USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 859 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 LYS NZ :NH3+ 180:sc= 0.729 (180deg=0) USER MOD Set 1.2: A 96 ASN : amide:sc= 1.5 K(o=2.2,f=-2.5) USER MOD Set 2.1: A 35 MET CE :methyl -175:sc= -0.153 (180deg=-0.162) USER MOD Set 2.2: A 38 LYS NZ :NH3+ 180:sc= 1.61 (180deg=1.61) USER MOD Single : A 12 SER OG : rot 180:sc= 0.00345 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -94:sc= 1.23 USER MOD Single : A 34 TYR OH : rot 4:sc= 1.21 USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -68:sc= 0.194 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 62:sc= 0.509 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -62:sc= 0.41 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0.00249 USER MOD Single : A 78 SER OG : rot 150:sc= 0.265 USER MOD Single : A 79 ASN : amide:sc= 1.45 K(o=1.4,f=-5.7!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 170:sc= 0 USER MOD Single : A 91 SER OG : rot 72:sc= 0.109 USER MOD Single : A 92 LYS NZ :NH3+ 177:sc= 1.2 (180deg=1.16) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.34) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ -171:sc= 1.14 (180deg=1.09) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 11 11.563 19.796 1.305 1.00 0.00 N ATOM 2 CA GLY A 11 10.975 20.415 0.094 1.00 0.00 C ATOM 3 C GLY A 11 10.747 21.906 0.288 1.00 0.00 C ATOM 4 O GLY A 11 10.044 22.315 1.212 1.00 0.00 O ATOM 0 HA2 GLY A 11 11.637 20.254 -0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.029 19.928 -0.142 1.00 0.00 H new ATOM 8 N SER A 12 11.331 22.742 -0.572 1.00 0.00 N ATOM 9 CA SER A 12 11.254 24.217 -0.493 1.00 0.00 C ATOM 10 C SER A 12 9.987 24.822 -1.137 1.00 0.00 C ATOM 11 O SER A 12 9.664 25.989 -0.892 1.00 0.00 O ATOM 12 CB SER A 12 12.510 24.808 -1.154 1.00 0.00 C ATOM 13 OG SER A 12 12.675 24.331 -2.489 1.00 0.00 O ATOM 0 H SER A 12 11.885 22.414 -1.363 1.00 0.00 H new ATOM 0 HA SER A 12 11.197 24.477 0.564 1.00 0.00 H new ATOM 0 HB2 SER A 12 12.440 25.896 -1.162 1.00 0.00 H new ATOM 0 HB3 SER A 12 13.389 24.549 -0.563 1.00 0.00 H new ATOM 0 HG SER A 12 13.481 24.727 -2.881 1.00 0.00 H new ATOM 19 N GLU A 13 9.254 24.042 -1.941 1.00 0.00 N ATOM 20 CA GLU A 13 8.059 24.452 -2.690 1.00 0.00 C ATOM 21 C GLU A 13 7.205 23.218 -3.039 1.00 0.00 C ATOM 22 O GLU A 13 7.744 22.135 -3.286 1.00 0.00 O ATOM 23 CB GLU A 13 8.492 25.217 -3.958 1.00 0.00 C ATOM 24 CG GLU A 13 7.320 25.803 -4.754 1.00 0.00 C ATOM 25 CD GLU A 13 7.830 26.668 -5.915 1.00 0.00 C ATOM 26 OE1 GLU A 13 8.112 26.122 -7.009 1.00 0.00 O ATOM 27 OE2 GLU A 13 7.949 27.907 -5.749 1.00 0.00 O ATOM 0 H GLU A 13 9.489 23.061 -2.094 1.00 0.00 H new ATOM 0 HA GLU A 13 7.446 25.115 -2.079 1.00 0.00 H new ATOM 0 HB2 GLU A 13 9.166 26.025 -3.672 1.00 0.00 H new ATOM 0 HB3 GLU A 13 9.057 24.544 -4.603 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.698 24.996 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.691 26.403 -4.096 1.00 0.00 H new ATOM 34 N GLU A 14 5.877 23.380 -3.064 1.00 0.00 N ATOM 35 CA GLU A 14 4.907 22.334 -3.416 1.00 0.00 C ATOM 36 C GLU A 14 3.979 22.809 -4.547 1.00 0.00 C ATOM 37 O GLU A 14 3.536 23.962 -4.563 1.00 0.00 O ATOM 38 CB GLU A 14 4.063 21.942 -2.189 1.00 0.00 C ATOM 39 CG GLU A 14 4.899 21.317 -1.065 1.00 0.00 C ATOM 40 CD GLU A 14 4.019 20.920 0.130 1.00 0.00 C ATOM 41 OE1 GLU A 14 3.521 21.821 0.848 1.00 0.00 O ATOM 42 OE2 GLU A 14 3.837 19.704 0.380 1.00 0.00 O ATOM 0 H GLU A 14 5.433 24.269 -2.833 1.00 0.00 H new ATOM 0 HA GLU A 14 5.466 21.463 -3.758 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.553 22.827 -1.807 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.291 21.237 -2.496 1.00 0.00 H new ATOM 0 HG2 GLU A 14 5.421 20.438 -1.443 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.661 22.025 -0.739 1.00 0.00 H new ATOM 49 N VAL A 15 3.665 21.908 -5.480 1.00 0.00 N ATOM 50 CA VAL A 15 2.740 22.125 -6.608 1.00 0.00 C ATOM 51 C VAL A 15 1.279 21.949 -6.158 1.00 0.00 C ATOM 52 O VAL A 15 0.409 22.715 -6.570 1.00 0.00 O ATOM 53 CB VAL A 15 3.054 21.151 -7.772 1.00 0.00 C ATOM 54 CG1 VAL A 15 2.133 21.375 -8.987 1.00 0.00 C ATOM 55 CG2 VAL A 15 4.513 21.297 -8.249 1.00 0.00 C ATOM 0 H VAL A 15 4.061 20.968 -5.475 1.00 0.00 H new ATOM 0 HA VAL A 15 2.877 23.147 -6.960 1.00 0.00 H new ATOM 0 HB VAL A 15 2.886 20.151 -7.373 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.393 20.669 -9.775 1.00 0.00 H new ATOM 0 HG12 VAL A 15 1.095 21.222 -8.690 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.259 22.393 -9.356 1.00 0.00 H new ATOM 0 HG21 VAL A 15 4.700 20.600 -9.066 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.682 22.316 -8.596 1.00 0.00 H new ATOM 0 HG23 VAL A 15 5.190 21.078 -7.423 1.00 0.00 H new ATOM 65 N SER A 16 1.016 20.971 -5.283 1.00 0.00 N ATOM 66 CA SER A 16 -0.317 20.620 -4.764 1.00 0.00 C ATOM 67 C SER A 16 -0.213 20.037 -3.340 1.00 0.00 C ATOM 68 O SER A 16 0.800 19.430 -2.985 1.00 0.00 O ATOM 69 CB SER A 16 -0.992 19.577 -5.677 1.00 0.00 C ATOM 70 OG SER A 16 -1.215 20.036 -7.008 1.00 0.00 O ATOM 0 H SER A 16 1.752 20.378 -4.901 1.00 0.00 H new ATOM 0 HA SER A 16 -0.914 21.532 -4.740 1.00 0.00 H new ATOM 0 HB2 SER A 16 -0.371 18.682 -5.711 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.947 19.287 -5.238 1.00 0.00 H new ATOM 0 HG SER A 16 -1.643 19.327 -7.531 1.00 0.00 H new ATOM 76 N GLU A 17 -1.258 20.195 -2.518 1.00 0.00 N ATOM 77 CA GLU A 17 -1.273 19.712 -1.131 1.00 0.00 C ATOM 78 C GLU A 17 -1.582 18.194 -1.069 1.00 0.00 C ATOM 79 O GLU A 17 -2.594 17.770 -1.643 1.00 0.00 O ATOM 80 CB GLU A 17 -2.296 20.534 -0.327 1.00 0.00 C ATOM 81 CG GLU A 17 -2.233 20.253 1.179 1.00 0.00 C ATOM 82 CD GLU A 17 -3.209 21.159 1.943 1.00 0.00 C ATOM 83 OE1 GLU A 17 -4.408 20.807 2.061 1.00 0.00 O ATOM 84 OE2 GLU A 17 -2.788 22.233 2.435 1.00 0.00 O ATOM 0 H GLU A 17 -2.120 20.663 -2.797 1.00 0.00 H new ATOM 0 HA GLU A 17 -0.286 19.846 -0.689 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.120 21.595 -0.501 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.299 20.313 -0.691 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.475 19.207 1.369 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.218 20.416 1.542 1.00 0.00 H new ATOM 91 N PRO A 18 -0.756 17.372 -0.382 1.00 0.00 N ATOM 92 CA PRO A 18 -0.982 15.935 -0.216 1.00 0.00 C ATOM 93 C PRO A 18 -2.065 15.639 0.837 1.00 0.00 C ATOM 94 O PRO A 18 -2.478 16.525 1.589 1.00 0.00 O ATOM 95 CB PRO A 18 0.383 15.365 0.190 1.00 0.00 C ATOM 96 CG PRO A 18 0.997 16.505 0.996 1.00 0.00 C ATOM 97 CD PRO A 18 0.500 17.748 0.257 1.00 0.00 C ATOM 0 HA PRO A 18 -1.355 15.477 -1.132 1.00 0.00 H new ATOM 0 HB2 PRO A 18 0.282 14.457 0.785 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.990 15.111 -0.679 1.00 0.00 H new ATOM 0 HG2 PRO A 18 0.664 16.491 2.034 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.086 16.451 1.009 1.00 0.00 H new ATOM 0 HD2 PRO A 18 0.351 18.577 0.948 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.229 18.077 -0.483 1.00 0.00 H new ATOM 105 N GLY A 19 -2.523 14.382 0.897 1.00 0.00 N ATOM 106 CA GLY A 19 -3.602 13.944 1.793 1.00 0.00 C ATOM 107 C GLY A 19 -3.523 12.481 2.225 1.00 0.00 C ATOM 108 O GLY A 19 -2.666 11.717 1.777 1.00 0.00 O ATOM 0 H GLY A 19 -2.150 13.630 0.317 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.593 14.572 2.684 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.558 14.110 1.296 1.00 0.00 H new ATOM 112 N ASP A 20 -4.444 12.080 3.098 1.00 0.00 N ATOM 113 CA ASP A 20 -4.559 10.719 3.631 1.00 0.00 C ATOM 114 C ASP A 20 -5.772 9.969 3.046 1.00 0.00 C ATOM 115 O ASP A 20 -6.732 10.582 2.567 1.00 0.00 O ATOM 116 CB ASP A 20 -4.710 10.764 5.165 1.00 0.00 C ATOM 117 CG ASP A 20 -3.633 11.579 5.901 1.00 0.00 C ATOM 118 OD1 ASP A 20 -3.807 12.810 6.064 1.00 0.00 O ATOM 119 OD2 ASP A 20 -2.623 10.985 6.346 1.00 0.00 O ATOM 0 H ASP A 20 -5.155 12.711 3.468 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.650 10.188 3.347 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -5.688 11.181 5.407 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.695 9.743 5.546 1.00 0.00 H new ATOM 124 N ALA A 21 -5.748 8.634 3.137 1.00 0.00 N ATOM 125 CA ALA A 21 -6.779 7.730 2.624 1.00 0.00 C ATOM 126 C ALA A 21 -6.734 6.359 3.338 1.00 0.00 C ATOM 127 O ALA A 21 -6.343 5.336 2.772 1.00 0.00 O ATOM 128 CB ALA A 21 -6.632 7.645 1.099 1.00 0.00 C ATOM 0 H ALA A 21 -4.980 8.137 3.588 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.774 8.119 2.842 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.392 6.975 0.697 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.757 8.637 0.666 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.642 7.262 0.850 1.00 0.00 H new ATOM 134 N ASN A 22 -7.143 6.360 4.613 1.00 0.00 N ATOM 135 CA ASN A 22 -7.507 5.202 5.451 1.00 0.00 C ATOM 136 C ASN A 22 -6.338 4.244 5.781 1.00 0.00 C ATOM 137 O ASN A 22 -5.929 4.140 6.938 1.00 0.00 O ATOM 138 CB ASN A 22 -8.707 4.454 4.833 1.00 0.00 C ATOM 139 CG ASN A 22 -9.954 5.330 4.743 1.00 0.00 C ATOM 140 OD1 ASN A 22 -10.557 5.693 5.747 1.00 0.00 O ATOM 141 ND2 ASN A 22 -10.371 5.708 3.545 1.00 0.00 N ATOM 0 H ASN A 22 -7.236 7.235 5.128 1.00 0.00 H new ATOM 0 HA ASN A 22 -7.795 5.611 6.419 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -8.439 4.104 3.836 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -8.929 3.571 5.432 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -11.195 6.302 3.456 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -9.868 5.405 2.711 1.00 0.00 H new ATOM 148 N ILE A 23 -5.811 3.532 4.776 1.00 0.00 N ATOM 149 CA ILE A 23 -4.701 2.558 4.878 1.00 0.00 C ATOM 150 C ILE A 23 -3.461 3.037 4.097 1.00 0.00 C ATOM 151 O ILE A 23 -2.378 2.471 4.247 1.00 0.00 O ATOM 152 CB ILE A 23 -5.152 1.149 4.402 1.00 0.00 C ATOM 153 CG1 ILE A 23 -6.630 0.782 4.700 1.00 0.00 C ATOM 154 CG2 ILE A 23 -4.260 0.057 5.030 1.00 0.00 C ATOM 155 CD1 ILE A 23 -7.569 1.102 3.526 1.00 0.00 C ATOM 0 H ILE A 23 -6.159 3.619 3.821 1.00 0.00 H new ATOM 0 HA ILE A 23 -4.420 2.484 5.929 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.051 1.194 3.318 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.696 -0.281 4.934 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.963 1.324 5.585 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.589 -0.924 4.686 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.224 0.217 4.731 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -4.336 0.105 6.116 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.589 0.825 3.790 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.528 2.169 3.308 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.256 0.539 2.646 1.00 0.00 H new ATOM 167 N PHE A 24 -3.589 4.088 3.279 1.00 0.00 N ATOM 168 CA PHE A 24 -2.478 4.743 2.606 1.00 0.00 C ATOM 169 C PHE A 24 -2.534 6.271 2.749 1.00 0.00 C ATOM 170 O PHE A 24 -3.535 6.843 3.181 1.00 0.00 O ATOM 171 CB PHE A 24 -2.430 4.274 1.138 1.00 0.00 C ATOM 172 CG PHE A 24 -3.745 4.295 0.382 1.00 0.00 C ATOM 173 CD1 PHE A 24 -4.582 3.167 0.440 1.00 0.00 C ATOM 174 CD2 PHE A 24 -4.137 5.418 -0.368 1.00 0.00 C ATOM 175 CE1 PHE A 24 -5.846 3.185 -0.171 1.00 0.00 C ATOM 176 CE2 PHE A 24 -5.391 5.426 -1.007 1.00 0.00 C ATOM 177 CZ PHE A 24 -6.258 4.327 -0.877 1.00 0.00 C ATOM 0 H PHE A 24 -4.492 4.511 3.066 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.545 4.451 3.087 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -1.717 4.901 0.602 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -2.039 3.257 1.117 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.250 2.280 0.959 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.479 6.270 -0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.497 2.326 -0.099 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -5.688 6.279 -1.599 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.242 4.361 -1.321 1.00 0.00 H new ATOM 187 N ARG A 25 -1.441 6.933 2.363 1.00 0.00 N ATOM 188 CA ARG A 25 -1.366 8.379 2.137 1.00 0.00 C ATOM 189 C ARG A 25 -1.178 8.621 0.648 1.00 0.00 C ATOM 190 O ARG A 25 -0.424 7.886 0.017 1.00 0.00 O ATOM 191 CB ARG A 25 -0.197 8.999 2.921 1.00 0.00 C ATOM 192 CG ARG A 25 -0.617 9.300 4.363 1.00 0.00 C ATOM 193 CD ARG A 25 0.513 9.893 5.217 1.00 0.00 C ATOM 194 NE ARG A 25 1.088 11.123 4.633 1.00 0.00 N ATOM 195 CZ ARG A 25 0.574 12.349 4.673 1.00 0.00 C ATOM 196 NH1 ARG A 25 -0.585 12.607 5.237 1.00 0.00 N ATOM 197 NH2 ARG A 25 1.236 13.350 4.134 1.00 0.00 N ATOM 0 H ARG A 25 -0.553 6.461 2.193 1.00 0.00 H new ATOM 0 HA ARG A 25 -2.286 8.848 2.486 1.00 0.00 H new ATOM 0 HB2 ARG A 25 0.653 8.316 2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.130 9.917 2.432 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -1.456 9.995 4.351 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.971 8.381 4.830 1.00 0.00 H new ATOM 0 HD2 ARG A 25 0.131 10.114 6.214 1.00 0.00 H new ATOM 0 