 -1.854 -9.021 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.771 1.806 -10.964 1.00 0.00 H new ATOM 1219 N THR A 81 3.039 -1.476 -5.270 1.00 0.00 N ATOM 1220 CA THR A 81 2.466 -1.561 -3.897 1.00 0.00 C ATOM 1221 C THR A 81 1.890 -2.960 -3.669 1.00 0.00 C ATOM 1222 O THR A 81 1.220 -3.513 -4.517 1.00 0.00 O ATOM 1223 CB THR A 81 1.355 -0.520 -3.743 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.853 0.759 -4.112 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.884 -0.485 -2.289 1.00 0.00 C ATOM 0 H THR A 81 2.403 -1.741 -6.022 1.00 0.00 H new ATOM 0 HA THR A 81 3.249 -1.368 -3.164 1.00 0.00 H new ATOM 0 HB THR A 81 0.517 -0.785 -4.388 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.385 0.679 -4.931 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.093 0.257 -2.181 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.503 -1.466 -2.006 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.720 -0.221 -1.642 1.00 0.00 H new ATOM 1233 N TYR A 82 2.146 -3.535 -2.526 1.00 0.00 N ATOM 1234 CA TYR A 82 1.613 -4.896 -2.238 1.00 0.00 C ATOM 1235 C TYR A 82 0.921 -4.888 -0.874 1.00 0.00 C ATOM 1236 O TYR A 82 1.507 -4.532 0.128 1.00 0.00 O ATOM 1237 CB TYR A 82 2.767 -5.901 -2.219 1.00 0.00 C ATOM 1238 CG TYR A 82 2.221 -7.294 -2.014 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.811 -8.055 -3.114 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.125 -7.824 -0.721 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.305 -9.346 -2.925 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.619 -9.116 -0.531 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.210 -9.877 -1.632 1.00 0.00 C ATOM 1244 OH TYR A 82 0.712 -11.149 -1.444 1.00 0.00 O ATOM 0 H TYR A 82 2.702 -3.120 -1.778 1.00 0.00 H new ATOM 0 HA TYR A 82 0.897 -5.180 -3.009 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.322 -5.851 -3.156 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.466 -5.652 -1.421 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.885 -7.646 -4.111 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.441 -7.237 0.129 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.988 -9.932 -3.775 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.544 -9.525 0.466 1.00 0.00 H new ATOM 0 HH TYR A 82 0.831 -11.412 -0.508 1.00 0.00 H new ATOM 1254 N SER A 83 -0.326 -5.273 -0.827 1.00 0.00 N ATOM 1255 CA SER A 83 -1.051 -5.280 0.475 1.00 0.00 C ATOM 1256 C SER A 83 -1.621 -6.674 0.742 1.00 0.00 C ATOM 1257 O SER A 83 -2.188 -7.302 -0.129 1.00 0.00 O ATOM 1258 CB SER A 83 -2.195 -4.265 0.425 1.00 0.00 C ATOM 1259 OG SER A 83 -1.676 -2.981 0.115 1.00 0.00 O ATOM 0 H SER A 83 -0.872 -5.582 -1.631 1.00 0.00 H new ATOM 0 HA SER A 83 -0.359 -5.014 1.274 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.928 -4.564 -0.325 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.713 -4.238 1.384 1.00 0.00 H new ATOM 0 HG SER A 83 -2.409 -2.331 0.081 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.480 -7.161 1.945 1.00 0.00 N ATOM 1266 CA TYR A 84 -2.018 -8.510 2.273 1.00 0.00 C ATOM 1267 C TYR A 84 -2.458 -8.537 3.738 1.00 0.00 C ATOM 1268 O TYR A 84 -2.395 -7.543 4.433 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.934 -9.567 2.050 1.00 0.00 C ATOM 1270 CG TYR A 84 0.178 -9.367 3.052 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.163 -8.400 2.820 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.222 -10.148 4.213 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.193 -8.215 3.751 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.252 -9.963 5.142 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.238 -8.996 4.911 1.00 0.00 C ATOM 1276 OH TYR A 84 3.252 -8.813 5.828 1.00 0.00 O ATOM 0 H TYR A 84 -1.014 -6.681 2.715 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.870 -8.725 1.628 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.358 -10.566 2.156 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.542 -9.493 1.036 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.129 -7.797 1.924 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.539 -10.893 4.392 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.953 -7.469 3.573 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.286 -10.566 6.037 1.00 0.00 H new ATOM 0 HH TYR A 84 2.883 -8.432 6.652 1.00 0.00 H new ATOM 1286 N SER A 85 -2.904 -9.667 4.211 1.00 0.00 N ATOM 1287 CA SER A 85 -3.345 -9.758 5.629 1.00 0.00 C ATOM 1288 C SER A 85 -3.138 -11.186 6.134 1.00 0.00 C ATOM 1289 O SER A 85 -3.192 -12.136 5.378 1.00 0.00 O ATOM 1290 CB SER A 85 -4.827 -9.392 5.728 1.00 0.00 C ATOM 1291 OG SER A 85 -5.596 -10.319 4.974 1.00 0.00 O ATOM 0 H SER A 85 -2.982 -10.532 3.676 1.00 0.00 H new ATOM 0 HA SER A 85 -2.760 -9.068 6.237 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.146 -9.402 6.770 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.988 -8.381 5.355 1.00 0.00 H new ATOM 0 HG SER A 85 -5.906 -9.892 4.148 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.902 -11.347 7.406 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.691 -12.714 7.956 1.00 0.00 C ATOM 1299 C LEU A 86 -4.043 -13.324 8.334 1.00 0.00 C ATOM 1300 O LEU A 86 -4.763 -12.801 9.162 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.799 -12.633 9.195 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.170 -14.000 9.459 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.261 -13.916 10.687 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -2.275 -15.025 9.711 1.00 0.00 C ATOM 0 H LEU A 86 -2.846 -10.591 8.088 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.209 -13.340 7.205 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.020 -11.885 9.047 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.385 -12.317 10.058 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.581 -14.304 8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.188 -14.891 10.875 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.526 -13.183 10.508 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.848 -13.613 11.554 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.829 -16.002 9.900 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.863 -14.721 10.577 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.922 -15.085 8.836 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.396 -14.426 7.729 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.703 -15.068 8.048 1.00 0.00 C ATOM 1318 C ILE A 87 -5.611 -15.790 9.395 1.00 0.00 C ATOM 1319 O ILE A 87 -6.297 -15.450 10.339 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.054 -16.076 6.952 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.265 -15.340 5.628 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.337 -16.818 7.334 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -6.405 -16.357 4.494 1.00 0.00 C ATOM 0 H ILE A 87 -3.835 -14.909 7.027 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.477 -14.302 8.103 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.239 -16.791 6.843 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.158 -14.717 5.684 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.424 -14.675 5.432 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.588 -17.536 6.554 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.186 -17.344 8.277 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.152 -16.103 7.444 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.555 -15.832 3.551 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.500 -16.961 4.433 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.260 -17.004 4.689 1.00 0.00 H new ATOM 1335 N GLU A 88 -4.773 -16.786 9.492 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.647 -17.526 10.780 1.00 0.00 C ATOM 1337 C GLU A 88 -3.174 -17.824 11.062 1.00 0.00 C ATOM 1338 O GLU A 88 -2.364 -17.908 10.161 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.425 -18.841 10.689 1.00 0.00 C ATOM 1340 CG GLU A 88 -6.911 -18.542 10.481 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.421 -17.671 11.632 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -6.770 -17.645 12.663 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -8.454 -17.046 11.463 1.00 0.00 O ATOM 0 H GLU A 88 -4.172 -17.119 8.738 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.052 -16.916 11.588 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.046 -19.444 9.864 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.284 -19.423 11.600 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.061 -18.031 9.530 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.477 -19.472 10.436 1.00 0.00 H new ATOM 1350 N GLY A 89 -2.823 -17.984 12.309 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.403 -18.278 12.658 1.00 0.00 C ATOM 1352 C GLY A 89 -1.305 -18.585 14.154 1.00 0.00 C ATOM 1353 O GLY A 89 -1.989 -17.991 14.964 1.00 0.00 O ATOM 0 H GLY A 89 -3.460 -17.924 13.103 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.041 -19.126 12.076 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.771 -17.426 12.407 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.465 -19.511 14.528 1.00 0.00 N ATOM 1358 CA ASP A 90 -0.330 -19.856 15.972 1.00 0.00 C ATOM 1359 C ASP A 90 -0.055 -18.586 16.781 1.00 0.00 C ATOM 1360 O ASP A 90 -0.463 -18.464 17.919 1.00 0.00 O ATOM 1361 CB ASP A 90 0.827 -20.839 16.154 1.00 0.00 C ATOM 1362 CG ASP A 90 0.322 -22.267 15.933 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -0.647 -22.425 15.209 1.00 0.00 O ATOM 1364 OD2 ASP A 90 0.913 -23.176 16.490 1.00 0.00 O ATOM 0 H ASP A 90 0.133 -20.043 13.897 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.255 -20.313 16.323 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.626 -20.611 15.449 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.247 -20.741 17.155 1.00 0.00 H new ATOM 1369 N ALA A 91 0.635 -17.639 16.204 1.00 0.00 N ATOM 1370 CA ALA A 91 0.934 -16.381 16.945 1.00 0.00 C ATOM 1371 C ALA A 91 -0.344 -15.551 17.082 1.00 0.00 C ATOM 1372 O ALA A 91 -0.447 -14.688 17.931 1.00 0.00 O ATOM 1373 CB ALA A 91 1.984 -15.575 16.177 1.00 0.00 C ATOM 0 H ALA A 91 1.003 -17.682 15.254 1.00 0.00 H new ATOM 0 HA ALA A 91 1.315 -16.626 17.936 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.203 -14.655 16.718 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.895 -16.165 16.079 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.602 -15.331 15.186 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.319 -15.804 16.253 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.589 -15.028 16.338 1.00 0.00 C ATOM 1381 C LEU A 92 -3.509 -15.667 17.379 1.00 0.00 C ATOM 1382 O LEU A 92 -4.225 -14.989 18.090 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.281 -15.032 14.974 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.576 -14.046 14.040 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.131 -14.496 13.818 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -3.309 -14.001 12.699 1.00 0.00 C ATOM 0 H LEU A 92 -1.292 -16.514 15.521 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.368 -14.001 16.630 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.258 -16.034 14.546 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.330 -14.757 15.086 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.581 -13.053 14.490 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.629 -13.793 13.153 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.609 -14.527 14.774 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.124 -15.489 13.369 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.807 -13.299 12.033 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.305 -14.994 12.249 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.338 -13.678 12.857 1.00 0.00 H new ATOM 1398 N SER A 93 -3.498 -16.968 17.475 1.00 0.00 N ATOM 1399 CA SER A 93 -4.373 -17.650 18.470 1.00 0.00 C ATOM 1400 C SER A 93 -5.838 -17.349 18.149 1.00 0.00 C ATOM 1401 O SER A 93 -6.142 -16.563 17.275 1.00 0.00 O ATOM 1402 CB SER A 93 -4.042 -17.139 19.874 1.00 0.00 C ATOM 1403 OG SER A 93 -4.853 -17.812 20.825 1.00 0.00 O ATOM 0 H SER A 93 -2.921 -17.588 16.907 1.00 0.00 H new ATOM 0 HA SER A 93 -4.205 -18.726 18.427 1.00 0.00 H new ATOM 0 HB2 SER A 93 -2.988 -17.307 20.095 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.212 -16.064 19.931 1.00 0.00 H new ATOM 0 HG SER A 93 -4.641 -17.487 21.725 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.747 -17.967 18.851 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.191 -17.716 18.585 1.00 0.00 C ATOM 1411 C GLU A 94 -8.611 -16.404 19.254 1.00 0.00 C ATOM 1412 O GLU A 94 -9.712 -15.926 19.067 1.00 0.00 O ATOM 1413 CB GLU A 94 -9.023 -18.867 19.154 1.00 0.00 C ATOM 1414 CG GLU A 94 -8.632 -20.173 18.456 1.00 0.00 C ATOM 1415 CD GLU A 94 -9.457 -21.326 19.031 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.123 -21.111 20.031 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -9.410 -22.403 18.462 1.00 0.00 O ATOM 0 H GLU A 94 -6.552 -18.635 19.597 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.356 -17.646 17.510 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.858 -18.953 20.228 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.085 -18.669 19.009 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.803 -20.089 17.383 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.569 -20.368 18.595 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.742 -15.817 20.031 1.00 0.00 N ATOM 1425 CA ASN A 95 -8.093 -14.537 20.708 1.00 0.00 C ATOM 1426 C ASN A 95 -7.823 -13.365 19.763 1.00 0.00 C ATOM 1427 O ASN A 95 -8.579 -12.417 19.702 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.241 -14.378 21.970 1.00 0.00 C ATOM 1429 CG ASN A 95 -7.456 -15.584 22.885 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -8.418 -16.311 22.737 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.593 -15.830 23.833 1.00 0.00 N ATOM 0 H ASN A 95 -6.805 -16.169 20.226 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.149 -14.549 20.978 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.188 -14.294 21.702 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.512 -13.460 22.491 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -6.727 -16.632 24.449 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.785 -15.220 23.958 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.747 -13.422 19.026 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.429 -12.309 18.088 1.00 0.00 C ATOM 1440 C ILE A 96 -7.117 -12.556 16.743 1.00 0.00 C ATOM 1441 O ILE A 96 -7.229 -13.676 16.287 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.914 -12.235 17.878 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.208 -12.270 19.235 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.563 -10.933 17.155 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.693 -12.294 19.019 1.00 0.00 C ATOM 0 H ILE A 96 -6.076 -14.190 19.033 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.786 -11.369 18.510 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.589 -13.084 17.277 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.488 -11.398 19.826 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.520 -13.150 19.797 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.485 -10.879 17.005 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.066 -10.907 16.188 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.888 -10.084 17.756 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.188 -12.319 19.985 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.421 -13.180 18.445 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.389 -11.401 18.474 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.575 -11.514 16.104 1.00 0.00 N ATOM 1458 CA GLU A 97 -8.253 -11.679 14.788 1.00 0.00 C ATOM 1459 C GLU A 97 -7.218 -11.555 13.667 1.00 0.00 C ATOM 1460 O GLU A 97 -6.043 -11.370 13.914 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.324 -10.600 14.621 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.368 -10.744 15.731 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.528 -9.781 15.468 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -11.394 -8.949 14.587 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.531 -9.893 16.154 1.00 0.00 O ATOM 0 H GLU A 97 -7.508 -10.553 16.438 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.725 -12.661 14.742 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.868 -9.611 14.661 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.800 -10.692 13.645 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.734 -11.770 15.769 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.916 -10.530 16.700 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.641 -11.661 12.437 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.674 -11.554 11.307 1.00 0.00 C ATOM 1474 C LYS A 98 -5.934 -10.218 11.392 1.00 0.00 C ATOM 1475 O LYS A 98 -6.371 -9.292 12.049 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.430 -11.633 9.980 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.216 -12.944 9.914 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.781 -13.130 8.505 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.731 -11.975 8.179 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.560 -12.331 6.993 1.00 0.00 N ATOM 0 H LYS A 98 -8.612 -11.817 12.166 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.956 -12.372 11.366 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.109 -10.785 9.886 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.730 -11.575 9.147 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.568 -13.782 10.171 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.026 -12.932 10.643 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -7.970 -13.164 7.778 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.310 -14.080 8.436 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.373 -11.766 9.035 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -9.161 -11.068 7.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.205 -11.546 6.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -9.940 -12.510 6.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.114 -13.186 7.201 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.809 -10.113 10.737 1.00 0.00 N ATOM 1495 CA ILE A 99 -4.036 -8.841 10.780 1.00 0.00 C ATOM 1496 C ILE A 99 -3.873 -8.296 9.360 1.00 0.00 C ATOM 1497 O ILE A 99 -3.583 -9.026 8.434 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.656 -9.106 11.387 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.819 -9.735 12.772 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.891 -7.787 11.512 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.470 -10.284 13.244 1.00 0.00 C ATOM 0 H ILE A 99 -4.393 -10.855 10.174 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.568 -8.111 11.390 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.101 -9.788 10.742 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.189 -8.993 13.479 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.557 -10.536 12.735 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.908 -7.976 11.944 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.773 -7.340 10.525 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.446 -7.104 12.156 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.585 -10.732 14.231 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.118 -11.039 12.541 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.745 -9.472 13.297 1.00 0.00 H new ATOM 1513 N ASP A 100 -4.054 -7.016 9.182 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.907 -6.426 7.822 1.00 0.00 C ATOM 1515 C ASP A 100 -2.472 -5.929 7.638 1.00 0.00 C ATOM 1516 O ASP A 100 -1.965 -5.164 8.433 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.876 -5.253 7.667 1.00 0.00 C ATOM 1518 CG ASP A 100 -6.315 -5.773 7.690 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -6.491 -6.976 7.596 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -7.217 -4.958 7.801 1.00 0.00 O ATOM 0 H ASP A 100 -4.297 -6.354 9.919 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.131 -7.183 7.070 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.725 -4.534 8.472 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.682 -4.729 6.731 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.812 -6.358 6.598 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.410 -5.908 6.367 1.00 0.00 C ATOM 1527 C TYR A 101 -0.332 -5.137 5.047 1.00 0.00 C ATOM 1528 O TYR A 101 -0.919 -5.524 4.055 1.00 0.00 O ATOM 1529 CB TYR A 101 0.512 -7.127 6.302 1.00 0.00 C ATOM 1530 CG TYR A 101 0.656 -7.724 7.681 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.597 -7.200 8.576 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.154 -8.800 8.066 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.730 -7.754 9.855 1.00 0.00 C ATOM 1534 CE2 TYR A 101 -0.021 -9.352 9.345 1.00 0.00 C ATOM 1535 CZ TYR A 101 0.920 -8.830 10.240 1.00 0.00 C ATOM 1536 OH TYR A 101 1.051 -9.375 11.500 1.00 0.00 O ATOM 0 H TYR A 101 -2.183 -7.001 5.898 1.00 0.00 H new ATOM 0 HA TYR A 101 -0.097 -5.259 7.185 1.00 0.00 H new ATOM 0 HB2 TYR A 101 0.105 -7.868 5.614 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.489 -6.837 5.916 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.220 -6.369 8.280 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.881 -9.203 7.376 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.457 -7.352 10.545 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.645 -10.182 9.642 1.00 0.00 H new ATOM 0 HH TYR A 101 1.750 -8.896 11.993 1.00 0.00 H new ATOM 1546 N GLU A 102 0.388 -4.049 5.027 1.00 0.00 N ATOM 1547 CA GLU A 102 0.503 -3.255 3.771 1.00 0.00 C ATOM 1548 C GLU A 102 1.979 -3.072 3.413 1.00 0.00 C ATOM 1549 O GLU A 102 2.819 -2.883 4.271 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.146 -1.884 3.973 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.624 -2.066 4.322 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.297 -0.695 4.419 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.587 0.296 4.378 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.512 -0.660 4.533 1.00 0.00 O ATOM 0 H GLU A 102 0.901 -3.676 5.825 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.003 -3.782 2.962 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.363 -1.343 4.771 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.046 -1.286 3.067 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.116 -2.672 3.561 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.723 -2.599 5.268 1.00 0.00 H new ATOM 1561 N THR A 103 2.303 -3.123 2.149 1.00 0.00 N ATOM 1562 CA THR A 103 3.724 -2.950 1.734 1.00 0.00 C ATOM 1563 C THR A 103 3.803 -1.902 0.623 1.00 0.00 C ATOM 1564 O THR A 103 3.013 -1.901 -0.299 1.00 0.00 O ATOM 1565 CB THR A 103 4.272 -4.283 1.220 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.017 -5.301 2.178 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.779 -4.164 0.988 1.00 0.00 C ATOM 0 H THR A 103 1.644 -3.277 1.386 1.00 0.00 H new ATOM 0 HA THR A 103 4.316 -2.621 2.588 1.00 0.00 H new ATOM 0 HB THR A 103 3.782 -4.538 0.280 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.366 -6.155 1.848 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.167 -5.115 0.622 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.973 -3.385 0.251 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.272 -3.908 1.926 1.00 0.00 H new ATOM 1575 N LYS A 104 4.752 -1.009 0.701 1.00 0.00 N ATOM 1576 CA LYS A 104 4.878 0.037 -0.352 1.00 0.00 C ATOM 1577 C LYS A 104 6.356 0.253 -0.685 1.00 0.00 C ATOM 1578 O LYS A 104 7.174 0.459 0.190 1.00 0.00 O ATOM 1579 CB LYS A 104 4.272 1.346 0.155 1.00 0.00 C ATOM 1580 CG LYS A 104 4.301 2.390 -0.962 1.00 0.00 C ATOM 1581 CD LYS A 104 3.747 3.716 -0.434 1.00 0.00 C ATOM 1582 CE LYS A 104 3.685 4.733 -1.575 1.00 0.00 C ATOM 1583 NZ LYS A 104 4.251 6.033 -1.113 1.00 0.00 N ATOM 0 H LYS A 104 5.445 -0.959 1.448 1.00 0.00 H new ATOM 0 HA LYS A 104 4.348 -0.285 -1.249 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.247 1.180 0.485 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.831 1.707 1.019 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.321 2.527 -1.321 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.708 2.048 -1.810 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.753 3.565 -0.013 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.380 4.093 0.369 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.245 4.365 -2.435 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.654 4.868 -1.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.477 6.703 -0.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 4.795 5.884 -0.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.876 6.420 -1.848 1.00 0.00 H new ATOM 1597 N LEU A 105 6.703 0.209 -1.942 1.00 0.00 N ATOM 1598 CA LEU A 105 8.127 0.413 -2.329 1.00 0.00 C ATOM 1599 C LEU A 105 8.291 1.797 -2.962 1.00 0.00 C ATOM 1600 O LEU A 105 7.788 2.063 -4.036 1.00 0.00 O ATOM 1601 CB LEU A 105 8.540 -0.663 -3.335 1.00 0.00 C ATOM 1602 CG LEU A 105 8.422 -2.042 -2.684 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.114 -2.023 -1.320 1.00 0.00 C ATOM 1604 CD2 LEU A 105 6.944 -2.393 -2.498 1.00 0.00 C ATOM 0 H LEU A 105 6.062 0.041 -2.717 1.00 0.00 H new ATOM 0 HA LEU A 105 8.759 0.343 -1.443 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.906 -0.611 -4.220 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.564 -0.492 -3.667 1.00 0.00 H new ATOM 0 HG LEU A 105 8.896 -2.787 -3.323 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.030 -3.006 -0.856 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.167 -1.772 -1.450 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.639 -1.278 -0.681 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.859 -3.376 -2.034 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.471 -1.648 -1.859 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.448 -2.406 -3.469 1.00 0.00 H new ATOM 1616 N VAL A 106 8.990 2.680 -2.304 1.00 0.00 N ATOM 1617 CA VAL A 106 9.187 4.047 -2.864 1.00 0.00 C ATOM 1618 C VAL A 106 10.670 4.409 -2.813 1.00 0.00 C ATOM 1619 O VAL A 106 11.305 4.305 -1.785 1.00 0.00 O ATOM 1620 CB VAL A 106 8.406 5.058 -2.029 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.346 6.392 -2.776 1.00 0.00 C ATOM 1622 CG2 VAL A 106 6.986 4.538 -1.791 1.00 0.00 C ATOM 0 H VAL A 106 9.434 2.514 -1.401 1.00 0.00 H new ATOM 0 HA VAL A 106 8.834 4.066 -3.895 1.00 0.00 H new ATOM 0 HB VAL A 106 8.902 5.200 -1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.789 7.117 -2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.358 6.761 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.849 6.250 -3.735 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.429 