USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 889 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: B 106 GLN : amide:sc= -0.15 K(o=0.81,f=-0.78) USER MOD Set 1.2: B 110 TYR OH : rot -70:sc= 0.959 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -166:sc=-0.00337 (180deg=-0.196) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 167:sc= -0.0248 (180deg=-0.204) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN :FLIP amide:sc= 0.167 F(o=-0.97,f=0.17) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 ASN :FLIP amide:sc= -1.14 F(o=-3!,f=-1.1) USER MOD Single : A 22 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 24 GLN :FLIP amide:sc=-0.00118 F(o=-0.78,f=-0.0012) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN :FLIP amide:sc= -0.0367 F(o=-3.3!,f=-0.037) USER MOD Single : A 30 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0324) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.196 X(o=-0.2,f=-0.2) USER MOD Single : B 88 SER OG : rot 180:sc= -0.0973 USER MOD Single : B 100 GLN : amide:sc= 0.623 K(o=0.62,f=-7.5!) USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 ASN :FLIP amide:sc= -1.27 F(o=-2.2,f=-1.3) USER MOD Single : B 111 LYS NZ :NH3+ 169:sc= -0.0334 (180deg=-0.256) USER MOD Single : B 112 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0247) USER MOD Single : B 115 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B 123 LYS NZ :NH3+ 180:sc=-0.00768 (180deg=-0.00768) USER MOD Single : B 130 SER OG : rot 180:sc= 0 USER MOD Single : B 133 THR OG1 : rot 180:sc= 0.795 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 31.724 -1.622 9.179 1.00 0.00 N ATOM 2 CA MET A 1 32.645 -0.537 9.585 1.00 0.00 C ATOM 3 C MET A 1 33.125 0.232 8.362 1.00 0.00 C ATOM 4 O MET A 1 34.076 -0.175 7.695 1.00 0.00 O ATOM 5 CB MET A 1 33.851 -1.107 10.334 1.00 0.00 C ATOM 6 CG MET A 1 33.501 -1.799 11.639 1.00 0.00 C ATOM 7 SD MET A 1 34.940 -2.549 12.427 1.00 0.00 S ATOM 8 CE MET A 1 34.181 -3.304 13.862 1.00 0.00 C ATOM 0 H1 MET A 1 31.223 -1.983 10.016 1.00 0.00 H new ATOM 0 H2 MET A 1 31.034 -1.253 8.494 1.00 0.00 H new ATOM 0 H3 MET A 1 32.268 -2.393 8.742 1.00 0.00 H new ATOM 0 HA MET A 1 32.103 0.139 10.247 1.00 0.00 H new ATOM 0 HB2 MET A 1 34.365 -1.816 9.686 1.00 0.00 H new ATOM 0 HB3 MET A 1 34.552 -0.298 10.541 1.00 0.00 H new ATOM 0 HG2 MET A 1 33.052 -1.077 12.321 1.00 0.00 H new ATOM 0 HG3 MET A 1 32.752 -2.568 11.450 1.00 0.00 H new ATOM 0 HE1 MET A 1 34.944 -3.810 14.454 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.703 -2.534 14.468 1.00 0.00 H new ATOM 0 HE3 MET A 1 33.433 -4.028 13.539 1.00 0.00 H new ATOM 20 N ASP A 2 32.463 1.340 8.066 1.00 0.00 N ATOM 21 CA ASP A 2 32.820 2.157 6.913 1.00 0.00 C ATOM 22 C ASP A 2 33.270 3.538 7.358 1.00 0.00 C ATOM 23 O ASP A 2 32.765 4.081 8.339 1.00 0.00 O ATOM 24 CB ASP A 2 31.636 2.289 5.954 1.00 0.00 C ATOM 25 CG ASP A 2 31.269 0.979 5.291 1.00 0.00 C ATOM 26 OD1 ASP A 2 31.872 0.650 4.247 1.00 0.00 O ATOM 27 OD2 ASP A 2 30.384 0.275 5.812 1.00 0.00 O ATOM 0 H ASP A 2 31.675 1.695 8.608 1.00 0.00 H new ATOM 0 HA ASP A 2 33.641 1.663 6.394 1.00 0.00 H new ATOM 0 HB2 ASP A 2 30.773 2.669 6.500 1.00 0.00 H new ATOM 0 HB3 ASP A 2 31.876 3.025 5.186 1.00 0.00 H new ATOM 32 N SER A 3 34.227 4.090 6.634 1.00 0.00 N ATOM 33 CA SER A 3 34.755 5.409 6.930 1.00 0.00 C ATOM 34 C SER A 3 34.001 6.473 6.138 1.00 0.00 C ATOM 35 O SER A 3 33.637 7.519 6.674 1.00 0.00 O ATOM 36 CB SER A 3 36.244 5.454 6.597 1.00 0.00 C ATOM 37 OG SER A 3 36.931 4.378 7.216 1.00 0.00 O ATOM 0 H SER A 3 34.658 3.639 5.828 1.00 0.00 H new ATOM 0 HA SER A 3 34.622 5.614 7.992 1.00 0.00 H new ATOM 0 HB2 SER A 3 36.381 5.406 5.517 1.00 0.00 H new ATOM 0 HB3 SER A 3 36.667 6.402 6.930 1.00 0.00 H new ATOM 0 HG SER A 3 37.883 4.424 6.989 1.00 0.00 H new ATOM 43 N ALA A 4 33.766 6.195 4.860 1.00 0.00 N ATOM 44 CA ALA A 4 33.012 7.103 4.007 1.00 0.00 C ATOM 45 C ALA A 4 31.536 7.051 4.374 1.00 0.00 C ATOM 46 O ALA A 4 30.892 8.083 4.561 1.00 0.00 O ATOM 47 CB ALA A 4 33.214 6.750 2.541 1.00 0.00 C ATOM 0 H ALA A 4 34.088 5.347 4.393 1.00 0.00 H new ATOM 0 HA ALA A 4 33.376 8.118 4.163 1.00 0.00 H new ATOM 0 HB1 ALA A 4 32.643 7.439 1.919 1.00 0.00 H new ATOM 0 HB2 ALA A 4 34.272 6.827 2.291 1.00 0.00 H new ATOM 0 HB3 ALA A 4 32.872 5.731 2.362 1.00 0.00 H new ATOM 53 N ILE A 5 31.012 5.841 4.488 1.00 0.00 N ATOM 54 CA ILE A 5 29.639 5.645 4.916 1.00 0.00 C ATOM 55 C ILE A 5 29.579 5.664 6.436 1.00 0.00 C ATOM 56 O ILE A 5 29.867 4.661 7.093 1.00 0.00 O ATOM 57 CB ILE A 5 29.079 4.301 4.406 1.00 0.00 C ATOM 58 CG1 ILE A 5 29.349 4.147 2.908 1.00 0.00 C ATOM 59 CG2 ILE A 5 27.585 4.205 4.692 1.00 0.00 C ATOM 60 CD1 ILE A 5 28.982 2.785 2.362 1.00 0.00 C ATOM 0 H ILE A 5 31.519 4.979 4.289 1.00 0.00 H new ATOM 0 HA ILE A 5 29.034 6.451 4.500 1.00 0.00 H new ATOM 0 HB ILE A 5 29.583 3.491 4.933 1.00 0.00 H new ATOM 0 HG12 ILE A 5 28.789 4.909 2.366 1.00 0.00 H new ATOM 0 HG13 ILE A 5 30.406 4.333 2.717 1.00 0.00 H new ATOM 0 HG21 ILE A 5 27.205 3.251 4.326 1.00 0.00 H new ATOM 0 HG22 ILE A 5 27.415 4.275 5.766 1.00 0.00 H new ATOM 0 HG23 ILE A 5 27.065 5.020 4.188 1.00 0.00 H new ATOM 0 HD11 ILE A 5 29.201 2.750 1.295 1.00 0.00 H new ATOM 0 HD12 ILE A 5 29.561 2.018 2.877 1.00 0.00 H new ATOM 0 HD13 ILE A 5 27.919 2.604 2.520 1.00 0.00 H new ATOM 72 N SER A 6 29.215 6.802 6.999 1.00 0.00 N ATOM 73 CA SER A 6 29.145 6.932 8.439 1.00 0.00 C ATOM 74 C SER A 6 27.722 6.666 8.904 1.00 0.00 C ATOM 75 O SER A 6 26.860 6.341 8.085 1.00 0.00 O ATOM 76 CB SER A 6 29.601 8.331 8.852 1.00 0.00 C ATOM 77 OG SER A 6 30.881 8.623 8.310 1.00 0.00 O ATOM 0 H SER A 6 28.965 7.645 6.482 1.00 0.00 H new ATOM 0 HA SER A 6 29.805 6.203 8.908 1.00 0.00 H new ATOM 0 HB2 SER A 6 28.878 9.071 8.508 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.636 8.401 9.939 1.00 0.00 H new ATOM 0 HG SER A 6 31.155 9.523 8.584 1.00 0.00 H new ATOM 83 N LYS A 7 27.465 6.800 10.199 1.00 0.00 N ATOM 84 CA LYS A 7 26.116 6.665 10.711 1.00 0.00 C ATOM 85 C LYS A 7 25.202 7.679 10.024 1.00 0.00 C ATOM 86 O LYS A 7 24.007 7.450 9.861 1.00 0.00 O ATOM 87 CB LYS A 7 26.129 6.870 12.222 1.00 0.00 C ATOM 88 CG LYS A 7 24.788 6.654 12.896 1.00 0.00 C ATOM 89 CD LYS A 7 24.235 5.250 12.662 1.00 0.00 C ATOM 90 CE LYS A 7 25.105 4.175 13.299 1.00 0.00 C ATOM 91 NZ LYS A 7 25.183 4.324 14.775 1.00 0.00 N ATOM 0 H LYS A 7 28.171 7.001 10.907 1.00 0.00 H new ATOM 0 HA LYS A 7 25.733 5.666 10.500 1.00 0.00 H new ATOM 0 HB2 LYS A 7 26.857 6.189 12.662 1.00 0.00 H new ATOM 0 HB3 LYS A 7 26.470 7.883 12.436 1.00 0.00 H new ATOM 0 HG2 LYS A 7 24.892 6.826 13.967 1.00 0.00 H new ATOM 0 HG3 LYS A 7 24.075 7.389 12.523 1.00 0.00 H new ATOM 0 HD2 LYS A 7 23.226 5.186 13.069 1.00 0.00 H new ATOM 0 HD3 LYS A 7 24.159 5.065 11.590 1.00 0.00 H new ATOM 0 HE2 LYS A 7 24.703 3.192 13.055 1.00 0.00 H new ATOM 0 HE3 LYS A 7 26.109 4.223 12.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 25.593 3.463 15.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 25.782 5.141 15.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 24.228 4.473 15.160 1.00 0.00 H new ATOM 105 N GLU A 8 25.804 8.781 9.593 1.00 0.00 N ATOM 106 CA GLU A 8 25.116 9.812 8.830 1.00 0.00 C ATOM 107 C GLU A 8 24.489 9.244 7.557 1.00 0.00 C ATOM 108 O GLU A 8 23.305 9.455 7.289 1.00 0.00 O ATOM 109 CB GLU A 8 26.111 10.910 8.462 1.00 0.00 C ATOM 110 CG GLU A 8 26.640 11.675 9.660 1.00 0.00 C ATOM 111 CD GLU A 8 25.546 12.416 10.396 1.00 0.00 C ATOM 112 OE1 GLU A 8 25.156 13.512 9.944 1.00 0.00 O ATOM 113 OE2 GLU A 8 25.064 11.903 11.425 1.00 0.00 O ATOM 0 H GLU A 8 26.789 8.984 9.765 1.00 0.00 H new ATOM 0 HA GLU A 8 24.314 10.217 9.447 1.00 0.00 H new ATOM 0 HB2 GLU A 8 26.949 10.465 7.926 1.00 0.00 H new ATOM 0 HB3 GLU A 8 25.631 11.609 7.778 1.00 0.00 H new ATOM 0 HG2 GLU A 8 27.130 10.982 10.344 1.00 0.00 H new ATOM 0 HG3 GLU A 8 27.398 12.385 9.329 1.00 0.00 H new ATOM 120 N ASP A 9 25.287 8.528 6.774 1.00 0.00 N ATOM 121 CA ASP A 9 24.812 7.957 5.514 1.00 0.00 C ATOM 122 C ASP A 9 23.949 6.735 5.794 1.00 0.00 C ATOM 123 O ASP A 9 23.031 6.412 5.041 1.00 0.00 O ATOM 124 CB ASP A 9 25.995 7.576 4.616 1.00 0.00 C ATOM 125 CG ASP A 9 25.595 7.403 3.163 1.00 0.00 C ATOM 126 OD1 ASP A 9 25.392 8.427 2.476 1.00 0.00 O ATOM 127 OD2 ASP A 9 25.491 6.254 2.692 1.00 0.00 O ATOM 0 H ASP A 9 26.264 8.328 6.986 1.00 0.00 H new ATOM 0 HA ASP A 9 24.213 8.705 4.994 1.00 0.00 H new ATOM 0 HB2 ASP A 9 26.763 8.346 4.688 1.00 0.00 H new ATOM 0 HB3 ASP A 9 26.438 6.649 4.980 1.00 0.00 H new ATOM 132 N GLU A 10 24.251 6.073 6.901 1.00 0.00 N ATOM 133 CA GLU A 10 23.498 4.911 7.348 1.00 0.00 C ATOM 134 C GLU A 10 22.058 5.297 7.678 1.00 0.00 C ATOM 135 O GLU A 10 21.112 4.806 7.057 1.00 0.00 O ATOM 136 CB GLU A 10 24.180 4.315 8.580 1.00 0.00 C ATOM 137 CG GLU A 10 23.513 3.065 9.111 1.00 0.00 C ATOM 138 CD GLU A 10 23.640 1.895 8.160 1.00 0.00 C ATOM 139 OE1 GLU A 10 22.620 1.487 7.572 1.00 0.00 O ATOM 140 OE2 GLU A 10 24.769 1.385 7.988 1.00 0.00 O ATOM 0 H GLU A 10 25.025 6.326 7.515 1.00 0.00 H new ATOM 0 HA GLU A 10 23.475 4.171 6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 10 25.216 4.084 8.332 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.201 5.066 9.370 1.00 0.00 H new ATOM 0 HG2 GLU A 10 23.957 2.799 10.071 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.458 3.269 9.293 1.00 0.00 H new ATOM 147 N GLU A 11 21.908 6.183 8.658 1.00 0.00 N ATOM 148 CA GLU A 11 20.609 6.704 9.053 1.00 0.00 C ATOM 149 C GLU A 11 19.870 7.313 7.869 1.00 0.00 C ATOM 150 O GLU A 11 18.644 7.291 7.824 1.00 0.00 O ATOM 151 CB GLU A 11 20.775 7.747 10.152 1.00 0.00 C ATOM 152 CG GLU A 11 21.207 7.153 11.479 1.00 0.00 C ATOM 153 CD GLU A 11 20.100 6.361 12.143 1.00 0.00 C ATOM 154 OE1 GLU A 11 19.236 6.982 12.793 1.00 0.00 O ATOM 155 OE2 GLU A 11 20.093 5.116 12.029 1.00 0.00 O ATOM 0 H GLU A 11 22.686 6.559 9.200 1.00 0.00 H new ATOM 0 HA GLU A 11 20.016 5.871 9.430 1.00 0.00 H new ATOM 0 HB2 GLU A 11 21.511 8.485 9.835 1.00 0.00 H new ATOM 0 HB3 GLU A 11 19.831 8.276 10.288 1.00 0.00 H new ATOM 0 HG2 GLU A 11 22.069 6.505 11.321 1.00 0.00 H new ATOM 0 HG3 GLU A 11 21.528 7.954 12.145 1.00 0.00 H new ATOM 162 N ARG A 12 20.620 7.852 6.916 1.00 0.00 N ATOM 163 CA ARG A 12 20.036 8.406 5.701 1.00 0.00 C ATOM 164 C ARG A 12 19.173 7.360 4.999 1.00 0.00 C ATOM 165 O ARG A 12 18.039 7.638 4.606 1.00 0.00 O ATOM 166 CB ARG A 12 21.139 8.894 4.764 1.00 0.00 C ATOM 167 CG ARG A 12 20.624 9.412 3.433 1.00 0.00 C ATOM 168 CD ARG A 12 21.760 9.665 2.458 1.00 0.00 C ATOM 169 NE ARG A 12 22.596 8.478 2.274 1.00 0.00 N ATOM 170 CZ ARG A 12 22.246 7.415 1.550 1.00 0.00 C ATOM 171 NH1 ARG A 12 21.075 7.386 0.920 1.00 0.00 N ATOM 172 NH2 ARG A 12 23.068 6.375 1.460 1.00 0.00 N ATOM 0 H ARG A 12 21.637 7.917 6.961 1.00 0.00 H new ATOM 0 HA ARG A 12 19.404 9.251 5.973 1.00 0.00 H new ATOM 0 HB2 ARG A 12 21.700 9.686 5.259 1.00 0.00 H new ATOM 0 HB3 ARG A 12 21.836 8.076 4.581 1.00 0.00 H new ATOM 0 HG2 ARG A 12 19.929 8.690 3.004 1.00 0.00 H new ATOM 0 HG3 ARG A 12 20.067 10.335 3.592 1.00 0.00 H new ATOM 0 HD2 ARG A 12 21.351 9.973 1.496 1.00 0.00 H new ATOM 0 HD3 ARG A 12 22.374 10.489 2.822 1.00 0.00 H new ATOM 0 HE ARG A 12 23.508 8.463 2.731 1.00 0.00 H new ATOM 0 HH11 ARG A 12 20.439 8.180 0.989 1.00 0.00 H new ATOM 0 HH12 ARG A 12 20.813 6.570 0.368 1.00 0.00 H new ATOM 0 HH21 ARG A 12 23.965 6.391 1.945 1.00 0.00 H new ATOM 0 HH22 ARG A 12 22.802 5.561 0.906 1.00 0.00 H new ATOM 186 N TYR A 13 19.709 6.150 4.863 1.00 0.00 N ATOM 187 CA TYR A 13 18.963 5.050 4.270 1.00 0.00 C ATOM 188 C TYR A 13 17.851 4.591 5.207 1.00 0.00 C ATOM 189 O TYR A 13 16.707 4.426 4.792 1.00 0.00 O ATOM 190 CB TYR A 13 19.899 3.878 3.945 1.00 0.00 C ATOM 191 CG TYR A 13 19.187 2.550 3.812 1.00 0.00 C ATOM 192 CD1 TYR A 13 18.216 2.351 2.840 1.00 0.00 C ATOM 193 CD2 TYR A 13 19.476 1.500 4.674 1.00 0.00 C ATOM 194 CE1 TYR A 13 17.555 1.148 2.730 1.00 0.00 C ATOM 195 CE2 TYR A 13 18.821 0.291 4.570 1.00 0.00 C ATOM 196 CZ TYR A 13 17.861 0.119 3.598 1.00 0.00 C ATOM 197 OH TYR A 13 17.200 -1.084 3.499 1.00 0.00 O ATOM 0 H TYR A 13 20.656 5.909 5.156 1.00 0.00 H new ATOM 0 HA TYR A 13 18.513 5.404 3.342 1.00 0.00 H new ATOM 0 HB2 TYR A 13 20.426 4.092 3.015 1.00 0.00 H new ATOM 0 HB3 TYR A 13 20.653 3.799 4.728 1.00 0.00 H new ATOM 0 HD1 TYR A 13 17.975 3.153 2.158 1.00 0.00 H new ATOM 0 HD2 TYR A 13 20.227 1.633 5.439 1.00 0.00 H new ATOM 0 HE1 TYR A 13 16.801 1.010 1.969 1.00 0.00 H new ATOM 0 HE2 TYR A 13 19.060 -0.516 5.247 1.00 0.00 H new ATOM 0 HH TYR A 13 17.536 -1.699 4.184 1.00 0.00 H new ATOM 207 N GLN A 14 18.200 4.393 6.468 1.00 0.00 N ATOM 208 CA GLN A 14 17.254 3.914 7.474 1.00 0.00 C ATOM 209 C GLN A 14 16.016 4.795 7.545 1.00 0.00 C ATOM 210 O GLN A 14 14.890 4.323 7.393 1.00 0.00 O ATOM 211 CB GLN A 14 17.923 3.874 8.840 1.00 0.00 C ATOM 212 CG GLN A 14 19.116 2.944 8.894 1.00 0.00 C ATOM 213 CD GLN A 14 18.768 1.506 8.548 1.00 0.00 C ATOM 214 OE1 GLN A 14 17.551 1.087 8.861 1.00 0.00 O flip ATOM 215 NE2 GLN A 14 19.593 0.774 8.005 1.00 0.00 N flip ATOM 0 H GLN A 14 19.141 4.558 6.826 1.00 0.00 H new ATOM 0 HA GLN A 14 16.943 2.911 7.182 1.00 0.00 H new ATOM 0 HB2 GLN A 14 18.243 4.880 9.110 1.00 0.00 H new ATOM 0 HB3 GLN A 14 17.193 3.561 9.586 1.00 0.00 H new ATOM 0 HG2 GLN A 14 19.880 3.303 8.204 1.00 0.00 H new ATOM 0 HG3 GLN A 14 19.549 2.976 9.894 1.00 0.00 H new ATOM 0 HE21 GLN A 14 20.521 1.131 7.779 1.00 0.00 H new ATOM 0 HE22 GLN A 14 19.349 -0.191 7.781 1.00 0.00 H new ATOM 224 N LYS A 15 16.234 6.074 7.785 1.00 0.00 N ATOM 225 CA LYS A 15 15.148 7.040 7.826 1.00 0.00 C ATOM 226 C LYS A 15 14.364 7.047 6.516 1.00 0.00 C ATOM 227 O LYS A 15 13.163 7.307 6.514 1.00 0.00 O ATOM 228 CB LYS A 15 15.678 8.445 8.128 1.00 0.00 C ATOM 229 CG LYS A 15 16.292 8.591 9.515 1.00 0.00 C ATOM 230 CD LYS A 15 15.275 8.362 10.625 1.00 0.00 C ATOM 231 CE LYS A 15 14.123 9.348 10.538 1.00 0.00 C ATOM 232 NZ LYS A 15 13.180 9.211 11.679 1.00 0.00 N ATOM 0 H LYS A 15 17.158 6.472 7.956 1.00 0.00 H new ATOM 0 HA LYS A 15 14.474 6.740 8.628 1.00 0.00 H new ATOM 0 HB2 LYS A 15 16.427 8.708 7.381 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.861 9.160 8.026 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.111 7.880 9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 15 16.720 9.588 9.617 1.00 0.00 H new ATOM 0 HD2 LYS A 15 14.890 7.344 10.562 1.00 0.00 H new ATOM 0 HD3 LYS A 15 15.765 8.458 11.594 1.00 0.00 H new ATOM 0 HE2 LYS A 15 14.517 10.364 10.515 1.00 0.00 H new ATOM 0 HE3 LYS A 15 13.584 9.194 9.