HD3 ARG A 25 1.301 9.150 5.335 1.00 0.00 H new ATOM 0 HE ARG A 25 1.978 11.020 4.145 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -1.123 11.853 5.664 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -0.946 13.561 5.248 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.138 13.184 3.689 1.00 0.00 H new ATOM 0 HH22 ARG A 25 0.847 14.292 4.162 1.00 0.00 H new ATOM 211 N VAL A 26 -1.844 9.640 0.112 1.00 0.00 N ATOM 212 CA VAL A 26 -1.648 10.085 -1.278 1.00 0.00 C ATOM 213 C VAL A 26 -0.722 11.302 -1.306 1.00 0.00 C ATOM 214 O VAL A 26 -1.076 12.375 -0.818 1.00 0.00 O ATOM 215 CB VAL A 26 -2.984 10.314 -2.026 1.00 0.00 C ATOM 216 CG1 VAL A 26 -3.968 11.290 -1.353 1.00 0.00 C ATOM 217 CG2 VAL A 26 -2.732 10.746 -3.481 1.00 0.00 C ATOM 0 H VAL A 26 -2.537 10.186 0.624 1.00 0.00 H new ATOM 0 HA VAL A 26 -1.160 9.283 -1.831 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.476 9.342 -1.993 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.869 11.376 -1.961 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.232 10.916 -0.364 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.500 12.270 -1.257 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.686 10.901 -3.985 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.162 11.675 -3.491 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -2.170 9.969 -3.999 1.00 0.00 H new ATOM 227 N ASP A 27 0.469 11.135 -1.881 1.00 0.00 N ATOM 228 CA ASP A 27 1.382 12.249 -2.135 1.00 0.00 C ATOM 229 C ASP A 27 1.040 12.895 -3.485 1.00 0.00 C ATOM 230 O ASP A 27 1.483 12.458 -4.550 1.00 0.00 O ATOM 231 CB ASP A 27 2.847 11.811 -2.033 1.00 0.00 C ATOM 232 CG ASP A 27 3.752 13.048 -1.918 1.00 0.00 C ATOM 233 OD1 ASP A 27 4.013 13.697 -2.958 1.00 0.00 O ATOM 234 OD2 ASP A 27 4.157 13.394 -0.782 1.00 0.00 O ATOM 0 H ASP A 27 0.827 10.229 -2.182 1.00 0.00 H new ATOM 0 HA ASP A 27 1.250 13.007 -1.362 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.984 11.166 -1.165 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.124 11.227 -2.911 1.00 0.00 H new ATOM 239 N LYS A 28 0.199 13.932 -3.434 1.00 0.00 N ATOM 240 CA LYS A 28 -0.320 14.633 -4.616 1.00 0.00 C ATOM 241 C LYS A 28 0.753 15.479 -5.339 1.00 0.00 C ATOM 242 O LYS A 28 0.628 15.743 -6.534 1.00 0.00 O ATOM 243 CB LYS A 28 -1.509 15.488 -4.134 1.00 0.00 C ATOM 244 CG LYS A 28 -2.369 16.175 -5.210 1.00 0.00 C ATOM 245 CD LYS A 28 -3.205 15.236 -6.096 1.00 0.00 C ATOM 246 CE LYS A 28 -2.463 14.793 -7.369 1.00 0.00 C ATOM 247 NZ LYS A 28 -3.360 14.045 -8.294 1.00 0.00 N ATOM 0 H LYS A 28 -0.148 14.316 -2.555 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.639 13.911 -5.367 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.162 14.851 -3.537 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.121 16.260 -3.469 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.043 16.875 -4.717 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.713 16.762 -5.853 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.484 14.354 -5.519 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.130 15.739 -6.378 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.061 15.668 -7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.615 14.165 -7.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.827 13.762 -9.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -3.724 13.197 -7.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -4.156 14.653 -8.573 1.00 0.00 H new ATOM 261 N ASP A 29 1.808 15.889 -4.625 1.00 0.00 N ATOM 262 CA ASP A 29 2.903 16.717 -5.143 1.00 0.00 C ATOM 263 C ASP A 29 3.862 15.920 -6.043 1.00 0.00 C ATOM 264 O ASP A 29 4.109 16.299 -7.187 1.00 0.00 O ATOM 265 CB ASP A 29 3.670 17.318 -3.956 1.00 0.00 C ATOM 266 CG ASP A 29 4.766 18.279 -4.432 1.00 0.00 C ATOM 267 OD1 ASP A 29 4.411 19.346 -4.988 1.00 0.00 O ATOM 268 OD2 ASP A 29 5.968 17.972 -4.251 1.00 0.00 O ATOM 0 H ASP A 29 1.927 15.646 -3.641 1.00 0.00 H new ATOM 0 HA ASP A 29 2.473 17.506 -5.760 1.00 0.00 H new ATOM 0 HB2 ASP A 29 2.977 17.848 -3.303 1.00 0.00 H new ATOM 0 HB3 ASP A 29 4.116 16.518 -3.365 1.00 0.00 H new ATOM 273 N SER A 30 4.389 14.807 -5.531 1.00 0.00 N ATOM 274 CA SER A 30 5.353 13.944 -6.227 1.00 0.00 C ATOM 275 C SER A 30 4.679 12.794 -7.014 1.00 0.00 C ATOM 276 O SER A 30 5.341 12.130 -7.817 1.00 0.00 O ATOM 277 CB SER A 30 6.375 13.421 -5.200 1.00 0.00 C ATOM 278 OG SER A 30 7.553 12.916 -5.810 1.00 0.00 O ATOM 0 H SER A 30 4.153 14.470 -4.598 1.00 0.00 H new ATOM 0 HA SER A 30 5.866 14.537 -6.984 1.00 0.00 H new ATOM 0 HB2 SER A 30 6.641 14.227 -4.516 1.00 0.00 H new ATOM 0 HB3 SER A 30 5.914 12.635 -4.602 1.00 0.00 H new ATOM 0 HG SER A 30 7.468 11.947 -5.933 1.00 0.00 H new ATOM 284 N ARG A 31 3.364 12.576 -6.812 1.00 0.00 N ATOM 285 CA ARG A 31 2.475 11.673 -7.574 1.00 0.00 C ATOM 286 C ARG A 31 2.649 10.203 -7.121 1.00 0.00 C ATOM 287 O ARG A 31 3.013 9.335 -7.915 1.00 0.00 O ATOM 288 CB ARG A 31 2.667 11.892 -9.094 1.00 0.00 C ATOM 289 CG ARG A 31 1.461 11.505 -9.961 1.00 0.00 C ATOM 290 CD ARG A 31 1.849 11.660 -11.440 1.00 0.00 C ATOM 291 NE ARG A 31 0.677 11.639 -12.335 1.00 0.00 N ATOM 292 CZ ARG A 31 0.716 11.618 -13.666 1.00 0.00 C ATOM 293 NH1 ARG A 31 1.848 11.500 -14.329 1.00 0.00 N ATOM 294 NH2 ARG A 31 -0.395 11.723 -14.361 1.00 0.00 N ATOM 0 H ARG A 31 2.862 13.056 -6.065 1.00 0.00 H new ATOM 0 HA ARG A 31 1.435 11.918 -7.358 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.899 12.943 -9.268 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.532 11.316 -9.423 1.00 0.00 H new ATOM 0 HG2 ARG A 31 1.161 10.478 -9.754 1.00 0.00 H new ATOM 0 HG3 ARG A 31 0.607 12.140 -9.726 1.00 0.00 H new ATOM 0 HD2 ARG A 31 2.389 12.597 -11.575 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.531 10.857 -11.720 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.244 11.641 -11.896 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.730 11.421 -13.823 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.843 11.487 -15.349 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.290 11.821 -13.881 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.362 11.707 -15.380 1.00 0.00 H new ATOM 308 N GLU A 32 2.453 9.930 -5.825 1.00 0.00 N ATOM 309 CA GLU A 32 2.860 8.675 -5.156 1.00 0.00 C ATOM 310 C GLU A 32 1.780 8.178 -4.166 1.00 0.00 C ATOM 311 O GLU A 32 0.914 8.962 -3.775 1.00 0.00 O ATOM 312 CB GLU A 32 4.218 8.862 -4.428 1.00 0.00 C ATOM 313 CG GLU A 32 5.216 9.762 -5.181 1.00 0.00 C ATOM 314 CD GLU A 32 6.640 9.834 -4.600 1.00 0.00 C ATOM 315 OE1 GLU A 32 6.870 9.480 -3.422 1.00 0.00 O ATOM 316 OE2 GLU A 32 7.543 10.324 -5.321 1.00 0.00 O ATOM 0 H GLU A 32 1.997 10.587 -5.192 1.00 0.00 H new ATOM 0 HA GLU A 32 2.976 7.914 -5.928 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.034 9.288 -3.442 1.00 0.00 H new ATOM 0 HB3 GLU A 32 4.673 7.884 -4.273 1.00 0.00 H new ATOM 0 HG2 GLU A 32 5.284 9.411 -6.211 1.00 0.00 H new ATOM 0 HG3 GLU A 32 4.808 10.772 -5.214 1.00 0.00 H new ATOM 323 N VAL A 33 1.829 6.906 -3.731 1.00 0.00 N ATOM 324 CA VAL A 33 0.962 6.373 -2.651 1.00 0.00 C ATOM 325 C VAL A 33 1.756 5.520 -1.659 1.00 0.00 C ATOM 326 O VAL A 33 2.498 4.611 -2.026 1.00 0.00 O ATOM 327 CB VAL A 33 -0.297 5.587 -3.121 1.00 0.00 C ATOM 328 CG1 VAL A 33 -1.523 6.503 -3.181 1.00 0.00 C ATOM 329 CG2 VAL A 33 -0.101 4.820 -4.439 1.00 0.00 C ATOM 0 H VAL A 33 2.471 6.213 -4.116 1.00 0.00 H new ATOM 0 HA VAL A 33 0.586 7.272 -2.163 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.469 4.820 -2.366 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.389 5.930 -3.512 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.718 6.916 -2.191 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -1.336 7.316 -3.883 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.023 4.299 -4.697 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.155 5.521 -5.233 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.705 4.095 -4.322 1.00 0.00 H new ATOM 339 N TYR A 34 1.607 5.833 -0.373 1.00 0.00 N ATOM 340 CA TYR A 34 2.351 5.204 0.720 1.00 0.00 C ATOM 341 C TYR A 34 1.409 4.323 1.543 1.00 0.00 C ATOM 342 O TYR A 34 0.577 4.842 2.283 1.00 0.00 O ATOM 343 CB TYR A 34 3.013 6.289 1.593 1.00 0.00 C ATOM 344 CG TYR A 34 3.826 7.368 0.886 1.00 0.00 C ATOM 345 CD1 TYR A 34 4.396 7.147 -0.382 1.00 0.00 C ATOM 346 CD2 TYR A 34 4.020 8.614 1.517 1.00 0.00 C ATOM 347 CE1 TYR A 34 5.147 8.148 -1.014 1.00 0.00 C ATOM 348 CE2 TYR A 34 4.768 9.628 0.886 1.00 0.00 C ATOM 349 CZ TYR A 34 5.337 9.397 -0.386 1.00 0.00 C ATOM 350 OH TYR A 34 6.071 10.360 -1.004 1.00 0.00 O ATOM 0 H TYR A 34 0.952 6.546 -0.054 1.00 0.00 H new ATOM 0 HA TYR A 34 3.140 4.571 0.314 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.229 6.782 2.167 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.667 5.791 2.309 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.253 6.196 -0.873 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.592 8.793 2.492 1.00 0.00 H new ATOM 0 HE1 TYR A 34 5.582 7.962 -1.985 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.906 10.581 1.375 1.00 0.00 H new ATOM 0 HH TYR A 34 6.334 10.049 -1.895 1.00 0.00 H new ATOM 360 N MET A 35 1.513 2.999 1.410 1.00 0.00 N ATOM 361 CA MET A 35 0.732 2.036 2.190 1.00 0.00 C ATOM 362 C MET A 35 1.276 1.983 3.619 1.00 0.00 C ATOM 363 O MET A 35 2.478 2.151 3.829 1.00 0.00 O ATOM 364 CB MET A 35 0.834 0.667 1.497 1.00 0.00 C ATOM 365 CG MET A 35 -0.158 -0.402 1.977 1.00 0.00 C ATOM 366 SD MET A 35 0.293 -2.099 1.512 1.00 0.00 S ATOM 367 CE MET A 35 0.580 -1.943 -0.276 1.00 0.00 C ATOM 0 H MET A 35 2.152 2.559 0.748 1.00 0.00 H new ATOM 0 HA MET A 35 -0.316 2.330 2.244 1.00 0.00 H new ATOM 0 HB2 MET A 35 0.692 0.812 0.426 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.845 0.285 1.636 1.00 0.00 H new ATOM 0 HG2 MET A 35 -0.240 -0.344 3.062 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.144 -0.176 1.570 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.776 -2.928 -0.700 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.302 -1.513 -0.750 1.00 0.00 H new ATOM 0 HE3 MET A 35 1.438 -1.295 -0.452 1.00 0.00 H new ATOM 377 N HIS A 36 0.423 1.642 4.584 1.00 0.00 N ATOM 378 CA HIS A 36 0.795 1.452 5.997 1.00 0.00 C ATOM 379 C HIS A 36 2.029 0.535 6.224 1.00 0.00 C ATOM 380 O HIS A 36 2.728 0.674 7.231 1.00 0.00 O ATOM 381 CB HIS A 36 -0.451 0.909 6.716 1.00 0.00 C ATOM 382 CG HIS A 36 -0.269 0.734 8.200 1.00 0.00 C ATOM 383 ND1 HIS A 36 -0.060 -0.484 8.850 1.00 0.00 N ATOM 384 CD2 HIS A 36 -0.275 1.738 9.122 1.00 0.00 C ATOM 385 CE1 HIS A 36 0.056 -0.181 10.155 1.00 0.00 C ATOM 386 NE2 HIS A 36 -0.069 1.146 10.349 1.00 0.00 N ATOM 0 H HIS A 36 -0.569 1.485 4.408 1.00 0.00 H new ATOM 0 HA HIS A 36 1.112 2.412 6.404 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -1.285 1.588 6.539 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -0.723 -0.051 6.277 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -0.414 2.791 8.929 1.00 0.00 H new ATOM 0 HE1 HIS A 36 0.226 -0.903 10.940 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -0.020 1.628 11.247 1.00 0.00 H new ATOM 394 N GLU A 37 2.317 -0.368 5.274 1.00 0.00 N ATOM 395 CA GLU A 37 3.472 -1.275 5.301 1.00 0.00 C ATOM 396 C GLU A 37 4.663 -0.791 4.448 1.00 0.00 C ATOM 397 O GLU A 37 5.794 -1.152 4.774 1.00 0.00 O ATOM 398 CB GLU A 37 3.042 -2.670 4.809 1.00 0.00 C ATOM 399 CG GLU A 37 1.931 -3.284 5.671 1.00 0.00 C ATOM 400 CD GLU A 37 1.590 -4.713 5.227 1.00 0.00 C ATOM 401 OE1 GLU A 37 1.687 -5.007 4.010 1.00 0.00 O ATOM 402 OE2 GLU A 37 1.221 -5.534 6.100 1.00 0.00 O ATOM 0 H GLU A 37 1.737 -0.490 4.444 1.00 0.00 H new ATOM 0 HA GLU A 37 3.813 -1.305 6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 37 2.698 -2.597 3.777 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.906 -3.334 4.810 1.00 0.00 H new ATOM 0 HG2 GLU A 37 2.244 -3.293 6.715 1.00 0.00 H new ATOM 0 HG3 GLU A 37 1.038 -2.662 5.611 1.00 0.00 H new ATOM 409 N LYS A 38 4.452 -0.014 3.363 1.00 0.00 N ATOM 410 CA LYS A 38 5.487 0.244 2.334 1.00 0.00 C ATOM 411 C LYS A 38 5.155 1.364 1.314 1.00 0.00 C ATOM 412 O LYS A 38 4.003 1.602 0.961 1.00 0.00 O ATOM 413 CB LYS A 38 5.897 -1.091 1.651 1.00 0.00 C ATOM 414 CG LYS A 38 4.859 -1.697 0.682 1.00 0.00 C ATOM 415 CD LYS A 38 4.989 -3.231 0.571 1.00 0.00 C ATOM 416 CE LYS A 38 4.401 -3.998 1.775 1.00 0.00 C ATOM 417 NZ LYS A 38 2.930 -4.249 1.646 1.00 0.00 N ATOM 0 H LYS A 38 3.564 0.451 3.175 1.00 0.00 H new ATOM 0 HA LYS A 38 6.345 0.655 2.867 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.825 -0.927 1.103 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.111 -1.824 2.429 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.855 -1.443 1.023 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.983 -1.251 -0.305 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.488 -3.563 -0.338 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.043 -3.490 0.467 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.919 -4.951 1.880 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.589 -3.431 2.