5.261 -1.195 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.485 4.395 -2.749 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.031 3.587 -1.260 1.00 0.00 H new ATOM 1632 N SER A 107 11.228 4.837 -3.910 1.00 0.00 N ATOM 1633 CA SER A 107 12.670 5.203 -3.904 1.00 0.00 C ATOM 1634 C SER A 107 12.833 6.698 -4.166 1.00 0.00 C ATOM 1635 O SER A 107 11.999 7.329 -4.785 1.00 0.00 O ATOM 1636 CB SER A 107 13.410 4.419 -4.986 1.00 0.00 C ATOM 1637 OG SER A 107 12.815 4.677 -6.249 1.00 0.00 O ATOM 0 H SER A 107 10.751 4.949 -4.805 1.00 0.00 H new ATOM 0 HA SER A 107 13.088 4.960 -2.927 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.462 4.705 -5.002 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.373 3.352 -4.766 1.00 0.00 H new ATOM 0 HG SER A 107 13.291 4.175 -6.943 1.00 0.00 H new ATOM 1643 N ALA A 108 13.910 7.263 -3.700 1.00 0.00 N ATOM 1644 CA ALA A 108 14.146 8.717 -3.920 1.00 0.00 C ATOM 1645 C ALA A 108 15.048 8.902 -5.139 1.00 0.00 C ATOM 1646 O ALA A 108 15.735 7.992 -5.556 1.00 0.00 O ATOM 1647 CB ALA A 108 14.841 9.313 -2.694 1.00 0.00 C ATOM 0 H ALA A 108 14.639 6.780 -3.175 1.00 0.00 H new ATOM 0 HA ALA A 108 13.192 9.218 -4.083 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.014 10.377 -2.855 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.210 9.177 -1.816 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.795 8.810 -2.536 1.00 0.00 H new ATOM 1653 N PRO A 109 15.059 10.114 -5.709 1.00 0.00 N ATOM 1654 CA PRO A 109 15.895 10.427 -6.871 1.00 0.00 C ATOM 1655 C PRO A 109 17.373 10.422 -6.480 1.00 0.00 C ATOM 1656 O PRO A 109 17.906 11.415 -6.027 1.00 0.00 O ATOM 1657 CB PRO A 109 15.451 11.837 -7.263 1.00 0.00 C ATOM 1658 CG PRO A 109 14.899 12.417 -6.005 1.00 0.00 C ATOM 1659 CD PRO A 109 14.263 11.272 -5.267 1.00 0.00 C ATOM 0 HA PRO A 109 15.787 9.706 -7.681 1.00 0.00 H new ATOM 0 HB2 PRO A 109 16.287 12.427 -7.639 1.00 0.00 H new ATOM 0 HB3 PRO A 109 14.699 11.812 -8.052 1.00 0.00 H new ATOM 0 HG2 PRO A 109 15.687 12.877 -5.408 1.00 0.00 H new ATOM 0 HG3 PRO A 109 14.168 13.196 -6.222 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.314 11.409 -4.187 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.210 11.160 -5.524 1.00 0.00 H new ATOM 1667 N HIS A 110 18.027 9.301 -6.627 1.00 0.00 N ATOM 1668 CA HIS A 110 19.462 9.215 -6.238 1.00 0.00 C ATOM 1669 C HIS A 110 19.547 9.060 -4.718 1.00 0.00 C ATOM 1670 O HIS A 110 20.578 9.285 -4.115 1.00 0.00 O ATOM 1671 CB HIS A 110 20.190 10.492 -6.660 1.00 0.00 C ATOM 1672 CG HIS A 110 21.668 10.225 -6.747 1.00 0.00 C ATOM 1673 ND1 HIS A 110 22.206 9.355 -7.682 1.00 0.00 N ATOM 1674 CD2 HIS A 110 22.730 10.704 -6.024 1.00 0.00 C ATOM 1675 CE1 HIS A 110 23.539 9.338 -7.499 1.00 0.00 C ATOM 1676 NE2 HIS A 110 23.912 10.143 -6.500 1.00 0.00 N ATOM 0 H HIS A 110 17.627 8.440 -7.001 1.00 0.00 H new ATOM 0 HA HIS A 110 19.928 8.361 -6.730 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.815 10.835 -7.624 1.00 0.00 H new ATOM 0 HB3 HIS A 110 19.996 11.288 -5.941 1.00 0.00 H new ATOM 0 HD2 HIS A 110 22.660 11.409 -5.209 1.00 0.00 H new ATOM 0 HE1 HIS A 110 24.224 8.746 -8.088 1.00 0.00 H new ATOM 0 HE2 HIS A 110 24.859 10.310 -6.159 1.00 0.00 H new ATOM 1684 N GLY A 111 18.462 8.683 -4.097 1.00 0.00 N ATOM 1685 CA GLY A 111 18.462 8.517 -2.617 1.00 0.00 C ATOM 1686 C GLY A 111 18.300 7.039 -2.266 1.00 0.00 C ATOM 1687 O GLY A 111 18.033 6.687 -1.134 1.00 0.00 O ATOM 0 H GLY A 111 17.572 8.482 -4.554 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.392 8.901 -2.198 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.651 9.097 -2.176 1.00 0.00 H new ATOM 1691 N GLY A 112 18.448 6.171 -3.225 1.00 0.00 N ATOM 1692 CA GLY A 112 18.290 4.719 -2.940 1.00 0.00 C ATOM 1693 C GLY A 112 16.804 4.369 -2.976 1.00 0.00 C ATOM 1694 O GLY A 112 16.029 4.998 -3.668 1.00 0.00 O ATOM 0 H GLY A 112 18.671 6.403 -4.193 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.835 4.128 -3.677 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.711 4.478 -1.964 1.00 0.00 H new ATOM 1698 N THR A 113 16.392 3.376 -2.239 1.00 0.00 N ATOM 1699 CA THR A 113 14.951 3.003 -2.244 1.00 0.00 C ATOM 1700 C THR A 113 14.417 2.977 -0.809 1.00 0.00 C ATOM 1701 O THR A 113 15.039 2.437 0.084 1.00 0.00 O ATOM 1702 CB THR A 113 14.783 1.619 -2.875 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.165 1.674 -4.243 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.321 1.182 -2.769 1.00 0.00 C ATOM 0 H THR A 113 16.988 2.809 -1.636 1.00 0.00 H new ATOM 0 HA THR A 113 14.392 3.738 -2.823 1.00 0.00 H new ATOM 0 HB THR A 113 15.413 0.901 -2.350 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.869 1.014 -4.413 1.00 0.00 H new ATOM 0 HG21 THR A 113 13.202 0.196 -3.219 1.00 0.00 H new ATOM 0 HG22 THR A 113 13.029 1.140 -1.720 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.688 1.898 -3.293 1.00 0.00 H new ATOM 1712 N ILE A 114 13.264 3.550 -0.582 1.00 0.00 N ATOM 1713 CA ILE A 114 12.689 3.549 0.792 1.00 0.00 C ATOM 1714 C ILE A 114 11.514 2.572 0.840 1.00 0.00 C ATOM 1715 O ILE A 114 10.675 2.557 -0.038 1.00 0.00 O ATOM 1716 CB ILE A 114 12.200 4.955 1.144 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.328 5.963 0.915 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.773 4.992 2.613 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.757 7.382 0.947 1.00 0.00 C ATOM 0 H ILE A 114 12.697 4.018 -1.289 1.00 0.00 H new ATOM 0 HA ILE A 114 13.451 3.244 1.509 1.00 0.00 H new ATOM 0 HB ILE A 114 11.351 5.213 0.511 1.00 0.00 H new ATOM 0 HG12 ILE A 114 14.093 5.850 1.683 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.809 5.775 -0.045 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.424 5.993 2.865 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.968 4.276 2.776 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.622 4.733 3.245 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.560 8.101 0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.008 7.491 0.163 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.296 7.567 1.917 1.00 0.00 H new ATOM 1731 N ILE A 115 11.446 1.755 1.854 1.00 0.00 N ATOM 1732 CA ILE A 115 10.323 0.780 1.943 1.00 0.00 C ATOM 1733 C ILE A 115 9.472 1.082 3.179 1.00 0.00 C ATOM 1734 O ILE A 115 9.932 0.990 4.300 1.00 0.00 O ATOM 1735 CB ILE A 115 10.887 -0.638 2.045 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.864 -0.882 0.894 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.740 -1.648 1.963 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.790 -2.048 1.249 1.00 0.00 C ATOM 0 H ILE A 115 12.116 1.720 2.622 1.00 0.00 H new ATOM 0 HA ILE A 115 9.702 0.863 1.051 1.00 0.00 H new ATOM 0 HB ILE A 115 11.409 -0.755 2.995 