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 12.410 9.903 11.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 12.783 8.250 11.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 13.687 9.384 12.571 1.00 0.00 H new ATOM 246 N LEU A 16 15.039 6.739 5.411 1.00 0.00 N ATOM 247 CA LEU A 16 14.393 6.703 4.104 1.00 0.00 C ATOM 248 C LEU A 16 13.387 5.562 4.037 1.00 0.00 C ATOM 249 O LEU A 16 12.275 5.729 3.527 1.00 0.00 O ATOM 250 CB LEU A 16 15.433 6.552 2.989 1.00 0.00 C ATOM 251 CG LEU A 16 14.904 6.736 1.566 1.00 0.00 C ATOM 252 CD1 LEU A 16 14.208 8.080 1.430 1.00 0.00 C ATOM 253 CD2 LEU A 16 16.041 6.614 0.566 1.00 0.00 C ATOM 0 H LEU A 16 16.033 6.511 5.396 1.00 0.00 H new ATOM 0 HA LEU A 16 13.865 7.646 3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 16 16.229 7.277 3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.881 5.562 3.066 1.00 0.00 H new ATOM 0 HG LEU A 16 14.175 5.953 1.357 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.837 8.196 0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 16 13.373 8.129 2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.915 8.880 1.652 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.653 6.747 -0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 16 16.789 7.380 0.771 1.00 0.00 H new ATOM 0 HD23 LEU A 16 16.498 5.628 0.653 1.00 0.00 H new ATOM 265 N VAL A 17 13.773 4.397 4.554 1.00 0.00 N ATOM 266 CA VAL A 17 12.857 3.265 4.607 1.00 0.00 C ATOM 267 C VAL A 17 11.684 3.623 5.500 1.00 0.00 C ATOM 268 O VAL A 17 10.535 3.361 5.168 1.00 0.00 O ATOM 269 CB VAL A 17 13.531 1.950 5.095 1.00 0.00 C ATOM 270 CG1 VAL A 17 14.964 1.883 4.616 1.00 0.00 C ATOM 271 CG2 VAL A 17 13.467 1.776 6.608 1.00 0.00 C ATOM 0 H VAL A 17 14.701 4.215 4.937 1.00 0.00 H new ATOM 0 HA VAL A 17 12.518 3.068 3.590 1.00 0.00 H new ATOM 0 HB VAL A 17 12.964 1.126 4.660 1.00 0.00 H new ATOM 0 HG11 VAL A 17 15.422 0.957 4.966 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.985 1.909 3.527 1.00 0.00 H new ATOM 0 HG13 VAL A 17 15.520 2.734 5.010 1.00 0.00 H new ATOM 0 HG21 VAL A 17 13.953 0.841 6.888 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.977 2.609 7.092 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.425 1.753 6.928 1.00 0.00 H new ATOM 281 N THR A 18 11.991 4.297 6.596 1.00 0.00 N ATOM 282 CA THR A 18 11.001 4.724 7.541 1.00 0.00 C ATOM 283 C THR A 18 9.991 5.657 6.876 1.00 0.00 C ATOM 284 O THR A 18 8.787 5.548 7.108 1.00 0.00 O ATOM 285 CB THR A 18 11.707 5.411 8.721 1.00 0.00 C ATOM 286 OG1 THR A 18 12.080 4.439 9.707 1.00 0.00 O ATOM 287 CG2 THR A 18 10.845 6.488 9.330 1.00 0.00 C ATOM 0 H THR A 18 12.944 4.560 6.847 1.00 0.00 H new ATOM 0 HA THR A 18 10.447 3.862 7.912 1.00 0.00 H new ATOM 0 HB THR A 18 12.609 5.891 8.342 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.530 4.887 10.453 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.376 6.952 10.161 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.619 7.243 8.577 1.00 0.00 H new ATOM 0 HG23 THR A 18 9.916 6.049 9.693 1.00 0.00 H new ATOM 295 N GLU A 19 10.489 6.542 6.021 1.00 0.00 N ATOM 296 CA GLU A 19 9.638 7.490 5.324 1.00 0.00 C ATOM 297 C GLU A 19 8.550 6.783 4.531 1.00 0.00 C ATOM 298 O GLU A 19 7.385 7.162 4.613 1.00 0.00 O ATOM 299 CB GLU A 19 10.467 8.390 4.409 1.00 0.00 C ATOM 300 CG GLU A 19 11.351 9.355 5.179 1.00 0.00 C ATOM 301 CD GLU A 19 12.052 10.358 4.290 1.00 0.00 C ATOM 302 OE1 GLU A 19 13.195 10.095 3.858 1.00 0.00 O ATOM 303 OE2 GLU A 19 11.463 11.426 4.025 1.00 0.00 O ATOM 0 H GLU A 19 11.481 6.621 5.795 1.00 0.00 H new ATOM 0 HA GLU A 19 9.152 8.111 6.077 1.00 0.00 H new ATOM 0 HB2 GLU A 19 11.089 7.770 3.763 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.798 8.955 3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.744 9.889 5.911 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.097 8.789 5.736 1.00 0.00 H new ATOM 310 N ASN A 20 8.914 5.738 3.793 1.00 0.00 N ATOM 311 CA ASN A 20 7.936 5.048 2.959 1.00 0.00 C ATOM 312 C ASN A 20 7.070 4.099 3.789 1.00 0.00 C ATOM 313 O ASN A 20 5.933 3.822 3.415 1.00 0.00 O ATOM 314 CB ASN A 20 8.590 4.309 1.779 1.00 0.00 C ATOM 315 CG ASN A 20 9.299 3.028 2.167 1.00 0.00 C ATOM 316 OD1 ASN A 20 10.599 3.112 2.374 1.00 0.00 O flip ATOM 317 ND2 ASN A 20 8.689 1.966 2.238 1.00 0.00 N flip ATOM 0 H ASN A 20 9.859 5.357 3.755 1.00 0.00 H new ATOM 0 HA ASN A 20 7.289 5.816 2.535 1.00 0.00 H new ATOM 0 HB2 ASN A 20 7.823 4.077 1.040 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.305 4.976 1.298 1.00 0.00 H new ATOM 0 HD21 ASN A 20 7.683 1.944 2.071 1.00 0.00 H new ATOM 0 HD22 ASN A 20 9.188 1.106 2.464 1.00 0.00 H new ATOM 324 N GLU A 21 7.594 3.613 4.914 1.00 0.00 N ATOM 325 CA GLU A 21 6.809 2.777 5.818 1.00 0.00 C ATOM 326 C GLU A 21 5.640 3.559 6.409 1.00 0.00 C ATOM 327 O GLU A 21 4.516 3.061 6.479 1.00 0.00 O ATOM 328 CB GLU A 21 7.691 2.266 6.950 1.00 0.00 C ATOM 329 CG GLU A 21 8.868 1.449 6.467 1.00 0.00 C ATOM 330 CD GLU A 21 8.534 -0.009 6.257 1.00 0.00 C ATOM 331 OE1 GLU A 21 8.528 -0.459 5.093 1.00 0.00 O ATOM 332 OE2 GLU A 21 8.280 -0.714 7.254 1.00 0.00 O ATOM 0 H GLU A 21 8.552 3.783 5.219 1.00 0.00 H new ATOM 0 HA GLU A 21 6.416 1.937 5.245 1.00 0.00 H new ATOM 0 HB2 GLU A 21 8.059 3.115 7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 21 7.088 1.659 7.625 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.234 1.870 5.531 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.679 1.529 7.191 1.00 0.00 H new ATOM 339 N GLN A 22 5.918 4.787 6.832 1.00 0.00 N ATOM 340 CA GLN A 22 4.917 5.624 7.484 1.00 0.00 C ATOM 341 C GLN A 22 3.732 5.897 6.571 1.00 0.00 C ATOM 342 O GLN A 22 2.597 5.531 6.874 1.00 0.00 O ATOM 343 CB GLN A 22 5.525 6.962 7.914 1.00 0.00 C ATOM 344 CG GLN A 22 6.709 6.821 8.860 1.00 0.00 C ATOM 345 CD GLN A 22 7.285 8.152 9.308 1.00 0.00 C ATOM 346 OE1 GLN A 22 7.220 9.157 8.447 1.00 0.00 O flip ATOM 347 NE2 GLN A 22 7.802 8.273 10.422 1.00 0.00 N flip ATOM 0 H GLN A 22 6.833 5.227 6.734 1.00 0.00 H new ATOM 0 HA GLN A 22 4.570 5.076 8.360 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.844 7.508 7.026 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.754 7.562 8.398 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.398 6.254 9.738 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.491 6.242 8.368 1.00 0.00 H new ATOM 0 HE21 GLN A 22 7.834 7.477 11.059 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.197 9.169 10.706 1.00 0.00 H new ATOM 356 N LEU A 23 4.001 6.525 5.441 1.00 0.00 N ATOM 357 CA LEU A 23 2.939 7.068 4.623 1.00 0.00 C ATOM 358 C LEU A 23 2.238 6.002 3.783 1.00 0.00 C ATOM 359 O LEU A 23 1.112 6.216 3.344 1.00 0.00 O ATOM 360 CB LEU A 23 3.462 8.232 3.773 1.00 0.00 C ATOM 361 CG LEU A 23 4.107 7.897 2.427 1.00 0.00 C ATOM 362 CD1 LEU A 23 4.597 9.173 1.772 1.00 0.00 C ATOM 363 CD2 LEU A 23 5.256 6.923 2.578 1.00 0.00 C ATOM 0 H LEU A 23 4.941 6.670 5.073 1.00 0.00 H new ATOM 0 HA LEU A 23 2.173 7.458 5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.630 8.911 3.586 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.193 8.780 4.368 1.00 0.00 H new ATOM 0 HG LEU A 23 3.352 7.420 1.802 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.057 8.936 0.813 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.755 9.847 1.614 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.332 9.654 2.418 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.685 6.712 1.599 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.019 7.358 3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.892 5.996 3.021 1.00 0.00 H new ATOM 375 N GLN A 24 2.873 4.846 3.583 1.00 0.00 N ATOM 376 CA GLN A 24 2.201 3.743 2.899 1.00 0.00 C ATOM 377 C GLN A 24 1.041 3.255 3.760 1.00 0.00 C ATOM 378 O GLN A 24 -0.003 2.836 3.255 1.00 0.00 O ATOM 379 CB GLN A 24 3.165 2.588 2.593 1.00 0.00 C ATOM 380 CG GLN A 24 3.615 1.805 3.817 1.00 0.00 C ATOM 381 CD GLN A 24 4.558 0.666 3.477 1.00 0.00 C ATOM 382 OE1 GLN A 24 5.371 0.848 2.448 1.00 0.00 O flip ATOM 383 NE2 GLN A 24 4.566 -0.365 4.150 1.00 0.00 N flip ATOM 0 H GLN A 24 3.830 4.652 3.878 1.00 0.00 H new ATOM 0 HA GLN A 24 1.826 4.108 1.943 1.00 0.00 H new ATOM 0 HB2 GLN A 24 2.683 1.903 1.896 1.00 0.00 H new ATOM 0 HB3 GLN A 24 4.045 2.989 2.089 1.00 0.00 H new ATOM 0 HG2 GLN A 24 4.108 2.482 4.514 1.00 0.00 H new ATOM 0 HG3 GLN A 24 2.739 1.405 4.328 1.00 0.00 H new ATOM 0 HE21 GLN A 24 3.923 -0.466 4.935 1.00 0.00 H new ATOM 0 HE22 GLN A 24 5.215 -1.118 3.922 1.00 0.00 H new ATOM 392 N ARG A 25 1.234 3.351 5.071 1.00 0.00 N ATOM 393 CA ARG A 25 0.207 3.035 6.037 1.00 0.00 C ATOM 394 C ARG A 25 -0.873 4.107 5.993 1.00 0.00 C ATOM 395 O ARG A 25 -2.059 3.805 5.925 1.00 0.00 O ATOM 396 CB ARG A 25 0.843 2.960 7.430 1.00 0.00 C ATOM 397 CG ARG A 25 -0.025 3.536 8.529 1.00 0.00 C ATOM 398 CD ARG A 25 0.804 4.025 9.706 1.00 0.00 C ATOM 399 NE ARG A 25 1.617 2.960 10.297 1.00 0.00 N ATOM 400 CZ ARG A 25 2.118 3.004 11.534 1.00 0.00 C ATOM 401 NH1 ARG A 25 1.908 4.066 12.302 1.00 0.00 N ATOM 402 NH2 ARG A 25 2.834 1.984 11.997 1.00 0.00 N ATOM 0 H ARG A 25 2.115 3.653 5.488 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.251 2.073 5.805 1.00 0.00 H new ATOM 0 HB2 ARG A 25 1.064 1.918 7.663 1.00 0.00 H new ATOM 0 HB3 ARG A 25 1.794 3.492 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.614 4.362 8.131 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.729 2.778 8.871 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.455 4.835 9.377 1.00 0.00 H new ATOM 0 HD3 ARG A 25 0.142 4.438 10.467 1.00 0.00 H new ATOM 0 HE ARG A 25 1.812 2.135 9.730 1.00 0.00 H new ATOM 0 HH11 ARG A 25 1.362 4.852 11.948 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.292 4.096 13.246 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.000 1.168 11.407 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.217 2.017 12.942 1.00 0.00 H new ATOM 416 N LEU A 26 -0.435 5.362 6.003 1.00 0.00 N ATOM 417 CA LEU A 26 -1.333 6.512 5.971 1.00 0.00 C ATOM 418 C LEU A 26 -2.260 6.435 4.765 1.00 0.00 C ATOM 419 O LEU A 26 -3.435 6.805 4.839 1.00 0.00 O ATOM 420 CB LEU A 26 -0.502 7.796 5.949 1.00 0.00 C ATOM 421 CG LEU A 26 0.416 7.952 7.169 1.00 0.00 C ATOM 422 CD1 LEU A 26 1.330 9.155 7.033 1.00 0.00 C ATOM 423 CD2 LEU A 26 -0.407 8.059 8.443 1.00 0.00 C ATOM 0 H LEU A 26 0.554 5.611 6.034 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.959 6.511 6.863 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.105 7.811 5.043 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.173 8.653 5.897 1.00 0.00 H new ATOM 0 HG LEU A 26 1.043 7.062 7.224 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.964 9.232 7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.954 9.039 6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.729 10.060 6.938 1.00 0.00 H new ATOM 0 HD21 LEU A 26 0.259 8.169 9.298 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.063 8.927 8.380 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.008 7.158 8.565 1.00 0.00 H new ATOM 435 N ILE A 27 -1.721 5.934 3.663 1.00 0.00 N ATOM 436 CA ILE A 27 -2.508 5.655 2.475 1.00 0.00 C ATOM 437 C ILE A 27 -3.604 4.647 2.780 1.00 0.00 C ATOM 438 O ILE A 27 -4.784 4.937 2.606 1.00 0.00 O ATOM 439 CB ILE A 27 -1.622 5.095 1.349 1.00 