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.591 -4.767 2.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.428 -3.341 1.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.748 -4.814 0.792 1.00 0.00 H new ATOM 431 N LYS A 39 6.193 2.031 0.797 1.00 0.00 N ATOM 432 CA LYS A 39 6.134 3.159 -0.161 1.00 0.00 C ATOM 433 C LYS A 39 6.013 2.683 -1.627 1.00 0.00 C ATOM 434 O LYS A 39 6.754 1.785 -2.015 1.00 0.00 O ATOM 435 CB LYS A 39 7.430 3.969 0.103 1.00 0.00 C ATOM 436 CG LYS A 39 7.639 5.306 -0.632 1.00 0.00 C ATOM 437 CD LYS A 39 8.226 5.194 -2.051 1.00 0.00 C ATOM 438 CE LYS A 39 8.652 6.566 -2.601 1.00 0.00 C ATOM 439 NZ LYS A 39 9.965 7.025 -2.063 1.00 0.00 N ATOM 0 H LYS A 39 7.153 1.791 1.045 1.00 0.00 H new ATOM 0 HA LYS A 39 5.243 3.770 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 39 7.479 4.171 1.173 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.275 3.325 -0.139 1.00 0.00 H new ATOM 0 HG2 LYS A 39 6.680 5.821 -0.693 1.00 0.00 H new ATOM 0 HG3 LYS A 39 8.300 5.932 -0.032 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.086 4.525 -2.037 1.00 0.00 H new ATOM 0 HD3 LYS A 39 7.486 4.749 -2.717 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.709 6.514 -3.688 1.00 0.00 H new ATOM 0 HE3 LYS A 39 7.887 7.303 -2.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 10.201 7.954 -2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.908 7.103 -1.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 10.704 6.339 -2.318 1.00 0.00 H new ATOM 453 N LEU A 40 5.180 3.305 -2.478 1.00 0.00 N ATOM 454 CA LEU A 40 5.287 3.166 -3.943 1.00 0.00 C ATOM 455 C LEU A 40 4.909 4.454 -4.696 1.00 0.00 C ATOM 456 O LEU A 40 4.117 5.271 -4.232 1.00 0.00 O ATOM 457 CB LEU A 40 4.516 1.927 -4.449 1.00 0.00 C ATOM 458 CG LEU A 40 2.997 1.926 -4.163 1.00 0.00 C ATOM 459 CD1 LEU A 40 2.202 1.586 -5.431 1.00 0.00 C ATOM 460 CD2 LEU A 40 2.639 0.940 -3.040 1.00 0.00 C ATOM 0 H LEU A 40 4.419 3.913 -2.175 1.00 0.00 H new ATOM 0 HA LEU A 40 6.340 3.000 -4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.665 1.842 -5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.954 1.038 -3.995 1.00 0.00 H new ATOM 0 HG LEU A 40 2.727 2.930 -3.836 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.136 1.591 -5.204 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.413 2.327 -6.202 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.492 0.598 -5.788 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.564 0.964 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.937 -0.067 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.163 1.223 -2.127 1.00 0.00 H new ATOM 472 N ASP A 41 5.499 4.636 -5.874 1.00 0.00 N ATOM 473 CA ASP A 41 5.516 5.908 -6.605 1.00 0.00 C ATOM 474 C ASP A 41 5.386 5.704 -8.127 1.00 0.00 C ATOM 475 O ASP A 41 6.111 6.295 -8.929 1.00 0.00 O ATOM 476 CB ASP A 41 6.743 6.738 -6.173 1.00 0.00 C ATOM 477 CG ASP A 41 8.109 6.087 -6.446 1.00 0.00 C ATOM 478 OD1 ASP A 41 8.479 5.139 -5.713 1.00 0.00 O ATOM 479 OD2 ASP A 41 8.830 6.559 -7.357 1.00 0.00 O ATOM 0 H ASP A 41 5.991 3.888 -6.362 1.00 0.00 H new ATOM 0 HA ASP A 41 4.633 6.490 -6.341 1.00 0.00 H new ATOM 0 HB2 ASP A 41 6.709 7.699 -6.686 1.00 0.00 H new ATOM 0 HB3 ASP A 41 6.664 6.943 -5.105 1.00 0.00 H new ATOM 484 N LEU A 42 4.452 4.823 -8.517 1.00 0.00 N ATOM 485 CA LEU A 42 4.060 4.589 -9.915 1.00 0.00 C ATOM 486 C LEU A 42 3.083 5.680 -10.414 1.00 0.00 C ATOM 487 O LEU A 42 2.869 6.693 -9.743 1.00 0.00 O ATOM 488 CB LEU A 42 3.561 3.121 -10.052 1.00 0.00 C ATOM 489 CG LEU A 42 3.989 2.306 -11.309 1.00 0.00 C ATOM 490 CD1 LEU A 42 5.486 2.509 -11.575 1.00 0.00 C ATOM 491 CD2 LEU A 42 3.785 0.811 -11.025 1.00 0.00 C ATOM 0 H LEU A 42 3.938 4.241 -7.855 1.00 0.00 H new ATOM 0 HA LEU A 42 4.913 4.687 -10.587 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.896 2.573 -9.171 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.472 3.137 -10.022 1.00 0.00 H new ATOM 0 HG LEU A 42 3.397 2.638 -12.162 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.780 1.937 -12.455 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.685 3.567 -11.747 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.058 2.168 -10.712 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.082 0.231 -11.899 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.394 0.517 -10.170 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.734 0.623 -10.804 1.00 0.00 H new ATOM 503 N THR A 43 2.526 5.507 -11.617 1.00 0.00 N ATOM 504 CA THR A 43 1.807 6.567 -12.365 1.00 0.00 C ATOM 505 C THR A 43 0.324 6.539 -11.990 1.00 0.00 C ATOM 506 O THR A 43 -0.123 5.572 -11.385 1.00 0.00 O ATOM 507 CB THR A 43 2.088 6.409 -13.871 1.00 0.00 C ATOM 508 OG1 THR A 43 3.491 6.389 -14.062 1.00 0.00 O ATOM 509 CG2 THR A 43 1.528 7.525 -14.758 1.00 0.00 C ATOM 0 H THR A 43 2.557 4.617 -12.114 1.00 0.00 H new ATOM 0 HA THR A 43 2.166 7.560 -12.094 1.00 0.00 H new ATOM 0 HB THR A 43 1.589 5.487 -14.169 1.00 0.00 H new ATOM 0 HG1 THR A 43 3.690 6.287 -15.016 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.778 7.322 -15.799 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.445 7.569 -14.647 1.00 0.00 H new ATOM 0 HG23 THR A 43 1.962 8.479 -14.460 1.00 0.00 H new ATOM 517 N ARG A 44 -0.453 7.585 -12.302 1.00 0.00 N ATOM 518 CA ARG A 44 -1.822 7.788 -11.780 1.00 0.00 C ATOM 519 C ARG A 44 -2.721 6.542 -11.854 1.00 0.00 C ATOM 520 O ARG A 44 -3.389 6.205 -10.878 1.00 0.00 O ATOM 521 CB ARG A 44 -2.480 8.971 -12.511 1.00 0.00 C ATOM 522 CG ARG A 44 -3.829 9.365 -11.878 1.00 0.00 C ATOM 523 CD ARG A 44 -4.462 10.584 -12.561 1.00 0.00 C ATOM 524 NE ARG A 44 -5.765 10.905 -11.951 1.00 0.00 N ATOM 525 CZ ARG A 44 -6.562 11.920 -12.270 1.00 0.00 C ATOM 526 NH1 ARG A 44 -6.249 12.790 -13.210 1.00 0.00 N ATOM 527 NH2 ARG A 44 -7.702 12.077 -11.634 1.00 0.00 N ATOM 0 H ARG A 44 -0.149 8.327 -12.932 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.717 8.004 -10.717 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -1.807 9.828 -12.492 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -2.634 8.710 -13.558 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.516 8.521 -11.938 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -3.681 9.581 -10.820 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.794 11.442 -12.477 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.592 10.384 -13.625 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.088 10.285 -11.208 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.370 12.696 -13.719 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.886 13.557 -13.428 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -7.971 11.422 -10.900 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.317 12.854 -11.875 1.00 0.00 H new ATOM 541 N ALA A 45 -2.724 5.837 -12.987 1.00 0.00 N ATOM 542 CA ALA A 45 -3.529 4.629 -13.184 1.00 0.00 C ATOM 543 C ALA A 45 -3.044 3.454 -12.306 1.00 0.00 C ATOM 544 O ALA A 45 -3.862 2.750 -11.712 1.00 0.00 O ATOM 545 CB ALA A 45 -3.510 4.317 -14.685 1.00 0.00 C ATOM 0 H ALA A 45 -2.163 6.090 -13.801 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.557 4.793 -12.860 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -4.100 3.421 -14.878 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.934 5.156 -15.236 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -2.483 4.152 -15.009 1.00 0.00 H new ATOM 551 N GLU A 46 -1.727 3.281 -12.165 1.00 0.00 N ATOM 552 CA GLU A 46 -1.085 2.301 -11.287 1.00 0.00 C ATOM 553 C GLU A 46 -1.320 2.600 -9.794 1.00 0.00 C ATOM 554 O GLU A 46 -1.595 1.717 -8.981 1.00 0.00 O ATOM 555 CB GLU A 46 0.410 2.277 -11.593 1.00 0.00 C ATOM 556 CG GLU A 46 0.716 1.678 -12.969 1.00 0.00 C ATOM 557 CD GLU A 46 0.949 2.750 -14.049 1.00 0.00 C ATOM 558 OE1 GLU A 46 0.034 3.564 -14.308 1.00 0.00 O ATOM 559 OE2 GLU A 46 2.053 2.772 -14.642 1.00 0.00 O ATOM 0 H GLU A 46 -1.051 3.844 -12.682 1.00 0.00 H new ATOM 0 HA GLU A 46 -1.532 1.326 -11.481 1.00 0.00 H new ATOM 0 HB2 GLU A 46 0.804 3.292 -11.546 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.926 1.700 -10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.600 1.045 -12.896 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -0.111 1.037 -13.273 1.00 0.00 H new ATOM 566 N TYR A 47 -1.288 3.878 -9.440 1.00 0.00 N ATOM 567 CA TYR A 47 -1.801 4.360 -8.161 1.00 0.00 C ATOM 568 C TYR A 47 -3.273 3.955 -7.975 1.00 0.00 C ATOM 569 O TYR A 47 -3.575 3.331 -6.960 1.00 0.00 O ATOM 570 CB TYR A 47 -1.529 5.873 -8.032 1.00 0.00 C ATOM 571 CG TYR A 47 -2.545 6.709 -7.254 1.00 0.00 C ATOM 572 CD1 TYR A 47 -3.096 6.275 -6.032 1.00 0.00 C ATOM 573 CD2 TYR A 47 -2.949 7.952 -7.771 1.00 0.00 C ATOM 574 CE1 TYR A 47 -4.061 7.052 -5.361 1.00 0.00 C ATOM 575 CE2 TYR A 47 -3.913 8.740 -7.113 1.00 0.00 C ATOM 576 CZ TYR A 47 -4.482 8.285 -5.903 1.00 0.00 C ATOM 577 OH TYR A 47 -5.429 9.023 -5.257 1.00 0.00 O ATOM 0 H TYR A 47 -0.904 4.614 -10.033 1.00 0.00 H new ATOM 0 HA TYR A 47 -1.273 3.884 -7.335 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -0.556 6.001 -7.559 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -1.451 6.288 -9.037 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -2.775 5.336 -5.605 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.511 8.310 -8.691 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -4.480 6.703 -4.429 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.216 9.688 -7.532 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.605 9.844 -5.762 1.00 0.00 H new ATOM 587 N GLU A 48 -4.152 4.228 -8.946 1.00 0.00 N ATOM 588 CA GLU A 48 -5.582 3.902 -8.874 1.00 0.00 C ATOM 589 C GLU A 48 -5.837 2.408 -8.592 1.00 0.00 C ATOM 590 O GLU A 48 -6.680 2.068 -7.754 1.00 0.00 O ATOM 591 CB GLU A 48 -6.292 4.306 -10.180 1.00 0.00 C ATOM 592 CG GLU A 48 -7.774 4.631 -9.979 1.00 0.00 C ATOM 593 CD GLU A 48 -7.986 5.967 -9.248 1.00 0.00 C ATOM 594 OE1 GLU A 48 -7.720 7.038 -9.847 1.00 0.00 O ATOM 595 OE2 GLU A 48 -8.460 5.964 -8.086 1.00 0.00 O ATOM 0 H GLU A 48 -3.887 4.688 -9.817 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.989 4.470 -8.038 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.790 5.174 -10.606 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -6.198 3.496 -10.904 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.270 4.668 -10.949 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.245 3.830 -9.410 1.00 0.00 H new ATOM 602 N ILE A 49 -5.101 1.499 -9.254 1.00 0.00 N ATOM 603 CA ILE A 49 -5.228 0.069 -8.966 1.00 0.00 C ATOM 604 C ILE A 49 -4.708 -0.277 -7.574 1.00 0.00 C ATOM 605 O ILE A 49 -5.426 -0.993 -6.883 1.00 0.00 O ATOM 606 CB ILE A 49 -4.594 -0.832 -10.042 1.00 0.00 C ATOM 607 CG1 ILE A 49 -3.170 -0.411 -10.389 1.00 0.00 C ATOM 608 CG2 ILE A 49 -5.514 -0.958 -11.250 1.00 0.00 C ATOM 609 CD1 ILE A 49 -2.361 -1.334 -11.284 1.00 0.00 C ATOM 0 H ILE A 49 -4.423 1.729 -9.981 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.297 -0.141 -8.988 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.489 -1.835 -9.628 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -3.216 0.566 -10.869 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -2.621 -0.282 -9.456 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.047 -1.599 -11.998 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.463 -1.395 -10.940 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.691 0.029 -11.677 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.371 -0.908 -11.445 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.263 -2.309 -10.807 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.868 -1.448 -12.242 1.00 0.00 H new ATOM 621 N LEU A 50 -3.527 0.193 -7.127 1.00 0.00 N ATOM 622 CA LEU A 50 -3.075 -0.186 -5.779 1.00 0.00 C ATOM 623 C LEU A 50 -3.940 0.443 -4.679 1.00 0.00 C ATOM 624 O LEU A 50 -4.283 -0.247 -3.726 1.00 0.00 O ATOM 625 CB LEU A 50 -1.599 0.183 -5.513 1.00 0.00 C ATOM 626 CG LEU A 50 -0.580 -0.967 -5.598 1.00 0.00 C ATOM 627 CD1 LEU A 50 -1.023 -2.296 -4.976 1.00 0.00 C ATOM 628 CD2 LEU A 50 -0.102 -1.146 -7.044 1.00 0.00 C ATOM 0 H LEU A 50 -2.899 0.804 -7.649 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.176 -1.271 -5.747 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.305 0.953 -6.227 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.531 0.627 -4.520 1.00 0.00 H new ATOM 0 HG LEU A 50 0.255 -0.658 -4.969 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.230 -3.034 -5.092 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.231 -2.150 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.924 -2.650 -5.477 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.619 -1.963 -7.091 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.954 -1.377 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.370 -0.226 -7.388 1.00 0.00 H new ATOM 640 N SER A 51 -4.298 1.723 -4.768 1.00 0.00 N ATOM 641 CA SER A 51 -5.227 2.352 -3.823 1.00 0.00 C ATOM 642 C SER A 51 -6.556 1.587 -3.730 1.00 0.00 C ATOM 643 O SER A 51 -6.988 1.276 -2.612 1.00 0.00 O ATOM 644 CB SER A 51 -5.454 3.833 -4.164 1.00 0.00 C ATOM 645 OG SER A 51 -6.096 4.030 -5.411 1.00 0.00 O ATOM 0 H SER A 51 -3.955 2.353 -5.493 1.00 0.00 H new ATOM 0 HA SER A 51 -4.763 2.307 -2.838 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.054 4.291 -3.378 1.00 0.00 H new ATOM 0 HB3 SER A 51 -4.493 4.348 -4.173 1.00 0.00 H new ATOM 0 HG SER A 51 -5.491 3.767 -6.136 1.00 0.00 H new ATOM 651 N LEU A 52 -7.167 1.180 -4.857 1.00 0.00 N ATOM 652 CA LEU A 52 -8.369 0.350 -4.788 1.00 0.00 C ATOM 653 C LEU A 52 -8.077 -1.054 -4.254 1.00 0.00 C ATOM 654 O LEU A 52 -8.914 -1.608 -3.551 1.00 0.00 O ATOM 655 CB LEU A 52 -9.028 0.289 -6.169 1.00 0.00 C ATOM 656 CG LEU A 52 -10.516 -0.143 -6.190 1.00 0.00 C ATOM 657 CD1 LEU A 52 -11.369 0.286 -4.980 1.00 0.00 C ATOM 658 CD2 LEU A 52 -11.184 0.450 -7.437 1.00 0.00 C ATOM 0 H LEU A 52 -6.854 1.408 -5.801 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.057 0.810 -4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.949 1.273 -6.632 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.460 -0.403 -6.791 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.483 -1.232 -6.173 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.390 -0.074 -5.109 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.947 -0.138 -4.069 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.374 1.373 -4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -12.232 0.153 -7.464 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -11.115 1.537 -7.404 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -10.680 0.081 -8.330 1.00 0.00 H new ATOM 670 N LEU A 53 -6.902 -1.624 -4.538 1.00 0.00 N ATOM 671 CA LEU A 53 -6.502 -2.938 -4.037 1.00 0.00 C ATOM 672 C LEU A 53 -6.405 -2.940 -2.510 1.00 0.00 C ATOM 673 O LEU A 53 -7.013 -3.776 -1.845 1.00 0.00 O ATOM 674 CB LEU A 53 -5.157 -3.327 -4.670 1.00 0.00 C ATOM 675 CG LEU A 53 -4.787 -4.789 -4.414 1.00 0.00 C ATOM 676 CD1 LEU A 53 -5.737 -5.732 -5.172 1.00 0.00 C ATOM 677 CD2 LEU A 53 -3.318 -5.019 -4.747 1.00 0.00 C ATOM 0 H LEU A 53 -6.197 -1.181 -5.127 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.259 -3.671 -4.314 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -5.201 -3.150 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.373 -2.683 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 53 -4.913 -5.020 -3.356 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -5.456 -6.767 -4.976 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.760 -5.564 -4.836 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -5.669 -5.534 -6.242 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.062 -6.062 -4.562 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.141 -4.782 -5.796 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -2.698 -4.377 -4.121 1.00 0.00 H new ATOM 689 N ILE A 54 -5.665 -1.985 -1.946 1.00 0.00 N ATOM 690 CA ILE A 54 -5.549 -1.830 -0.489 1.00 0.00 C ATOM 691 C ILE A 54 -6.926 -1.530 0.139 1.00 0.00 C ATOM 692 O ILE A 54 -7.261 -2.103 1.175 1.00 0.00 O ATOM 693 CB ILE A 54 -4.510 -0.734 -0.148 1.00 0.00 C ATOM 694 CG1 ILE A 54 -3.122 -0.923 -0.812 1.00 0.00 C ATOM 695 CG2 ILE A 54 -4.296 -0.686 1.374 1.00 0.00 C ATOM 696 CD1 ILE A 54 -2.408 0.422 -1.032 1.00 0.00 C ATOM 0 H ILE A 54 -5.131 -1.299 -2.479 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.196 -2.768 -0.061 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.931 0.191 -0.543 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -2.503 -1.565 -0.185 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.242 -1.432 -1.768 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -3.565 0.086 1.614 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.241 -0.457 1.867 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -3.931 -1.653 1.721 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.439 0.247 -1.499 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -3.015 1.054 -1.680 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.264 0.919 -0.072 1.00 0.00 H new ATOM 708 N SER A 55 -7.746 -0.686 -0.494 1.00 0.00 N ATOM 709 CA SER A 55 -9.097 -0.361 -0.008 1.00 0.00 C ATOM 710 C SER A 55 -10.063 -1.567 -0.015 1.00 0.00 C ATOM 711 O SER A 55 -10.791 -1.787 0.959 1.00 0.00 O ATOM 712 CB SER A 55 -9.673 0.793 -0.844 1.00 0.00 C ATOM 713 OG SER A 55 -10.886 1.281 -0.283 1.00 0.00 O ATOM 0 H SER A 55 -7.495 -0.207 -1.359 1.00 0.00 H new ATOM 0 HA SER A 55 -8.999 -0.063 1.036 1.00 0.00 H new ATOM 0 HB2 SER A 55 -8.945 1.602 -0.902 1.00 0.00 H new ATOM 0 HB3 SER A 55 -9.852 0.452 -1.864 1.00 0.00 H new ATOM 0 HG SER A 55 -11.229 2.015 -0.834 1.00 0.00 H new ATOM 719 N LYS A 56 -10.062 -2.382 -1.082 1.00 0.00 N ATOM 720 CA LYS A 56 -10.933 -3.564 -1.226 1.00 0.00 C ATOM 721 C LYS A 56 -10.370 -4.833 -0.545 1.00 0.00 C ATOM 722 O LYS A 56 -11.103 -5.813 -0.389 1.00 0.00 O ATOM 723 CB LYS A 56 -11.274 -3.773 -2.718 1.00 0.00 C ATOM 724 CG LYS A 56 -10.242 -4.580 -3.528 1.00 0.00 C ATOM 725 CD LYS A 56 -10.447 -4.369 -5.040 1.00 0.00 C ATOM 726 CE LYS A 56 -9.613 -5.330 -5.909 1.00 0.00 C ATOM 727 NZ LYS A 56 -10.257 -6.671 -6.037 1.00 0.00 N ATOM 0 H LYS A 56 -9.447 -2.238 -1.883 1.00 0.00 H new ATOM 0 HA LYS A 56 -11.859 -3.369 -0.686 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.238 -4.278 -2.785 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.393 -2.796 -3.186 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.234 -4.275 -3.247 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -10.333 -5.639 -3.288 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.503 -4.499 -5.278 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -10.187 -3.342 -5.295 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -9.477 -4.897 -6.900 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -8.621 -5.445 -5.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.663 -7.286 -6.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -10.364 -7.096 -5.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -11.193 -6.566 -6.477 1.00 0.00 H new ATOM 741 N LYS A 57 -9.087 -4.787 -0.157 1.00 0.00 N ATOM 742 CA LYS A 57 -8.250 -5.786 0.536 1.00 0.00 C ATOM 743 C LYS A 57 -7.467 -6.670 -0.458 1.00 0.00 C ATOM 744 O LYS A 57 -7.838 -6.804 -1.626 1.00 0.00 O ATOM 745 CB LYS A 57 -8.999 -6.617 1.601 1.00 0.00 C ATOM 746 CG LYS A 57 -9.669 -5.742 2.681 1.00 0.00 C ATOM 747 CD LYS A 57 -10.282 -6.549 3.836 1.00 0.00 C ATOM 748 CE LYS A 57 -11.377 -7.520 3.366 1.00 0.00 C ATOM 749 NZ LYS A 57 -11.996 -8.249 4.506 1.00 0.00 N ATOM 0 H LYS A 57 -8.542 -3.945 -0.344 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.522 -5.206 1.103 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.758 -7.227 1.111 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -8.299 -7.303 2.078 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.930 -5.050 3.085 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -10.449 -5.140 2.216 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.495 -7.111 4.339 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.702 -5.862 4.571 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -12.147 -6.967 2.828 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -10.950 -8.237 2.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.729 -8.894 4.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -11.266 -8.797 5.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -12.425 -7.566 5.163 1.00 0.00 H new ATOM 763 N GLY A 58 -6.366 -7.255 0.039 1.00 0.00 N ATOM 764 CA GLY A 58 -5.210 -7.720 -0.739 1.00 0.00 C ATOM 765 C GLY A 58 -5.521 -8.517 -2.007 1.00 0.00 C ATOM 766 O GLY A 58 -5.230 -8.025 -3.094 1.00 0.00 O ATOM 0 H GLY A 58 -6.254 -7.424 1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -4.614 -6.851 -1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.588 -8.337 -0.091 1.00 0.00 H new ATOM 770 N TYR A 59 -6.097 -9.721 -1.876 1.00 0.00 N ATOM 771 CA TYR A 59 -6.620 -10.546 -2.974 1.00 0.00 C ATOM 772 C TYR A 59 -5.498 -10.991 -3.946 1.00 0.00 C ATOM 773 O TYR A 59 -4.311 -10.799 -3.671 1.00 0.00 O ATOM 774 CB TYR A 59 -7.801 -9.774 -3.610 1.00 0.00 C ATOM 775 CG TYR A 59 -8.620 -10.504 -4.657 1.00 0.00 C ATOM 776 CD1 TYR A 59 -9.431 -11.594 -4.287 1.00 0.00 C ATOM 777 CD2 TYR A 59 -8.548 -10.112 -6.008 1.00 0.00 C ATOM 778 CE1 TYR A 59 -10.169 -12.294 -5.263 1.00 0.00 C ATOM 779 CE2 TYR A 59 -9.282 -10.808 -6.988 1.00 0.00 C ATOM 780 CZ TYR A 59 -10.096 -11.902 -6.620 1.00 0.00 C ATOM 781 OH TYR A 59 -10.800 -12.575 -7.574 1.00 0.00 O ATOM 0 H TYR A 59 -6.216 -10.164 -0.965 1.00 0.00 H new ATOM 0 HA TYR A 59 -7.010 -11.498 -2.615 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -8.473 -9.465 -2.810 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.406 -8.865 -4.063 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -9.488 -11.895 -3.251 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.928 -9.275 -6.293 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -10.790 -13.129 -4.975 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.222 -10.505 -8.023 1.00 0.00 H new ATOM 0 HH TYR A 59 -10.633 -12.170 -8.451 1.00 0.00 H new ATOM 791 N VAL A 60 -5.845 -11.617 -5.073 1.00 0.00 N ATOM 792 CA VAL A 60 -4.909 -11.870 -6.180 1.00 0.00 C ATOM 793 C VAL A 60 -5.135 -10.809 -7.263 1.00 0.00 C ATOM 794 O VAL A 60 -6.130 -10.822 -7.984 1.00 0.00 O ATOM 795 CB VAL A 60 -5.024 -13.310 -6.715 1.00 0.00 C ATOM 796 CG1 VAL A 60 -3.999 -13.560 -7.833 1.00 0.00 C ATOM 797 CG2 VAL A 60 -4.774 -14.340 -5.600 1.00 0.00 C ATOM 0 H VAL A 60 -6.787 -11.966 -5.248 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.884 -11.786 -5.820 1.00 0.00 H new ATOM 0 HB VAL A 60 -6.037 -13.425 -7.101 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.098 -14.583 -8.196 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.179 -12.865 -8.653 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.992 -13.409 -7.444 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -4.862 -15.347 -6.008 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.773 -14.200 -5.193 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.510 -14.204 -4.808 1.00 0.00 H new ATOM 807 N PHE A 61 -4.197 -9.869 -7.332 1.00 0.00 N ATOM 808 CA PHE A 61 -4.170 -8.692 -8.197 1.00 0.00 C ATOM 809 C PHE A 61 -3.832 -9.143 -9.632 1.00 0.00 C ATOM 810 O PHE A 61 -2.701 -9.533 -9.914 1.00 0.00 O ATOM 811 CB PHE A 61 -3.128 -7.758 -7.547 1.00 0.00 C ATOM 812 CG PHE A 61 -3.086 -6.282 -7.895 1.00 0.00 C ATOM 813 CD1 PHE A 61 -4.249 -5.527 -8.141 1.00 0.00 C ATOM 814 CD2 PHE A 61 -1.856 -5.611 -7.764 1.00 0.00 C ATOM 815 CE1 PHE A 61 -4.172 -4.131 -8.274 1.00 0.00 C ATOM 816 CE2 PHE A 61 -1.761 -4.230 -7.974 1.00 0.00 C ATOM 817 CZ PHE A 61 -2.925 -3.484 -8.208 1.00 0.00 C ATOM 0 H PHE A 61 -3.370 -9.914 -6.737 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.117 -8.159 -8.286 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.263 -7.829 -6.468 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.144 -8.169 -7.773 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.204 -6.024 -8.228 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -0.971 -6.170 -7.497 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.072 -3.553 -8.427 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.797 -3.742 -7.956 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.864 -2.414 -8.337 1.00 0.00 H new ATOM 827 N SER A 62 -4.839 -9.201 -10.508 1.00 0.00 N ATOM 828 CA SER A 62 -4.816 -9.990 -11.763 1.00 0.00 C ATOM 829 C SER A 62 -4.869 -9.133 -13.028 1.00 0.00 C ATOM 830 O SER A 62 -5.578 -8.131 -13.042 1.00 0.00 O ATOM 831 CB SER A 62 -6.065 -10.880 -11.815 1.00 0.00 C ATOM 832 OG SER A 62 -6.077 -11.851 -10.778 1.00 0.00 O ATOM 0 H SER A 62 -5.714 -8.695 -10.371 1.00 0.00 H new ATOM 0 HA SER A 62 -3.879 -10.546 -11.747 1.00 0.00 H new ATOM 0 HB2 SER A 62 -6.956 -10.257 -11.737 1.00 0.00 H new ATOM 0 HB3 SER A 62 -6.111 -11.383 -12.781 1.00 0.00 H new ATOM 0 HG SER A 62 -6.093 -11.400 -9.908 1.00 0.00 H new ATOM 838 N ARG A 63 -4.233 -9.561 -14.129 1.00 0.00 N ATOM 839 CA ARG A 63 -4.138 -8.783 -15.383 1.00 0.00 C ATOM 840 C ARG A 63 -5.464 -8.198 -15.919 1.00 0.00 C ATOM 841 O ARG A 63 -5.470 -7.045 -16.345 1.00 0.00 O ATOM 842 CB ARG A 63 -3.368 -9.587 -16.451 1.00 0.00 C ATOM 843 CG ARG A 63 -4.102 -10.823 -16.999 1.00 0.00 C ATOM 844 CD ARG A 63 -3.195 -11.612 -17.952 1.00 0.00 C ATOM 845 NE ARG A 63 -3.880 -12.808 -18.474 1.00 0.00 N ATOM 846 CZ ARG A 63 -3.308 -13.872 -19.031 1.00 0.00 C ATOM 847 NH1 ARG A 63 -2.001 -14.002 -19.134 1.00 0.00 N ATOM 848 NH2 ARG A 63 -4.062 -14.842 -19.500 1.00 0.00 N ATOM 0 H ARG A 63 -3.764 -10.465 -14.179 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.571 -7.888 -15.127 