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.316 -1.105 -0.021 1.00 0.00 H new ATOM 0 HG13 ILE A 115 12.450 0.017 0.704 1.00 0.00 H new ATOM 0 HG21 ILE A 115 10.140 -2.659 2.035 1.00 0.00 H new ATOM 0 HG22 ILE A 115 9.043 -1.474 2.782 1.00 0.00 H new ATOM 0 HG23 ILE A 115 9.219 -1.531 1.013 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.486 -2.222 0.429 1.00 0.00 H new ATOM 0 HD12 ILE A 115 13.348 -1.807 2.154 1.00 0.00 H new ATOM 0 HD13 ILE A 115 12.196 -2.946 1.417 1.00 0.00 H new ATOM 1750 N LYS A 116 8.230 1.432 2.980 1.00 0.00 N ATOM 1751 CA LYS A 116 7.342 1.729 4.138 1.00 0.00 C ATOM 1752 C LYS A 116 6.363 0.569 4.324 1.00 0.00 C ATOM 1753 O LYS A 116 5.730 0.126 3.386 1.00 0.00 O ATOM 1754 CB LYS A 116 6.563 3.018 3.867 1.00 0.00 C ATOM 1755 CG LYS A 116 7.537 4.192 3.758 1.00 0.00 C ATOM 1756 CD LYS A 116 6.749 5.494 3.598 1.00 0.00 C ATOM 1757 CE LYS A 116 7.721 6.670 3.487 1.00 0.00 C ATOM 1758 NZ LYS A 116 7.844 7.081 2.059 1.00 0.00 N ATOM 0 H LYS A 116 7.792 1.525 2.063 1.00 0.00 H new ATOM 0 HA LYS A 116 7.941 1.854 5.040 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.989 2.921 2.945 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.848 3.199 4.670 1.00 0.00 H new ATOM 0 HG2 LYS A 116 8.165 4.241 4.647 1.00 0.00 H new ATOM 0 HG3 LYS A 116 8.202 4.049 2.906 1.00 0.00 H new ATOM 0 HD2 LYS A 116 6.120 5.444 2.709 1.00 0.00 H new ATOM 0 HD3 LYS A 116 6.085 5.637 4.451 1.00 0.00 H new ATOM 0 HE2 LYS A 116 7.366 7.507 4.088 1.00 0.00 H new ATOM 0 HE3 LYS A 116 8.697 6.387 3.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 8.505 7.881 1.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 8.202 6.282 1.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.911 7.368 1.699 1.00 0.00 H new ATOM 1772 N THR A 117 6.235 0.067 5.521 1.00 0.00 N ATOM 1773 CA THR A 117 5.298 -1.070 5.748 1.00 0.00 C ATOM 1774 C THR A 117 4.296 -0.710 6.848 1.00 0.00 C ATOM 1775 O THR A 117 4.663 -0.257 7.914 1.00 0.00 O ATOM 1776 CB THR A 117 6.093 -2.308 6.170 1.00 0.00 C ATOM 1777 OG1 THR A 117 7.049 -2.620 5.165 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.139 -3.489 6.354 1.00 0.00 C ATOM 0 H THR A 117 6.736 0.392 6.348 1.00 0.00 H new ATOM 0 HA THR A 117 4.757 -1.277 4.825 1.00 0.00 H new ATOM 0 HB THR A 117 6.607 -2.109 7.111 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.355 -3.544 5.280 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.705 -4.371 6.654 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.406 -3.248 7.124 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.625 -3.691 5.414 1.00 0.00 H new ATOM 1786 N THR A 118 3.034 -0.918 6.596 1.00 0.00 N ATOM 1787 CA THR A 118 2.000 -0.601 7.622 1.00 0.00 C ATOM 1788 C THR A 118 1.139 -1.842 7.861 1.00 0.00 C ATOM 1789 O THR A 118 0.790 -2.551 6.939 1.00 0.00 O ATOM 1790 CB THR A 118 1.117 0.544 7.122 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.936 1.646 6.753 1.00 0.00 O ATOM 1792 CG2 THR A 118 0.155 0.971 8.232 1.00 0.00 C ATOM 0 H THR A 118 2.672 -1.295 5.720 1.00 0.00 H new ATOM 0 HA THR A 118 2.484 -0.302 8.552 1.00 0.00 H new ATOM 0 HB THR A 118 0.545 0.210 6.256 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.372 2.380 6.431 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.474 1.787 7.875 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.473 0.126 8.514 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.725 1.305 9.099 1.00 0.00 H new ATOM 1800 N SER A 119 0.796 -2.118 9.090 1.00 0.00 N ATOM 1801 CA SER A 119 -0.037 -3.321 9.369 1.00 0.00 C ATOM 1802 C SER A 119 -1.022 -3.026 10.503 1.00 0.00 C ATOM 1803 O SER A 119 -0.770 -2.204 11.362 1.00 0.00 O ATOM 1804 CB SER A 119 0.870 -4.484 9.777 1.00 0.00 C ATOM 1805 OG SER A 119 1.478 -4.193 11.027 1.00 0.00 O ATOM 0 H SER A 119 1.055 -1.566 9.908 1.00 0.00 H new ATOM 0 HA SER A 119 -0.594 -3.584 8.470 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.290 -5.404 9.848 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.635 -4.647 9.017 1.00 0.00 H new ATOM 0 HG SER A 119 2.058 -4.938 11.290 1.00 0.00 H new ATOM 1811 N LYS A 120 -2.143 -3.696 10.511 1.00 0.00 N ATOM 1812 CA LYS A 120 -3.147 -3.467 11.587 1.00 0.00 C ATOM 1813 C LYS A 120 -3.489 -4.805 12.246 1.00 0.00 C ATOM 1814 O LYS A 120 -3.553 -5.828 11.594 1.00 0.00 O ATOM 1815 CB LYS A 120 -4.415 -2.857 10.985 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.063 -1.546 10.278 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.329 -0.944 9.665 1.00 0.00 C ATOM 1818 CE LYS A 120 -4.963 0.316 8.877 1.00 0.00 C ATOM 1819 NZ LYS A 120 -6.210 1.034 8.484 1.00 0.00 N ATOM 0 H LYS A 120 -2.406 -4.394 9.816 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.737 -2.784 12.331 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -4.867 -3.554 10.279 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -5.151 -2.674 11.768 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -3.620 -0.846 10.986 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.320 -1.727 9.501 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.809 -1.670 9.009 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.046 -0.700 10.449 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -4.331 0.966 9.482 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -4.389 0.049 7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -5.963 1.891 7.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -6.797 0.412 7.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -6.741 1.300 9.338 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.705 -4.811 13.533 1.00 0.00 N ATOM 1834 CA TYR A 121 -4.036 -6.088 14.225 1.00 0.00 C ATOM 1835 C TYR A 121 -5.491 -6.057 14.700 1.00 0.00 C ATOM 1836 O TYR A 121 -5.895 -5.179 15.436 1.00 0.00 O ATOM 1837 CB TYR A 121 -3.112 -6.267 15.431 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.673 -6.244 14.972 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -1.048 -7.428 14.565 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.965 -5.036 14.955 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.286 -7.406 14.141 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.369 -5.014 14.530 1.00 0.00 C ATOM 1843 CZ TYR A 121 0.994 -6.198 14.122 1.00 0.00 C ATOM 1844 OH TYR A 121 2.309 -6.176 13.704 1.00 0.00 O ATOM 0 H TYR A 121 -3.667 -3.988 14.134 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.900 -6.919 13.532 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.286 -5.473 16.157 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -3.330 -7.210 15.932 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.595 -8.359 14.578 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.447 -4.122 15.269 