0.00 C ATOM 440 CG1 ILE A 27 -0.635 6.152 0.880 1.00 0.00 C ATOM 441 CG2 ILE A 27 -2.465 4.594 0.184 1.00 0.00 C ATOM 442 CD1 ILE A 27 0.384 5.614 -0.087 1.00 0.00 C ATOM 0 H ILE A 27 -0.730 5.711 3.569 1.00 0.00 H new ATOM 0 HA ILE A 27 -2.955 6.595 2.152 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.064 4.247 1.746 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.182 6.968 0.407 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -0.121 6.572 1.745 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.812 4.204 -0.597 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -3.130 3.802 0.530 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.058 5.416 -0.216 1.00 0.00 H new ATOM 0 HD11 ILE A 27 1.060 6.415 -0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 27 0.954 4.817 0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.123 5.220 -0.968 1.00 0.00 H new ATOM 454 N THR A 28 -3.199 3.474 3.260 1.00 0.00 N ATOM 455 CA THR A 28 -4.128 2.373 3.496 1.00 0.00 C ATOM 456 C THR A 28 -5.274 2.788 4.431 1.00 0.00 C ATOM 457 O THR A 28 -6.403 2.333 4.262 1.00 0.00 O ATOM 458 CB THR A 28 -3.401 1.117 4.055 1.00 0.00 C ATOM 459 OG1 THR A 28 -4.005 -0.072 3.527 1.00 0.00 O ATOM 460 CG2 THR A 28 -3.452 1.057 5.578 1.00 0.00 C ATOM 0 H THR A 28 -2.229 3.261 3.494 1.00 0.00 H new ATOM 0 HA THR A 28 -4.557 2.113 2.528 1.00 0.00 H new ATOM 0 HB THR A 28 -2.357 1.186 3.748 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.542 -0.859 3.881 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.932 0.164 5.925 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.970 1.942 5.993 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.491 1.022 5.906 1.00 0.00 H new ATOM 468 N GLN A 29 -4.983 3.670 5.392 1.00 0.00 N ATOM 469 CA GLN A 29 -5.990 4.121 6.351 1.00 0.00 C ATOM 470 C GLN A 29 -7.071 4.926 5.643 1.00 0.00 C ATOM 471 O GLN A 29 -8.268 4.725 5.854 1.00 0.00 O ATOM 472 CB GLN A 29 -5.357 4.996 7.437 1.00 0.00 C ATOM 473 CG GLN A 29 -4.041 4.476 7.999 1.00 0.00 C ATOM 474 CD GLN A 29 -4.180 3.350 9.016 1.00 0.00 C ATOM 475 OE1 GLN A 29 -5.194 2.512 8.872 1.00 0.00 O flip ATOM 476 NE2 GLN A 29 -3.363 3.232 9.928 1.00 0.00 N flip ATOM 0 H GLN A 29 -4.060 4.084 5.525 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.428 3.236 6.812 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.191 5.993 7.028 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.068 5.102 8.257 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.423 4.126 7.173 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -3.509 5.305 8.466 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -2.592 3.895 10.011 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.456 2.471 10.601 1.00 0.00 H new ATOM 485 N LYS A 30 -6.634 5.849 4.807 1.00 0.00 N ATOM 486 CA LYS A 30 -7.551 6.673 4.038 1.00 0.00 C ATOM 487 C LYS A 30 -8.234 5.842 2.953 1.00 0.00 C ATOM 488 O LYS A 30 -9.442 5.947 2.756 1.00 0.00 O ATOM 489 CB LYS A 30 -6.807 7.861 3.428 1.00 0.00 C ATOM 490 CG LYS A 30 -6.151 8.762 4.467 1.00 0.00 C ATOM 491 CD LYS A 30 -7.148 9.218 5.526 1.00 0.00 C ATOM 492 CE LYS A 30 -6.542 10.248 6.470 1.00 0.00 C ATOM 493 NZ LYS A 30 -5.393 9.698 7.238 1.00 0.00 N ATOM 0 H LYS A 30 -5.647 6.048 4.642 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.323 7.057 4.705 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.043 7.490 2.745 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.505 8.452 2.835 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.330 8.228 4.946 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.720 9.633 3.974 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -8.025 9.644 5.039 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -7.488 8.356 6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.212 11.114 5.897 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.307 10.597 7.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.055 10.411 7.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.695 8.847 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.624 9.451 6.583 1.00 0.00 H new ATOM 507 N GLU A 31 -7.455 4.996 2.285 1.00 0.00 N ATOM 508 CA GLU A 31 -7.956 4.149 1.205 1.00 0.00 C ATOM 509 C GLU A 31 -9.139 3.294 1.644 1.00 0.00 C ATOM 510 O GLU A 31 -10.174 3.287 0.979 1.00 0.00 O ATOM 511 CB GLU A 31 -6.839 3.250 0.677 1.00 0.00 C ATOM 512 CG GLU A 31 -5.895 3.950 -0.285 1.00 0.00 C ATOM 513 CD GLU A 31 -6.438 4.011 -1.698 1.00 0.00 C ATOM 514 OE1 GLU A 31 -5.854 3.351 -2.586 1.00 0.00 O ATOM 515 OE2 GLU A 31 -7.455 4.698 -1.929 1.00 0.00 O ATOM 0 H GLU A 31 -6.460 4.878 2.476 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.302 4.812 0.412 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.265 2.866 1.520 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.283 2.390 0.175 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -5.706 4.963 0.071 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.937 3.430 -0.291 1.00 0.00 H new ATOM 522 N GLU A 32 -8.991 2.583 2.764 1.00 0.00 N ATOM 523 CA GLU A 32 -10.044 1.686 3.243 1.00 0.00 C ATOM 524 C GLU A 32 -11.349 2.443 3.488 1.00 0.00 C ATOM 525 O GLU A 32 -12.433 1.938 3.193 1.00 0.00 O ATOM 526 CB GLU A 32 -9.609 0.940 4.515 1.00 0.00 C ATOM 527 CG GLU A 32 -9.028 1.836 5.598 1.00 0.00 C ATOM 528 CD GLU A 32 -8.806 1.116 6.911 1.00 0.00 C ATOM 529 OE1 GLU A 32 -9.442 1.492 7.916 1.00 0.00 O ATOM 530 OE2 GLU A 32 -7.997 0.165 6.946 1.00 0.00 O ATOM 0 H GLU A 32 -8.158 2.610 3.352 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.220 0.948 2.460 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.469 0.408 4.922 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.868 0.188 4.245 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -8.080 2.246 5.251 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.699 2.679 5.762 1.00 0.00 H new ATOM 537 N LYS A 33 -11.243 3.664 4.002 1.00 0.00 N ATOM 538 CA LYS A 33 -12.425 4.476 4.265 1.00 0.00 C ATOM 539 C LYS A 33 -12.980 5.076 2.975 1.00 0.00 C ATOM 540 O LYS A 33 -14.197 5.156 2.792 1.00 0.00 O ATOM 541 CB LYS A 33 -12.107 5.576 5.280 1.00 0.00 C ATOM 542 CG LYS A 33 -11.817 5.039 6.673 1.00 0.00 C ATOM 543 CD LYS A 33 -11.630 6.156 7.690 1.00 0.00 C ATOM 544 CE LYS A 33 -10.358 6.949 7.439 1.00 0.00 C ATOM 545 NZ LYS A 33 -10.175 8.027 8.446 1.00 0.00 N ATOM 0 H LYS A 33 -10.358 4.110 4.243 1.00 0.00 H new ATOM 0 HA LYS A 33 -13.191 3.827 4.688 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.246 6.146 4.931 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.948 6.268 5.332 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.636 4.394 6.990 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -10.919 4.422 6.643 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -12.488 6.827 7.653 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -11.600 5.731 8.693 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.500 6.278 7.464 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.392 7.385 6.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -9.297 8.546 8.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.982 8.681 8.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -10.117 7.608 9.396 1.00 0.00 H new ATOM 559 N ILE A 34 -12.092 5.484 2.072 1.00 0.00 N ATOM 560 CA ILE A 34 -12.512 6.029 0.785 1.00 0.00 C ATOM 561 C ILE A 34 -13.214 4.956 -0.048 1.00 0.00 C ATOM 562 O ILE A 34 -14.116 5.259 -0.827 1.00 0.00 O ATOM 563 CB ILE A 34 -11.327 6.624 -0.013 1.00 0.00 C ATOM 564 CG1 ILE A 34 -10.768 7.851 0.705 1.00 0.00 C ATOM 565 CG2 ILE A 34 -11.770 6.998 -1.418 1.00 0.00 C ATOM 566 CD1 ILE A 34 -9.368 8.229 0.263 1.00 0.00 C ATOM 0 H ILE A 34 -11.082 5.448 2.207 1.00 0.00 H new ATOM 0 HA ILE A 34 -13.210 6.840 0.995 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.543 5.870 -0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.434 8.696 0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.762 7.662 1.778 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -10.926 7.415 -1.967 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -12.134 6.109 -1.933 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.568 7.738 -1.363 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.037 9.109 0.815 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.688 7.400 0.460 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.371 8.451 -0.804 1.00 0.00 H new ATOM 578 N ARG A 35 -12.809 3.701 0.137 1.00 0.00 N ATOM 579 CA ARG A 35 -13.447 2.582 -0.549 1.00 0.00 C ATOM 580 C ARG A 35 -14.937 2.566 -0.254 1.00 0.00 C ATOM 581 O ARG A 35 -15.764 2.441 -1.159 1.00 0.00 O ATOM 582 CB ARG A 35 -12.844 1.248 -0.116 1.00 0.00 C ATOM 583 CG ARG A 35 -11.425 1.015 -0.604 1.00 0.00 C ATOM 584 CD ARG A 35 -10.972 -0.407 -0.318 1.00 0.00 C ATOM 585 NE ARG A 35 -11.875 -1.393 -0.911 1.00 0.00 N ATOM 586 CZ ARG A 35 -11.670 -2.708 -0.885 1.00 0.00 C ATOM 587 NH1 ARG A 35 -10.584 -3.205 -0.301 1.00 0.00 N ATOM 588 NH2 ARG A 35 -12.555 -3.523 -1.443 1.00 0.00 N ATOM 0 H ARG A 35 -12.043 3.435 0.756 1.00 0.00 H new ATOM 0 HA ARG A 35 -13.279 2.715 -1.618 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -12.855 1.194 0.973 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -13.478 0.440 -0.481 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -11.370 1.209 -1.675 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -10.750 1.719 -0.118 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -9.965 -0.554 -0.710 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -10.921 -0.563 0.760 1.00 0.00 H new ATOM 0 HE ARG A 35 -12.717 -1.051 -1.375 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -9.904 -2.578 0.129 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.431 -4.213 -0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -13.389 -3.142 -1.890 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -12.402 -4.531 -1.425 1.00 0.00 H new ATOM 602 N VAL A 36 -15.265 2.711 1.021 1.00 0.00 N ATOM 603 CA VAL A 36 -16.650 2.724 1.453 1.00 0.00 C ATOM 604 C VAL A 36 -17.358 3.955 0.914 1.00 0.00 C ATOM 605 O VAL A 36 -18.519 3.894 0.520 1.00 0.00 O ATOM 606 CB VAL A 36 -16.762 2.707 2.982 1.00 0.00 C ATOM 607 CG1 VAL A 36 -18.196 2.423 3.399 1.00 0.00 C ATOM 608 CG2 VAL A 36 -15.798 1.687 3.569 1.00 0.00 C ATOM 0 H VAL A 36 -14.587 2.821 1.775 1.00 0.00 H new ATOM 0 HA VAL A 36 -17.123 1.824 1.060 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.488 3.687 3.372 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -18.263 2.413 4.487 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.851 3.199 3.002 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.503 1.453 3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -15.887 1.685 4.655 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -16.037 0.696 3.183 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -14.777 1.948 3.290 1.00 0.00 H new ATOM 618 N LEU A 37 -16.646 5.075 0.898 1.00 0.00 N ATOM 619 CA LEU A 37 -17.171 6.308 0.328 1.00 0.00 C ATOM 620 C LEU A 37 -17.522 6.110 -1.128 1.00 0.00 C ATOM 621 O LEU A 37 -18.568 6.548 -1.583 1.00 0.00 O ATOM 622 CB LEU A 37 -16.159 7.443 0.471 1.00 0.00 C ATOM 623 CG LEU A 37 -16.435 8.403 1.622 1.00 0.00 C ATOM 624 CD1 LEU A 37 -17.615 9.302 1.290 1.00 0.00 C ATOM 625 CD2 LEU A 37 -16.703 7.621 2.896 1.00 0.00 C ATOM 0 H LEU A 37 -15.701 5.154 1.274 1.00 0.00 H new ATOM 0 HA LEU A 37 -18.075 6.576 0.875 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -15.167 7.012 0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -16.136 8.010 -0.459 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.558 9.032 1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -17.800 9.982 2.122 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -17.392 9.879 0.392 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -18.501 8.691 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.899 8.314 3.714 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -17.569 6.976 2.751 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.833 7.011 3.138 1.00 0.00 H new ATOM 637 N ARG A 38 -16.654 5.416 -1.836 1.00 0.00 N ATOM 638 CA ARG A 38 -16.836 5.154 -3.238 1.00 0.00 C ATOM 639 C ARG A 38 -18.092 4.306 -3.450 1.00 0.00 C ATOM 640 O ARG A 38 -18.885 4.577 -4.349 1.00 0.00 O ATOM 641 CB ARG A 38 -15.573 4.477 -3.769 1.00 0.00 C ATOM 642 CG ARG A 38 -15.792 3.663 -5.012 1.00 0.00 C ATOM 643 CD ARG A 38 -14.491 3.060 -5.521 1.00 0.00 C ATOM 644 NE ARG A 38 -14.664 2.399 -6.813 1.00 0.00 N ATOM 645 CZ ARG A 38 -13.818 1.506 -7.323 1.00 0.00 C ATOM 646 NH1 ARG A 38 -12.716 1.168 -6.667 1.00 0.00 N ATOM 647 NH2 ARG A 38 -14.081 0.955 -8.500 1.00 0.00 N ATOM 0 H ARG A 38 -15.799 5.018 -1.447 1.00 0.00 H new ATOM 0 HA ARG A 38 -16.986 6.080 -3.794 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -14.823 5.241 -3.975 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -15.165 3.831 -2.991 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -16.507 