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -3.136 -8.924 -17.284 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -2.418 -9.908 -16.025 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.415 -11.462 -16.174 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.006 -10.513 -17.523 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -2.891 -10.973 -18.781 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.286 -11.910 -17.429 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.897 -12.821 -18.401 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.386 -13.270 -18.779 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.604 -14.835 -19.569 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.078 -14.775 -19.435 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.631 -15.661 -19.929 1.00 0.00 H new ATOM 862 N GLU A 64 -6.579 -8.936 -15.837 1.00 0.00 N ATOM 863 CA GLU A 64 -7.904 -8.432 -16.237 1.00 0.00 C ATOM 864 C GLU A 64 -8.420 -7.359 -15.269 1.00 0.00 C ATOM 865 O GLU A 64 -8.676 -6.230 -15.674 1.00 0.00 O ATOM 866 CB GLU A 64 -8.898 -9.596 -16.356 1.00 0.00 C ATOM 867 CG GLU A 64 -10.165 -9.188 -17.119 1.00 0.00 C ATOM 868 CD GLU A 64 -11.117 -10.382 -17.275 1.00 0.00 C ATOM 869 OE1 GLU A 64 -11.969 -10.605 -16.383 1.00 0.00 O ATOM 870 OE2 GLU A 64 -11.022 -11.111 -18.291 1.00 0.00 O ATOM 0 H GLU A 64 -6.591 -9.896 -15.493 1.00 0.00 H new ATOM 0 HA GLU A 64 -7.804 -7.957 -17.213 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -8.420 -10.432 -16.867 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -9.170 -9.945 -15.360 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.670 -8.381 -16.588 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -9.894 -8.802 -18.102 1.00 0.00 H new ATOM 877 N SER A 65 -8.530 -7.685 -13.979 1.00 0.00 N ATOM 878 CA SER A 65 -8.964 -6.735 -12.933 1.00 0.00 C ATOM 879 C SER A 65 -8.112 -5.449 -12.952 1.00 0.00 C ATOM 880 O SER A 65 -8.636 -4.333 -12.932 1.00 0.00 O ATOM 881 CB SER A 65 -8.881 -7.434 -11.564 1.00 0.00 C ATOM 882 OG SER A 65 -9.334 -6.616 -10.492 1.00 0.00 O ATOM 0 H SER A 65 -8.321 -8.617 -13.622 1.00 0.00 H new ATOM 0 HA SER A 65 -9.993 -6.434 -13.127 1.00 0.00 H new ATOM 0 HB2 SER A 65 -9.475 -8.347 -11.592 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.849 -7.731 -11.376 1.00 0.00 H new ATOM 0 HG SER A 65 -9.260 -7.111 -9.649 1.00 0.00 H new ATOM 888 N ILE A 66 -6.792 -5.611 -13.105 1.00 0.00 N ATOM 889 CA ILE A 66 -5.819 -4.530 -13.353 1.00 0.00 C ATOM 890 C ILE A 66 -6.229 -3.663 -14.538 1.00 0.00 C ATOM 891 O ILE A 66 -6.522 -2.490 -14.349 1.00 0.00 O ATOM 892 CB ILE A 66 -4.416 -5.139 -13.559 1.00 0.00 C ATOM 893 CG1 ILE A 66 -3.925 -5.721 -12.222 1.00 0.00 C ATOM 894 CG2 ILE A 66 -3.407 -4.157 -14.182 1.00 0.00 C ATOM 895 CD1 ILE A 66 -3.169 -4.732 -11.347 1.00 0.00 C ATOM 0 H ILE A 66 -6.352 -6.530 -13.059 1.00 0.00 H new ATOM 0 HA ILE A 66 -5.796 -3.875 -12.482 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.496 -5.941 -14.292 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.784 -6.097 -11.666 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.279 -6.575 -12.426 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.443 -4.651 -14.298 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.769 -3.834 -15.158 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.294 -3.290 -13.531 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.859 -5.224 -10.425 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.289 -4.373 -11.880 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.817 -3.889 -11.108 1.00 0.00 H new ATOM 907 N ALA A 67 -6.274 -4.219 -15.747 1.00 0.00 N ATOM 908 CA ALA A 67 -6.555 -3.481 -16.973 1.00 0.00 C ATOM 909 C ALA A 67 -7.998 -2.941 -17.029 1.00 0.00 C ATOM 910 O ALA A 67 -8.292 -2.075 -17.852 1.00 0.00 O ATOM 911 CB ALA A 67 -6.229 -4.390 -18.159 1.00 0.00 C ATOM 0 H ALA A 67 -6.113 -5.214 -15.903 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.926 -2.591 -17.007 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -6.431 -3.860 -19.090 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -5.177 -4.672 -18.123 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.847 -5.287 -18.111 1.00 0.00 H new ATOM 917 N ILE A 68 -8.888 -3.407 -16.148 1.00 0.00 N ATOM 918 CA ILE A 68 -10.202 -2.793 -15.912 1.00 0.00 C ATOM 919 C ILE A 68 -10.114 -1.590 -14.947 1.00 0.00 C ATOM 920 O ILE A 68 -10.791 -0.591 -15.205 1.00 0.00 O ATOM 921 CB ILE A 68 -11.218 -3.875 -15.473 1.00 0.00 C ATOM 922 CG1 ILE A 68 -11.536 -4.883 -16.609 1.00 0.00 C ATOM 923 CG2 ILE A 68 -12.528 -3.271 -14.938 1.00 0.00 C ATOM 924 CD1 ILE A 68 -12.268 -4.321 -17.838 1.00 0.00 C ATOM 0 H ILE A 68 -8.716 -4.230 -15.571 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.570 -2.370 -16.847 1.00 0.00 H new ATOM 0 HB ILE A 68 -10.731 -4.413 -14.660 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -10.599 -5.327 -16.944 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -12.139 -5.689 -16.191 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -13.205 -4.073 -14.644 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -12.313 -2.643 -14.074 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -12.996 -2.668 -15.717 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -12.433 -5.120 -18.560 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -13.228 -3.905 -17.531 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -11.663 -3.538 -18.295 1.00 0.00 H new ATOM 936 N GLU A 69 -9.281 -1.618 -13.892 1.00 0.00 N ATOM 937 CA GLU A 69 -9.176 -0.496 -12.942 1.00 0.00 C ATOM 938 C GLU A 69 -8.106 0.565 -13.292 1.00 0.00 C ATOM 939 O GLU A 69 -8.332 1.743 -13.006 1.00 0.00 O ATOM 940 CB GLU A 69 -8.980 -1.014 -11.507 1.00 0.00 C ATOM 941 CG GLU A 69 -10.244 -0.925 -10.656 1.00 0.00 C ATOM 942 CD GLU A 69 -11.450 -1.695 -11.217 1.00 0.00 C ATOM 943 OE1 GLU A 69 -11.508 -2.939 -11.070 1.00 0.00 O ATOM 944 OE2 GLU A 69 -12.392 -1.048 -11.736 1.00 0.00 O ATOM 0 H GLU A 69 -8.670 -2.406 -13.675 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.128 0.029 -13.021 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.648 -2.051 -11.545 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.186 -0.442 -11.027 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.021 -1.302 -9.658 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.519 0.124 -10.546 1.00 0.00 H new ATOM 951 N SER A 70 -6.965 0.216 -13.901 1.00 0.00 N ATOM 952 CA SER A 70 -5.959 1.204 -14.337 1.00 0.00 C ATOM 953 C SER A 70 -6.288 1.694 -15.756 1.00 0.00 C ATOM 954 O SER A 70 -6.485 2.891 -15.974 1.00 0.00 O ATOM 955 CB SER A 70 -4.525 0.641 -14.262 1.00 0.00 C ATOM 956 OG SER A 70 -4.370 -0.507 -15.085 1.00 0.00 O ATOM 0 H SER A 70 -6.711 -0.750 -14.106 1.00 0.00 H new ATOM 0 HA SER A 70 -5.999 2.051 -13.652 1.00 0.00 H new ATOM 0 HB2 SER A 70 -3.815 1.409 -14.570 1.00 0.00 H new ATOM 0 HB3 SER A 70 -4.288 0.384 -13.230 1.00 0.00 H new ATOM 0 HG SER A 70 -4.963 -1.220 -14.767 1.00 0.00 H new ATOM 962 N GLU A 71 -6.389 0.757 -16.710 1.00 0.00 N ATOM 963 CA GLU A 71 -7.026 0.934 -18.024 1.00 0.00 C ATOM 964 C GLU A 71 -6.231 1.872 -18.968 1.00 0.00 C ATOM 965 O GLU A 71 -6.755 2.409 -19.944 1.00 0.00 O ATOM 966 CB GLU A 71 -8.509 1.306 -17.807 1.00 0.00 C ATOM 967 CG GLU A 71 -9.423 1.037 -19.012 1.00 0.00 C ATOM 968 CD GLU A 71 -10.901 1.284 -18.668 1.00 0.00 C ATOM 969 OE1 GLU A 71 -11.270 2.438 -18.339 1.00 0.00 O ATOM 970 OE2 GLU A 71 -11.722 0.340 -18.775 1.00 0.00 O ATOM 0 H GLU A 71 -6.014 -0.183 -16.582 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.007 -0.007 -18.575 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.887 0.749 -16.950 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.570 2.364 -17.551 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.130 1.680 -19.842 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -9.294 0.007 -19.345 1.00 0.00 H new ATOM 977 N SER A 72 -4.930 2.054 -18.709 1.00 0.00 N ATOM 978 CA SER A 72 -4.013 2.766 -19.620 1.00 0.00 C ATOM 979 C SER A 72 -3.722 1.952 -20.904 1.00 0.00 C ATOM 980 O SER A 72 -3.441 2.517 -21.966 1.00 0.00 O ATOM 981 CB SER A 72 -2.714 3.094 -18.865 1.00 0.00 C ATOM 982 OG SER A 72 -1.899 4.009 -19.589 1.00 0.00 O ATOM 0 H SER A 72 -4.479 1.712 -17.861 1.00 0.00 H new ATOM 0 HA SER A 72 -4.491 3.690 -19.944 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.957 3.516 -17.890 1.00 0.00 H new ATOM 0 HB3 SER A 72 -2.157 2.175 -18.684 1.00 0.00 H new ATOM 0 HG SER A 72 -1.083 4.195 -19.079 1.00 0.00 H new ATOM 988 N ILE A 73 -3.843 0.617 -20.829 1.00 0.00 N ATOM 989 CA ILE A 73 -3.789 -0.315 -21.969 1.00 0.00 C ATOM 990 C ILE A 73 -5.223 -0.691 -22.385 1.00 0.00 C ATOM 991 O ILE A 73 -6.037 -1.074 -21.542 1.00 0.00 O ATOM 992 CB ILE A 73 -2.955 -1.566 -21.590 1.00 0.00 C ATOM 993 CG1 ILE A 73 -1.516 -1.228 -21.123 1.00 0.00 C ATOM 994 CG2 ILE A 73 -2.908 -2.575 -22.751 1.00 0.00 C ATOM 995 CD1 ILE A 73 -0.652 -0.452 -22.127 1.00 0.00 C ATOM 0 H ILE A 73 -3.987 0.138 -19.940 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.300 0.161 -22.819 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.468 -2.016 -20.740 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.580 -0.647 -20.203 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -1.006 -2.159 -20.877 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.316 -3.442 -22.456 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.921 -2.894 -22.997 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.453 -2.105 -23.623 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.333 -0.271 -21.696 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.546 -1.035 -23.042 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -1.129 0.501 -22.357 1.00 0.00 H new ATOM 1007 N ASN A 74 -5.536 -0.588 -23.682 1.00 0.00 N ATOM 1008 CA ASN A 74 -6.898 -0.775 -24.203 1.00 0.00 C ATOM 1009 C ASN A 74 -7.444 -2.222 -24.072 1.00 0.00 C ATOM 1010 O ASN A 74 -8.539 -2.371 -23.514 1.00 0.00 O ATOM 1011 CB ASN A 74 -6.984 -0.239 -25.645 1.00 0.00 C ATOM 1012 CG ASN A 74 -6.779 1.274 -25.709 1.00 0.00 C ATOM 1013 OD1 ASN A 74 -5.689 1.759 -25.985 1.00 0.00 O ATOM 1014 ND2 ASN A 74 -7.810 2.059 -25.444 1.00 0.00 N ATOM 0 H ASN A 74 -4.849 -0.372 -24.404 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.562 -0.190 -23.567 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.232 -0.733 -26.260 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -7.957 -0.491 -26.068 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -7.699 3.073 -25.469 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.716 1.651 -25.215 1.00 0.00 H new ATOM 1021 N PRO A 75 -6.749 -3.286 -24.548 1.00 0.00 N ATOM 1022 CA PRO A 75 -7.200 -4.666 -24.365 1.00 0.00 C ATOM 1023 C PRO A 75 -7.032 -5.108 -22.906 1.00 0.00 C ATOM 1024 O PRO A 75 -5.942 -5.025 -22.338 1.00 0.00 O ATOM 1025 CB PRO A 75 -6.361 -5.518 -25.326 1.00 0.00 C ATOM 1026 CG PRO A 75 -5.077 -4.709 -25.492 1.00 0.00 C ATOM 1027 CD PRO A 75 -5.572 -3.266 -25.412 1.00 0.00 C ATOM 0 HA PRO A 75 -8.262 -4.776 -24.585 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -6.161 -6.508 -24.915 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.869 -5.665 -26.279 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.354 -4.932 -24.707 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.589 -4.917 -26.444 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.801 -2.612 -25.004 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -5.822 -2.885 -26.402 1.00 0.00 H new ATOM 1035 N GLU A 76 -8.114 -5.610 -22.304 1.00 0.00 N ATOM 1036 CA GLU A 76 -8.159 -6.030 -20.905 1.00 0.00 C ATOM 1037 C GLU A 76 -7.486 -7.393 -20.652 1.00 0.00 C ATOM 1038 O GLU A 76 -7.126 -7.714 -19.523 1.00 0.00 O ATOM 1039 CB GLU A 76 -9.611 -6.006 -20.390 1.00 0.00 C ATOM 1040 CG GLU A 76 -10.602 -6.961 -21.077 1.00 0.00 C ATOM 1041 CD GLU A 76 -11.228 -6.351 -22.343 1.00 0.00 C ATOM 1042 OE1 GLU A 76 -10.578 -6.368 -23.415 1.00 0.00 O ATOM 1043 OE2 GLU A 76 -12.376 -5.850 -22.275 1.00 0.00 O ATOM 0 H GLU A 76 -9.002 -5.738 -22.789 1.00 0.00 H new ATOM 0 HA GLU A 76 -7.571 -5.310 -20.337 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -9.598 -6.237 -19.325 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -9.992 -4.990 -20.491 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -10.088 -7.886 -21.339 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -11.393 -7.224 -20.375 1.00 0.00 H new ATOM 1050 N SER A 77 -7.263 -8.197 -21.693 1.00 0.00 N ATOM 1051 CA SER A 77 -6.552 -9.484 -21.614 1.00 0.00 C ATOM 1052 C SER A 77 -5.014 -9.339 -21.624 1.00 0.00 C ATOM 1053 O SER A 77 -4.294 -10.337 -21.557 1.00 0.00 O ATOM 1054 CB SER A 77 -7.032 -10.377 -22.773 1.00 0.00 C ATOM 1055 OG SER A 77 -6.879 -9.744 -24.046 1.00 0.00 O ATOM 0 H SER A 77 -7.577 -7.971 -22.637 1.00 0.00 H new ATOM 0 HA SER A 77 -6.789 -9.942 -20.654 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.471 -11.312 -22.765 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.080 -10.633 -22.621 1.00 0.00 H new ATOM 0 HG SER A 77 -7.194 -10.347 -24.751 1.00 0.00 H new ATOM 1061 N SER A 78 -4.486 -8.113 -21.718 1.00 0.00 N ATOM 1062 CA SER A 78 -3.046 -7.838 -21.820 1.00 0.00 C ATOM 1063 C SER A 78 -2.261 -8.239 -20.560 1.00 0.00 C ATOM 1064 O SER A 78 -2.426 -7.650 -19.487 1.00 0.00 O ATOM 1065 CB SER A 78 -2.812 -6.352 -22.124 1.00 0.00 C ATOM 1066 OG SER A 78 -1.418 -6.061 -22.133 1.00 0.00 O ATOM 0 H SER A 78 -5.057 -7.268 -21.726 1.00 0.00 H new ATOM 0 HA SER A 78 -2.671 -8.454 -22.637 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.249 -6.099 -23.090 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.313 -5.738 -21.376 1.00 0.00 H new ATOM 0 HG SER A 78 -1.242 -5.325 -22.755 1.00 0.00 H new ATOM 1072 N ASN A 79 -1.315 -9.178 -20.702 1.00 0.00 N ATOM 1073 CA ASN A 79 -0.302 -9.417 -19.670 1.00 0.00 C ATOM 1074 C ASN A 79 0.701 -8.254 -19.592 1.00 0.00 C ATOM 1075 O ASN A 79 1.191 -7.946 -18.511 1.00 0.00 O ATOM 1076 CB ASN A 79 0.405 -10.760 -19.920 1.00 0.00 C ATOM 1077 CG ASN A 79 0.805 -11.420 -18.603 1.00 0.00 C ATOM 1078 OD1 ASN A 79 0.079 -12.266 -18.094 1.00 0.00 O ATOM 1079 ND2 ASN A 79 1.912 -11.046 -17.992 1.00 0.00 N ATOM 0 H ASN A 79 -1.232 -9.782 -21.520 1.00 0.00 H new ATOM 0 HA ASN A 79 -0.801 -9.472 -18.702 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.255 -11.424 -20.478 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.291 -10.600 -20.535 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.165 -11.461 -17.095 1.00 0.00 H new ATOM 0 HD22 ASN A 79 2.516 -10.342 -18.416 1.00 0.00 H new ATOM 1086 N LYS A 80 0.945 -7.542 -20.705 1.00 0.00 N ATOM 1087 CA LYS A 80 1.864 -6.393 -20.763 1.00 0.00 C ATOM 1088 C LYS A 80 1.393 -5.226 -19.886 1.00 0.00 C ATOM 1089 O LYS A 80 2.224 -4.533 -19.303 1.00 0.00 O ATOM 1090 CB LYS A 80 2.088 -5.971 -22.230 1.00 0.00 C ATOM 1091 CG LYS A 80 3.327 -6.620 -22.871 1.00 0.00 C ATOM 1092 CD LYS A 80 3.280 -8.155 -22.940 1.00 0.00 C ATOM 1093 CE LYS A 80 4.543 -8.670 -23.645 1.00 0.00 C ATOM 1094 NZ LYS A 80 4.577 -10.156 -23.719 1.00 0.00 N ATOM 0 H LYS A 80 0.504 -7.751 -21.601 1.00 0.00 H new ATOM 0 HA LYS A 80 2.823 -6.703 -20.348 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.206 -6.234 -22.814 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.190 -4.887 -22.277 1.00 0.00 H new ATOM 0 HG2 LYS A 80 3.446 -6.227 -23.881 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.211 -6.321 -22.307 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.214 -8.574 -21.936 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.390 -8.479 -23.480 1.00 0.00 H new ATOM 0 HE2 LYS A 80 4.589 -8.256 -24.652 1.00 0.00 H new ATOM 0 HE3 LYS A 80 5.425 -8.314 -23.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.446 -10.460 -24.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.559 -10.552 -22.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.749 -10.496 -24.249 1.00 0.00 H new ATOM 1108 N SER A 81 0.083 -5.077 -19.685 1.00 0.00 N ATOM 1109 CA SER A 81 -0.460 -4.209 -18.625 1.00 0.00 C ATOM 1110 C SER A 81 0.113 -4.608 -17.250 1.00 0.00 C ATOM 1111 O SER A 81 0.839 -3.829 -16.633 1.00 0.00 O ATOM 1112 CB SER A 81 -1.998 -4.252 -18.644 1.00 0.00 C ATOM 1113 OG SER A 81 -2.556 -3.355 -17.694 1.00 0.00 O ATOM 0 H SER A 81 -0.630 -5.547 -20.243 1.00 0.00 H new ATOM 0 HA SER A 81 -0.155 -3.180 -18.813 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.358 -3.998 -19.641 1.00 0.00 H new ATOM 0 HB3 SER A 81 -2.337 -5.266 -18.432 1.00 0.00 H new ATOM 0 HG SER A 81 -3.523 -3.285 -17.839 1.00 0.00 H new ATOM 1119 N ILE A 82 -0.084 -5.856 -16.805 1.00 0.00 N ATOM 1120 CA ILE A 82 0.482 -6.346 -15.530 1.00 0.00 C ATOM 1121 C ILE A 82 2.018 -6.266 -15.480 1.00 0.00 C ATOM 1122 O ILE A 82 2.569 -5.981 -14.419 1.00 0.00 O ATOM 1123 CB ILE A 82 -0.082 -7.755 -15.188 1.00 0.00 C ATOM 1124 CG1 ILE A 82 -0.982 -7.707 -13.932 1.00 0.00 C ATOM 1125 CG2 ILE A 82 0.968 -8.875 -15.066 1.00 0.00 C ATOM 1126 CD1 ILE A 82 -0.311 -7.276 -12.620 1.00 0.00 C ATOM 0 H ILE A 82 -0.634 -6.552 -17.309 1.00 0.00 H new ATOM 0 HA ILE A 82 0.155 -5.670 -14.740 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.680 -8.026 -16.058 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -1.809 -7.025 -14.131 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.414 -8.697 -13.784 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.471 -9.815 -14.826 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.502 -8.978 -16.011 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.675 -8.626 -14.275 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -1.047 -7.283 -11.816 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.496 -7.968 -12.380 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.095 -6.271 -12.732 1.00 0.00 H new ATOM 1138 N ASP A 83 2.706 -6.449 -16.609 1.00 0.00 N ATOM 1139 CA ASP A 83 4.169 -6.372 -16.695 1.00 0.00 C ATOM 1140 C ASP A 83 4.702 -4.929 -16.612 1.00 0.00 C ATOM 1141 O ASP A 83 5.730 -4.727 -15.967 1.00 0.00 O ATOM 1142 CB ASP A 83 4.691 -7.066 -17.963 1.00 0.00 C ATOM 1143 CG ASP A 83 4.443 -8.587 -17.987 1.00 0.00 C ATOM 1144 OD1 ASP A 83 4.863 -9.283 -17.032 1.00 0.00 O ATOM 1145 OD2 ASP A 83 3.887 -9.094 -18.992 1.00 0.00 O ATOM 0 H ASP A 83 2.259 -6.658 -17.502 1.00 0.00 H new ATOM 0 HA ASP A 83 4.550 -6.902 -15.822 1.00 0.00 H new ATOM 0 HB2 ASP A 83 4.215 -6.616 -18.834 1.00 0.00 H new ATOM 0 HB3 ASP A 83 5.761 -6.880 -18.053 1.00 0.00 H new ATOM 1150 N VAL A 84 4.013 -3.919 -17.175 1.00 0.00 N ATOM 1151 CA VAL A 84 4.331 -2.499 -16.868 1.00 0.00 C ATOM 1152 C VAL A 84 4.110 -2.259 -15.388 1.00 0.00 C ATOM 1153 O VAL A 84 4.950 -1.646 -14.745 1.00 0.00 O ATOM 1154 CB VAL A 84 3.492 -1.442 -17.628 1.00 0.00 C ATOM 1155 CG1 VAL A 84 3.681 0.005 -17.132 1.00 0.00 C ATOM 1156 CG2 VAL A 84 3.870 -1.468 -19.120 1.00 0.00 C ATOM 0 H VAL A 84 3.245 -4.048 -17.834 1.00 0.00 H new ATOM 0 HA VAL A 84 5.365 -2.368 -17.188 1.00 0.00 H new ATOM 0 HB VAL A 84 2.452 -1.716 -17.449 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.056 0.676 -17.721 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.395 0.070 -16.082 1.00 0.00 H new ATOM 0 HG13 VAL A 84 4.726 0.294 -17.242 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.281 -0.725 -19.658 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.930 -1.240 -19.231 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.667 -2.457 -19.530 1.00 0.00 H new ATOM 1166 N ILE A 85 2.986 -2.732 -14.846 1.00 0.00 N ATOM 1167 CA ILE A 85 2.624 -2.445 -13.462 1.00 0.00 C ATOM 1168 C ILE A 85 3.657 -3.063 -12.525 1.00 0.00 C ATOM 1169 O ILE A 85 4.387 -2.326 -11.875 1.00 0.00 O ATOM 1170 CB ILE A 85 1.165 -2.888 -13.195 1.00 0.00 C ATOM 1171 CG1 ILE A 85 0.060 -2.141 -14.003 1.00 0.00 C ATOM 1172 CG2 ILE A 85 0.836 -2.801 -11.691 1.00 0.00 C ATOM 1173 CD1 ILE A 85 0.446 -1.066 -15.035 1.00 0.00 C ATOM 0 H ILE A 85 2.314 -3.314 -15.346 1.00 0.00 H new ATOM 0 HA ILE A 85 2.645 -1.373 -13.267 1.00 0.00 H new ATOM 0 HB ILE A 85 1.139 -3.918 -13.552 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.523 -2.898 -14.528 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.606 -1.670 -13.280 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.194 -3.117 -11.525 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.509 -3.452 -11.133 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.960 -1.773 -11.350 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.456 -0.661 -15.493 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.992 -0.264 -14.538 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.076 -1.511 -15.805 1.00 0.00 H new ATOM 1185 N ILE A 86 3.787 -4.385 -12.473 1.00 0.00 N ATOM 1186 CA ILE A 86 4.680 -5.034 -11.501 1.00 0.00 C ATOM 1187 C ILE A 86 6.152 -4.876 -11.890 1.00 0.00 C ATOM 1188 O ILE A 86 6.981 -4.714 -11.000 1.00 0.00 O ATOM 1189 CB ILE A 86 4.257 -6.500 -11.257 1.00 0.00 C ATOM 1190 CG1 ILE A 86 2.800 -6.603 -10.744 1.00 0.00 C ATOM 1191 CG2 ILE A 86 5.218 -7.190 -10.271 1.00 0.00 C ATOM 1192 CD1 ILE A 86 2.499 -5.937 -9.392 1.00 0.00 C ATOM 0 H ILE A 86 3.291 -5.031 -13.087 1.00 0.00 H new ATOM 0 HA ILE A 86 4.578 -4.523 -10.544 1.00 0.00 H new ATOM 0 HB ILE A 86 4.308 -7.013 -12.218 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.143 -6.164 -11.494 1.00 0.00 H new ATOM 0 HG13 ILE A 86 2.539 -7.659 -10.670 1.00 0.00 H new ATOM 0 HG21 ILE A 86 4.900 -8.221 -10.115 1.00 0.00 H new ATOM 0 HG22 ILE A 86 6.228 -7.180 -10.680 1.00 0.00 H new ATOM 0 HG23 ILE A 86 5.206 -6.658 -9.319 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.447 -6.078 -9.143 1.00 0.00 H new ATOM 0 HD12 ILE A 86 3.119 -6.389 -8.618 1.00 0.00 H new ATOM 0 HD13 ILE A 86 2.717 -4.871 -9.455 1.00 0.00 H new ATOM 1204 N GLY A 87 6.499 -4.817 -13.180 1.00 0.00 N ATOM 1205 CA GLY A 87 7.883 -4.587 -13.613 1.00 0.00 C ATOM 1206 C GLY A 87 8.364 -3.173 -13.297 1.00 0.00 C ATOM 1207 O GLY A 87 9.497 -3.004 -12.839 1.00 0.00 O ATOM 0 H GLY A 87 5.836 -4.926 -13.948 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.538 -5.308 -13.125 1.00 0.00 H new ATOM 0 HA3 GLY A 87 7.959 -4.762 -14.686 1.00 0.00 H new ATOM 1211 N ARG A 88 7.511 -2.149 -13.462 1.00 0.00 N ATOM 1212 CA ARG A 88 7.891 -0.764 -13.151 1.00 0.00 C ATOM 1213 C ARG A 88 7.722 -0.451 -11.652 1.00 0.00 C ATOM 1214 O ARG A 88 8.538 0.293 -11.118 1.00 0.00 O ATOM 1215 CB ARG A 88 7.179 0.210 -14.112 1.00 0.00 C ATOM 1216 CG ARG A 88 7.874 1.585 -14.226 1.00 0.00 C ATOM 1217 CD ARG A 88 8.442 1.858 -15.628 1.00 0.00 C ATOM 1218 NE ARG A 88 9.471 0.874 -16.020 1.00 0.00 N ATOM 1219 CZ ARG A 88 10.770 0.911 -15.743 1.00 0.00 C ATOM 1220 NH1 ARG A 88 11.312 1.877 -15.030 1.00 0.00 N ATOM 1221 NH2 ARG A 88 11.553 -0.045 -16.190 1.00 0.00 N ATOM 0 H ARG A 88 6.557 -2.255 -13.808 1.00 0.00 H new ATOM 0 HA ARG A 88 8.957 -0.625 -13.329 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.125 -0.244 -15.102 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.154 0.357 -13.773 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.161 2.369 -13.970 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.682 1.639 -13.496 1.00 0.00 H new ATOM 0 HD2 ARG A 88 7.631 1.840 -16.356 1.00 0.00 H new ATOM 0 HD3 ARG A 88 8.872 2.859 -15.654 1.00 0.00 H new ATOM 0 HE ARG A 88 9.148 0.075 -16.565 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.730 2.633 -14.669 1.00 0.00 H new ATOM 0 HH12 ARG A 88 12.314 1.869 -14.839 1.00 0.00 H new ATOM 0 HH21 ARG A 88 11.162 -0.807 -16.744 1.00 0.00 H new ATOM 0 HH22 ARG A 88 12.551 -0.025 -15.983 1.00 0.00 H new ATOM 1235 N LEU A 89 6.800 -1.104 -10.923 1.00 0.00 N ATOM 1236 CA LEU A 89 6.800 -1.136 -9.446 1.00 0.00 C ATOM 1237 C LEU A 89 8.114 -1.750 -8.940 1.00 0.00 C ATOM 1238 O LEU A 89 8.801 -1.116 -8.152 1.00 0.00 O ATOM 1239 CB LEU A 89 5.550 -1.889 -8.925 1.00 0.00 C ATOM 1240 CG LEU A 89 4.999 -1.418 -7.565 1.00 0.00 C ATOM 1241 CD1 LEU A 89 3.731 -2.221 -7.235 1.00 0.00 C ATOM 1242 CD2 LEU A 89 5.999 -1.552 -6.410 1.00 0.00 C ATOM 0 H LEU A 89 6.030 -1.627 -11.341 1.00 0.00 H new ATOM 0 HA LEU A 89 6.743 -0.121 -9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.758 -1.796 -9.668 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.793 -2.949 -8.849 1.00 0.00 H new ATOM 0 HG LEU A 89 4.785 -0.354 -7.664 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.334 -1.895 -6.274 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.984 -2.057 -8.011 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.975 -3.282 -7.185 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.538 -1.201 -5.487 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.286 -2.597 -6.297 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.884 -0.953 -6.624 1.00 0.00 H new ATOM 1254 N ARG A 90 8.536 -2.914 -9.450 1.00 0.00 N ATOM 1255 CA ARG A 90 9.835 -3.524 -9.107 1.00 0.00 C ATOM 1256 C ARG A 90 11.025 -2.626 -9.458 1.00 0.00 C ATOM 1257 O ARG A 90 11.957 -2.542 -8.669 1.00 0.00 O ATOM 1258 CB ARG A 90 9.992 -4.903 -9.763 1.00 0.00 C ATOM 1259 CG ARG A 90 9.202 -5.978 -9.001 1.00 0.00 C ATOM 1260 CD ARG A 90 9.265 -7.331 -9.718 1.00 0.00 C ATOM 1261 NE ARG A 90 10.627 -7.901 -9.731 1.00 0.00 N ATOM 1262 CZ ARG A 90 11.223 -8.585 -8.758 1.00 0.00 C ATOM 1263 NH1 ARG A 90 10.634 -8.829 -7.604 1.00 0.00 N ATOM 1264 NH2 ARG A 90 12.442 -9.044 -8.939 1.00 0.00 N ATOM 0 H ARG A 90 7.989 -3.463 -10.113 1.00 0.00 H new ATOM 0 HA ARG A 90 9.836 -3.648 -8.024 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.646 -4.858 -10.796 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.047 -5.176 -9.792 1.00 0.00 H new ATOM 0 HG2 ARG A 90 9.603 -6.080 -7.992 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.163 -5.665 -8.901 1.00 0.00 H new ATOM 0 HD2 ARG A 90 8.587 -8.030 -9.228 1.00 0.00 H new ATOM 0 HD3 ARG A 90 8.915 -7.212 -10.743 1.00 