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.769 -8.320 13.829 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.916 -4.083 14.517 1.00 0.00 H new ATOM 0 HH TYR A 121 2.652 -5.259 13.751 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.279 -7.014 14.290 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.704 -7.041 14.723 1.00 0.00 C ATOM 1856 C HIS A 122 -7.842 -7.949 15.947 1.00 0.00 C ATOM 1857 O HIS A 122 -7.273 -9.022 16.001 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.575 -7.579 13.587 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.506 -6.639 12.413 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -9.084 -5.379 12.441 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -7.932 -6.762 11.173 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -8.847 -4.799 11.250 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.148 -5.598 10.440 1.00 0.00 N ATOM 0 H HIS A 122 -5.997 -7.777 13.675 1.00 0.00 H new ATOM 0 HA HIS A 122 -8.027 -6.032 14.977 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.234 -8.572 13.292 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.607 -7.683 13.923 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -7.395 -7.629 10.819 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -9.182 -3.808 10.982 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -7.839 -5.399 9.489 1.00 0.00 H new ATOM 1871 N THR A 123 -8.591 -7.531 16.930 1.00 0.00 N ATOM 1872 CA THR A 123 -8.760 -8.375 18.146 1.00 0.00 C ATOM 1873 C THR A 123 -10.249 -8.524 18.464 1.00 0.00 C ATOM 1874 O THR A 123 -11.052 -7.673 18.137 1.00 0.00 O ATOM 1875 CB THR A 123 -8.051 -7.712 19.330 1.00 0.00 C ATOM 1876 OG1 THR A 123 -8.794 -6.577 19.749 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.646 -7.278 18.909 1.00 0.00 C ATOM 0 H THR A 123 -9.093 -6.643 16.944 1.00 0.00 H new ATOM 0 HA THR A 123 -8.327 -9.359 17.966 1.00 0.00 H new ATOM 0 HB THR A 123 -7.977 -8.422 20.153 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.342 -6.152 20.508 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.143 -6.806 19.753 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.077 -8.150 18.588 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.716 -6.568 18.085 1.00 0.00 H new ATOM 2169 N ALA A 142 10.754 -6.482 9.912 1.00 0.00 N ATOM 2170 CA ALA A 142 11.850 -5.551 9.524 1.00 0.00 C ATOM 2171 C ALA A 142 13.132 -6.348 9.275 1.00 0.00 C ATOM 2172 O ALA A 142 13.880 -6.068 8.359 1.00 0.00 O ATOM 2173 CB ALA A 142 12.087 -4.544 10.651 1.00 0.00 C ATOM 0 HA ALA A 142 11.570 -5.019 8.615 1.00 0.00 H new ATOM 0 HB1 ALA A 142 12.889 -3.863 10.367 1.00 0.00 H new ATOM 0 HB2 ALA A 142 11.174 -3.976 10.829 1.00 0.00 H new ATOM 0 HB3 ALA A 142 12.367 -5.075 11.561 1.00 0.00 H new ATOM 2179 N HIS A 143 13.392 -7.339 10.082 1.00 0.00 N ATOM 2180 CA HIS A 143 14.626 -8.152 9.890 1.00 0.00 C ATOM 2181 C HIS A 143 14.579 -8.838 8.525 1.00 0.00 C ATOM 2182 O HIS A 143 15.550 -8.856 7.794 1.00 0.00 O ATOM 2183 CB HIS A 143 14.714 -9.211 10.991 1.00 0.00 C ATOM 2184 CG HIS A 143 15.990 -9.991 10.835 1.00 0.00 C ATOM 2185 ND1 HIS A 143 17.236 -9.417 11.034 1.00 0.00 N ATOM 2186 CD2 HIS A 143 16.230 -11.301 10.498 1.00 0.00 C ATOM 2187 CE1 HIS A 143 18.161 -10.371 10.818 1.00 0.00 C ATOM 2188 NE2 HIS A 143 17.602 -11.538 10.488 1.00 0.00 N ATOM 0 H HIS A 143 12.804 -7.621 10.866 1.00 0.00 H new ATOM 0 HA HIS A 143 15.500 -7.503 9.939 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.684 -8.735 11.971 1.00 0.00 H new ATOM 0 HB3 HIS A 143 13.856 -9.881 10.935 1.00 0.00 H new ATOM 0 HD2 HIS A 143 15.470 -12.035 10.275 1.00 0.00 H new ATOM 0 HE1 HIS A 143 19.226 -10.212 10.901 1.00 0.00 H new ATOM 0 HE2 HIS A 143 18.078 -12.415 10.275 1.00 0.00 H new ATOM 2196 N LEU A 144 13.458 -9.405 8.173 1.00 0.00 N ATOM 2197 CA LEU A 144 13.351 -10.090 6.854 1.00 0.00 C ATOM 2198 C LEU A 144 13.778 -9.128 5.743 1.00 0.00 C ATOM 2199 O LEU A 144 14.545 -9.477 4.868 1.00 0.00 O ATOM 2200 CB LEU A 144 11.902 -10.525 6.622 1.00 0.00 C ATOM 2201 CG LEU A 144 11.494 -11.532 7.700 1.00 0.00 C ATOM 2202 CD1 LEU A 144 10.067 -12.015 7.432 1.00 0.00 C ATOM 2203 CD2 LEU A 144 12.450 -12.726 7.671 1.00 0.00 C ATOM 0 H LEU A 144 12.611 -9.424 8.742 1.00 0.00 H new ATOM 0 HA LEU A 144 14.000 -10.966 6.846 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.242 -9.658 6.650 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.799 -10.972 5.633 1.00 0.00 H new ATOM 0 HG LEU A 144 11.539 -11.055 8.679 1.00 0.00 H new ATOM 0 HD11 LEU A 144 9.776 -12.732 8.199 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.385 -11.165 7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 144 10.022 -12.493 6.453 1.00 0.00 H new ATOM 0 HD21 LEU A 144 12.160 -13.443 8.439 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.406 -13.204 6.692 1.00 0.00 H new ATOM 0 HD23 LEU A 144 13.467 -12.383 7.861 1.00 0.00 H new ATOM 2215 N PHE A 145 13.287 -7.920 5.771 1.00 0.00 N ATOM 2216 CA PHE A 145 13.665 -6.936 4.717 1.00 0.00 C ATOM 2217 C PHE A 145 15.189 -6.840 4.628 1.00 0.00 C ATOM 2218 O PHE A 145 15.747 -6.616 3.572 1.00 0.00 O ATOM 2219 CB PHE A 145 13.086 -5.564 5.069 1.00 0.00 C ATOM 2220 CG PHE A 145 11.589 -5.586 4.875 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.048 -5.457 3.590 1.00 0.00 C ATOM 2222 CD2 PHE A 145 10.741 -5.738 5.979 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.661 -5.477 3.408 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.353 -5.758 5.798 1.00 0.00 C ATOM 2225 CZ PHE A 145 8.813 -5.628 4.512 1.00 0.00 C ATOM 0 H PHE A 145 12.640 -7.571 6.478 1.00 0.00 H new ATOM 0 HA PHE A 145 13.267 -7.263 3.756 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.326 -5.310 6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.534 -4.796 4.439 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.702 -5.342 2.738 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.158 -5.840 6.970 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.245 -5.376 2.417 1.00 0.00 H new ATOM 0 HE2 PHE A 145 8.699 -5.874 6.649 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.742 -5.644 4.372 1.00 0.00 H new ATOM 2235 N LYS A 146 15.869 -7.004 5.730 1.00 0.00 N ATOM 2236 CA LYS A 146 17.357 -6.920 5.707 1.00 0.00 C ATOM 2237 C LYS A 146 17.925 -8.112 4.934 1.00 0.00 C ATOM 2238 O LYS A 146 18.927 -8.004 4.257 1.00 0.00 O ATOM 2239 CB LYS A 146 17.891 -6.939 7.141 1.00 0.00 C ATOM 2240 CG LYS A 146 19.410 -6.751 7.121 1.00 0.00 C ATOM 2241 CD LYS A 146 19.953 -6.846 8.548 1.00 0.00 C ATOM 2242 CE LYS A 146 21.449 -6.523 8.548 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.016 -6.797 9.898 1.00 0.00 N ATOM 0 H LYS A 146 15.459 -7.192 6.645 1.00 0.00 H new ATOM 0 HA LYS A 146 17.661 -5.994 5.219 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.423 -6.147 7.725 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.637 -7.883 7.623 1.00 0.00 H new ATOM 0 HG2 LYS A 146 19.873 -7.512 6.493 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.662 -5.783 6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.420 -6.152 9.198 1.00 0.00 H new ATOM 0 HD3 LYS A 146 19.786 -7.847 8.946 1.00 0.00 H new ATOM 0 HE2 LYS A 146 21.962 -7.125 7.797 1.00 0.00 H new ATOM 0 HE3 LYS A 146 21.606 -5.478 8.