2.867 -4.805 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -16.231 4.292 -5.787 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -13.739 3.844 -5.612 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -14.115 2.341 -4.793 1.00 0.00 H new ATOM 0 HE ARG A 38 -15.490 2.638 -7.362 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.510 1.593 -5.763 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.075 0.483 -7.066 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -14.926 1.216 -9.008 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.438 0.270 -8.898 1.00 0.00 H new ATOM 661 N GLN A 39 -18.277 3.307 -2.591 1.00 0.00 N ATOM 662 CA GLN A 39 -19.503 2.511 -2.574 1.00 0.00 C ATOM 663 C GLN A 39 -20.710 3.382 -2.261 1.00 0.00 C ATOM 664 O GLN A 39 -21.752 3.279 -2.905 1.00 0.00 O ATOM 665 CB GLN A 39 -19.402 1.422 -1.512 1.00 0.00 C ATOM 666 CG GLN A 39 -18.273 0.435 -1.729 1.00 0.00 C ATOM 667 CD GLN A 39 -18.597 -0.577 -2.802 1.00 0.00 C ATOM 668 OE1 GLN A 39 -19.178 -1.628 -2.527 1.00 0.00 O ATOM 669 NE2 GLN A 39 -18.211 -0.286 -4.028 1.00 0.00 N ATOM 0 H GLN A 39 -17.588 3.027 -1.892 1.00 0.00 H new ATOM 0 HA GLN A 39 -19.626 2.065 -3.561 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.273 1.893 -0.538 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -20.344 0.875 -1.480 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -17.368 0.976 -2.004 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -18.062 -0.084 -0.794 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -17.732 0.595 -4.216 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -18.391 -0.942 -4.788 1.00 0.00 H new ATOM 678 N ARG A 40 -20.560 4.229 -1.256 1.00 0.00 N ATOM 679 CA ARG A 40 -21.607 5.143 -0.852 1.00 0.00 C ATOM 680 C ARG A 40 -22.029 6.036 -2.009 1.00 0.00 C ATOM 681 O ARG A 40 -23.215 6.305 -2.200 1.00 0.00 O ATOM 682 CB ARG A 40 -21.126 5.987 0.323 1.00 0.00 C ATOM 683 CG ARG A 40 -21.217 5.272 1.663 1.00 0.00 C ATOM 684 CD ARG A 40 -20.517 6.050 2.764 1.00 0.00 C ATOM 685 NE ARG A 40 -20.761 5.477 4.087 1.00 0.00 N ATOM 686 CZ ARG A 40 -20.331 6.013 5.233 1.00 0.00 C ATOM 687 NH1 ARG A 40 -19.603 7.124 5.221 1.00 0.00 N ATOM 688 NH2 ARG A 40 -20.629 5.433 6.387 1.00 0.00 N ATOM 0 H ARG A 40 -19.708 4.300 -0.700 1.00 0.00 H new ATOM 0 HA ARG A 40 -22.476 4.562 -0.545 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -20.092 6.283 0.148 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -21.716 6.902 0.368 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -22.264 5.128 1.928 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -20.771 4.281 1.578 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -19.445 6.066 2.569 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -20.860 7.085 2.749 1.00 0.00 H new ATOM 0 HE ARG A 40 -21.295 4.610 4.139 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -19.370 7.572 4.335 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -19.277 7.530 6.098 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -21.186 4.579 6.400 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.301 5.841 7.263 1.00 0.00 H new ATOM 702 N LEU A 41 -21.060 6.487 -2.792 1.00 0.00 N ATOM 703 CA LEU A 41 -21.367 7.327 -3.936 1.00 0.00 C ATOM 704 C LEU A 41 -22.005 6.511 -5.057 1.00 0.00 C ATOM 705 O LEU A 41 -22.671 7.065 -5.927 1.00 0.00 O ATOM 706 CB LEU A 41 -20.138 8.037 -4.495 1.00 0.00 C ATOM 707 CG LEU A 41 -19.102 8.539 -3.490 1.00 0.00 C ATOM 708 CD1 LEU A 41 -17.937 9.169 -4.227 1.00 0.00 C ATOM 709 CD2 LEU A 41 -19.703 9.530 -2.508 1.00 0.00 C ATOM 0 H LEU A 41 -20.069 6.288 -2.658 1.00 0.00 H new ATOM 0 HA LEU A 41 -22.065 8.081 -3.571 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -19.638 7.355 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -20.479 8.889 -5.083 1.00 0.00 H new ATOM 0 HG LEU A 41 -18.749 7.683 -2.914 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -17.201 9.526 -3.507 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -17.476 8.428 -4.880 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -18.295 10.007 -4.825 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -18.934 9.863 -1.811 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -20.096 10.389 -3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -20.511 9.050 -1.956 1.00 0.00 H new ATOM 721 N VAL A 42 -21.789 5.200 -5.057 1.00 0.00 N ATOM 722 CA VAL A 42 -22.452 4.328 -6.021 1.00 0.00 C ATOM 723 C VAL A 42 -23.960 4.445 -5.871 1.00 0.00 C ATOM 724 O VAL A 42 -24.694 4.532 -6.857 1.00 0.00 O ATOM 725 CB VAL A 42 -22.028 2.851 -5.839 1.00 0.00 C ATOM 726 CG1 VAL A 42 -22.851 1.936 -6.728 1.00 0.00 C ATOM 727 CG2 VAL A 42 -20.544 2.677 -6.115 1.00 0.00 C ATOM 0 H VAL A 42 -21.166 4.721 -4.407 1.00 0.00 H new ATOM 0 HA VAL A 42 -22.152 4.647 -7.019 1.00 0.00 H new ATOM 0 HB VAL A 42 -22.216 2.573 -4.802 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -22.533 0.904 -6.581 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -23.906 2.031 -6.471 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -22.706 2.215 -7.772 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -20.269 1.631 -5.981 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -20.326 2.981 -7.139 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -19.970 3.294 -5.424 1.00 0.00 H new ATOM 737 N GLU A 43 -24.413 4.475 -4.634 1.00 0.00 N ATOM 738 CA GLU A 43 -25.827 4.617 -4.353 1.00 0.00 C ATOM 739 C GLU A 43 -26.246 6.086 -4.310 1.00 0.00 C ATOM 740 O GLU A 43 -27.430 6.393 -4.167 1.00 0.00 O ATOM 741 CB GLU A 43 -26.179 3.904 -3.051 1.00 0.00 C ATOM 742 CG GLU A 43 -25.864 2.419 -3.101 1.00 0.00 C ATOM 743 CD GLU A 43 -26.288 1.676 -1.856 1.00 0.00 C ATOM 744 OE1 GLU A 43 -27.455 1.231 -1.788 1.00 0.00 O ATOM 745 OE2 GLU A 43 -25.454 1.514 -0.946 1.00 0.00 O ATOM 0 H GLU A 43 -23.821 4.403 -3.806 1.00 0.00 H new ATOM 0 HA GLU A 43 -26.384 4.149 -5.165 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -25.629 4.362 -2.229 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -27.240 4.041 -2.840 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -26.360 1.978 -3.966 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -24.792 2.287 -3.247 1.00 0.00 H new ATOM 752 N ARG A 44 -25.280 6.995 -4.426 1.00 0.00 N ATOM 753 CA ARG A 44 -25.597 8.407 -4.611 1.00 0.00 C ATOM 754 C ARG A 44 -25.797 8.663 -6.098 1.00 0.00 C ATOM 755 O ARG A 44 -26.568 9.527 -6.514 1.00 0.00 O ATOM 756 CB ARG A 44 -24.496 9.329 -4.055 1.00 0.00 C ATOM 757 CG ARG A 44 -23.520 9.809 -5.095 1.00 0.00 C ATOM 758 CD ARG A 44 -23.018 11.222 -4.823 1.00 0.00 C ATOM 759 NE ARG A 44 -22.609 11.438 -3.434 1.00 0.00 N ATOM 760 CZ ARG A 44 -21.703 12.344 -3.062 1.00 0.00 C ATOM 761 NH1 ARG A 44 -21.044 13.046 -3.980 1.00 0.00 N ATOM 762 NH2 ARG A 44 -21.454 12.541 -1.774 1.00 0.00 N ATOM 0 H ARG A 44 -24.283 6.782 -4.396 1.00 0.00 H new ATOM 0 HA ARG A 44 -26.507 8.635 -4.055 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -24.963 10.193 -3.583 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -23.950 8.797 -3.276 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -22.671 9.127 -5.132 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -23.996 9.779 -6.075 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -22.173 11.432 -5.479 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -23.804 11.934 -5.077 1.00 0.00 H new ATOM 0 HE ARG A 44 -23.041 10.864 -2.710 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -21.231 12.892 -4.971 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -20.352 13.738 -3.693 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -21.955 12.000 -1.069 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -20.762 13.233 -1.489 1.00 0.00 H new ATOM 776 N GLY A 45 -25.083 7.875 -6.876 1.00 0.00 N ATOM 777 CA GLY A 45 -25.157 7.939 -8.317 1.00 0.00 C ATOM 778 C GLY A 45 -24.010 8.732 -8.897 1.00 0.00 C ATOM 779 O GLY A 45 -24.160 9.423 -9.903 1.00 0.00 O ATOM 0 H GLY A 45 -24.434 7.171 -6.523 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -25.147 6.929 -8.728 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -26.102 8.394 -8.614 1.00 0.00 H new ATOM 783 N ASP A 46 -22.854 8.622 -8.258 1.00 0.00 N ATOM 784 CA ASP A 46 -21.642 9.299 -8.714 1.00 0.00 C ATOM 785 C ASP A 46 -21.010 8.512 -9.858 1.00 0.00 C ATOM 786 O ASP A 46 -20.002 8.906 -10.433 1.00 0.00 O ATOM 787 CB ASP A 46 -20.658 9.444 -7.548 1.00 0.00 C ATOM 788 CG ASP A 46 -19.403 10.215 -7.910 1.00 0.00 C ATOM 789 OD1 ASP A 46 -19.451 11.462 -7.926 1.00 0.00 O ATOM 790 OD2 ASP A 46 -18.358 9.578 -8.160 1.00 0.00 O ATOM 0 H ASP A 46 -22.727 8.065 -7.413 1.00 0.00 H new ATOM 0 HA ASP A 46 -21.897 10.294 -9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -21.158 9.947 -6.721 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.377 8.452 -7.194 1.00 0.00 H new ATOM 795 N ALA A 47 -21.656 7.406 -10.208 1.00 0.00 N ATOM 796 CA ALA A 47 -21.179 6.524 -11.267 1.00 0.00 C ATOM 797 C ALA A 47 -21.386 7.140 -12.650 1.00 0.00 C ATOM 798 O ALA A 47 -21.257 6.462 -13.667 1.00 0.00 O ATOM 799 CB ALA A 47 -21.886 5.183 -11.177 1.00 0.00 C ATOM 0 H ALA A 47 -22.522 7.096 -9.768 1.00 0.00 H new ATOM 0 HA ALA A 47 -20.107 6.380 -11.129 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -21.526 4.528 -11.970 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -21.680 4.727 -10.209 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -22.960 5.330 -11.287 1.00 0.00 H new ATOM 805 N LYS A 48 -21.706 8.429 -12.677 1.00 0.00 N ATOM 806 CA LYS A 48 -21.883 9.157 -13.924 1.00 0.00 C ATOM 807 C LYS A 48 -20.551 9.280 -14.658 1.00 0.00 C ATOM 808 O LYS A 48 -20.511 9.457 -15.878 1.00 0.00 O ATOM 809 CB LYS A 48 -22.476 10.542 -13.653 1.00 0.00 C ATOM 810 CG LYS A 48 -23.826 10.489 -12.956 1.00 0.00 C ATOM 811 CD LYS A 48 -24.855 9.749 -13.795 1.00 0.00 C ATOM 812 CE LYS A 48 -26.098 9.430 -12.992 1.00 0.00 C ATOM 813 NZ LYS A 48 -27.149 8.772 -13.815 1.00 0.00 N ATOM 0 H LYS A 48 -21.849 8.994 -11.840 1.00 0.00 H new ATOM 0 HA LYS A 48 -22.577 8.603 -14.556 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -21.780 11.115 -13.040 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -22.583 11.076 -14.597 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -23.719 9.996 -11.990 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -24.176 11.503 -12.759 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -25.125 10.355 -14.660 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -24.419 8.825 -14.176 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -25.832 8.780 -12.158 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -26.497 10.350 -12.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -27.980 8.573 -13.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -27.423 9.402 -14.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -26.779 7.881 -14.203 1.00 0.00 H new ATOM 827 N GLY A 49 -19.463 9.196 -13.900 1.00 0.00 N ATOM 828 CA GLY A 49 -18.144 9.156 -14.497 1.00 0.00 C ATOM 829 C GLY A 49 -17.822 7.770 -15.013 1.00 0.00 C ATOM 830 O GLY A 49 -18.188 7.418 -16.135 1.00 0.00 O ATOM 0 H GLY A 49 -19.473 9.155 -12.881 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -18.090 9.874 -15.315 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -17.399 9.456 -13.760 1.00 0.00 H new ATOM 834 N THR A 50 -17.150 6.975 -14.192 1.00 0.00 N ATOM 835 CA THR A 50 -16.861 5.594 -14.539 1.00 0.00 C ATOM 836 C THR A 50 -16.872 4.709 -13.295 1.00 0.00 C ATOM 837 O THR A 50 -15.851 4.526 -12.629 1.00 0.00 O ATOM 838 CB THR A 50 -15.502 5.452 -15.260 1.00 0.00 C ATOM 839 OG1 THR A 50 -15.459 6.313 -16.407 1.00 0.00 O ATOM 840 CG2 THR A 50 -15.276 4.012 -15.702 1.00 0.00 C ATOM 0 H THR A 50 -16.795 7.265 -13.281 1.00 0.00 H new ATOM 0 HA THR A 50 -17.645 5.269 -15.223 1.00 0.00 H new ATOM 0 HB THR A 50 -14.715 5.736 -14.561 1.00 0.00 H new ATOM 0 HG1 THR A 50 -14.593 6.217 -16.856 1.00 0.00 H new ATOM 0 HG21 THR A 50 -14.314 3.933 -16.208 1.00 0.00 H new ATOM 0 HG22 THR A 50 -15.282 3.358 -14.830 1.00 0.00 H new ATOM 0 HG23 THR A 50 -16.070 3.712 -16.385 1.00 0.00 H new ATOM 848 N GLU A 51 -18.040 4.177 -12.978 1.00 0.00 N ATOM 849 CA GLU A 51 -18.180 3.225 -11.891 1.00 0.00 C ATOM 850 C GLU A 51 -19.212 2.184 -12.283 1.00 0.00 C ATOM 851 O GLU A 51 -20.409 2.344 -12.041 1.00 0.00 O ATOM 852 CB GLU A 51 -18.611 3.918 -10.609 1.00 0.00 C ATOM 853 CG GLU A 51 -18.397 3.083 -9.360 1.00 0.00 C ATOM 854 CD GLU A 51 -16.942 2.726 -9.148 1.00 0.00 C ATOM 855 OE1 GLU A 51 -16.188 3.577 -8.637 1.00 0.00 O ATOM 856 OE2 GLU A 51 -16.540 1.595 -9.487 1.00 0.00 O ATOM 0 H GLU A 51 -18.911 4.391 -13.463 1.00 0.00 H new ATOM 0 HA GLU A 51 -17.215 2.751 -11.709 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.059 4.853 -10.509 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.667 4.178 -10.685 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -18.764 3.631 -8.492 