0.00 H new ATOM 0 HE ARG A 90 11.172 -7.754 -10.581 1.00 0.00 H new ATOM 0 HH11 ARG A 90 9.688 -8.489 -7.433 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.125 -9.357 -6.883 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.925 -8.875 -9.821 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.905 -9.569 -8.197 1.00 0.00 H new ATOM 1278 N SER A 91 10.987 -1.882 -10.561 1.00 0.00 N ATOM 1279 CA SER A 91 12.003 -0.844 -10.830 1.00 0.00 C ATOM 1280 C SER A 91 12.021 0.234 -9.734 1.00 0.00 C ATOM 1281 O SER A 91 13.085 0.576 -9.218 1.00 0.00 O ATOM 1282 CB SER A 91 11.805 -0.220 -12.218 1.00 0.00 C ATOM 1283 OG SER A 91 12.055 -1.169 -13.250 1.00 0.00 O ATOM 0 H SER A 91 10.273 -1.970 -11.284 1.00 0.00 H new ATOM 0 HA SER A 91 12.977 -1.334 -10.819 1.00 0.00 H new ATOM 0 HB2 SER A 91 10.787 0.159 -12.307 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.474 0.633 -12.335 1.00 0.00 H new ATOM 0 HG SER A 91 11.328 -1.826 -13.274 1.00 0.00 H new ATOM 1289 N LYS A 92 10.848 0.697 -9.282 1.00 0.00 N ATOM 1290 CA LYS A 92 10.743 1.554 -8.090 1.00 0.00 C ATOM 1291 C LYS A 92 11.304 0.886 -6.815 1.00 0.00 C ATOM 1292 O LYS A 92 12.091 1.526 -6.120 1.00 0.00 O ATOM 1293 CB LYS A 92 9.285 2.040 -7.918 1.00 0.00 C ATOM 1294 CG LYS A 92 9.013 3.423 -8.529 1.00 0.00 C ATOM 1295 CD LYS A 92 9.199 3.513 -10.051 1.00 0.00 C ATOM 1296 CE LYS A 92 8.670 4.839 -10.630 1.00 0.00 C ATOM 1297 NZ LYS A 92 9.357 6.040 -10.076 1.00 0.00 N ATOM 0 H LYS A 92 9.953 0.492 -9.726 1.00 0.00 H new ATOM 0 HA LYS A 92 11.376 2.427 -8.248 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.614 1.313 -8.376 1.00 0.00 H new ATOM 0 HB3 LYS A 92 9.045 2.070 -6.855 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.992 3.716 -8.286 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.674 4.149 -8.055 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.257 3.411 -10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.682 2.680 -10.527 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.790 4.828 -11.713 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.602 4.915 -10.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.991 6.895 -10.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.180 6.100 -9.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.380 5.964 -10.246 1.00 0.00 H new ATOM 1311 N ILE A 93 10.977 -0.379 -6.496 1.00 0.00 N ATOM 1312 CA ILE A 93 11.508 -1.053 -5.275 1.00 0.00 C ATOM 1313 C ILE A 93 13.026 -1.276 -5.359 1.00 0.00 C ATOM 1314 O ILE A 93 13.714 -1.165 -4.348 1.00 0.00 O ATOM 1315 CB ILE A 93 10.729 -2.340 -4.849 1.00 0.00 C ATOM 1316 CG1 ILE A 93 11.221 -3.705 -5.404 1.00 0.00 C ATOM 1317 CG2 ILE A 93 9.231 -2.227 -5.156 1.00 0.00 C ATOM 1318 CD1 ILE A 93 12.411 -4.342 -4.669 1.00 0.00 C ATOM 0 H ILE A 93 10.353 -0.960 -7.056 1.00 0.00 H new ATOM 0 HA ILE A 93 11.326 -0.352 -4.460 1.00 0.00 H new ATOM 0 HB ILE A 93 10.938 -2.363 -3.779 1.00 0.00 H new ATOM 0 HG12 ILE A 93 10.387 -4.406 -5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.495 -3.572 -6.451 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.726 -3.141 -4.845 1.00 0.00 H new ATOM 0 HG22 ILE A 93 8.812 -1.379 -4.615 1.00 0.00 H new ATOM 0 HG23 ILE A 93 9.089 -2.080 -6.227 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.667 -5.290 -5.143 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.268 -3.671 -4.714 1.00 0.00 H new ATOM 0 HD13 ILE A 93 12.143 -4.518 -3.627 1.00 0.00 H new ATOM 1330 N GLU A 94 13.555 -1.545 -6.555 1.00 0.00 N ATOM 1331 CA GLU A 94 14.985 -1.761 -6.799 1.00 0.00 C ATOM 1332 C GLU A 94 15.783 -0.449 -6.650 1.00 0.00 C ATOM 1333 O GLU A 94 16.873 -0.456 -6.071 1.00 0.00 O ATOM 1334 CB GLU A 94 15.150 -2.422 -8.181 1.00 0.00 C ATOM 1335 CG GLU A 94 16.535 -3.030 -8.451 1.00 0.00 C ATOM 1336 CD GLU A 94 17.630 -2.011 -8.818 1.00 0.00 C ATOM 1337 OE1 GLU A 94 17.401 -1.146 -9.697 1.00 0.00 O ATOM 1338 OE2 GLU A 94 18.761 -2.120 -8.285 1.00 0.00 O ATOM 0 H GLU A 94 12.989 -1.621 -7.400 1.00 0.00 H new ATOM 0 HA GLU A 94 15.400 -2.434 -6.049 1.00 0.00 H new ATOM 0 HB2 GLU A 94 14.400 -3.206 -8.283 1.00 0.00 H new ATOM 0 HB3 GLU A 94 14.941 -1.678 -8.950 1.00 0.00 H new ATOM 0 HG2 GLU A 94 16.853 -3.580 -7.565 1.00 0.00 H new ATOM 0 HG3 GLU A 94 16.446 -3.754 -9.261 1.00 0.00 H new ATOM 1345 N LYS A 95 15.231 0.691 -7.097 1.00 0.00 N ATOM 1346 CA LYS A 95 15.852 2.016 -6.917 1.00 0.00 C ATOM 1347 C LYS A 95 15.717 2.582 -5.482 1.00 0.00 C ATOM 1348 O LYS A 95 16.633 3.252 -4.999 1.00 0.00 O ATOM 1349 CB LYS A 95 15.267 2.987 -7.961 1.00 0.00 C ATOM 1350 CG LYS A 95 15.735 2.639 -9.387 1.00 0.00 C ATOM 1351 CD LYS A 95 15.074 3.513 -10.467 1.00 0.00 C ATOM 1352 CE LYS A 95 15.419 5.011 -10.379 1.00 0.00 C ATOM 1353 NZ LYS A 95 16.849 5.292 -10.692 1.00 0.00 N ATOM 0 H LYS A 95 14.341 0.721 -7.594 1.00 0.00 H new ATOM 0 HA LYS A 95 16.925 1.899 -7.071 1.00 0.00 H new ATOM 0 HB2 LYS A 95 14.178 2.956 -7.917 1.00 0.00 H new ATOM 0 HB3 LYS A 95 15.567 4.006 -7.718 1.00 0.00 H new ATOM 0 HG2 LYS A 95 16.817 2.754 -9.446 1.00 0.00 H new ATOM 0 HG3 LYS A 95 15.514 1.591 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 95 15.371 3.142 -11.448 1.00 0.00 H new ATOM 0 HD3 LYS A 95 13.992 3.398 -10.397 1.00 0.00 H new ATOM 0 HE2 LYS A 95 14.784 5.567 -11.069 1.00 0.00 H new ATOM 0 HE3 LYS A 95 15.193 5.373 -9.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 17.026 6.314 -10.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 17.458 4.785 -10.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 17.062 4.973 -11.659 1.00 0.00 H new ATOM 1367 N ASN A 96 14.600 2.322 -4.791 1.00 0.00 N ATOM 1368 CA ASN A 96 14.375 2.703 -3.382 1.00 0.00 C ATOM 1369 C ASN A 96 15.091 1.742 -2.385 1.00 0.00 C ATOM 1370 O ASN A 96 15.536 0.662 -2.784 1.00 0.00 O ATOM 1371 CB ASN A 96 12.850 2.755 -3.115 1.00 0.00 C ATOM 1372 CG ASN A 96 12.180 4.032 -3.624 1.00 0.00 C ATOM 1373 OD1 ASN A 96 11.953 4.975 -2.873 1.00 0.00 O ATOM 1374 ND2 ASN A 96 11.829 4.099 -4.892 1.00 0.00 N ATOM 0 H ASN A 96 13.806 1.830 -5.201 1.00 0.00 H new ATOM 0 HA ASN A 96 14.812 3.688 -3.216 1.00 0.00 H new ATOM 0 HB2 ASN A 96 12.378 1.894 -3.588 1.00 0.00 H new ATOM 0 HB3 ASN A 96 12.675 2.666 -2.043 1.00 0.00 H new ATOM 0 HD21 ASN A 96 11.368 4.936 -5.250 1.00 0.00 H new ATOM 0 HD22 ASN A 96 12.018 3.314 -5.516 1.00 0.00 H new ATOM 1381 N PRO A 97 15.171 2.088 -1.080 1.00 0.00 N ATOM 1382 CA PRO A 97 15.522 1.141 -0.013 1.00 0.00 C ATOM 1383 C PRO A 97 14.370 0.173 0.337 1.00 0.00 C ATOM 1384 O PRO A 97 14.610 -0.874 0.936 1.00 0.00 O ATOM 1385 CB PRO A 97 15.894 2.021 1.186 1.00 0.00 C ATOM 1386 CG PRO A 97 15.030 3.266 0.994 1.00 0.00 C ATOM 1387 CD PRO A 97 15.004 3.431 -0.526 1.00 0.00 C ATOM 0 HA PRO A 97 16.339 0.489 -0.324 1.00 0.00 H new ATOM 0 HB2 PRO A 97 15.678 1.524 2.132 1.00 0.00 H new ATOM 0 HB3 PRO A 97 16.956 2.266 1.190 1.00 0.00 H new ATOM 0 HG2 PRO A 97 14.029 3.130 1.403 1.00 0.00 H new ATOM 0 HG3 PRO A 97 15.461 4.137 1.488 1.00 0.00 H new ATOM 0 HD2 PRO A 97 14.064 3.874 -0.854 1.00 0.00 H new ATOM 0 HD3 PRO A 97 15.803 4.093 -0.860 1.00 0.00 H new ATOM 1395 N LYS A 98 13.126 0.504 -0.042 1.00 0.00 N ATOM 1396 CA LYS A 98 11.906 -0.300 0.153 1.00 0.00 C ATOM 1397 C LYS A 98 12.018 -1.726 -0.434 1.00 0.00 C ATOM 1398 O LYS A 98 12.311 -1.888 -1.617 1.00 0.00 O ATOM 1399 CB LYS A 98 10.760 0.526 -0.479 1.00 0.00 C ATOM 1400 CG LYS A 98 9.324 -0.026 -0.391 1.00 0.00 C ATOM 1401 CD LYS A 98 8.994 -1.168 -1.376 1.00 0.00 C ATOM 1402 CE LYS A 98 7.535 -1.077 -1.869 1.00 0.00 C ATOM 1403 NZ LYS A 98 7.011 -2.362 -2.438 1.00 0.00 N ATOM 0 H LYS A 98 12.932 1.385 -0.518 1.00 0.00 H new ATOM 0 HA LYS A 98 11.722 -0.481 1.212 1.00 0.00 H new ATOM 0 HB2 LYS A 98 10.766 1.512 -0.014 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.997 0.669 -1.533 1.00 0.00 H new ATOM 0 HG2 LYS A 98 9.151 -0.383 0.624 1.00 0.00 H new ATOM 0 HG3 LYS A 98 8.626 0.793 -0.564 1.00 0.00 H new ATOM 0 HD2 LYS A 98 9.672 -1.123 -2.228 1.00 0.00 H new ATOM 0 HD3 LYS A 98 9.157 -2.130 -0.889 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.898 -0.771 -1.039 1.00 0.00 H new ATOM 0 HE3 LYS A 98 7.465 -0.298 -2.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.265 -2.155 -3.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 7.785 -2.877 -2.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.618 -2.946 -1.672 1.00 0.00 H new ATOM 1417 N GLN A 99 11.691 -2.762 0.350 1.00 0.00 N ATOM 1418 CA GLN A 99 11.628 -4.169 -0.092 1.00 0.00 C ATOM 1419 C GLN A 99 10.214 -4.763 0.130 1.00 0.00 C ATOM 1420 O GLN A 99 9.517 -4.323 1.050 1.00 0.00 O ATOM 1421 CB GLN A 99 12.682 -4.999 0.671 1.00 0.00 C ATOM 1422 CG GLN A 99 14.126 -4.615 0.304 1.00 0.00 C ATOM 1423 CD GLN A 99 15.152 -5.507 1.008 1.00 0.00 C ATOM 1424 OE1 GLN A 99 15.690 -5.178 2.059 1.00 0.00 O ATOM 1425 NE2 GLN A 99 15.456 -6.676 0.475 1.00 0.00 N ATOM 0 H GLN A 99 11.456 -2.646 1.336 1.00 0.00 H new ATOM 0 HA GLN A 99 11.841 -4.206 -1.160 1.00 0.00 H new ATOM 0 HB2 GLN A 99 12.537 -4.864 1.743 1.00 0.00 H new ATOM 0 HB3 GLN A 99 12.527 -6.057 0.459 1.00 0.00 H new ATOM 0 HG2 GLN A 99 14.259 -4.692 -0.775 1.00 0.00 H new ATOM 0 HG3 GLN A 99 14.304 -3.574 0.574 1.00 0.00 H new ATOM 0 HE21 GLN A 99 15.019 -6.967 -0.399 1.00 0.00 H new ATOM 0 HE22 GLN A 99 16.128 -7.288 0.937 1.00 0.00 H new ATOM 1434 N PRO A 100 9.777 -5.753 -0.683 1.00 0.00 N ATOM 1435 CA PRO A 100 8.518 -6.478 -0.489 1.00 0.00 C ATOM 1436 C PRO A 100 8.604 -7.468 0.678 1.00 0.00 C ATOM 1437 O PRO A 100 9.683 -7.864 1.119 1.00 0.00 O ATOM 1438 CB PRO A 100 8.261 -7.196 -1.820 1.00 0.00 C ATOM 1439 CG PRO A 100 9.669 -7.493 -2.326 1.00 0.00 C ATOM 1440 CD PRO A 100 10.457 -6.265 -1.871 1.00 0.00 C ATOM 0 HA PRO A 100 7.703 -5.803 -0.229 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.681 -8.108 -1.681 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.706 -6.568 -2.517 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.068 -8.412 -1.896 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.693 -7.611 -3.409 1.00 0.00 H new ATOM 0 HD2 PRO A 100 11.490 -6.529 -1.643 1.00 0.00 H new ATOM 0 HD3 PRO A 100 10.487 -5.510 -2.657 1.00 0.00 H new ATOM 1448 N GLN A 101 7.424 -7.889 1.139 1.00 0.00 N ATOM 1449 CA GLN A 101 7.228 -8.903 2.180 1.00 0.00 C ATOM 1450 C GLN A 101 5.784 -9.428 2.173 1.00 0.00 C ATOM 1451 O GLN A 101 5.588 -10.638 2.263 1.00 0.00 O ATOM 1452 CB GLN A 101 7.667 -8.382 3.567 1.00 0.00 C ATOM 1453 CG GLN A 101 7.040 -7.050 4.018 1.00 0.00 C ATOM 1454 CD GLN A 101 7.589 -6.599 5.374 1.00 0.00 C ATOM 1455 OE1 GLN A 101 6.971 -6.773 6.418 1.00 0.00 O ATOM 1456 NE2 GLN A 101 8.772 -6.016 5.420 1.00 0.00 N ATOM 0 H GLN A 101 6.543 -7.518 0.783 1.00 0.00 H new ATOM 0 HA GLN A 101 7.873 -9.752 1.954 1.00 0.00 H new ATOM 0 HB2 GLN A 101 7.429 -9.143 4.311 1.00 0.00 H new ATOM 0 HB3 GLN A 101 8.751 -8.268 3.564 1.00 0.00 H new ATOM 0 HG2 GLN A 101 7.239 -6.282 3.271 1.00 0.00 H new ATOM 0 HG3 GLN A 101 5.957 -7.160 4.081 1.00 0.00 H new ATOM 0 HE21 GLN A 101 9.299 -5.864 4.560 1.00 0.00 H new ATOM 0 HE22 GLN A 101 9.159 -5.718 6.315 1.00 0.00 H new ATOM 1465 N TYR A 102 4.775 -8.551 2.003 1.00 0.00 N ATOM 1466 CA TYR A 102 3.356 -8.974 1.963 1.00 0.00 C ATOM 1467 C TYR A 102 2.742 -9.094 0.553 1.00 0.00 C ATOM 1468 O TYR A 102 1.534 -9.295 0.429 1.00 0.00 O ATOM 1469 CB TYR A 102 2.548 -8.080 2.925 1.00 0.00 C ATOM 1470 CG TYR A 102 2.355 -8.675 4.313 1.00 0.00 C ATOM 1471 CD1 TYR A 102 3.466 -9.060 5.091 1.00 0.00 C ATOM 1472 CD2 TYR A 102 1.055 -8.857 4.825 1.00 0.00 C ATOM 1473 CE1 TYR A 102 3.282 -9.624 6.367 1.00 0.00 C ATOM 1474 CE2 TYR A 102 0.861 -9.421 6.101 1.00 0.00 C ATOM 1475 CZ TYR A 102 1.977 -9.807 6.877 1.00 0.00 C ATOM 1476 OH TYR A 102 1.802 -10.352 8.116 1.00 0.00 O ATOM 0 H TYR A 102 4.913 -7.547 1.891 1.00 0.00 H new ATOM 0 HA TYR A 102 3.309 -10.007 2.308 1.00 0.00 H new ATOM 0 HB2 TYR A 102 3.053 -7.119 3.021 1.00 0.00 H new ATOM 0 HB3 TYR A 102 1.570 -7.884 2.486 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.465 -8.921 4.705 1.00 0.00 H new ATOM 0 HD2 TYR A 102 0.200 -8.562 4.234 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.138 -9.917 6.956 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.139 -9.558 6.486 1.00 0.00 H new ATOM 0 HH TYR A 102 0.844 -10.408 8.317 1.00 0.00 H new ATOM 1486 N ILE A 103 3.547 -9.017 -0.516 1.00 0.00 N ATOM 1487 CA ILE A 103 3.123 -9.380 -1.885 1.00 0.00 C ATOM 1488 C ILE A 103 3.936 -10.574 -2.431 1.00 0.00 C ATOM 1489 O ILE A 103 5.163 -10.606 -2.330 1.00 0.00 O ATOM 1490 CB ILE A 103 3.147 -8.141 -2.819 1.00 0.00 C ATOM 1491 CG1 ILE A 103 2.381 -8.449 -4.128 1.00 0.00 C ATOM 1492 CG2 ILE A 103 4.568 -7.612 -3.093 1.00 0.00 C ATOM 1493 CD1 ILE A 103 2.153 -7.227 -5.028 1.00 0.00 C ATOM 0 H ILE A 103 4.515 -8.701 -0.460 1.00 0.00 H new ATOM 0 HA ILE A 103 2.087 -9.718 -1.848 1.00 0.00 H new ATOM 0 HB ILE A 103 2.637 -7.331 -2.297 1.00 0.00 H new ATOM 