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.033 -6.578 9.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 21.534 -6.205 10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 21.878 -7.800 10.135 1.00 0.00 H new ATOM 2257 N LEU A 147 17.292 -9.249 5.031 1.00 0.00 N ATOM 2258 CA LEU A 147 17.798 -10.446 4.302 1.00 0.00 C ATOM 2259 C LEU A 147 17.543 -10.277 2.803 1.00 0.00 C ATOM 2260 O LEU A 147 18.358 -10.641 1.979 1.00 0.00 O ATOM 2261 CB LEU A 147 17.070 -11.695 4.805 1.00 0.00 C ATOM 2262 CG LEU A 147 17.525 -12.011 6.232 1.00 0.00 C ATOM 2263 CD1 LEU A 147 19.054 -12.015 6.292 1.00 0.00 C ATOM 2264 CD2 LEU A 147 16.979 -10.949 7.188 1.00 0.00 C ATOM 0 H LEU A 147 16.448 -9.401 5.583 1.00 0.00 H new ATOM 0 HA LEU A 147 18.868 -10.553 4.479 1.00 0.00 H new ATOM 0 HB2 LEU A 147 15.992 -11.534 4.783 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.280 -12.540 4.149 1.00 0.00 H new ATOM 0 HG LEU A 147 17.148 -12.991 6.525 1.00 0.00 H new ATOM 0 HD11 LEU A 147 19.378 -12.240 7.308 1.00 0.00 H new ATOM 0 HD12 LEU A 147 19.443 -12.772 5.611 1.00 0.00 H new ATOM 0 HD13 LEU A 147 19.432 -11.036 5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 147 17.303 -11.173 8.204 1.00 0.00 H new ATOM 0 HD22 LEU A 147 17.355 -9.969 6.896 1.00 0.00 H new ATOM 0 HD23 LEU A 147 15.890 -10.947 7.146 1.00 0.00 H new ATOM 2276 N ILE A 148 16.416 -9.726 2.443 1.00 0.00 N ATOM 2277 CA ILE A 148 16.108 -9.534 0.998 1.00 0.00 C ATOM 2278 C ILE A 148 17.176 -8.639 0.363 1.00 0.00 C ATOM 2279 O ILE A 148 17.687 -8.927 -0.702 1.00 0.00 O ATOM 2280 CB ILE A 148 14.738 -8.871 0.853 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.672 -9.755 1.503 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.413 -8.689 -0.632 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.320 -9.040 1.456 1.00 0.00 C ATOM 0 H ILE A 148 15.695 -9.401 3.087 1.00 0.00 H new ATOM 0 HA ILE A 148 16.099 -10.502 0.497 1.00 0.00 H new ATOM 0 HB ILE A 148 14.752 -7.898 1.344 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.609 -10.710 0.982 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.945 -9.973 2.536 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.436 -8.216 -0.735 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.172 -8.059 -1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.399 -9.662 -1.123 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.560 -9.669 1.919 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.389 -8.096 1.997 1.00 0.00 H new ATOM 0 HD13 ILE A 148 12.047 -8.845 0.419 1.00 0.00 H new ATOM 2295 N GLU A 149 17.517 -7.558 1.008 1.00 0.00 N ATOM 2296 CA GLU A 149 18.550 -6.646 0.442 1.00 0.00 C ATOM 2297 C GLU A 149 19.919 -7.327 0.498 1.00 0.00 C ATOM 2298 O GLU A 149 20.754 -7.137 -0.365 1.00 0.00 O ATOM 2299 CB GLU A 149 18.589 -5.353 1.259 1.00 0.00 C ATOM 2300 CG GLU A 149 19.510 -4.342 0.572 1.00 0.00 C ATOM 2301 CD GLU A 149 19.780 -3.172 1.521 1.00 0.00 C ATOM 2302 OE1 GLU A 149 19.236 -3.184 2.614 1.00 0.00 O ATOM 2303 OE2 GLU A 149 20.524 -2.284 1.140 1.00 0.00 O ATOM 0 H GLU A 149 17.125 -7.267 1.903 1.00 0.00 H new ATOM 0 HA GLU A 149 18.303 -6.415 -0.594 1.00 0.00 H new ATOM 0 HB2 GLU A 149 17.585 -4.940 1.354 1.00 0.00 H new ATOM 0 HB3 GLU A 149 18.946 -5.559 2.268 1.00 0.00 H new ATOM 0 HG2 GLU A 149 20.448 -4.821 0.291 1.00 0.00 H new ATOM 0 HG3 GLU A 149 19.049 -3.980 -0.347 1.00 0.00 H new ATOM 2310 N GLY A 150 20.158 -8.118 1.509 1.00 0.00 N ATOM 2311 CA GLY A 150 21.473 -8.809 1.620 1.00 0.00 C ATOM 2312 C GLY A 150 21.607 -9.842 0.499 1.00 0.00 C ATOM 2313 O GLY A 150 22.648 -9.977 -0.113 1.00 0.00 O ATOM 0 H GLY A 150 19.499 -8.315 2.262 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.283 -8.083 1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.557 -9.298 2.591 1.00 0.00 H new ATOM 2317 N TYR A 151 20.562 -10.573 0.224 1.00 0.00 N ATOM 2318 CA TYR A 151 20.633 -11.597 -0.858 1.00 0.00 C ATOM 2319 C TYR A 151 20.889 -10.907 -2.198 1.00 0.00 C ATOM 2320 O TYR A 151 21.727 -11.325 -2.973 1.00 0.00 O ATOM 2321 CB TYR A 151 19.310 -12.363 -0.923 1.00 0.00 C ATOM 2322 CG TYR A 151 19.123 -13.154 0.350 1.00 0.00 C ATOM 2323 CD1 TYR A 151 20.165 -13.953 0.837 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.908 -13.089 1.041 1.00 0.00 C ATOM 2325 CE1 TYR A 151 19.990 -14.687 2.016 1.00 0.00 C ATOM 2326 CE2 TYR A 151 17.734 -13.823 2.222 1.00 0.00 C ATOM 2327 CZ TYR A 151 18.776 -14.622 2.709 1.00 0.00 C ATOM 2328 OH TYR A 151 18.604 -15.345 3.872 1.00 0.00 O ATOM 0 H TYR A 151 19.663 -10.506 0.701 1.00 0.00 H new ATOM 0 HA TYR A 151 21.445 -12.292 -0.647 1.00 0.00 H new ATOM 0 HB2 TYR A 151 18.481 -11.668 -1.057 1.00 0.00 H new ATOM 0 HB3 TYR A 151 19.307 -13.032 -1.783 1.00 0.00 H new ATOM 0 HD1 TYR A 151 21.103 -14.003 0.303 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.105 -12.473 0.664 1.00 0.00 H new ATOM 0 HE1 TYR A 151 20.793 -15.304 2.391 1.00 0.00 H new ATOM 0 HE2 TYR A 151 16.797 -13.773 2.756 1.00 0.00 H new ATOM 0 HH TYR A 151 18.256 -14.757 4.574 1.00 0.00 H new ATOM 2338 N LEU A 152 20.174 -9.852 -2.480 1.00 0.00 N ATOM 2339 CA LEU A 152 20.378 -9.137 -3.771 1.00 0.00 C ATOM 2340 C LEU A 152 21.837 -8.687 -3.883 1.00 0.00 C ATOM 2341 O LEU A 152 22.476 -8.871 -4.899 1.00 0.00 O ATOM 2342 CB LEU A 152 19.462 -7.914 -3.827 1.00 0.00 C ATOM 2343 CG LEU A 152 18.001 -8.367 -3.767 1.00 0.00 C ATOM 2344 CD1 LEU A 152 17.084 -7.154 -3.936 1.00 0.00 C ATOM 2345 CD2 LEU A 152 17.734 -9.370 -4.892 1.00 0.00 C ATOM 0 H LEU A 152 19.458 -9.455 -1.872 1.00 0.00 H new ATOM 0 HA LEU A 152 20.141 -9.807 -4.597 1.00 0.00 H new ATOM 0 HB2 LEU A 152 19.681 -7.244 -2.995 1.00 0.00 H new ATOM 0 HB3 LEU A 152 19.642 -7.353 -4.744 1.00 0.00 H new ATOM 0 HG LEU A 152 17.804 -8.839 -2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 152 16.043 -7.476 -3.893 1.00 0.00 H new ATOM 0 HD12 LEU A 152 17.276 -6.439 -3.136 1.00 0.00 H new ATOM 0 HD13 LEU A 152 17.279 -6.682 -4.899 1.00 0.00 H new ATOM 0 HD21 LEU A 152 16.694 -9.694 -4.851 1.00 0.00 H new ATOM 0 HD22 LEU A 152 17.929 -8.898 -5.855 1.00 0.00 H new ATOM 0 HD23 LEU A 152 18.388 -10.234 -4.772 1.00 0.00 H new