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.986 2.169 -9.432 1.00 0.00 H new ATOM 863 N LEU A 52 -18.738 1.134 -12.909 1.00 0.00 N ATOM 864 CA LEU A 52 -19.617 0.117 -13.452 1.00 0.00 C ATOM 865 C LEU A 52 -19.861 -0.976 -12.428 1.00 0.00 C ATOM 866 O LEU A 52 -20.880 -0.986 -11.733 1.00 0.00 O ATOM 867 CB LEU A 52 -19.027 -0.480 -14.739 1.00 0.00 C ATOM 868 CG LEU A 52 -18.368 0.524 -15.693 1.00 0.00 C ATOM 869 CD1 LEU A 52 -17.791 -0.194 -16.899 1.00 0.00 C ATOM 870 CD2 LEU A 52 -19.359 1.589 -16.136 1.00 0.00 C ATOM 0 H LEU A 52 -17.744 0.958 -13.057 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.571 0.585 -13.695 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -18.287 -1.232 -14.464 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -19.822 -0.997 -15.276 1.00 0.00 H new ATOM 0 HG LEU A 52 -17.558 1.018 -15.157 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.327 0.532 -17.567 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -17.043 -0.915 -16.570 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -18.589 -0.715 -17.428 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.865 2.287 -16.812 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -20.195 1.116 -16.651 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -19.728 2.128 -15.263 1.00 0.00 H new ATOM 882 N ASN A 53 -18.911 -1.881 -12.328 1.00 0.00 N ATOM 883 CA ASN A 53 -19.010 -3.016 -11.421 1.00 0.00 C ATOM 884 C ASN A 53 -17.644 -3.335 -10.832 1.00 0.00 C ATOM 885 O ASN A 53 -16.799 -3.937 -11.494 1.00 0.00 O ATOM 886 CB ASN A 53 -19.555 -4.253 -12.151 1.00 0.00 C ATOM 887 CG ASN A 53 -20.925 -4.027 -12.770 1.00 0.00 C ATOM 888 OD1 ASN A 53 -21.039 -3.614 -13.927 1.00 0.00 O ATOM 889 ND2 ASN A 53 -21.972 -4.294 -12.008 1.00 0.00 N ATOM 0 H ASN A 53 -18.047 -1.855 -12.870 1.00 0.00 H new ATOM 0 HA ASN A 53 -19.699 -2.750 -10.619 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -18.854 -4.544 -12.933 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -19.613 -5.085 -11.449 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -22.915 -4.160 -12.372 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -21.836 -4.634 -11.056 1.00 0.00 H new TER 896 ASN A 53 ATOM 897 N GLY B 84 19.781 -15.188 -5.270 1.00 0.00 N ATOM 898 CA GLY B 84 20.476 -14.105 -5.931 1.00 0.00 C ATOM 899 C GLY B 84 21.208 -14.552 -7.178 1.00 0.00 C ATOM 900 O GLY B 84 21.484 -15.740 -7.349 1.00 0.00 O ATOM 0 HA2 GLY B 84 19.759 -13.327 -6.195 1.00 0.00 H new ATOM 0 HA3 GLY B 84 21.189 -13.660 -5.237 1.00 0.00 H new ATOM 904 N PRO B 85 21.513 -13.612 -8.081 1.00 0.00 N ATOM 905 CA PRO B 85 22.260 -13.882 -9.305 1.00 0.00 C ATOM 906 C PRO B 85 23.767 -13.888 -9.072 1.00 0.00 C ATOM 907 O PRO B 85 24.223 -13.913 -7.929 1.00 0.00 O ATOM 908 CB PRO B 85 21.858 -12.723 -10.207 1.00 0.00 C ATOM 909 CG PRO B 85 21.659 -11.585 -9.267 1.00 0.00 C ATOM 910 CD PRO B 85 21.139 -12.186 -7.983 1.00 0.00 C ATOM 0 HA PRO B 85 22.039 -14.865 -9.721 1.00 0.00 H new ATOM 0 HB2 PRO B 85 22.632 -12.503 -10.942 1.00 0.00 H new ATOM 0 HB3 PRO B 85 20.947 -12.947 -10.761 1.00 0.00 H new ATOM 0 HG2 PRO B 85 22.595 -11.052 -9.097 1.00 0.00 H new ATOM 0 HG3 PRO B 85 20.951 -10.863 -9.674 1.00 0.00 H new ATOM 0 HD2 PRO B 85 21.589 -11.714 -7.110 1.00 0.00 H new ATOM 0 HD3 PRO B 85 20.060 -12.061 -7.892 1.00 0.00 H new ATOM 918 N LEU B 86 24.527 -13.919 -10.161 1.00 0.00 N ATOM 919 CA LEU B 86 25.983 -13.832 -10.092 1.00 0.00 C ATOM 920 C LEU B 86 26.442 -12.685 -9.183 1.00 0.00 C ATOM 921 O LEU B 86 25.968 -11.551 -9.285 1.00 0.00 O ATOM 922 CB LEU B 86 26.630 -13.708 -11.497 1.00 0.00 C ATOM 923 CG LEU B 86 25.844 -13.000 -12.634 1.00 0.00 C ATOM 924 CD1 LEU B 86 24.762 -13.902 -13.219 1.00 0.00 C ATOM 925 CD2 LEU B 86 25.243 -11.678 -12.180 1.00 0.00 C ATOM 0 H LEU B 86 24.157 -14.004 -11.108 1.00 0.00 H new ATOM 0 HA LEU B 86 26.326 -14.769 -9.653 1.00 0.00 H new ATOM 0 HB2 LEU B 86 27.577 -13.182 -11.377 1.00 0.00 H new ATOM 0 HB3 LEU B 86 26.866 -14.716 -11.840 1.00 0.00 H new ATOM 0 HG LEU B 86 26.569 -12.784 -13.418 1.00 0.00 H new ATOM 0 HD11 LEU B 86 24.235 -13.371 -14.011 1.00 0.00 H new ATOM 0 HD12 LEU B 86 25.221 -14.802 -13.629 1.00 0.00 H new ATOM 0 HD13 LEU B 86 24.056 -14.179 -12.436 1.00 0.00 H new ATOM 0 HD21 LEU B 86 24.703 -11.220 -13.009 1.00 0.00 H new ATOM 0 HD22 LEU B 86 24.555 -11.856 -11.353 1.00 0.00 H new ATOM 0 HD23 LEU B 86 26.039 -11.010 -11.852 1.00 0.00 H new ATOM 937 N GLY B 87 27.369 -12.998 -8.287 1.00 0.00 N ATOM 938 CA GLY B 87 27.832 -12.024 -7.321 1.00 0.00 C ATOM 939 C GLY B 87 28.934 -11.143 -7.866 1.00 0.00 C ATOM 940 O GLY B 87 29.448 -10.275 -7.163 1.00 0.00 O ATOM 0 H GLY B 87 27.810 -13.915 -8.213 1.00 0.00 H new ATOM 0 HA2 GLY B 87 26.994 -11.400 -7.009 1.00 0.00 H new ATOM 0 HA3 GLY B 87 28.192 -12.542 -6.432 1.00 0.00 H new ATOM 944 N SER B 88 29.277 -11.351 -9.131 1.00 0.00 N ATOM 945 CA SER B 88 30.333 -10.590 -9.789 1.00 0.00 C ATOM 946 C SER B 88 29.963 -9.112 -9.944 1.00 0.00 C ATOM 947 O SER B 88 30.803 -8.287 -10.299 1.00 0.00 O ATOM 948 CB SER B 88 30.632 -11.214 -11.152 1.00 0.00 C ATOM 949 OG SER B 88 29.436 -11.658 -11.776 1.00 0.00 O ATOM 0 H SER B 88 28.833 -12.049 -9.728 1.00 0.00 H new ATOM 0 HA SER B 88 31.224 -10.631 -9.162 1.00 0.00 H new ATOM 0 HB2 SER B 88 31.131 -10.484 -11.790 1.00 0.00 H new ATOM 0 HB3 SER B 88 31.317 -12.053 -11.031 1.00 0.00 H new ATOM 0 HG SER B 88 29.649 -12.052 -12.648 1.00 0.00 H new ATOM 955 N ARG B 89 28.705 -8.777 -9.676 1.00 0.00 N ATOM 956 CA ARG B 89 28.263 -7.388 -9.742 1.00 0.00 C ATOM 957 C ARG B 89 28.617 -6.659 -8.451 1.00 0.00 C ATOM 958 O ARG B 89 28.653 -5.429 -8.417 1.00 0.00 O ATOM 959 CB ARG B 89 26.751 -7.288 -9.933 1.00 0.00 C ATOM 960 CG ARG B 89 26.141 -8.314 -10.869 1.00 0.00 C ATOM 961 CD ARG B 89 24.636 -8.111 -10.967 1.00 0.00 C ATOM 962 NE ARG B 89 24.043 -7.811 -9.657 1.00 0.00 N ATOM 963 CZ ARG B 89 22.734 -7.761 -9.412 1.00 0.00 C ATOM 964 NH1 ARG B 89 21.858 -8.006 -10.375 1.00 0.00 N ATOM 965 NH2 ARG B 89 22.302 -7.443 -8.198 1.00 0.00 N ATOM 0 H ARG B 89 27.978 -9.442 -9.413 1.00 0.00 H new ATOM 0 HA ARG B 89 28.768 -6.934 -10.595 1.00 0.00 H new ATOM 0 HB2 ARG B 89 26.272 -7.382 -8.958 1.00 0.00 H new ATOM 0 HB3 ARG B 89 26.515 -6.293 -10.310 1.00 0.00 H new ATOM 0 HG2 ARG B 89 26.592 -8.227 -11.858 1.00 0.00 H new ATOM 0 HG3 ARG B 89 26.356 -9.319 -10.507 1.00 0.00 H new ATOM 0 HD2 ARG B 89 24.423 -7.296 -11.658 1.00 0.00 H new ATOM 0 HD3 ARG B 89 24.174 -9.008 -11.379 1.00 0.00 H new ATOM 0 HE ARG B 89 24.678 -7.628 -8.880 1.00 0.00 H new ATOM 0 HH11 ARG B 89 22.183 -8.235 -11.314 1.00 0.00 H new ATOM 0 HH12 ARG B 89 20.858 -7.965 -10.177 1.00 0.00 H new ATOM 0 HH21 ARG B 89 22.971 -7.238 -7.456 1.00 0.00 H new ATOM 0 HH22 ARG B 89 21.301 -7.404 -8.007 1.00 0.00 H new ATOM 979 N ARG B 90 28.880 -7.442 -7.400 1.00 0.00 N ATOM 980 CA ARG B 90 29.062 -6.925 -6.043 1.00 0.00 C ATOM 981 C ARG B 90 27.737 -6.392 -5.499 1.00 0.00 C ATOM 982 O ARG B 90 27.383 -5.228 -5.702 1.00 0.00 O ATOM 983 CB ARG B 90 30.149 -5.845 -5.986 1.00 0.00 C ATOM 984 CG ARG B 90 31.509 -6.336 -6.453 1.00 0.00 C ATOM 985 CD ARG B 90 32.569 -5.257 -6.334 1.00 0.00 C ATOM 986 NE ARG B 90 33.853 -5.705 -6.870 1.00 0.00 N ATOM 987 CZ ARG B 90 35.029 -5.474 -6.292 1.00 0.00 C ATOM 988 NH1 ARG B 90 35.102 -4.777 -5.164 1.00 0.00 N ATOM 989 NH2 ARG B 90 36.137 -5.942 -6.852 1.00 0.00 N ATOM 0 H ARG B 90 28.973 -8.455 -7.468 1.00 0.00 H new ATOM 0 HA ARG B 90 29.395 -7.750 -5.413 1.00 0.00 H new ATOM 0 HB2 ARG B 90 29.844 -5.000 -6.603 1.00 0.00 H new ATOM 0 HB3 ARG B 90 30.234 -5.479 -4.963 1.00 0.00 H new ATOM 0 HG2 ARG B 90 31.805 -7.203 -5.862 1.00 0.00 H new ATOM 0 HG3 ARG B 90 31.440 -6.665 -7.490 1.00 0.00 H new ATOM 0 HD2 ARG B 90 32.242 -4.364 -6.868 1.00 0.00 H new ATOM 0 HD3 ARG B 90 32.688 -4.977 -5.287 1.00 0.00 H new ATOM 0 HE ARG B 90 33.847 -6.229 -7.745 1.00 0.00 H new ATOM 0 HH11 ARG B 90 34.252 -4.414 -4.733 1.00 0.00 H new ATOM 0 HH12 ARG B 90 36.008 -4.605 -4.728 1.00 0.00 H new ATOM 0 HH21 ARG B 90 36.084 -6.475 -7.720 1.00 0.00 H new ATOM 0 HH22 ARG B 90 37.042 -5.769 -6.415 1.00 0.00 H new ATOM 1003 N PHE B 91 27.013 -7.260 -4.796 1.00 0.00 N ATOM 1004 CA PHE B 91 25.684 -6.938 -4.283 1.00 0.00 C ATOM 1005 C PHE B 91 25.735 -5.777 -3.305 1.00 0.00 C ATOM 1006 O PHE B 91 24.750 -5.067 -3.124 1.00 0.00 O ATOM 1007 CB PHE B 91 25.059 -8.149 -3.594 1.00 0.00 C ATOM 1008 CG PHE B 91 24.820 -9.307 -4.512 1.00 0.00 C ATOM 1009 CD1 PHE B 91 23.955 -9.183 -5.585 1.00 0.00 C ATOM 1010 CD2 PHE B 91 25.452 -10.520 -4.301 1.00 0.00 C ATOM 1011 CE1 PHE B 91 23.724 -10.247 -6.430 1.00 0.00 C ATOM 1012 CE2 PHE B 91 25.225 -11.589 -5.143 1.00 0.00 C ATOM 1013 CZ PHE B 91 24.359 -11.450 -6.209 1.00 0.00 C ATOM 0 H PHE B 91 27.329 -8.202 -4.567 1.00 0.00 H new ATOM 0 HA PHE B 91 25.070 -6.652 -5.137 1.00 0.00 H new ATOM 0 HB2 PHE B 91 25.710 -8.470 -2.781 1.00 0.00 H new ATOM 0 HB3 PHE B 91 24.112 -7.851 -3.145 1.00 0.00 H new ATOM 0 HD1 PHE B 91 23.455 -8.242 -5.762 1.00 0.00 H new ATOM 0 HD2 PHE B 91 26.130 -10.631 -3.468 1.00 0.00 H new ATOM 0 HE1 PHE B 91 23.046 -10.138 -7.264 1.00 0.00 H new ATOM 0 HE2 PHE B 91 25.723 -12.531 -4.969 1.00 0.00 H new ATOM 0 HZ PHE B 91 24.179 -12.285 -6.870 1.00 0.00 H new ATOM 1023 N VAL B 92 26.886 -5.596 -2.676 1.00 0.00 N ATOM 1024 CA VAL B 92 27.091 -4.491 -1.753 1.00 0.00 C ATOM 1025 C VAL B 92 26.824 -3.155 -2.450 1.00 0.00 C ATOM 1026 O VAL B 92 26.338 -2.208 -1.835 1.00 0.00 O ATOM 1027 CB VAL B 92 28.527 -4.509 -1.179 1.00 0.00 C ATOM 1028 CG1 VAL B 92 28.746 -3.360 -0.209 1.00 0.00 C ATOM 1029 CG2 VAL B 92 28.804 -5.840 -0.495 1.00 0.00 C ATOM 0 H VAL B 92 27.697 -6.204 -2.789 1.00 0.00 H new ATOM 0 HA VAL B 92 26.388 -4.607 -0.928 1.00 0.00 H new ATOM 0 HB VAL B 92 29.224 -4.385 -2.008 1.00 0.00 H new ATOM 0 HG11 VAL B 92 29.764 -3.399 0.178 1.00 0.00 H new ATOM 0 HG12 VAL B 92 28.590 -2.413 -0.726 1.00 0.00 H new ATOM 0 HG13 VAL B 92 28.041 -3.442 0.618 1.00 0.00 H new ATOM 0 HG21 VAL B 92 29.818 -5.840 -0.095 1.00 0.00 H new ATOM 0 HG22 VAL B 92 28.093 -5.986 0.319 1.00 0.00 H new ATOM 0 HG23 VAL B 92 28.699 -6.649 -1.218 1.00 0.00 H new ATOM 1039 N VAL B 93 27.104 -3.106 -3.748 1.00 0.00 N ATOM 1040 CA VAL B 93 26.913 -1.892 -4.523 1.00 0.00 C ATOM 1041 C VAL B 93 25.435 -1.661 -4.835 1.00 0.00 C ATOM 1042 O VAL B 93 24.901 -0.580 -4.564 1.00 0.00 O ATOM 1043 CB VAL B 93 27.712 -1.928 -5.841 1.00 0.00 C ATOM 1044 CG1 VAL B 93 27.557 -0.621 -6.605 1.00 0.00 C ATOM 1045 CG2 VAL B 93 29.181 -2.219 -5.572 1.00 0.00 C ATOM 0 H VAL B 93 27.464 -3.896 -4.283 1.00 0.00 H new ATOM 0 HA VAL B 93 27.282 -1.069 -3.912 1.00 0.00 H new ATOM 0 HB VAL B 93 27.310 -2.732 -6.457 1.00 0.00 H new ATOM 0 HG11 VAL B 93 28.130 -0.671 -7.531 1.00 0.00 H new ATOM 0 HG12 VAL B 93 26.505 -0.458 -6.838 1.00 0.00 H new ATOM 0 HG13 VAL B 93 27.925 0.203 -5.994 1.00 0.00 H new ATOM 0 HG21 VAL B 93 29.726 -2.240 -6.515 1.00 0.00 H new ATOM 0 HG22 VAL B 93 29.595 -1.441 -4.931 1.00 0.00 H new ATOM 0 HG23 VAL B 93 29.276 -3.185 -5.077 1.00 0.00 H new ATOM 1055 N ASP B 94 24.762 -2.674 -5.381 1.00 0.00 N ATOM 1056 CA ASP B 94 23.366 -2.503 -5.784 1.00 0.00 C ATOM 1057 C ASP B 94 22.436 -2.502 -4.586 1.00 0.00 C ATOM 1058 O ASP B 94 21.362 -1.917 -4.634 1.00 0.00 O ATOM 1059 CB ASP B 94 22.902 -3.554 -6.798 1.00 0.00 C ATOM 1060 CG ASP B 94 22.851 -4.967 -6.248 1.00 0.00 C ATOM 1061 OD1 ASP B 94 23.832 -5.714 -6.424 1.00 0.00 O ATOM 1062 OD2 ASP B 94 21.808 -5.345 -5.669 1.00 0.00 O ATOM 0 H ASP B 94 25.150 -3.602 -5.552 1.00 0.00 H new ATOM 0 HA ASP B 94 23.320 -1.530 -6.274 1.00 0.00 H new ATOM 0 HB2 ASP B 94 21.911 -3.281 -7.160 1.00 0.00 H new ATOM 0 HB3 ASP B 94 23.572 -3.534 -7.658 1.00 0.00 H new ATOM 1067 N ASP B 95 22.823 -3.142 -3.507 1.00 0.00 N ATOM 1068 CA ASP B 95 22.014 -3.075 -2.304 1.00 0.00 C ATOM 1069 C ASP B 95 22.156 -1.692 -1.694 1.00 0.00 C ATOM 1070 O ASP B 95 21.264 -1.196 -1.025 1.00 0.00 O ATOM 1071 CB ASP B 95 22.423 -4.142 -1.293 1.00 0.00 C ATOM 1072 CG ASP B 95 21.232 -4.862 -0.689 1.00 0.00 C ATOM 1073 OD1 ASP B 95 20.891 -4.587 0.480 1.00 0.00 O ATOM 1074 OD2 ASP B 95 20.640 -5.724 -1.377 1.00 0.00 O ATOM 0 H ASP B 95 23.671 -3.703 -3.432 1.00 0.00 H new ATOM 0 HA ASP B 95 20.974 -3.262 -2.571 1.00 0.00 H new ATOM 0 HB2 ASP B 95 23.073 -4.869 -1.780 1.00 0.00 H new ATOM 0 HB3 ASP B 95 23.005 -3.678 -0.496 1.00 0.00 H new ATOM 1079 N ARG B 96 23.258 -1.033 -2.000 1.00 0.00 N ATOM 1080 CA ARG B 96 23.541 0.253 -1.390 1.00 0.00 C ATOM 1081 C ARG B 96 22.879 1.365 -2.182 1.00 0.00 C ATOM 1082 O ARG B 96 21.881 1.927 -1.752 1.00 0.00 O ATOM 1083 CB ARG B 96 25.047 0.494 -1.296 1.00 0.00 C ATOM 1084 CG ARG B 96 25.415 1.816 -0.637 1.00 0.00 C ATOM 1085 CD ARG B 96 26.921 1.990 -0.547 1.00 0.00 C ATOM 1086 NE ARG B 96 27.558 1.994 -1.864 1.00 0.00 N ATOM 1087 CZ ARG B 96 28.574 1.203 -2.209 1.00 0.00 C ATOM 1088 NH1 ARG B 96 29.036 0.293 -1.359 1.00 0.00 N ATOM 1089 NH2 ARG B 96 29.122 1.317 -3.414 1.00 0.00 N ATOM 0 H ARG B 96 23.964 -1.361 -2.659 1.00 0.00 H new ATOM 0 HA ARG B 96 23.134 0.248 -0.379 1.00 0.00 H new ATOM 0 HB2 ARG B 96 25.502 -0.321 -0.734 1.00 0.00 H new ATOM 0 HB3 ARG B 96 25.474 0.467 -2.299 1.00 0.00 H new ATOM 0 HG2 ARG B 96 24.985 2.640 -1.206 1.00 0.00 H new ATOM 0 HG3 ARG B 96 24.982 1.859 0.362 1.00 0.00 H new ATOM 0 HD2 ARG B 96 27.147 2.925 -0.034 1.00 0.00 H new ATOM 0 HD3 ARG B 96 27.342 1.185 0.056 1.00 0.00 H new ATOM 0 HE ARG B 96 27.201 2.645 -2.564 1.00 0.00 H new ATOM 0 HH11 ARG B 96 28.613 0.196 -0.436 1.00 0.00 H new ATOM 0 HH12 ARG B 96 29.814 -0.309 -1.629 1.00 0.00 H new ATOM 0 HH21 ARG B 96 28.765 2.009 -4.073 1.00 0.00 H new ATOM 0 HH22 ARG B 96 29.900 0.713 -3.680 1.00 0.00 H new ATOM 1103 N ARG B 97 23.407 1.636 -3.366 1.00 0.00 N ATOM 1104 CA ARG B 97 22.921 2.742 -4.177 1.00 0.00 C ATOM 1105 C ARG B 97 21.602 2.386 -4.848 1.00 0.00 C ATOM 1106 O ARG B 97 20.686 3.200 -4.912 1.00 0.00 O ATOM 1107 CB ARG B 97 23.974 3.134 -5.224 1.00 0.00 C ATOM 1108 CG ARG B 97 23.516 4.206 -6.206 1.00 0.00 C ATOM 1109 CD ARG B 97 22.902 3.599 -7.462 1.00 0.00 C ATOM 1110 NE ARG B 97 22.332 4.619 -8.340 1.00 0.00 N ATOM 1111 CZ ARG B 97 22.340 4.551 -9.670 1.00 0.00 C ATOM 1112 NH1 ARG B 97 22.911 3.526 -10.288 1.00 0.00 N ATOM 1113 NH2 ARG B 97 21.785 5.521 -10.383 1.00 0.00 N ATOM 0 H ARG B 97 24.171 1.106 -3.786 1.00 0.00 H new ATOM 0 HA ARG B 97 22.744 3.596 -3.523 1.00 0.00 H new ATOM 0 HB2 ARG B 97 24.867 3.488 -4.709 1.00 0.00 H new ATOM 0 HB3 ARG B 97 24.261 2.244 -5.784 1.00 0.00 H new ATOM 0 HG2 ARG B 97 22.786 4.854 -5.722 1.00 0.00 H new ATOM 0 HG3 ARG B 97 24.364 4.832 -6.482 1.00 0.00 H new ATOM 0 HD2 ARG B 97 23.664 3.039 -8.004 1.00 0.00 H new ATOM 0 HD3 ARG B 97 22.125 2.889 -7.179 1.00 0.00 H new ATOM 0 HE ARG B 97 21.900 5.435 -7.906 1.00 0.00 H new ATOM 0 HH11 ARG B 97 23.348 2.782 -9.744 1.00 0.00 H new ATOM 0 HH12 ARG B 97 22.913 3.482 -11.307 1.00 0.00 H new ATOM 0 HH21 ARG B 97 21.353 6.317 -9.913 1.00 0.00 H new ATOM 0 HH22 ARG B 97 21.790 5.472 -11.402 1.00 0.00 H new ATOM 1127 N GLU B 98 21.506 1.162 -5.332 1.00 0.00 N ATOM 1128 CA GLU B 98 20.349 0.750 -6.106 1.00 0.00 C ATOM 1129 C GLU B 98 19.139 0.453 -5.215 1.00 0.00 C ATOM 1130 O GLU B 98 17.997 0.707 -5.612 1.00 0.00 O ATOM 1131 CB GLU B 98 20.691 -0.465 -6.965 1.00 0.00 C ATOM 1132 CG GLU B 98 21.653 -0.171 -8.105 1.00 0.00 C ATOM 1133 CD GLU B 98 21.660 -1.268 -9.147 1.00 0.00 C ATOM 1134 OE1 GLU B 98 20.577 -1.611 -9.661 1.00 0.00 O ATOM 1135 OE2 GLU B 98 22.747 -1.783 -9.474 1.00 0.00 O ATOM 0 H GLU B 98 22.212 0.437 -5.204 1.00 0.00 H new ATOM 0 HA GLU B 98 20.077 1.581 -6.756 1.00 0.00 H new ATOM 0 HB2 GLU B 98 21.125 -1.236 -6.328 1.00 0.00 H new ATOM 0 HB3 GLU B 98 19.769 -0.875 -7.379 1.00 0.00 H new ATOM 0 HG2 GLU B 98 21.378 0.773 -8.576 1.00 0.00 H new ATOM 0 HG3 GLU B 98 22.659 -0.046 -7.705 1.00 0.00 H new ATOM 1142 N LEU B 99 19.367 -0.077 -4.013 1.00 0.00 N ATOM 1143 CA LEU B 99 18.259 -0.397 -3.127 1.00 0.00 C ATOM 1144 C LEU B 99 17.713 0.877 -2.495 1.00 0.00 C ATOM 1145 O LEU B 99 16.506 1.091 -2.487 1.00 0.00 O ATOM 1146 CB LEU B 99 18.706 -1.427 -2.078 1.00 0.00 C ATOM 1147 CG LEU B 99 17.666 -1.894 -1.048 1.00 0.00 C ATOM 1148 CD1 LEU B 99 17.542 -0.898 0.093 1.00 0.00 C ATOM 1149 CD2 LEU B 99 16.313 -2.132 -1.702 1.00 0.00 C ATOM 0 H LEU B 99 20.292 -0.289 -3.640 1.00 0.00 H new ATOM 0 HA LEU B 99 17.447 -0.848 -3.698 1.00 0.00 H new ATOM 0 HB2 LEU B 99 19.073 -2.307 -2.607 1.00 0.00 H new ATOM 0 HB3 LEU B 99 19.552 -1.006 -1.534 1.00 0.00 H new ATOM 0 HG LEU B 99 18.013 -2.842 -0.636 1.00 0.00 H new ATOM 0 HD11 LEU B 99 16.799 -1.254 0.807 1.00 0.00 H new ATOM 0 HD12 LEU B 99 18.505 -0.795 0.592 1.00 0.00 H new ATOM 0 HD13 LEU B 99 17.232 0.070 -0.301 1.00 0.00 H new ATOM 0 HD21 LEU B 99 15.598 -2.462 -0.949 1.00 0.00 H new ATOM 0 HD22 LEU B 99 15.961 -1.206 -2.156 1.00 0.00 H new ATOM 0 HD23 LEU B 99 16.410 -2.899 -2.470 1.00 0.00 H new ATOM 1161 N GLN B 100 18.601 1.741 -2.006 1.00 0.00 N ATOM 1162 CA GLN B 100 18.179 2.990 -1.375 1.00 0.00 C ATOM 1163 C GLN B 100 17.394 3.842 -2.363 1.00 0.00 C ATOM 1164 O GLN B 100 16.471 4.564 -1.986 1.00 0.00 O ATOM 1165 CB GLN B 100 19.391 3.775 -0.874 1.00 0.00 C ATOM 1166 CG GLN B 100 20.248 4.340 -1.993 1.00 0.00 C ATOM 1167 CD GLN B 100 21.445 5.110 -1.489 1.00 0.00 C ATOM 1168 OE1 GLN B 100 21.987 4.818 -0.425 1.00 0.00 O ATOM 1169 NE2 GLN B 100 21.869 6.104 -2.250 1.00 0.00 N ATOM 0 H GLN B 100 19.611 1.601 -2.034 1.00 0.00 H new ATOM 0 HA GLN B 100 17.541 2.744 -0.526 1.00 0.00 H new ATOM 0 HB2 GLN B 100 19.048 4.593 -0.240 1.00 0.00 H new ATOM 0 HB3 GLN B 100 20.004 3.124 -0.250 1.00 0.00 H new ATOM 0 HG2 GLN B 100 20.590 3.523 -2.629 1.00 0.00 H new ATOM 0 HG3 GLN B 100 19.638 4.995 -2.615 1.00 0.00 H new ATOM 0 HE21 GLN B 100 21.392 6.315 -3.126 1.00 0.00 H new ATOM 0 HE22 GLN B 100 22.674 6.660 -1.961 1.00 0.00 H new ATOM 1178 N TYR B 101 17.767 3.735 -3.634 1.00 0.00 N ATOM 1179 CA TYR B 101 17.122 4.495 -4.692 1.00 0.00 C ATOM 1180 C TYR B 101 15.635 4.170 -4.768 1.00 0.00 C ATOM 1181 O TYR B 101 14.811 5.068 -4.896 1.00 0.00 O ATOM 1182 CB TYR B 101 17.787 4.221 -6.043 1.00 0.00 C ATOM 1183 CG TYR B 101 17.220 5.051 -7.176 1.00 0.00 C ATOM 1184 CD1 TYR B 101 16.109 4.618 -7.891 1.00 0.00 C ATOM 1185 CD2 TYR B 101 17.792 6.268 -7.527 1.00 0.00 C ATOM 1186 CE1 TYR B 101 15.587 5.372 -8.919 1.00 0.00 C ATOM 1187 CE2 TYR B 101 17.273 7.026 -8.557 1.00 0.00 C ATOM 1188 CZ TYR B 101 16.171 6.572 -9.249 1.00 0.00 C ATOM 1189 OH TYR B 101 15.648 7.324 -10.277 1.00 0.00 O ATOM 0 H TYR B 101 18.518 3.124 -3.955 1.00 0.00 H new ATOM 0 HA TYR B 101 17.235 5.553 -4.455 1.00 0.00 H new ATOM 0 HB2 TYR B 101 18.856 4.417 -5.959 1.00 0.00 H new ATOM 0 HB3 TYR B 101 17.675 3.164 -6.286 1.00 0.00 H new ATOM 0 HD1 TYR B 101 15.648 3.675 -7.636 1.00 0.00 H new ATOM 0 HD2 TYR B 101 18.655 6.626 -6.986 1.00 0.00 H new ATOM 0 HE1 TYR B 101 14.723 5.022 -9.463 1.00 0.00 H new ATOM 0 HE2 TYR B 101 17.728 7.970 -8.819 1.00 0.00 H new ATOM 0 HH TYR B 101 16.174 8.144 -10.383 1.00 0.00 H new ATOM 1199 N ARG B 102 15.283 2.889 -4.679 1.00 0.00 N ATOM 1200 CA ARG B 102 13.880 2.501 -4.772 1.00 0.00 C ATOM 1201 C ARG B 102 13.123 2.946 -3.527 1.00 0.00 C ATOM 1202 O ARG B 102 11.910 3.119 -3.558 1.00 0.00 O ATOM 1203 CB ARG B 102 13.710 0.990 -4.978 1.00 0.00 C ATOM 1204 CG ARG B 102 13.979 0.157 -3.737 1.00 0.00 C ATOM 1205 CD ARG B 102 13.497 -1.274 -3.911 1.00 0.00 C ATOM 1206 NE ARG B 102 12.060 -1.335 -4.182 1.00 0.00 N ATOM 1207 CZ ARG B 102 11.184 -2.008 -3.436 1.00 0.00 C ATOM 1208 NH1 ARG B 102 11.583 -2.663 -2.352 1.00 0.00 N ATOM 1209 NH2 ARG B 102 9.899 -2.014 -3.773 1.00 0.00 N ATOM 0 H ARG B 102 15.936 2.117 -4.545 1.00 0.00 H new ATOM 0 HA ARG B 102 13.465 3.001 -5.647 1.00 0.00 H new ATOM 0 HB2 ARG B 102 12.694 0.794 -5.320 1.00 0.00 H new ATOM 0 HB3 ARG B 102 14.382 0.665 -5.772 1.00 0.00 H new ATOM 0 HG2 ARG B 102 15.047 0.158 -3.521 1.00 0.00 H new ATOM 0 HG3 ARG B 102 13.480 0.608 -2.879 1.00 0.00 H new ATOM 0 HD2 ARG B 102 14.041 -1.744 -4.730 1.00 0.00 H new ATOM 0 HD3 ARG B 102 13.721 -1.845 -3.010 1.00 0.00 H new ATOM 0 HE ARG B 102 11.706 -0.830 -4.994 1.00 0.00 H new ATOM 0 HH11 ARG B 102 12.567 -2.654 -2.084 1.00 0.00 H new ATOM 0 HH12 ARG B 102 10.905 -3.175 -1.787 1.00 0.00 H new ATOM 0 HH21 ARG B 102 9.586 -1.505 -4.600 1.00 0.00 H new ATOM 0 HH22 ARG B 102 9.225 -2.528 -3.205 1.00 0.00 H new ATOM 1223 N VAL B 103 13.851 3.160 -2.442 1.00 0.00 N ATOM 1224 CA VAL B 103 13.239 3.533 -1.177 1.00 0.00 C ATOM 1225 C VAL B 103 12.748 4.983 -1.216 1.00 0.00 C ATOM 1226 O VAL B 103 11.634 5.280 -0.775 1.00 0.00 O ATOM 1227 CB VAL B 103 14.226 3.342 -0.009 1.00 0.00 C ATOM 1228 CG1 VAL B 103 13.518 3.445 1.319 1.00 0.00 C ATOM 1229 CG2 VAL B 103 14.932 2.005 -0.107 1.00 0.00 C ATOM 0 H VAL B 103 14.868 3.082 -2.413 1.00 0.00 H new ATOM 0 HA VAL B 103 12.382 2.878 -1.018 1.00 0.00 H new ATOM 0 HB VAL B 103 14.968 4.138 -0.076 1.00 0.00 H new ATOM 0 HG11 VAL B 103 14.237 3.307 2.126 1.00 0.00 H new ATOM 0 HG12 VAL B 103 13.056 4.428 1.410 1.00 0.00 H new ATOM 0 HG13 VAL B 103 12.749 2.675 1.382 1.00 0.00 H new ATOM 0 HG21 VAL B 103 15.623 1.896 0.729 1.00 0.00 H new ATOM 0 HG22 VAL B 103 14.196 1.202 -0.077 1.00 0.00 H new ATOM 0 HG23 VAL B 103 15.486 1.954 -1.044 1.00 0.00 H new ATOM 1239 N GLU B 104 13.575 5.882 -1.748 1.00 0.00 N ATOM 1240 CA GLU B 104 13.183 7.284 -1.891 1.00 0.00 C ATOM 1241 C GLU B 104 12.007 7.447 -2.850 1.00 0.00 C ATOM 1242 O GLU B 104 11.076 8.201 -2.561 1.00 0.00 O ATOM 1243 CB GLU B 104 14.357 8.163 -2.334 1.00 0.00 C ATOM 1244 CG GLU B 104 15.317 7.473 -3.276 1.00 0.00 C ATOM 1245 CD GLU B 104 16.233 8.440 -3.993 1.00 0.00 C ATOM 1246 OE1 GLU B 104 17.336 8.717 -3.481 1.00 0.00 O ATOM 1247 OE2 GLU B 104 15.851 8.934 -5.076 1.00 0.00 O ATOM 0 H GLU B 104 14.514 5.667 -2.085 1.00 0.00 H new ATOM 0 HA GLU B 104 12.865 7.619 -0.904 1.00 0.00 H new ATOM 0 HB2 GLU B 104 13.966 9.057 -2.820 1.00 0.00 H new ATOM 0 HB3 GLU B 104 14.904 8.494 -1.451 1.00 0.00 H new ATOM 0 HG2 GLU B 104 15.919 6.758 -2.715 1.00 0.00 H new ATOM 0 HG3 GLU B 104 14.750 6.903 -4.012 1.00 0.00 H new ATOM 1254 N VAL B 105 12.029 6.744 -3.982 1.00 0.00 N ATOM 1255 CA VAL B 105 10.898 6.798 -4.903 1.00 0.00 C ATOM 1256 C VAL B 105 9.644 6.262 -4.224 1.00 0.00 C ATOM 1257 O VAL B 105 8.583 6.853 -4.346 1.00 0.00 O ATOM 1258 CB VAL B 105 11.154 6.063 -6.253 1.00 0.00 C ATOM 1259 CG1 VAL B 105 12.102 4.899 -6.091 1.00 0.00 C ATOM 1260 CG2 VAL B 105 9.861 5.569 -6.873 1.00 0.00 C ATOM 0 H VAL B 105 12.799 6.144 -4.278 1.00 0.00 H new ATOM 0 HA VAL B 105 10.756 7.848 -5.160 1.00 0.00 H new ATOM 0 HB VAL B 105 11.611 6.797 -6.917 1.00 0.00 H new ATOM 0 HG11 VAL B 105 12.252 4.415 -7.056 1.00 0.00 H new ATOM 0 HG12 VAL B 105 13.059 5.259 -5.712 1.00 0.00 H new ATOM 0 HG13 VAL B 105 11.680 4.181 -5.387 1.00 0.00 H new ATOM 0 HG21 VAL B 105 10.079 5.062 -7.813 1.00 0.00 H new ATOM 0 HG22 VAL B 105 9.372 4.874 -6.190 1.00 0.00 H new ATOM 0 HG23 VAL B 105 9.201 6.416 -7.062 1.00 0.00 H new ATOM 1270 N GLN B 106 9.775 5.174 -3.472 1.00 0.00 N ATOM 1271 CA GLN B 106 8.641 4.630 -2.731 1.00 0.00 C ATOM 1272 C GLN B 106 8.065 5.679 -1.782 1.00 0.00 C ATOM 1273 O GLN B 106 6.853 5.874 -1.726 1.00 0.00 O ATOM 1274 CB GLN B 106 9.052 3.367 -1.967 1.00 0.00 C ATOM 1275 CG GLN B 106 9.200 2.151 -2.868 1.00 0.00 C ATOM 1276 CD GLN B 106 7.894 1.738 -3.517 1.00 0.00 C ATOM 1277 OE1 GLN B 106 7.164 0.905 -2.987 1.00 0.00 O ATOM 1278 NE2 GLN B 106 7.582 2.327 -4.664 1.00 0.00 N ATOM 0 H GLN B 106 10.646 4.655 -3.359 1.00 0.00 H new ATOM 0 HA GLN B 106 7.863 4.356 -3.444 1.00 0.00 H new ATOM 0 HB2 GLN B 106 9.996 3.550 -1.454 1.00 0.00 H new ATOM 0 HB3 GLN B 106 8.308 3.155 -1.199 1.00 0.00 H new ATOM 0 HG2 GLN B 106 9.934 2.367 -3.644 1.00 0.00 H new ATOM 0 HG3 GLN B 106 9.590 1.317 -2.284 1.00 0.00 H new ATOM 0 HE21 GLN B 106 8.215 3.014 -5.073 1.00 0.00 H new ATOM 0 HE22 GLN B 106 6.709 2.092 -5.137 1.00 0.00 H new ATOM 1287 N ASN B 107 8.947 6.368 -1.065 1.00 0.00 N ATOM 1288 CA ASN B 107 8.544 7.468 -0.186 1.00 0.00 C ATOM 1289 C ASN B 107 7.759 8.526 -0.967 1.00 0.00 C ATOM 1290 O ASN B 107 6.697 8.973 -0.540 1.00 0.00 O ATOM 1291 CB ASN B 107 9.785 8.105 0.450 1.00 0.00 C ATOM 1292 CG ASN B 107 9.473 9.353 1.262 1.00 0.00 C ATOM 1293 OD1 ASN B 107 8.345 9.364 1.958 1.00 0.00 O flip ATOM 1294 ND2 ASN B 107 10.260 10.300 1.276 1.00 0.00 N flip ATOM 0 H ASN B 107 9.950 6.185 -1.074 1.00 0.00 H new ATOM 0 HA ASN B 107 7.900 7.068 0.597 1.00 0.00 H new ATOM 0 HB2 ASN B 107 10.270 7.373 1.095 1.00 0.00 H new ATOM 0 HB3 ASN B 107 10.497 8.360 -0.335 1.00 0.00 H new ATOM 0 HD21 ASN B 107 11.119 10.257 0.728 1.00 0.00 H new ATOM 0 HD22 ASN B 107 10.053 11.127 1.836 1.00 0.00 H new ATOM 1301 N ARG B 108 8.279 8.890 -2.125 1.00 0.00 N ATOM 1302 CA ARG B 108 7.717 9.968 -2.929 1.00 0.00 C ATOM 1303 C ARG B 108 6.423 9.563 -3.638 1.00 0.00 C ATOM 1304 O ARG B 108 5.467 10.337 -3.682 1.00 0.00 O ATOM 1305 CB ARG B 108 8.764 10.429 -3.935 1.00 0.00 C ATOM 1306 CG ARG B 108 9.900 11.194 -3.279 1.00 0.00 C ATOM 1307 CD ARG B 108 11.053 11.437 -4.234 1.00 0.00 C ATOM 1308 NE ARG B 108 12.150 12.145 -3.577 1.00 0.00 N ATOM 1309 CZ ARG B 108 13.442 11.919 -3.817 1.00 0.00 C ATOM 1310 NH1 ARG B 108 13.810 10.999 -4.698 1.00 0.00 N ATOM 1311 NH2 ARG B 108 14.364 12.613 -3.167 1.00 0.00 N ATOM 0 H ARG B 108 9.102 8.450 -2.537 1.00 0.00 H new ATOM 0 HA ARG B 108 7.452 10.787 -2.261 1.00 0.00 H new ATOM 0 HB2 ARG B 108 9.168 9.562 -4.458 1.00 0.00 H new ATOM 0 HB3 ARG B 108 8.289 11.061 -4.685 1.00 0.00 H new ATOM 0 HG2 ARG B 108 9.527 12.150 -2.911 1.00 0.00 H new ATOM 0 HG3 ARG B 108 10.259 10.637 -2.413 1.00 0.00 H new ATOM 0 HD2 ARG B 108 11.413 10.484 -4.621 1.00 0.00 H new ATOM 0 HD3 ARG B 108 10.704 12.017 -5.088 