0 HG12 ILE A 103 2.934 -9.202 -4.690 1.00 0.00 H new ATOM 0 HG13 ILE A 103 1.415 -8.885 -3.876 1.00 0.00 H new ATOM 0 HG21 ILE A 103 4.513 -6.746 -3.752 1.00 0.00 H new ATOM 0 HG22 ILE A 103 5.036 -7.323 -2.152 1.00 0.00 H new ATOM 0 HG23 ILE A 103 5.161 -8.393 -3.569 1.00 0.00 H new ATOM 0 HD11 ILE A 103 1.610 -7.531 -5.923 1.00 0.00 H new ATOM 0 HD12 ILE A 103 1.572 -6.480 -4.487 1.00 0.00 H new ATOM 0 HD13 ILE A 103 3.115 -6.801 -5.314 1.00 0.00 H new ATOM 1505 N ILE A 104 3.237 -11.557 -3.005 1.00 0.00 N ATOM 1506 CA ILE A 104 3.769 -12.784 -3.642 1.00 0.00 C ATOM 1507 C ILE A 104 3.291 -12.865 -5.110 1.00 0.00 C ATOM 1508 O ILE A 104 2.227 -12.353 -5.443 1.00 0.00 O ATOM 1509 CB ILE A 104 3.306 -14.018 -2.818 1.00 0.00 C ATOM 1510 CG1 ILE A 104 3.723 -13.961 -1.325 1.00 0.00 C ATOM 1511 CG2 ILE A 104 3.773 -15.353 -3.429 1.00 0.00 C ATOM 1512 CD1 ILE A 104 5.234 -13.992 -1.053 1.00 0.00 C ATOM 0 H ILE A 104 2.218 -11.523 -3.044 1.00 0.00 H new ATOM 0 HA ILE A 104 4.859 -12.764 -3.654 1.00 0.00 H new ATOM 0 HB ILE A 104 2.218 -13.973 -2.863 1.00 0.00 H new ATOM 0 HG12 ILE A 104 3.312 -13.051 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 104 3.262 -14.801 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE A 104 3.420 -16.179 -2.811 1.00 0.00 H new ATOM 0 HG22 ILE A 104 3.368 -15.454 -4.436 1.00 0.00 H new ATOM 0 HG23 ILE A 104 4.862 -15.372 -3.473 1.00 0.00 H new ATOM 0 HD11 ILE A 104 5.411 -13.947 0.022 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.657 -14.914 -1.453 1.00 0.00 H new ATOM 0 HD13 ILE A 104 5.708 -13.137 -1.535 1.00 0.00 H new ATOM 1524 N SER A 105 4.035 -13.506 -6.009 1.00 0.00 N ATOM 1525 CA SER A 105 3.682 -13.676 -7.424 1.00 0.00 C ATOM 1526 C SER A 105 3.002 -15.035 -7.712 1.00 0.00 C ATOM 1527 O SER A 105 3.350 -16.064 -7.126 1.00 0.00 O ATOM 1528 CB SER A 105 4.944 -13.503 -8.290 1.00 0.00 C ATOM 1529 OG SER A 105 5.994 -14.382 -7.893 1.00 0.00 O ATOM 0 H SER A 105 4.928 -13.936 -5.769 1.00 0.00 H new ATOM 0 HA SER A 105 2.951 -12.909 -7.678 1.00 0.00 H new ATOM 0 HB2 SER A 105 4.694 -13.687 -9.335 1.00 0.00 H new ATOM 0 HB3 SER A 105 5.291 -12.472 -8.222 1.00 0.00 H new ATOM 0 HG SER A 105 6.774 -14.241 -8.469 1.00 0.00 H new ATOM 1535 N VAL A 106 2.032 -15.042 -8.638 1.00 0.00 N ATOM 1536 CA VAL A 106 1.278 -16.232 -9.092 1.00 0.00 C ATOM 1537 C VAL A 106 1.326 -16.318 -10.626 1.00 0.00 C ATOM 1538 O VAL A 106 0.564 -15.651 -11.331 1.00 0.00 O ATOM 1539 CB VAL A 106 -0.188 -16.233 -8.574 1.00 0.00 C ATOM 1540 CG1 VAL A 106 -0.874 -17.573 -8.893 1.00 0.00 C ATOM 1541 CG2 VAL A 106 -0.282 -15.977 -7.059 1.00 0.00 C ATOM 0 H VAL A 106 1.736 -14.189 -9.113 1.00 0.00 H new ATOM 0 HA VAL A 106 1.754 -17.116 -8.668 1.00 0.00 H new ATOM 0 HB VAL A 106 -0.694 -15.416 -9.089 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -1.899 -17.554 -8.523 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.881 -17.731 -9.972 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -0.329 -18.385 -8.411 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.328 -15.989 -6.752 1.00 0.00 H new ATOM 0 HG22 VAL A 106 0.262 -16.756 -6.524 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.154 -15.005 -6.826 1.00 0.00 H new ATOM 1551 N ARG A 107 2.269 -17.127 -11.135 1.00 0.00 N ATOM 1552 CA ARG A 107 2.458 -17.502 -12.557 1.00 0.00 C ATOM 1553 C ARG A 107 2.819 -16.332 -13.506 1.00 0.00 C ATOM 1554 O ARG A 107 2.877 -16.516 -14.722 1.00 0.00 O ATOM 1555 CB ARG A 107 1.237 -18.319 -13.060 1.00 0.00 C ATOM 1556 CG ARG A 107 1.402 -19.839 -12.890 1.00 0.00 C ATOM 1557 CD ARG A 107 1.556 -20.309 -11.437 1.00 0.00 C ATOM 1558 NE ARG A 107 1.639 -21.780 -11.357 1.00 0.00 N ATOM 1559 CZ ARG A 107 2.717 -22.540 -11.543 1.00 0.00 C ATOM 1560 NH1 ARG A 107 3.899 -22.035 -11.834 1.00 0.00 N ATOM 1561 NH2 ARG A 107 2.614 -23.848 -11.438 1.00 0.00 N ATOM 0 H ARG A 107 2.965 -17.567 -10.533 1.00 0.00 H new ATOM 0 HA ARG A 107 3.347 -18.132 -12.586 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.347 -17.996 -12.520 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.070 -18.096 -14.114 1.00 0.00 H new ATOM 0 HG2 ARG A 107 0.537 -20.336 -13.328 1.00 0.00 H new ATOM 0 HG3 ARG A 107 2.276 -20.161 -13.456 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.453 -19.868 -11.003 1.00 0.00 H new ATOM 0 HD3 ARG A 107 0.710 -19.957 -10.847 1.00 0.00 H new ATOM 0 HE ARG A 107 0.773 -22.270 -11.134 1.00 0.00 H new ATOM 0 HH11 ARG A 107 4.014 -21.026 -11.925 1.00 0.00 H new ATOM 0 HH12 ARG A 107 4.699 -22.654 -11.968 1.00 0.00 H new ATOM 0 HH21 ARG A 107 1.714 -24.272 -11.216 1.00 0.00 H new ATOM 0 HH22 ARG A 107 3.435 -24.437 -11.579 1.00 0.00 H new ATOM 1575 N GLY A 108 3.029 -15.118 -12.974 1.00 0.00 N ATOM 1576 CA GLY A 108 3.177 -13.873 -13.752 1.00 0.00 C ATOM 1577 C GLY A 108 1.847 -13.291 -14.253 1.00 0.00 C ATOM 1578 O GLY A 108 1.853 -12.399 -15.101 1.00 0.00 O ATOM 0 H GLY A 108 3.103 -14.969 -11.968 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.679 -13.128 -13.135 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.824 -14.066 -14.608 1.00 0.00 H new ATOM 1582 N ILE A 109 0.713 -13.806 -13.756 1.00 0.00 N ATOM 1583 CA ILE A 109 -0.658 -13.460 -14.190 1.00 0.00 C ATOM 1584 C ILE A 109 -1.434 -12.780 -13.050 1.00 0.00 C ATOM 1585 O ILE A 109 -2.084 -11.757 -13.281 1.00 0.00 O ATOM 1586 CB ILE A 109 -1.381 -14.737 -14.701 1.00 0.00 C ATOM 1587 CG1 ILE A 109 -0.617 -15.347 -15.903 1.00 0.00 C ATOM 1588 CG2 ILE A 109 -2.843 -14.428 -15.087 1.00 0.00 C ATOM 1589 CD1 ILE A 109 -1.198 -16.661 -16.440 1.00 0.00 C ATOM 0 H ILE A 109 0.721 -14.503 -13.011 1.00 0.00 H new ATOM 0 HA ILE A 109 -0.608 -12.746 -15.012 1.00 0.00 H new ATOM 0 HB ILE A 109 -1.394 -15.467 -13.891 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -0.600 -14.617 -16.712 1.00 0.00 H new ATOM 0 HG13 ILE A 109 0.418 -15.519 -15.607 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -3.326 -15.339 -15.441 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -3.377 -14.049 -14.216 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -2.860 -13.677 -15.877 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.596 -17.009 -17.279 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -1.189 -17.412 -15.650 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -2.223 -16.497 -16.773 1.00 0.00 H new ATOM 1601 N GLY A 110 -1.351 -13.331 -11.829 1.00 0.00 N ATOM 1602 CA GLY A 110 -1.853 -12.725 -10.598 1.00 0.00 C ATOM 1603 C GLY A 110 -0.735 -12.470 -9.594 1.00 0.00 C ATOM 1604 O GLY A 110 0.309 -13.120 -9.630 1.00 0.00 O ATOM 0 H GLY A 110 -0.917 -14.241 -11.672 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -2.351 -11.785 -10.833 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.601 -13.379 -10.150 1.00 0.00 H new ATOM 1608 N TYR A 111 -0.958 -11.547 -8.662 1.00 0.00 N ATOM 1609 CA TYR A 111 -0.043 -11.293 -7.541 1.00 0.00 C ATOM 1610 C TYR A 111 -0.827 -11.188 -6.231 1.00 0.00 C ATOM 1611 O TYR A 111 -1.695 -10.337 -6.057 1.00 0.00 O ATOM 1612 CB TYR A 111 0.803 -10.044 -7.801 1.00 0.00 C ATOM 1613 CG TYR A 111 1.680 -10.139 -9.041 1.00 0.00 C ATOM 1614 CD1 TYR A 111 1.120 -9.998 -10.327 1.00 0.00 C ATOM 1615 CD2 TYR A 111 3.050 -10.439 -8.910 1.00 0.00 C ATOM 1616 CE1 TYR A 111 1.909 -10.200 -11.475 1.00 0.00 C ATOM 1617 CE2 TYR A 111 3.851 -10.619 -10.056 1.00 0.00 C ATOM 1618 CZ TYR A 111 3.285 -10.493 -11.344 1.00 0.00 C ATOM 1619 OH TYR A 111 4.070 -10.639 -12.447 1.00 0.00 O ATOM 0 H TYR A 111 -1.783 -10.947 -8.659 1.00 0.00 H new ATOM 0 HA TYR A 111 0.645 -12.134 -7.450 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.141 -9.184 -7.901 1.00 0.00 H new ATOM 0 HB3 TYR A 111 1.437 -9.859 -6.933 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.078 -9.733 -10.432 1.00 0.00 H new ATOM 0 HD2 TYR A 111 3.489 -10.532 -7.927 1.00 0.00 H new ATOM 0 HE1 TYR A 111 1.463 -10.131 -12.456 1.00 0.00 H new ATOM 0 HE2 TYR A 111 4.900 -10.854 -9.949 1.00 0.00 H new ATOM 0 HH TYR A 111 4.989 -10.837 -12.171 1.00 0.00 H new ATOM 1629 N LYS A 112 -0.533 -12.101 -5.314 1.00 0.00 N ATOM 1630 CA LYS A 112 -1.260 -12.287 -4.061 1.00 0.00 C ATOM 1631 C LYS A 112 -0.754 -11.309 -3.001 1.00 0.00 C ATOM 1632 O LYS A 112 0.424 -11.308 -2.646 1.00 0.00 O ATOM 1633 CB LYS A 112 -1.165 -13.760 -3.629 1.00 0.00 C ATOM 1634 CG LYS A 112 -2.182 -14.176 -2.545 1.00 0.00 C ATOM 1635 CD LYS A 112 -1.750 -14.004 -1.077 1.00 0.00 C ATOM 1636 CE LYS A 112 -0.533 -14.878 -0.726 1.00 0.00 C ATOM 1637 NZ LYS A 112 -0.415 -15.119 0.739 1.00 0.00 N ATOM 0 H LYS A 112 0.243 -12.754 -5.424 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.317 -12.061 -4.199 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.308 -14.392 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -0.158 -13.952 -3.258 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.095 -13.601 -2.699 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -2.435 -15.224 -2.703 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -1.510 -12.957 -0.890 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -2.582 -14.262 -0.422 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -0.613 -15.834 -1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 112 0.375 -14.395 -1.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 0.495 -15.579 0.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -0.465 -14.212 1.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -1.192 -15.734 1.053 1.00 0.00 H new ATOM 1651 N LEU A 113 -1.666 -10.498 -2.483 1.00 0.00 N ATOM 1652 CA LEU A 113 -1.459 -9.550 -1.386 1.00 0.00 C ATOM 1653 C LEU A 113 -2.462 -9.893 -0.269 1.00 0.00 C ATOM 1654 O LEU A 113 -3.433 -10.613 -0.499 1.00 0.00 O ATOM 1655 CB LEU A 113 -1.619 -8.117 -1.958 1.00 0.00 C ATOM 1656 CG LEU A 113 -0.580 -7.075 -1.491 1.00 0.00 C ATOM 1657 CD1 LEU A 113 -0.724 -5.797 -2.326 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -0.704 -6.695 -0.009 1.00 0.00 C ATOM 0 H LEU A 113 -2.624 -10.479 -2.833 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.462 -9.610 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.579 -8.176 -3.046 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.612 -7.752 -1.695 1.00 0.00 H new ATOM 0 HG LEU A 113 0.395 -7.542 -1.627 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.010 -5.062 -1.996 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.557 -6.029 -3.378 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -1.727 -5.390 -2.199 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.060 -5.959 0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.691 -6.272 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -0.569 -7.584 0.607 1.00 0.00 H new ATOM 1670 N GLU A 114 -2.256 -9.372 0.936 1.00 0.00 N ATOM 1671 CA GLU A 114 -3.141 -9.585 2.085 1.00 0.00 C ATOM 1672 C GLU A 114 -3.095 -8.412 3.081 1.00 0.00 C ATOM 1673 O GLU A 114 -2.147 -7.621 3.084 1.00 0.00 O ATOM 1674 CB GLU A 114 -2.804 -10.930 2.750 1.00 0.00 C ATOM 1675 CG GLU A 114 -1.390 -11.012 3.342 1.00 0.00 C ATOM 1676 CD GLU A 114 -1.007 -12.471 3.619 1.00 0.00 C ATOM 1677 OE1 GLU A 114 -0.485 -13.138 2.693 1.00 0.00 O ATOM 1678 OE2 GLU A 114 -1.235 -12.966 4.748 1.00 0.00 O ATOM 0 H GLU A 114 -1.455 -8.778 1.150 1.00 0.00 H new ATOM 0 HA GLU A 114 -4.170 -9.624 1.728 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.527 -11.120 3.543 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.922 -11.725 2.013 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -0.674 -10.567 2.651 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -1.342 -10.436 4.266 1.00 0.00 H new ATOM 1685 N TYR A 115 -4.150 -8.291 3.898 1.00 0.00 N ATOM 1686 CA TYR A 115 -4.376 -7.195 4.855 1.00 0.00 C ATOM 1687 C TYR A 115 -3.909 -7.519 6.292 1.00 0.00 C ATOM 1688 O TYR A 115 -3.651 -6.561 7.058 1.00 0.00 O ATOM 1689 CB TYR A 115 -5.859 -6.786 4.814 1.00 0.00 C ATOM 1690 CG TYR A 115 -6.845 -7.805 5.363 1.00 0.00 C ATOM 1691 CD1 TYR A 115 -7.342 -8.838 4.540 1.00 0.00 C ATOM 1692 CD2 TYR A 115 -7.288 -7.701 6.697 1.00 0.00 C ATOM 1693 CE1 TYR A 115 -8.279 -9.760 5.050 1.00 0.00 C ATOM 1694 CE2 TYR A 115 -8.223 -8.621 7.210 1.00 0.00 C ATOM 1695 CZ TYR A 115 -8.721 -9.655 6.387 1.00 0.00 C ATOM 1696 OH TYR A 115 -9.640 -10.539 6.864 1.00 0.00 O ATOM 1697 OXT TYR A 115 -3.794 -8.714 6.663 1.00 0.00 O ATOM 0 H TYR A 115 -4.901 -8.981 3.912 1.00 0.00 H new ATOM 0 HA TYR A 115 -3.755 -6.354 4.545 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -5.976 -5.858 5.374 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -6.128 -6.570 3.780 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -7.004 -8.923 3.518 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -6.909 -6.912 7.329 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -8.659 -10.548 4.417 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -8.559 -8.536 8.233 1.00 0.00 H new ATOM 0 HH TYR A 115 -9.838 -10.332 7.801 1.00 0.00 H new TER 1707 TYR A 115