1.00 0.00 H new ATOM 0 HE ARG B 108 11.911 12.859 -2.889 1.00 0.00 H new ATOM 0 HH11 ARG B 108 13.103 10.459 -5.197 1.00 0.00 H new ATOM 0 HH12 ARG B 108 14.800 10.831 -4.877 1.00 0.00 H new ATOM 0 HH21 ARG B 108 14.085 13.318 -2.485 1.00 0.00 H new ATOM 0 HH22 ARG B 108 15.353 12.442 -3.349 1.00 0.00 H new ATOM 1325 N VAL B 109 6.404 8.366 -4.204 1.00 0.00 N ATOM 1326 CA VAL B 109 5.213 7.846 -4.877 1.00 0.00 C ATOM 1327 C VAL B 109 4.032 7.770 -3.918 1.00 0.00 C ATOM 1328 O VAL B 109 2.937 8.236 -4.230 1.00 0.00 O ATOM 1329 CB VAL B 109 5.454 6.446 -5.478 1.00 0.00 C ATOM 1330 CG1 VAL B 109 4.184 5.906 -6.120 1.00 0.00 C ATOM 1331 CG2 VAL B 109 6.582 6.490 -6.493 1.00 0.00 C ATOM 0 H VAL B 109 7.202 7.730 -4.213 1.00 0.00 H new ATOM 0 HA VAL B 109 4.988 8.542 -5.685 1.00 0.00 H new ATOM 0 HB VAL B 109 5.740 5.774 -4.669 1.00 0.00 H new ATOM 0 HG11 VAL B 109 4.379 4.918 -6.537 1.00 0.00 H new ATOM 0 HG12 VAL B 109 3.398 5.834 -5.368 1.00 0.00 H new ATOM 0 HG13 VAL B 109 3.864 6.579 -6.916 1.00 0.00 H new ATOM 0 HG21 VAL B 109 6.738 5.494 -6.907 1.00 0.00 H new ATOM 0 HG22 VAL B 109 6.322 7.180 -7.296 1.00 0.00 H new ATOM 0 HG23 VAL B 109 7.497 6.828 -6.006 1.00 0.00 H new ATOM 1341 N TYR B 110 4.268 7.194 -2.746 1.00 0.00 N ATOM 1342 CA TYR B 110 3.222 7.067 -1.741 1.00 0.00 C ATOM 1343 C TYR B 110 2.738 8.442 -1.289 1.00 0.00 C ATOM 1344 O TYR B 110 1.580 8.613 -0.908 1.00 0.00 O ATOM 1345 CB TYR B 110 3.717 6.261 -0.538 1.00 0.00 C ATOM 1346 CG TYR B 110 3.982 4.798 -0.827 1.00 0.00 C ATOM 1347 CD1 TYR B 110 4.986 4.114 -0.155 1.00 0.00 C ATOM 1348 CD2 TYR B 110 3.229 4.100 -1.763 1.00 0.00 C ATOM 1349 CE1 TYR B 110 5.232 2.778 -0.409 1.00 0.00 C ATOM 1350 CE2 TYR B 110 3.468 2.766 -2.022 1.00 0.00 C ATOM 1351 CZ TYR B 110 4.469 2.109 -1.343 1.00 0.00 C ATOM 1352 OH TYR B 110 4.710 0.780 -1.599 1.00 0.00 O ATOM 0 H TYR B 110 5.171 6.809 -2.469 1.00 0.00 H new ATOM 0 HA TYR B 110 2.386 6.534 -2.194 1.00 0.00 H new ATOM 0 HB2 TYR B 110 4.634 6.716 -0.165 1.00 0.00 H new ATOM 0 HB3 TYR B 110 2.978 6.332 0.260 1.00 0.00 H new ATOM 0 HD1 TYR B 110 5.584 4.634 0.578 1.00 0.00 H new ATOM 0 HD2 TYR B 110 2.442 4.611 -2.298 1.00 0.00 H new ATOM 0 HE1 TYR B 110 6.018 2.260 0.121 1.00 0.00 H new ATOM 0 HE2 TYR B 110 2.873 2.240 -2.754 1.00 0.00 H new ATOM 0 HH TYR B 110 5.562 0.688 -2.075 1.00 0.00 H new ATOM 1362 N LYS B 111 3.630 9.423 -1.346 1.00 0.00 N ATOM 1363 CA LYS B 111 3.284 10.788 -0.981 1.00 0.00 C ATOM 1364 C LYS B 111 2.319 11.360 -2.014 1.00 0.00 C ATOM 1365 O LYS B 111 1.351 12.037 -1.667 1.00 0.00 O ATOM 1366 CB LYS B 111 4.550 11.649 -0.879 1.00 0.00 C ATOM 1367 CG LYS B 111 4.480 12.745 0.179 1.00 0.00 C ATOM 1368 CD LYS B 111 3.485 13.836 -0.181 1.00 0.00 C ATOM 1369 CE LYS B 111 3.384 14.884 0.915 1.00 0.00 C ATOM 1370 NZ LYS B 111 4.703 15.499 1.217 1.00 0.00 N ATOM 0 H LYS B 111 4.598 9.297 -1.642 1.00 0.00 H new ATOM 0 HA LYS B 111 2.797 10.790 -0.006 1.00 0.00 H new ATOM 0 HB2 LYS B 111 5.399 11.002 -0.659 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.742 12.108 -1.849 1.00 0.00 H new ATOM 0 HG2 LYS B 111 4.201 12.305 1.136 1.00 0.00 H new ATOM 0 HG3 LYS B 111 5.468 13.186 0.307 1.00 0.00 H new ATOM 0 HD2 LYS B 111 3.788 14.312 -1.114 1.00 0.00 H new ATOM 0 HD3 LYS B 111 2.504 13.393 -0.353 1.00 0.00 H new ATOM 0 HE2 LYS B 111 2.682 15.661 0.611 1.00 0.00 H new ATOM 0 HE3 LYS B 111 2.981 14.427 1.819 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 4.567 16.330 1.828 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 5.306 14.806 1.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 5.160 15.793 0.330 1.00 0.00 H new ATOM 1384 N LYS B 112 2.581 11.054 -3.281 1.00 0.00 N ATOM 1385 CA LYS B 112 1.703 11.459 -4.372 1.00 0.00 C ATOM 1386 C LYS B 112 0.296 10.926 -4.152 1.00 0.00 C ATOM 1387 O LYS B 112 -0.687 11.634 -4.389 1.00 0.00 O ATOM 1388 CB LYS B 112 2.236 10.941 -5.705 1.00 0.00 C ATOM 1389 CG LYS B 112 3.518 11.613 -6.161 1.00 0.00 C ATOM 1390 CD LYS B 112 4.178 10.843 -7.292 1.00 0.00 C ATOM 1391 CE LYS B 112 3.233 10.622 -8.465 1.00 0.00 C ATOM 1392 NZ LYS B 112 2.778 11.903 -9.070 1.00 0.00 N ATOM 0 H LYS B 112 3.400 10.523 -3.578 1.00 0.00 H new ATOM 0 HA LYS B 112 1.674 12.548 -4.394 1.00 0.00 H new ATOM 0 HB2 LYS B 112 2.410 9.868 -5.623 1.00 0.00 H new ATOM 0 HB3 LYS B 112 1.472 11.082 -6.470 1.00 0.00 H new ATOM 0 HG2 LYS B 112 3.300 12.629 -6.490 1.00 0.00 H new ATOM 0 HG3 LYS B 112 4.208 11.691 -5.321 1.00 0.00 H new ATOM 0 HD2 LYS B 112 5.058 11.387 -7.634 1.00 0.00 H new ATOM 0 HD3 LYS B 112 4.524 9.879 -6.920 1.00 0.00 H new ATOM 0 HE2 LYS B 112 3.734 10.021 -9.224 1.00 0.00 H new ATOM 0 HE3 LYS B 112 2.366 10.053 -8.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 2.206 11.704 -9.915 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 2.205 12.429 -8.380 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 3.605 12.473 -9.339 1.00 0.00 H new ATOM 1406 N GLU B 113 0.210 9.678 -3.691 1.00 0.00 N ATOM 1407 CA GLU B 113 -1.075 9.045 -3.443 1.00 0.00 C ATOM 1408 C GLU B 113 -1.859 9.820 -2.395 1.00 0.00 C ATOM 1409 O GLU B 113 -3.004 10.181 -2.624 1.00 0.00 O ATOM 1410 CB GLU B 113 -0.911 7.592 -2.981 1.00 0.00 C ATOM 1411 CG GLU B 113 -0.021 6.745 -3.877 1.00 0.00 C ATOM 1412 CD GLU B 113 -0.289 5.259 -3.723 1.00 0.00 C ATOM 1413 OE1 GLU B 113 -1.432 4.822 -3.986 1.00 0.00 O ATOM 1414 OE2 GLU B 113 0.643 4.515 -3.362 1.00 0.00 O ATOM 0 H GLU B 113 1.017 9.090 -3.483 1.00 0.00 H new ATOM 0 HA GLU B 113 -1.622 9.048 -4.386 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -0.499 7.589 -1.972 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -1.896 7.128 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -0.177 7.033 -4.916 1.00 0.00 H new ATOM 0 HG3 GLU B 113 1.024 6.949 -3.643 1.00 0.00 H new ATOM 1421 N ILE B 114 -1.228 10.093 -1.256 1.00 0.00 N ATOM 1422 CA ILE B 114 -1.896 10.766 -0.145 1.00 0.00 C ATOM 1423 C ILE B 114 -2.460 12.126 -0.544 1.00 0.00 C ATOM 1424 O ILE B 114 -3.521 12.516 -0.076 1.00 0.00 O ATOM 1425 CB ILE B 114 -0.944 10.932 1.050 1.00 0.00 C ATOM 1426 CG1 ILE B 114 -0.456 9.560 1.497 1.00 0.00 C ATOM 1427 CG2 ILE B 114 -1.633 11.657 2.200 1.00 0.00 C ATOM 1428 CD1 ILE B 114 0.585 9.616 2.583 1.00 0.00 C ATOM 0 H ILE B 114 -0.252 9.858 -1.078 1.00 0.00 H new ATOM 0 HA ILE B 114 -2.732 10.129 0.144 1.00 0.00 H new ATOM 0 HB ILE B 114 -0.091 11.537 0.743 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -1.307 8.978 1.851 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -0.044 9.032 0.637 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -0.938 11.761 3.033 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -1.953 12.645 1.868 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -2.502 11.084 2.523 1.00 0.00 H new ATOM 0 HD11 ILE B 114 0.886 8.603 2.851 1.00 0.00 H new ATOM 0 HD12 ILE B 114 1.453 10.170 2.226 1.00 0.00 H new ATOM 0 HD13 ILE B 114 0.171 10.115 3.459 1.00 0.00 H new ATOM 1440 N GLN B 115 -1.764 12.840 -1.415 1.00 0.00 N ATOM 1441 CA GLN B 115 -2.240 14.142 -1.864 1.00 0.00 C ATOM 1442 C GLN B 115 -3.477 13.973 -2.734 1.00 0.00 C ATOM 1443 O GLN B 115 -4.436 14.745 -2.647 1.00 0.00 O ATOM 1444 CB GLN B 115 -1.143 14.864 -2.628 1.00 0.00 C ATOM 1445 CG GLN B 115 0.169 14.891 -1.874 1.00 0.00 C ATOM 1446 CD GLN B 115 1.205 15.776 -2.530 1.00 0.00 C ATOM 1447 OE1 GLN B 115 1.979 15.321 -3.370 1.00 0.00 O ATOM 1448 NE2 GLN B 115 1.226 17.043 -2.152 1.00 0.00 N ATOM 0 H GLN B 115 -0.877 12.545 -1.822 1.00 0.00 H new ATOM 0 HA GLN B 115 -2.507 14.743 -0.995 1.00 0.00 H new ATOM 0 HB2 GLN B 115 -0.994 14.376 -3.591 1.00 0.00 H new ATOM 0 HB3 GLN B 115 -1.461 15.886 -2.834 1.00 0.00 H new ATOM 0 HG2 GLN B 115 -0.009 15.241 -0.857 1.00 0.00 H new ATOM 0 HG3 GLN B 115 0.560 13.876 -1.798 1.00 0.00 H new ATOM 0 HE21 GLN B 115 0.564 17.377 -1.451 1.00 0.00 H new ATOM 0 HE22 GLN B 115 1.904 17.686 -2.561 1.00 0.00 H new ATOM 1457 N ALA B 116 -3.451 12.943 -3.562 1.00 0.00 N ATOM 1458 CA ALA B 116 -4.611 12.569 -4.358 1.00 0.00 C ATOM 1459 C ALA B 116 -5.748 12.138 -3.442 1.00 0.00 C ATOM 1460 O ALA B 116 -6.898 12.543 -3.612 1.00 0.00 O ATOM 1461 CB ALA B 116 -4.251 11.444 -5.313 1.00 0.00 C ATOM 0 H ALA B 116 -2.635 12.347 -3.702 1.00 0.00 H new ATOM 0 HA ALA B 116 -4.934 13.431 -4.942 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -5.127 11.173 -5.903 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -3.453 11.773 -5.979 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -3.915 10.577 -4.744 1.00 0.00 H new ATOM 1467 N LEU B 117 -5.395 11.333 -2.449 1.00 0.00 N ATOM 1468 CA LEU B 117 -6.344 10.834 -1.470 1.00 0.00 C ATOM 1469 C LEU B 117 -6.880 11.968 -0.613 1.00 0.00 C ATOM 1470 O LEU B 117 -7.974 11.877 -0.081 1.00 0.00 O ATOM 1471 CB LEU B 117 -5.677 9.782 -0.579 1.00 0.00 C ATOM 1472 CG LEU B 117 -5.085 8.590 -1.328 1.00 0.00 C ATOM 1473 CD1 LEU B 117 -4.296 7.703 -0.388 1.00 0.00 C ATOM 1474 CD2 LEU B 117 -6.175 7.791 -2.017 1.00 0.00 C ATOM 0 H LEU B 117 -4.439 11.008 -2.302 1.00 0.00 H new ATOM 0 HA LEU B 117 -7.177 10.378 -2.004 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.885 10.262 -0.005 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -6.412 9.414 0.137 1.00 0.00 H new ATOM 0 HG LEU B 117 -4.407 8.975 -2.090 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -3.884 6.860 -0.943 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -3.483 8.277 0.057 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -4.952 7.332 0.399 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -5.730 6.947 -2.544 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -6.881 7.422 -1.273 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -6.698 8.429 -2.730 1.00 0.00 H new ATOM 1486 N ASP B 118 -6.104 13.035 -0.487 1.00 0.00 N ATOM 1487 CA ASP B 118 -6.522 14.201 0.284 1.00 0.00 C ATOM 1488 C ASP B 118 -7.773 14.822 -0.328 1.00 0.00 C ATOM 1489 O ASP B 118 -8.625 15.358 0.380 1.00 0.00 O ATOM 1490 CB ASP B 118 -5.395 15.232 0.361 1.00 0.00 C ATOM 1491 CG ASP B 118 -5.796 16.474 1.134 1.00 0.00 C ATOM 1492 OD1 ASP B 118 -6.172 17.483 0.492 1.00 0.00 O ATOM 1493 OD2 ASP B 118 -5.734 16.453 2.381 1.00 0.00 O ATOM 0 H ASP B 118 -5.179 13.119 -0.909 1.00 0.00 H new ATOM 0 HA ASP B 118 -6.756 13.876 1.298 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -4.524 14.779 0.834 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -5.097 15.516 -0.648 1.00 0.00 H new ATOM 1498 N ALA B 119 -7.890 14.730 -1.649 1.00 0.00 N ATOM 1499 CA ALA B 119 -9.110 15.145 -2.332 1.00 0.00 C ATOM 1500 C ALA B 119 -10.274 14.268 -1.881 1.00 0.00 C ATOM 1501 O ALA B 119 -11.390 14.741 -1.650 1.00 0.00 O ATOM 1502 CB ALA B 119 -8.934 15.065 -3.841 1.00 0.00 C ATOM 0 H ALA B 119 -7.159 14.374 -2.265 1.00 0.00 H new ATOM 0 HA ALA B 119 -9.325 16.182 -2.073 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -9.855 15.379 -4.332 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -8.118 15.720 -4.147 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -8.702 14.039 -4.126 1.00 0.00 H new ATOM 1508 N GLU B 120 -9.994 12.983 -1.735 1.00 0.00 N ATOM 1509 CA GLU B 120 -10.973 12.045 -1.230 1.00 0.00 C ATOM 1510 C GLU B 120 -11.226 12.277 0.259 1.00 0.00 C ATOM 1511 O GLU B 120 -12.295 11.977 0.766 1.00 0.00 O ATOM 1512 CB GLU B 120 -10.521 10.612 -1.474 1.00 0.00 C ATOM 1513 CG GLU B 120 -10.797 10.081 -2.873 1.00 0.00 C ATOM 1514 CD GLU B 120 -10.156 10.894 -3.980 1.00 0.00 C ATOM 1515 OE1 GLU B 120 -10.718 11.944 -4.352 1.00 0.00 O ATOM 1516 OE2 GLU B 120 -9.107 10.468 -4.502 1.00 0.00 O ATOM 0 H GLU B 120 -9.090 12.568 -1.962 1.00 0.00 H new ATOM 0 HA GLU B 120 -11.907 12.208 -1.768 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -9.450 10.547 -1.281 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -11.015 9.963 -0.751 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -10.439 9.053 -2.937 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -11.875 10.054 -3.034 1.00 0.00 H new ATOM 1523 N ILE B 121 -10.235 12.788 0.967 1.00 0.00 N ATOM 1524 CA ILE B 121 -10.429 13.174 2.356 1.00 0.00 C ATOM 1525 C ILE B 121 -11.592 14.162 2.469 1.00 0.00 C ATOM 1526 O ILE B 121 -12.339 14.138 3.440 1.00 0.00 O ATOM 1527 CB ILE B 121 -9.127 13.753 2.976 1.00 0.00 C ATOM 1528 CG1 ILE B 121 -8.370 12.664 3.749 1.00 0.00 C ATOM 1529 CG2 ILE B 121 -9.412 14.941 3.884 1.00 0.00 C ATOM 1530 CD1 ILE B 121 -7.970 11.472 2.908 1.00 0.00 C ATOM 0 H ILE B 121 -9.293 12.945 0.608 1.00 0.00 H new ATOM 0 HA ILE B 121 -10.680 12.281 2.928 1.00 0.00 H new ATOM 0 HB ILE B 121 -8.504 14.106 2.155 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -7.474 13.102 4.188 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -8.993 12.320 4.574 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -8.476 15.316 4.297 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -9.897 15.730 3.309 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -10.068 14.629 4.697 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -7.440 10.750 3.529 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -8.862 11.006 2.490 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -7.319 11.800 2.098 1.00 0.00 H new ATOM 1542 N ARG B 122 -11.773 14.985 1.441 1.00 0.00 N ATOM 1543 CA ARG B 122 -12.900 15.907 1.391 1.00 0.00 C ATOM 1544 C ARG B 122 -14.223 15.136 1.370 1.00 0.00 C ATOM 1545 O ARG B 122 -15.155 15.474 2.100 1.00 0.00 O ATOM 1546 CB ARG B 122 -12.796 16.809 0.160 1.00 0.00 C ATOM 1547 CG ARG B 122 -13.918 17.828 0.042 1.00 0.00 C ATOM 1548 CD ARG B 122 -13.782 18.643 -1.231 1.00 0.00 C ATOM 1549 NE ARG B 122 -14.882 19.591 -1.403 1.00 0.00 N ATOM 1550 CZ ARG B 122 -15.324 20.008 -2.590 1.00 0.00 C ATOM 1551 NH1 ARG B 122 -14.757 19.565 -3.709 1.00 0.00 N ATOM 1552 NH2 ARG B 122 -16.328 20.871 -2.659 1.00 0.00 N ATOM 0 H ARG B 122 -11.153 15.032 0.632 1.00 0.00 H new ATOM 0 HA ARG B 122 -12.874 16.530 2.285 1.00 0.00 H new ATOM 0 HB2 ARG B 122 -11.842 17.336 0.188 1.00 0.00 H new ATOM 0 HB3 ARG B 122 -12.790 16.186 -0.734 1.00 0.00 H new ATOM 0 HG2 ARG B 122 -14.881 17.317 0.049 1.00 0.00 H new ATOM 0 HG3 ARG B 122 -13.903 18.492 0.906 1.00 0.00 H new ATOM 0 HD2 ARG B 122 -12.837 19.186 -1.213 1.00 0.00 H new ATOM 0 HD3 ARG B 122 -13.747 17.971 -2.088 1.00 0.00 H new ATOM 0 HE ARG B 122 -15.338 19.955 -0.566 1.00 0.00 H new ATOM 0 HH11 ARG B 122 -13.982 18.904 -3.661 1.00 0.00 H new ATOM 0 HH12 ARG B 122 -15.098 19.886 -4.615 1.00 0.00 H new ATOM 0 HH21 ARG B 122 -16.763 21.217 -1.804 1.00 0.00 H new ATOM 0 HH22 ARG B 122 -16.665 21.189 -3.567 1.00 0.00 H new ATOM 1566 N LYS B 123 -14.295 14.089 0.545 1.00 0.00 N ATOM 1567 CA LYS B 123 -15.508 13.267 0.464 1.00 0.00 C ATOM 1568 C LYS B 123 -15.747 12.560 1.795 1.00 0.00 C ATOM 1569 O LYS B 123 -16.886 12.356 2.214 1.00 0.00 O ATOM 1570 CB LYS B 123 -15.409 12.243 -0.679 1.00 0.00 C ATOM 1571 CG LYS B 123 -14.620 10.988 -0.335 1.00 0.00 C ATOM 1572 CD LYS B 123 -13.973 10.374 -1.562 1.00 0.00 C ATOM 1573 CE LYS B 123 -14.991 9.888 -2.565 1.00 0.00 C ATOM 1574 NZ LYS B 123 -14.397 9.733 -3.920 1.00 0.00 N ATOM 0 H LYS B 123 -13.538 13.791 -0.070 1.00 0.00 H new ATOM 0 HA LYS B 123 -16.353 13.922 0.252 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -16.416 11.953 -0.978 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -14.946 12.723 -1.541 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -13.851 11.232 0.398 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -15.283 10.258 0.130 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -13.324 11.111 -2.035 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -13.340 9.541 -1.257 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -15.400 8.933 -2.235 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -15.822 10.592 -2.610 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -15.126 9.398 -4.582 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -14.029 10.650 -4.245 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -13.620 9.043 -3.882 1.00 0.00 H new ATOM 1588 N LEU B 124 -14.661 12.182 2.449 1.00 0.00 N ATOM 1589 CA LEU B 124 -14.725 11.617 3.781 1.00 0.00 C ATOM 1590 C LEU B 124 -15.286 12.634 4.770 1.00 0.00 C ATOM 1591 O LEU B 124 -16.312 12.389 5.404 1.00 0.00 O ATOM 1592 CB LEU B 124 -13.333 11.167 4.228 1.00 0.00 C ATOM 1593 CG LEU B 124 -12.771 9.944 3.502 1.00 0.00 C ATOM 1594 CD1 LEU B 124 -11.336 9.680 3.931 1.00 0.00 C ATOM 1595 CD2 LEU B 124 -13.626 8.730 3.789 1.00 0.00 C ATOM 0 H LEU B 124 -13.716 12.259 2.072 1.00 0.00 H new ATOM 0 HA LEU B 124 -15.389 10.753 3.757 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -12.641 11.998 4.092 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -13.366 10.950 5.296 1.00 0.00 H new ATOM 0 HG LEU B 124 -12.783 10.144 2.431 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -10.954 8.806 3.404 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -10.720 10.547 3.692 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -11.305 9.498 5.005 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -13.217 7.865 3.267 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -13.634 8.536 4.862 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -14.644 8.913 3.445 1.00 0.00 H new ATOM 1607 N GLU B 125 -14.626 13.787 4.865 1.00 0.00 N ATOM 1608 CA GLU B 125 -14.952 14.789 5.875 1.00 0.00 C ATOM 1609 C GLU B 125 -16.376 15.313 5.740 1.00 0.00 C ATOM 1610 O GLU B 125 -17.034 15.568 6.745 1.00 0.00 O ATOM 1611 CB GLU B 125 -13.964 15.955 5.831 1.00 0.00 C ATOM 1612 CG GLU B 125 -12.522 15.540 6.071 1.00 0.00 C ATOM 1613 CD GLU B 125 -11.589 16.722 6.215 1.00 0.00 C ATOM 1614 OE1 GLU B 125 -11.361 17.440 5.219 1.00 0.00 O ATOM 1615 OE2 GLU B 125 -11.070 16.939 7.331 1.00 0.00 O ATOM 0 H GLU B 125 -13.857 14.050 4.249 1.00 0.00 H new ATOM 0 HA GLU B 125 -14.874 14.288 6.840 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -14.036 16.444 4.860 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -14.251 16.692 6.581 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -12.469 14.929 6.972 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -12.186 14.916 5.243 1.00 0.00 H new ATOM 1622 N ARG B 126 -16.860 15.467 4.513 1.00 0.00 N ATOM 1623 CA ARG B 126 -18.222 15.953 4.304 1.00 0.00 C ATOM 1624 C ARG B 126 -19.239 14.991 4.919 1.00 0.00 C ATOM 1625 O ARG B 126 -20.260 15.416 5.461 1.00 0.00 O ATOM 1626 CB ARG B 126 -18.516 16.169 2.815 1.00 0.00 C ATOM 1627 CG ARG B 126 -18.372 14.921 1.968 1.00 0.00 C ATOM 1628 CD ARG B 126 -18.661 15.198 0.502 1.00 0.00 C ATOM 1629 NE ARG B 126 -20.041 15.626 0.278 1.00 0.00 N ATOM 1630 CZ ARG B 126 -20.517 16.010 -0.907 1.00 0.00 C ATOM 1631 NH1 ARG B 126 -19.723 16.028 -1.973 1.00 0.00 N ATOM 1632 NH2 ARG B 126 -21.787 16.378 -1.027 1.00 0.00 N ATOM 0 H ARG B 126 -16.340 15.266 3.659 1.00 0.00 H new ATOM 0 HA ARG B 126 -18.310 16.917 4.804 1.00 0.00 H new ATOM 0 HB2 ARG B 126 -19.531 16.552 2.708 1.00 0.00 H new ATOM 0 HB3 ARG B 126 -17.843 16.936 2.430 1.00 0.00 H new ATOM 0 HG2 ARG B 126 -17.361 14.526 2.071 1.00 0.00 H new ATOM 0 HG3 ARG B 126 -19.053 14.153 2.334 1.00 0.00 H new ATOM 0 HD2 ARG B 126 -17.981 15.969 0.140 1.00 0.00 H new ATOM 0 HD3 ARG B 126 -18.463 14.299 -0.081 1.00 0.00 H new ATOM 0 HE ARG B 126 -20.677 15.631 1.075 1.00 0.00 H new ATOM 0 HH11 ARG B 126 -18.746 15.747 -1.886 1.00 0.00 H new ATOM 0 HH12 ARG B 126 -20.091 16.322 -2.878 1.00 0.00 H new ATOM 0 HH21 ARG B 126 -22.400 16.367 -0.212 1.00 0.00 H new ATOM 0 HH22 ARG B 126 -22.149 16.671 -1.934 1.00 0.00 H new ATOM 1646 N LEU B 127 -18.947 13.695 4.856 1.00 0.00 N ATOM 1647 CA LEU B 127 -19.802 12.698 5.483 1.00 0.00 C ATOM 1648 C LEU B 127 -19.485 12.574 6.968 1.00 0.00 C ATOM 1649 O LEU B 127 -20.365 12.261 7.772 1.00 0.00 O ATOM 1650 CB LEU B 127 -19.670 11.336 4.797 1.00 0.00 C ATOM 1651 CG LEU B 127 -20.689 11.074 3.684 1.00 0.00 C ATOM 1652 CD1 LEU B 127 -20.512 12.057 2.543 1.00 0.00 C ATOM 1653 CD2 LEU B 127 -20.582 9.646 3.184 1.00 0.00 C ATOM 0 H LEU B 127 -18.129 13.314 4.380 1.00 0.00 H new ATOM 0 HA LEU B 127 -20.833 13.033 5.371 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -18.667 11.252 4.379 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -19.768 10.555 5.551 1.00 0.00 H new ATOM 0 HG LEU B 127 -21.686 11.217 4.100 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -21.248 11.849 1.766 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -20.652 13.073 2.913 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -19.509 11.957 2.129 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -21.315 9.481 2.394 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -19.580 9.472 2.792 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -20.774 8.957 4.007 1.00 0.00 H new ATOM 1665 N LEU B 128 -18.224 12.815 7.326 1.00 0.00 N ATOM 1666 CA LEU B 128 -17.812 12.841 8.728 1.00 0.00 C ATOM 1667 C LEU B 128 -18.606 13.890 9.487 1.00 0.00 C ATOM 1668 O LEU B 128 -19.284 13.591 10.468 1.00 0.00 O ATOM 1669 CB LEU B 128 -16.322 13.167 8.858 1.00 0.00 C ATOM 1670 CG LEU B 128 -15.367 12.171 8.211 1.00 0.00 C ATOM 1671 CD1 LEU B 128 -13.925 12.535 8.524 1.00 0.00 C ATOM 1672 CD2 LEU B 128 -15.674 10.760 8.664 1.00 0.00 C ATOM 0 H LEU B 128 -17.470 12.995 6.663 1.00 0.00 H new ATOM 0 HA LEU B 128 -18.000 11.852 9.146 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -16.145 14.149 8.420 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -16.077 13.242 9.917 1.00 0.00 H new ATOM 0 HG LEU B 128 -15.506 12.217 7.131 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -13.257 11.813 8.054 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -13.710 13.532 8.140 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -13.772 12.521 9.603 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -14.980 10.066 8.189 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -15.569 10.695 9.747 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -16.695 10.501 8.382 1.00 0.00 H new ATOM 1684 N GLU B 129 -18.510 15.121 9.005 1.00 0.00 N ATOM 1685 CA GLU B 129 -19.194 16.255 9.606 1.00 0.00 C ATOM 1686 C GLU B 129 -20.706 16.048 9.637 1.00 0.00 C ATOM 1687 O GLU B 129 -21.365 16.389 10.619 1.00 0.00 O ATOM 1688 CB GLU B 129 -18.867 17.528 8.830 1.00 0.00 C ATOM 1689 CG GLU B 129 -17.403 17.919 8.881 1.00 0.00 C ATOM 1690 CD GLU B 129 -17.125 19.202 8.133 1.00 0.00 C ATOM 1691 OE1 GLU B 129 -17.416 20.287 8.679 1.00 0.00 O ATOM 1692 OE2 GLU B 129 -16.611 19.139 6.998 1.00 0.00 O ATOM 0 H GLU B 129 -17.954 15.361 8.184 1.00 0.00 H new ATOM 0 HA GLU B 129 -18.845 16.348 10.634 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -19.161 17.393 7.789 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -19.466 18.348 9.227 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -17.096 18.033 9.921 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -16.800 17.116 8.457 1.00 0.00 H new ATOM 1699 N SER B 130 -21.249 15.491 8.561 1.00 0.00 N ATOM 1700 CA SER B 130 -22.684 15.266 8.465 1.00 0.00 C ATOM 1701 C SER B 130 -23.137 14.201 9.459 1.00 0.00 C ATOM 1702 O SER B 130 -24.183 14.331 10.095 1.00 0.00 O ATOM 1703 CB SER B 130 -23.068 14.863 7.039 1.00 0.00 C ATOM 1704 OG SER B 130 -24.470 14.704 6.911 1.00 0.00 O ATOM 0 H SER B 130 -20.718 15.188 7.745 1.00 0.00 H new ATOM 0 HA SER B 130 -23.190 16.199 8.713 1.00 0.00 H new ATOM 0 HB2 SER B 130 -22.720 15.622 6.338 1.00 0.00 H new ATOM 0 HB3 SER B 130 -22.568 13.931 6.775 1.00 0.00 H new ATOM 0 HG SER B 130 -24.688 14.448 5.990 1.00 0.00 H new ATOM 1710 N GLY B 131 -22.333 13.161 9.605 1.00 0.00 N ATOM 1711 CA GLY B 131 -22.650 12.114 10.553 1.00 0.00 C ATOM 1712 C GLY B 131 -22.977 10.788 9.892 1.00 0.00 C ATOM 1713 O GLY B 131 -23.728 9.987 10.446 1.00 0.00 O ATOM 0 H GLY B 131 -21.467 13.022 9.085 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -21.806 11.977 11.229 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -23.498 12.428 11.161 1.00 0.00 H new ATOM 1717 N LEU B 132 -22.416 10.549 8.712 1.00 0.00 N ATOM 1718 CA LEU B 132 -22.639 9.288 8.006 1.00 0.00 C ATOM 1719 C LEU B 132 -21.605 8.253 8.420 1.00 0.00 C ATOM 1720 O LEU B 132 -21.842 7.052 8.329 1.00 0.00 O ATOM 1721 CB LEU B 132 -22.580 9.474 6.482 1.00 0.00 C ATOM 1722 CG LEU B 132 -23.815 10.098 5.824 1.00 0.00 C ATOM 1723 CD1 LEU B 132 -25.069 9.313 6.173 1.00 0.00 C ATOM 1724 CD2 LEU B 132 -23.963 11.554 6.223 1.00 0.00 C ATOM 0 H LEU B 132 -21.807 11.206 8.225 1.00 0.00 H new ATOM 0 HA LEU B 132 -23.636 8.941 8.277 1.00 0.00 H new ATOM 0 HB2 LEU B 132 -21.716 10.096 6.247 1.00 0.00 H new ATOM 0 HB3 LEU B 132 -22.405 8.500 6.025 1.00 0.00 H new ATOM 0 HG LEU B 132 -23.678 10.056 4.743 1.00 0.00 H new ATOM 0 HD11 LEU B 132 -25.932 9.775 5.694 1.00 0.00 H new ATOM 0 HD12 LEU B 132 -24.965 8.287 5.821 1.00 0.00 H new ATOM 0 HD13 LEU B 132 -25.210 9.314 7.254 1.00 0.00 H new ATOM 0 HD21 LEU B 132 -24.847 11.975 5.743 1.00 0.00 H new ATOM 0 HD22 LEU B 132 -24.069 11.626 7.305 1.00 0.00 H new ATOM 0 HD23 LEU B 132 -23.080 12.109 5.907 1.00 0.00 H new ATOM 1736 N THR B 133 -20.460 8.725 8.869 1.00 0.00 N ATOM 1737 CA THR B 133 -19.369 7.840 9.231 1.00 0.00 C ATOM 1738 C THR B 133 -19.213 7.768 10.748 1.00 0.00 C ATOM 1739 O THR B 133 -18.636 8.708 11.339 1.00 0.00 O ATOM 1740 CB THR B 133 -18.055 8.315 8.592 1.00 0.00 C ATOM 1741 OG1 THR B 133 -18.279 8.655 7.213 1.00 0.00 O ATOM 1742 CG2 THR B 133 -16.987 7.237 8.680 1.00 0.00 C ATOM 1743 OXT THR B 133 -19.681 6.778 11.348 1.00 0.00 O ATOM 0 H THR B 133 -20.260 9.717 8.992 1.00 0.00 H new ATOM 0 HA THR B 133 -19.604 6.844 8.856 1.00 0.00 H new ATOM 0 HB THR B 133 -17.709 9.193 9.137 1.00 0.00 H new ATOM 0 HG1 THR B 133 -17.439 8.959 6.810 1.00 0.00 H new ATOM 0 HG21 THR B 133 -16.067 7.598 8.221 1.00 0.00 H new ATOM 0 HG22 THR B 133 -16.800 6.995 9.726 1.00 0.00 H new ATOM 0 HG23 THR B 133 -17.328 6.344 8.156 1.00 0.00 H new TER 1751 THR B 133